| 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 | 88.3 | Confident | 94.2 | Very high | 31 Ų | 31 | 63.8 Ų | 63.8 | 15% | 0.153 | 34% | 0.335 | C | S | . | . | 0 | -50.5 | 0 | -66.7 | -49.5 | -71.2 | 0 | 0 | 114.2 | V3 T4 A5 L301 H304 P306 P367 F371 | M1-V3 PolarHBondContact O-N 3.35Å; M1-T4 WeakPolarHBondContact O-CB 3.36Å; M1-T4 PolarHBondContact O-N 3.39Å; M1-A5 PolarHBondContact O-N 3Å; M1-L301 HydrophobicContact CE-CD2 4Å; M1-H304 HydrophobicContact CG-CB 3.87Å; M1-P306 HydrophobicContact CB-CB 4.17Å; M1-P367 HydrophobicContact CE-CB 4.22Å; M1-P367 HydrophobicContact CG-CB 4.17Å; M1-P367 HydrophobicContact CG-CG 4.27Å; M1-P367 HydrophobicContact SD-CB 3.72Å; M1-P367 HydrophobicContact SD-CG 3.99Å; M1-F371 HydrophobicContact CE-CB 3.94Å; M1-F371 HydrophobicContact CE-CG 4.35Å | |||
| 2 | L | 89.3 | Confident | 94.5 | Very high | 95 Ų | 95 | 60.2 Ų | 60.2 | 50% | 0.497 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -54.5 | -56.9 | -177.1 | -170.6 | 148.8 | 0 | 0 | 0 | 113.7 | T4 A5 Y6 P307 | L2-T4 VanDerWaalsContact C-N 3.27Å; L2-T4 PolarHBondContact O-N 2.69Å; L2-A5 PolarHBondContact O-N 2.66Å; L2-Y6 HydrophobicContact CD2-CD2 3.71Å; L2-Y6 HydrophobicContact CD2-CE2 3.79Å; L2-Y6 HydrophobicContact CG-CD2 4.04Å; L2-Y6 HydrophobicContact CG-CE2 3.88Å; L2-Y6 VanDerWaalsContact O-CD2 3.3Å; L2-Y6 WeakPolarHBondContact O-CD2 3.19Å; L2-Y6 PolarHBondContact O-N 3.11Å; L2-Y6 VanDerWaalsContact O-N 3.14Å; L2-P307 HydrophobicContact CG-CG 4.42Å |
| 3 | V | 91.9 | Very high | 94.6 | Very high | 116 Ų | 116 | 61.1 Ų | 61.1 | 70% | 0.703 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -57.6 | -42 | 179.2 | 178.5 | 0 | 0 | 0 | 0 | 111.5 | M1 A5 Y6 F7 | M1-V3 PolarHBondContact O-N 3.35Å; V3-A5 PolarHBondContact O-N 3.11Å; V3-Y6 PolarHBondContact O-N 3.38Å; V3-F7 VanDerWaalsContact O-CB 3.29Å; V3-F7 WeakPolarHBondContact O-CB 3.34Å; V3-F7 PolarHBondContact O-N 2.83Å |
| 4 | T | 93.1 | Very high | 94.7 | Very high | 49 Ų | 49 | 61.2 Ų | 61.2 | 30% | 0.301 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 178.3 | -47 | 0 | 0 | 0 | 0 | 112 | M1 L2 A8 H368 F371 | M1-T4 WeakPolarHBondContact O-CB 3.36Å; M1-T4 PolarHBondContact O-N 3.39Å; L2-T4 VanDerWaalsContact C-N 3.27Å; L2-T4 PolarHBondContact O-N 2.69Å; T4-A8 WeakPolarHBondContact O-CB 3.36Å; T4-A8 PolarHBondContact O-N 3.44Å; T4-H368 PolarHBondContact OG1-CE1 2.9Å; T4-H368 PolarHBondContact OG1-ND1 3.39Å; T4-F371 HydrophobicContact CG2-CD1 4.18Å; T4-F371 HydrophobicContact CG2-CE1 4.35Å |
| 5 | A | 93.8 | Very high | 94.8 | Very high | 1 Ų | 1 | 62.3 Ų | 62.3 | 1% | 0.008 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.6 | -45.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | M1 L2 V3 A8 I9 P307 I310 V311 C314 | M1-A5 PolarHBondContact O-N 3Å; L2-A5 PolarHBondContact O-N 2.66Å; V3-A5 PolarHBondContact O-N 3.11Å; A5-A8 PolarHBondContact O-N 3.25Å; A5-I9 PolarHBondContact O-N 3.07Å; A5-P307 HydrophobicContact CB-CG 4.1Å; A5-I310 HydrophobicContact CB-CG2 4.15Å; A5-V311 HydrophobicContact CB-CG2 4.18Å; A5-C314 PolarHBondContact O-SG 3.2Å; A5-C314 VanDerWaalsContact O-SG 3.4Å |
| 6 | Y | 95.8 | Very high | 94.7 | Very high | 64 Ų | 64 | 58.9 Ų | 58.9 | 25% | 0.251 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.6 | -39.4 | 177.1 | -78.7 | -75.2 | 0 | 0 | 0 | 112.9 | L2 V3 I9 I10 W198 P307 I310 | L2-Y6 HydrophobicContact CD2-CD2 3.71Å; L2-Y6 HydrophobicContact CD2-CE2 3.79Å; L2-Y6 HydrophobicContact CG-CD2 4.04Å; L2-Y6 HydrophobicContact CG-CE2 3.88Å; L2-Y6 VanDerWaalsContact O-CD2 3.3Å; L2-Y6 WeakPolarHBondContact O-CD2 3.19Å; L2-Y6 PolarHBondContact O-N 3.11Å; L2-Y6 VanDerWaalsContact O-N 3.14Å; V3-Y6 PolarHBondContact O-N 3.38Å; Y6-I9 WeakPolarHBondContact O-CG2 3.38Å; Y6-I10 WeakPolarHBondContact O-CD1 3.44Å; Y6-I10 VanDerWaalsContact O-CG1 3.3Å; Y6-I10 WeakPolarHBondContact O-CG1 3.35Å; Y6-I10 PolarHBondContact O-N 3.33Å; Y6-W198 HydrophobicContact CE1-CZ2 4.11Å; Y6-W198 PolarHBondContact OH-NE1 2.93Å; Y6-W198 VanDerWaalsContact OH-NE1 3.07Å; Y6-P307 HydrophobicContact CD2-CG 4.34Å; Y6-P307 HydrophobicContact CE2-CB 4.35Å; Y6-P307 HydrophobicContact CE2-CG 3.81Å; Y6-I310 HydrophobicContact CD1-CG1 4.43Å; Y6-I310 HydrophobicContact CD1-CG2 4.32Å; Y6-I310 HydrophobicContact CE1-CD1 3.9Å; Y6-I310 HydrophobicContact CE1-CG1 3.76Å; Y6-I310 HydrophobicContact CE1-CG2 4.46Å |
| 7 | F | 96.5 | Very high | 94.7 | Very high | 142 Ų | 142 | 61.6 Ų | 61.6 | 62% | 0.623 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -64.1 | -45.2 | 174.1 | -179.3 | -102.9 | 0 | 0 | 0 | 111.2 | V3 I9 I10 V11 | V3-F7 VanDerWaalsContact O-CB 3.29Å; V3-F7 WeakPolarHBondContact O-CB 3.34Å; V3-F7 PolarHBondContact O-N 2.83Å; F7-I9 PolarHBondContact O-N 3.44Å; F7-I10 PolarHBondContact O-N 3.21Å; F7-V11 HydrophobicContact CD1-CG2 4.22Å; F7-V11 HydrophobicContact CE1-CG2 3.79Å; F7-V11 HydrophobicContact CE2-CG2 4.11Å; F7-V11 HydrophobicContact CZ-CG2 3.73Å; F7-V11 WeakPolarHBondContact O-CG2 3.49Å; F7-V11 PolarHBondContact O-N 3.19Å |
| 8 | A | 96.3 | Very high | 94.6 | Very high | 13 Ų | 13 | 60.1 Ų | 60.1 | 11% | 0.107 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.3 | -45.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T4 A5 I10 V11 L12 F371 L375 | T4-A8 WeakPolarHBondContact O-CB 3.36Å; T4-A8 PolarHBondContact O-N 3.44Å; A5-A8 PolarHBondContact O-N 3.25Å; A8-I10 VanDerWaalsContact C-N 3.33Å; A8-I10 PolarHBondContact O-N 3.31Å; A8-V11 PolarHBondContact O-N 3.37Å; A8-L12 WeakPolarHBondContact O-CB 3.37Å; A8-L12 VanDerWaalsContact O-CG 3.25Å; A8-L12 WeakPolarHBondContact O-CG 3.36Å; A8-L12 PolarHBondContact O-N 2.74Å; A8-F371 HydrophobicContact CB-CE1 3.79Å; A8-F371 HydrophobicContact CB-CZ 4.07Å; A8-L375 HydrophobicContact CB-CD1 4.49Å |
| 9 | I | 96.8 | Very high | 94.5 | Very high | 9 Ų | 9 | 58.2 Ų | 58.2 | 5% | 0.046 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63 | -39.9 | 178.9 | -170.3 | 60.3 | 0 | 0 | 0 | 111.7 | A5 Y6 F7 L12 L13 V186 I310 A317 | A5-I9 PolarHBondContact O-N 3.07Å; Y6-I9 WeakPolarHBondContact O-CG2 3.38Å; F7-I9 PolarHBondContact O-N 3.44Å; I9-L12 PolarHBondContact O-N 3.23Å; I9-L13 HydrophobicContact CD1-CD1 4.29Å; I9-L13 HydrophobicContact CD1-CD2 4.49Å; I9-L13 HydrophobicContact CD1-CG 4.06Å; I9-L13 HydrophobicContact CG1-CD1 3.92Å; I9-L13 HydrophobicContact CG1-CG 4.15Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CG 3.48Å; I9-L13 PolarHBondContact O-N 3.41Å; I9-V186 HydrophobicContact CD1-CG1 4.4Å; I9-I310 HydrophobicContact CB-CG2 4.26Å; I9-I310 HydrophobicContact CG2-CG2 3.91Å; I9-A317 HydrophobicContact CD1-CB 4.04Å |
| 10 | I | 97.1 | Very high | 94.3 | Very high | 113 Ų | 113 | 56.9 Ų | 56.9 | 58% | 0.579 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -62.6 | -47 | 177.8 | -67.2 | 166.4 | 0 | 0 | 0 | 110.3 | Y6 F7 A8 L13 A14 | Y6-I10 WeakPolarHBondContact O-CD1 3.44Å; Y6-I10 VanDerWaalsContact O-CG1 3.3Å; Y6-I10 WeakPolarHBondContact O-CG1 3.35Å; Y6-I10 PolarHBondContact O-N 3.33Å; F7-I10 PolarHBondContact O-N 3.21Å; A8-I10 VanDerWaalsContact C-N 3.33Å; A8-I10 PolarHBondContact O-N 3.31Å; I10-L13 PolarHBondContact O-N 3.05Å; I10-A14 WeakPolarHBondContact O-CB 3.38Å; I10-A14 PolarHBondContact O-N 3.42Å |
| 11 | V | 97.5 | Very high | 94.1 | Very high | 69 Ų | 69 | 59.6 Ų | 59.6 | 42% | 0.418 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.9 | -45.4 | 178.5 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | F7 A8 A14 L15 | F7-V11 HydrophobicContact CD1-CG2 4.22Å; F7-V11 HydrophobicContact CE1-CG2 3.79Å; F7-V11 HydrophobicContact CE2-CG2 4.11Å; F7-V11 HydrophobicContact CZ-CG2 3.73Å; F7-V11 WeakPolarHBondContact O-CG2 3.49Å; F7-V11 PolarHBondContact O-N 3.19Å; A8-V11 PolarHBondContact O-N 3.37Å; V11-A14 PolarHBondContact O-N 3.37Å; V11-L15 WeakPolarHBondContact O-CB 3.43Å; V11-L15 PolarHBondContact O-N 3.29Å |
| 12 | L | 97.2 | Very high | 94.1 | Very high | 20 Ų | 20 | 61 Ų | 61 | 11% | 0.105 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.1 | -41 | 179.7 | -72.7 | 166.9 | 0 | 0 | 0 | 111.9 | A8 I9 L15 C16 C314 A317 A318 V321 L375 | A8-L12 WeakPolarHBondContact O-CB 3.37Å; A8-L12 VanDerWaalsContact O-CG 3.25Å; A8-L12 WeakPolarHBondContact O-CG 3.36Å; A8-L12 PolarHBondContact O-N 2.74Å; I9-L12 PolarHBondContact O-N 3.23Å; L12-L15 PolarHBondContact O-N 3.46Å; L12-C16 PolarHBondContact O-N 2.95Å; L12-C16 PolarHBondContact O-SG 2.94Å; L12-C16 VanDerWaalsContact O-SG 3.34Å; L12-C314 HydrophobicContact CD1-CB 3.86Å; L12-C314 WeakPolarHBondContact CD1-O 3.15Å; L12-A317 HydrophobicContact CB-CB 3.89Å; L12-A317 HydrophobicContact CD1-CB 4.35Å; L12-A318 HydrophobicContact CD2-CB 4.29Å; L12-V321 HydrophobicContact CD2-CG2 4.31Å; L12-L375 HydrophobicContact CD1-CD2 4.03Å |
| 13 | L | 95.8 | Very high | 93.9 | Very high | 72 Ų | 72 | 56.6 Ų | 56.6 | 38% | 0.377 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.7 | -43.6 | 175.4 | -71.8 | 176.3 | 0 | 0 | 0 | 111.6 | I9 I10 L15 C16 V17 V186 | I9-L13 HydrophobicContact CD1-CD1 4.29Å; I9-L13 HydrophobicContact CD1-CD2 4.49Å; I9-L13 HydrophobicContact CD1-CG 4.06Å; I9-L13 HydrophobicContact CG1-CD1 3.92Å; I9-L13 HydrophobicContact CG1-CG 4.15Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CG 3.48Å; I9-L13 PolarHBondContact O-N 3.41Å; I10-L13 PolarHBondContact O-N 3.05Å; L13-L15 VanDerWaalsContact C-N 3.29Å; L13-L15 PolarHBondContact O-N 3.33Å; L13-C16 PolarHBondContact O-N 2.91Å; L13-V17 WeakPolarHBondContact O-CG2 3.35Å; L13-V17 PolarHBondContact O-N 3.22Å; L13-V186 HydrophobicContact CD2-CG1 4.08Å |
| 14 | A | 96.3 | Very high | 93.5 | Very high | 63 Ų | 63 | 59.5 Ų | 59.5 | 52% | 0.521 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.6 | -41.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | I10 V11 V17 G18 | I10-A14 WeakPolarHBondContact O-CB 3.38Å; I10-A14 PolarHBondContact O-N 3.42Å; V11-A14 PolarHBondContact O-N 3.37Å; A14-V17 PolarHBondContact O-N 2.98Å; A14-G18 PolarHBondContact O-N 3.07Å |
| 15 | L | 96 | Very high | 93 | Very high | 77 Ų | 77 | 66 Ų | 66 | 40% | 0.403 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.6 | -44.9 | 175.8 | -176.1 | 61.6 | 0 | 0 | 0 | 111.8 | V11 L12 L13 V17 G18 L19 V321 | V11-L15 WeakPolarHBondContact O-CB 3.43Å; V11-L15 PolarHBondContact O-N 3.29Å; L12-L15 PolarHBondContact O-N 3.46Å; L13-L15 VanDerWaalsContact C-N 3.29Å; L13-L15 PolarHBondContact O-N 3.33Å; L15-V17 VanDerWaalsContact C-N 3.33Å; L15-V17 PolarHBondContact O-N 2.81Å; L15-G18 PolarHBondContact O-N 2.69Å; L15-L19 HydrophobicContact CD1-CD1 4Å; L15-L19 HydrophobicContact CD1-CG 3.98Å; L15-L19 HydrophobicContact CG-CD1 3.86Å; L15-L19 HydrophobicContact CG-CG 4.26Å; L15-L19 WeakPolarHBondContact O-CB 3.31Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.31Å; L15-L19 PolarHBondContact O-N 3.34Å; L15-V321 HydrophobicContact CB-CG2 4.39Å; L15-V321 HydrophobicContact CD2-CB 4.48Å; L15-V321 HydrophobicContact CD2-CG1 3.69Å; L15-V321 HydrophobicContact CD2-CG2 3.89Å; L15-V321 HydrophobicContact CG-CG1 4.26Å; L15-V321 HydrophobicContact CG-CG2 4.07Å |
| 16 | C | 93.9 | Very high | 92.2 | Very high | 8 Ų | 8 | 68 Ų | 68 | 5% | 0.054 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -55.7 | -47.5 | 174.2 | -76.8 | 0 | 0 | 0 | 0 | 111.5 | L12 L13 E20 M320 V321 L324 | L12-C16 PolarHBondContact O-N 2.95Å; L12-C16 PolarHBondContact O-SG 2.94Å; L12-C16 VanDerWaalsContact O-SG 3.34Å; L13-C16 PolarHBondContact O-N 2.91Å; C16-E20 WeakPolarHBondContact O-CB 3.47Å; C16-E20 PolarHBondContact O-N 2.74Å; C16-M320 HydrophobicContact CB-CE 4.48Å; C16-M320 HydrophobicContact CB-SD 4.44Å; C16-V321 WeakPolarHBondContact SG-CG2 3.45Å; C16-L324 HydrophobicContact CB-CD1 4.28Å |
| 17 | V | 93.4 | Very high | 90.8 | Very high | 105 Ų | 105 | 68 Ų | 68 | 64% | 0.636 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -63.6 | -45.5 | 178.5 | 173.3 | 0 | 0 | 0 | 0 | 111 | L13 A14 L15 E20 F21 | L13-V17 WeakPolarHBondContact O-CG2 3.35Å; L13-V17 PolarHBondContact O-N 3.22Å; A14-V17 PolarHBondContact O-N 2.98Å; L15-V17 VanDerWaalsContact C-N 3.33Å; L15-V17 PolarHBondContact O-N 2.81Å; V17-E20 PolarHBondContact O-N 3.21Å; V17-F21 WeakPolarHBondContact O-CB 3.34Å; V17-F21 PolarHBondContact O-N 2.77Å |
| 18 | G | 93.8 | Very high | 88.9 | Confident | 34 Ų | 34 | 65.4 Ų | 65.4 | 35% | 0.351 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.8 | -43.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A14 L15 T22 | A14-G18 PolarHBondContact O-N 3.07Å; L15-G18 PolarHBondContact O-N 2.69Å; G18-T22 WeakPolarHBondContact O-CB 3.48Å; G18-T22 PolarHBondContact O-N 2.91Å; G18-T22 PolarHBondContact O-OG1 2.86Å |
| 19 | L | 92.5 | Very high | 86.6 | Confident | 24 Ų | 24 | 71 Ų | 71 | 13% | 0.126 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -69.3 | -40.3 | 177.4 | -70.7 | 175.8 | 0 | 0 | 0 | 112.1 | L15 T22 A23 V321 L324 L325 L328 | L15-L19 HydrophobicContact CD1-CD1 4Å; L15-L19 HydrophobicContact CD1-CG 3.98Å; L15-L19 HydrophobicContact CG-CD1 3.86Å; L15-L19 HydrophobicContact CG-CG 4.26Å; L15-L19 WeakPolarHBondContact O-CB 3.31Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.31Å; L15-L19 PolarHBondContact O-N 3.34Å; L19-T22 PolarHBondContact O-N 3.37Å; L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.31Å; L19-A23 PolarHBondContact O-N 3.49Å; L19-V321 HydrophobicContact CD1-CG1 3.79Å; L19-L324 HydrophobicContact CB-CB 4.14Å; L19-L324 HydrophobicContact CB-CD1 4.02Å; L19-L324 HydrophobicContact CD1-CB 4.36Å; L19-L325 HydrophobicContact CD1-CD2 4.08Å; L19-L325 HydrophobicContact CD1-CG 4.16Å; L19-L325 HydrophobicContact CD2-CD2 4.11Å; L19-L328 HydrophobicContact CD2-CD1 3.77Å |
| 20 | E | 90.2 | Very high | 84.3 | Confident | 32 Ų | 32 | 77.8 Ų | 77.8 | 15% | 0.15 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.5 | -44.1 | 175.4 | 179.3 | 64.6 | -167.5 | 0 | 0 | 110.9 | C16 V17 T22 A23 R24 L324 R327 | C16-E20 WeakPolarHBondContact O-CB 3.47Å; C16-E20 PolarHBondContact O-N 2.74Å; V17-E20 PolarHBondContact O-N 3.21Å; E20-T22 VanDerWaalsContact C-N 3.34Å; E20-T22 PolarHBondContact O-N 3.34Å; E20-A23 PolarHBondContact O-N 3.27Å; E20-R24 WeakPolarHBondContact O-CB 3.47Å; E20-R24 VanDerWaalsContact O-CG 3.31Å; E20-R24 WeakPolarHBondContact O-CG 3.4Å; E20-R24 PolarHBondContact O-N 2.92Å; E20-R24 IonicContact OE1-CZ 3.57Å; E20-R24 VanDerWaalsContact OE1-CZ 3.29Å; E20-R24 IonicContact OE1-NE 3.47Å; E20-R24 PolarHBondContact OE1-NE 2.91Å; E20-R24 IonicContact OE1-NH2 3.72Å; E20-R24 PolarHBondContact OE1-NH2 3.48Å; E20-L324 HydrophobicContact CB-CD2 4.45Å; E20-L324 WeakPolarHBondContact OE2-CD2 3.36Å; E20-R327 IonicContact OE2-CZ 3.29Å; E20-R327 IonicContact OE2-NH1 3.05Å; E20-R327 PolarHBondContact OE2-NH1 3.18Å; E20-R327 IonicContact OE2-NH2 3.42Å; E20-R327 PolarHBondContact OE2-NH2 2.9Å |
| 21 | F | 90 | Very high | 81.7 | Confident | 115 Ų | 115 | 77.6 Ų | 77.6 | 50% | 0.504 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.6 | -43.3 | 175.1 | -173.5 | -107.7 | 0 | 0 | 0 | 112.1 | V17 R24 R25 | V17-F21 WeakPolarHBondContact O-CB 3.34Å; V17-F21 PolarHBondContact O-N 2.77Å; F21-R24 PolarHBondContact O-N 3.45Å; F21-R25 WeakPolarHBondContact O-CG 3.3Å; F21-R25 PolarHBondContact O-N 3.25Å; F21-R25 VanDerWaalsContact O-N 3.13Å |
| 22 | T | 88.6 | Confident | 79.3 | Confident | 61 Ų | 61 | 79.2 Ų | 79.2 | 37% | 0.374 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -63.8 | -46.3 | 177.7 | -58 | 0 | 0 | 0 | 0 | 111.4 | G18 L19 E20 R24 R25 L26 L328 | G18-T22 WeakPolarHBondContact O-CB 3.48Å; G18-T22 PolarHBondContact O-N 2.91Å; G18-T22 PolarHBondContact O-OG1 2.86Å; L19-T22 PolarHBondContact O-N 3.37Å; E20-T22 VanDerWaalsContact C-N 3.34Å; E20-T22 PolarHBondContact O-N 3.34Å; T22-R24 VanDerWaalsContact C-N 3.35Å; T22-R24 PolarHBondContact O-N 3.43Å; T22-R25 PolarHBondContact O-N 3.2Å; T22-R25 VanDerWaalsContact O-N 3.17Å; T22-L26 HydrophobicContact CG2-CD1 3.79Å; T22-L26 HydrophobicContact CG2-CG 4.43Å; T22-L26 WeakPolarHBondContact O-CG 3.38Å; T22-L26 PolarHBondContact O-N 2.67Å; T22-L328 HydrophobicContact CG2-CD2 4.48Å |
| 23 | A | 84.8 | Confident | 77.4 | Confident | 2 Ų | 2 | 80.9 Ų | 80.9 | 2% | 0.017 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -64 | -38.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L19 E20 R25 L26 T27 L328 | L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.31Å; L19-A23 PolarHBondContact O-N 3.49Å; E20-A23 PolarHBondContact O-N 3.27Å; A23-R25 VanDerWaalsContact C-N 3.31Å; A23-R25 PolarHBondContact O-N 2.96Å; A23-L26 PolarHBondContact O-N 3.14Å; A23-T27 WeakPolarHBondContact O-CB 3.4Å; A23-T27 PolarHBondContact O-N 2.95Å; A23-T27 PolarHBondContact O-OG1 3.05Å; A23-L328 HydrophobicContact CB-CD2 3.76Å; A23-L328 HydrophobicContact CB-CG 4.21Å |
| 24 | R | 83.4 | Confident | 75.5 | Confident | 177 Ų | 177 | 82.7 Ų | 82.7 | 67% | 0.668 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -64.7 | -34.2 | 173.9 | -74.1 | 179.6 | -172.9 | -167.5 | 4.1 | 113 | E20 F21 T22 | E20-R24 WeakPolarHBondContact O-CB 3.47Å; E20-R24 VanDerWaalsContact O-CG 3.31Å; E20-R24 WeakPolarHBondContact O-CG 3.4Å; E20-R24 PolarHBondContact O-N 2.92Å; E20-R24 IonicContact OE1-CZ 3.57Å; E20-R24 VanDerWaalsContact OE1-CZ 3.29Å; E20-R24 IonicContact OE1-NE 3.47Å; E20-R24 PolarHBondContact OE1-NE 2.91Å; E20-R24 IonicContact OE1-NH2 3.72Å; E20-R24 PolarHBondContact OE1-NH2 3.48Å; F21-R24 PolarHBondContact O-N 3.45Å; T22-R24 VanDerWaalsContact C-N 3.35Å; T22-R24 PolarHBondContact O-N 3.43Å |
| 25 | R | 84.3 | Confident | 73.8 | Confident | 186 Ų | 186 | 79.8 Ų | 79.8 | 70% | 0.702 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -71.9 | -35.1 | 175.1 | -74.9 | -177.2 | 173.4 | -127.1 | -0.2 | 112.8 | F21 T22 A23 | F21-R25 WeakPolarHBondContact O-CG 3.3Å; F21-R25 PolarHBondContact O-N 3.25Å; F21-R25 VanDerWaalsContact O-N 3.13Å; T22-R25 PolarHBondContact O-N 3.2Å; T22-R25 VanDerWaalsContact O-N 3.17Å; A23-R25 VanDerWaalsContact C-N 3.31Å; A23-R25 PolarHBondContact O-N 2.96Å |
| 26 | L | 77 | Confident | 72.2 | Confident | 42 Ų | 42 | 77.7 Ų | 77.7 | 22% | 0.22 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -84.7 | -23.4 | -176.9 | -68.8 | 174.4 | 0 | 0 | 0 | 113.5 | T22 A23 P28 L328 | T22-L26 HydrophobicContact CG2-CD1 3.79Å; T22-L26 HydrophobicContact CG2-CG 4.43Å; T22-L26 WeakPolarHBondContact O-CG 3.38Å; T22-L26 PolarHBondContact O-N 2.67Å; A23-L26 PolarHBondContact O-N 3.14Å; L26-P28 WeakPolarHBondContact O-CD 3.19Å; L26-L328 HydrophobicContact CD1-CD2 3.75Å |
| 27 | T | 66.3 | Low | 71.3 | Confident | 65 Ų | 65 | 80.8 Ų | 80.8 | 40% | 0.399 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -83.1 | 113.5 | 175 | -49.3 | 0 | 0 | 0 | 0 | 107.8 | A23 | A23-T27 WeakPolarHBondContact O-CB 3.4Å; A23-T27 PolarHBondContact O-N 2.95Å; A23-T27 PolarHBondContact O-OG1 3.05Å |
| 28 | P | 56.1 | Low | 70.9 | Confident | 86 Ų | 86 | 78.2 Ų | 78.2 | 56% | 0.558 | 44% | 0.435 | S | S | * | . | trans | -57.5 | 147.8 | 174.8 | 23.2 | -31.3 | 0 | 0 | 0 | 109.4 | L26 Q30 | L26-P28 WeakPolarHBondContact O-CD 3.19Å; P28-Q30 PolarHBondContact O-N 2.98Å | ||
| 29 | P | 48.2 | Very low | 70.6 | Confident | 131 Ų | 131 | 81.5 Ų | 81.5 | 85% | 0.851 | 45% | 0.45 | S | S | * | . | trans | -58.1 | 105.1 | 174.3 | 23.4 | -30.6 | 0 | 0 | 0 | 107.9 | S31 | P29-S31 PolarHBondContact O-N 3.12Š| ||
| 30 | Q | 47.5 | Very low | 70.4 | Confident | 152 Ų | 152 | 82.2 Ų | 82.2 | 71% | 0.71 | 46% | 0.46 | S | S | * | . | trans | -56.8 | 132.8 | 168.1 | -75.4 | -174.5 | -16.7 | 0 | 0 | 106.7 | P28 T32 | P28-Q30 PolarHBondContact O-N 2.98Å; Q30-T32 PolarHBondContact O-N 3.04Å | ||
| 31 | S | 42.1 | Very low | 70.4 | Confident | 108 Ų | 108 | 80.7 Ų | 80.7 | 76% | 0.755 | 45% | 0.453 | S | S | * | . | trans | -45.3 | 120.9 | 166.2 | 49.7 | 0 | 0 | 0 | 0 | 107.5 | P29 P33 | P29-S31 PolarHBondContact O-N 3.12Å; S31-P33 WeakPolarHBondContact O-CD 3.2Å | ||
| 32 | T | 47.8 | Very low | 70.3 | Confident | 104 Ų | 104 | 81.8 Ų | 81.8 | 64% | 0.638 | 45% | 0.453 | S | S | * | . | trans | -38.8 | 111.9 | -177.3 | -44.7 | 0 | 0 | 0 | 0 | 108.6 | Q30 T34 V36 | Q30-T32 PolarHBondContact O-N 3.04Å; T32-T34 PolarHBondContact O-N 2.82Å; T32-V36 HydrophobicContact CG2-CB 4.01Å; T32-V36 HydrophobicContact CG2-CG1 4.09Å | ||
| 33 | P | 56.7 | Low | 70.4 | Confident | 55 Ų | 55 | 85.6 Ų | 85.6 | 36% | 0.357 | 46% | 0.461 | S | S | . | . | trans | -54.8 | 133.4 | -177.6 | -22.2 | 29.1 | 0 | 0 | 0 | 107.1 | S31 A35 V36 | S31-P33 WeakPolarHBondContact O-CD 3.2Å; P33-A35 HydrophobicContact CB-CB 4.22Å; P33-A35 PolarHBondContact O-N 2.82Å; P33-V36 HydrophobicContact CB-CG2 4.29Å; P33-V36 HydrophobicContact CG-CG2 4.21Å; P33-V36 WeakPolarHBondContact O-CA 3.42Å; P33-V36 WeakPolarHBondContact O-CB 3.28Å; P33-V36 PolarHBondContact O-N 2.72Å | ||
| 34 | T | 56.8 | Low | 70.7 | Confident | 110 Ų | 110 | 85.7 Ų | 85.7 | 68% | 0.675 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -48.4 | -29.5 | 176.9 | 19.7 | 0 | 0 | 0 | 0 | 111.8 | T32 V36 A37 | T32-T34 PolarHBondContact O-N 2.82Å; T34-V36 VanDerWaalsContact C-N 3.33Å; T34-V36 PolarHBondContact O-N 3.22Å; T34-A37 PolarHBondContact O-N 3.06Å; T34-A37 VanDerWaalsContact O-N 3.11Å |
| 35 | A | 59.8 | Low | 71.1 | Confident | 1 Ų | 1 | 77.6 Ų | 77.6 | 1% | 0.008 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -48.7 | -47.9 | 168 | 0 | 0 | 0 | 0 | 0 | 114 | P33 A37 N38 F41 W169 | P33-A35 HydrophobicContact CB-CB 4.22Å; P33-A35 PolarHBondContact O-N 2.82Å; A35-A37 PolarHBondContact O-N 3.06Å; A35-N38 PolarHBondContact O-N 3.19Å; A35-F41 HydrophobicContact CB-CD1 4.37Å; A35-F41 HydrophobicContact CB-CE1 4.06Å; A35-F41 WeakPolarHBondContact O-CD1 3.37Å; A35-W169 VanDerWaalsContact CA-CD2 3.49Å; A35-W169 HydrophobicContact CB-CB 4.03Å; A35-W169 VanDerWaalsContact CB-CD1 3.47Å; A35-W169 HydrophobicContact CB-CD2 3.4Å; A35-W169 VanDerWaalsContact CB-CD2 3.4Å; A35-W169 HydrophobicContact CB-CE3 4.06Å; A35-W169 HydrophobicContact CB-CG 3.36Å; A35-W169 HydrophobicContact CB-CZ2 4.31Å |
| 36 | V | 64.2 | Low | 71.5 | Confident | 34 Ų | 34 | 71.1 Ų | 71.1 | 21% | 0.206 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -72.1 | -19.8 | -176.4 | -179.2 | 0 | 0 | 0 | 0 | 110.6 | T32 P33 T34 R42 | T32-V36 HydrophobicContact CG2-CB 4.01Å; T32-V36 HydrophobicContact CG2-CG1 4.09Å; P33-V36 HydrophobicContact CB-CG2 4.29Å; P33-V36 HydrophobicContact CG-CG2 4.21Å; P33-V36 WeakPolarHBondContact O-CA 3.42Å; P33-V36 WeakPolarHBondContact O-CB 3.28Å; P33-V36 PolarHBondContact O-N 2.72Å; T34-V36 VanDerWaalsContact C-N 3.33Å; T34-V36 PolarHBondContact O-N 3.22Å; V36-R42 VanDerWaalsContact CG1-NH2 3.29Å; V36-R42 PolarHBondContact O-NE 3.24Å; V36-R42 PolarHBondContact O-NH2 2.87Å |
| 37 | A | 73.2 | Confident | 72.2 | Confident | 73 Ų | 73 | 70 Ų | 70 | 60% | 0.603 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -78.2 | -24.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | T34 A35 P39 | T34-A37 PolarHBondContact O-N 3.06Å; T34-A37 VanDerWaalsContact O-N 3.11Å; A35-A37 PolarHBondContact O-N 3.06Å; A37-P39 WeakPolarHBondContact O-CD 3.5Å |
| 38 | N | 86.1 | Confident | 73.5 | Confident | 51 Ų | 51 | 66.9 Ų | 66.9 | 27% | 0.273 | 39% | 0.389 | S | S | . | . | trans | -78.2 | 116.6 | -174.1 | -174.2 | -32.1 | 0 | 0 | 0 | 112 | A35 A40 F41 R42 W169 | A35-N38 PolarHBondContact O-N 3.19Å; N38-A40 PolarHBondContact O-N 2.99Å; N38-A40 WeakPolarHBondContact OD1-CB 3.17Å; N38-A40 PolarHBondContact OD1-N 3.43Å; N38-F41 HydrophobicContact CB-CB 3.97Å; N38-F41 PolarHBondContact O-N 3.35Å; N38-F41 PolarHBondContact OD1-N 3.39Å; N38-R42 PolarHBondContact O-N 3.27Å; N38-R42 VanDerWaalsContact O-N 3.11Å; N38-W169 HydrophobicContact CB-CH2 4Å; N38-W169 HydrophobicContact CB-CZ3 4.08Å | ||
| 39 | P | 88.1 | Confident | 75.3 | Confident | 102 Ų | 102 | 63.8 Ų | 63.8 | 66% | 0.662 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -67.9 | -32.2 | -178.3 | 27.3 | -34.1 | 0 | 0 | 0 | 113.2 | A37 R42 R43 | A37-P39 WeakPolarHBondContact O-CD 3.5Å; P39-R42 PolarHBondContact O-N 3.23Å; P39-R43 PolarHBondContact O-N 2.93Å |
| 40 | A | 87.9 | Confident | 77.5 | Confident | 39 Ų | 39 | 64.3 Ų | 64.3 | 32% | 0.322 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67.7 | -42.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | N38 R43 F44 F165 | N38-A40 PolarHBondContact O-N 2.99Å; N38-A40 WeakPolarHBondContact OD1-CB 3.17Å; N38-A40 PolarHBondContact OD1-N 3.43Å; A40-R43 PolarHBondContact O-N 3.44Å; A40-F44 WeakPolarHBondContact O-CB 3.49Å; A40-F44 PolarHBondContact O-N 3.3Å; A40-F165 HydrophobicContact CB-CZ 4.33Å |
| 41 | F | 89.6 | Confident | 79.8 | Confident | 1 Ų | 1 | 57 Ų | 57 | 0% | 0.004 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 174.1 | 176.3 | -107.5 | 0 | 0 | 0 | 111.7 | A35 N38 R43 F44 Q45 H159 F165 W169 | A35-F41 HydrophobicContact CB-CD1 4.37Å; A35-F41 HydrophobicContact CB-CE1 4.06Å; A35-F41 WeakPolarHBondContact O-CD1 3.37Å; N38-F41 HydrophobicContact CB-CB 3.97Å; N38-F41 PolarHBondContact O-N 3.35Å; N38-F41 PolarHBondContact OD1-N 3.39Å; F41-R43 PolarHBondContact O-N 3.4Å; F41-F44 PolarHBondContact O-N 3.03Å; F41-Q45 WeakPolarHBondContact O-CB 3.46Å; F41-Q45 PolarHBondContact O-N 3Å; F41-H159 AromaticContact CE2-CE1 3.59Å; F41-H159 AromaticContact CE2-ND1 3.79Å; F41-F165 HydrophobicContact CB-CE1 4.29Å; F41-F165 HydrophobicContact CB-CE2 4.24Å; F41-F165 HydrophobicContact CB-CZ 4.04Å; F41-F165 AromaticContact CD2-CD2 3.84Å; F41-F165 HydrophobicContact CD2-CD2 3.84Å; F41-F165 AromaticContact CD2-CE2 3.99Å; F41-F165 HydrophobicContact CD2-CE2 3.99Å; F41-F165 HydrophobicContact CD2-CG 4.31Å; F41-W169 HydrophobicContact CB-CE3 4.12Å; F41-W169 HydrophobicContact CB-CZ3 3.88Å; F41-W169 HydrophobicContact CD1-CE3 4.15Å; F41-W169 AromaticContact CD2-CE3 3.7Å; F41-W169 HydrophobicContact CD2-CE3 3.7Å; F41-W169 HydrophobicContact CD2-CZ3 4.29Å; F41-W169 HydrophobicContact CE2-CB 4.04Å; F41-W169 HydrophobicContact CE2-CE3 4.12Å; F41-W169 AromaticContact CG-CE3 3.7Å; F41-W169 HydrophobicContact CG-CE3 3.7Å; F41-W169 AromaticContact CG-CZ3 3.99Å; F41-W169 HydrophobicContact CG-CZ3 3.99Å; F41-W169 HydrophobicContact CZ-CB 3.94Å; F41-W169 HydrophobicContact CZ-CE3 4.49Å |
| 42 | R | 88.9 | Confident | 82.3 | Confident | 137 Ų | 137 | 53.3 Ų | 53.3 | 52% | 0.517 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.4 | -42 | 176.1 | -72.7 | -172.2 | -177.4 | -179.3 | 6.2 | 112.8 | V36 N38 P39 S46 | V36-R42 VanDerWaalsContact CG1-NH2 3.29Å; V36-R42 PolarHBondContact O-NE 3.24Å; V36-R42 PolarHBondContact O-NH2 2.87Å; N38-R42 PolarHBondContact O-N 3.27Å; N38-R42 VanDerWaalsContact O-N 3.11Å; P39-R42 PolarHBondContact O-N 3.23Å; R42-S46 WeakPolarHBondContact O-CB 3.48Å; R42-S46 PolarHBondContact O-N 3.38Å |
| 43 | R | 90.1 | Very high | 84.6 | Confident | 142 Ų | 142 | 49.7 Ų | 49.7 | 54% | 0.536 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.6 | -50.7 | 176.7 | -177.2 | 176.9 | 174.1 | -156.5 | -8.4 | 110.3 | P39 A40 F41 S46 I47 E231 | P39-R43 PolarHBondContact O-N 2.93Å; A40-R43 PolarHBondContact O-N 3.44Å; F41-R43 PolarHBondContact O-N 3.4Å; R43-S46 PolarHBondContact O-N 2.99Å; R43-I47 HydrophobicContact CG-CD1 4.03Å; R43-I47 WeakPolarHBondContact O-CG1 3.32Å; R43-I47 PolarHBondContact O-N 3.46Å; R43-I47 VanDerWaalsContact O-N 3.07Å; R43-E231 IonicContact CZ-OE2 3.62Å; R43-E231 IonicContact NH1-OE2 3.38Å; R43-E231 PolarHBondContact NH1-OE2 3.44Å; R43-E231 IonicContact NH2-OE1 3.2Å; R43-E231 PolarHBondContact NH2-OE1 2.84Å; R43-E231 IonicContact NH2-OE2 3.07Å; R43-E231 PolarHBondContact NH2-OE2 3.34Å; R43-E231 VanDerWaalsContact NH2-OE2 3.07Å |
| 44 | F | 91 | Very high | 86.5 | Confident | 3 Ų | 3 | 49.5 Ų | 49.5 | 1% | 0.013 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.4 | -48.9 | 176.7 | 170.5 | -113.3 | 0 | 0 | 0 | 112.2 | A40 F41 S46 I47 F48 W154 Y155 R158 H159 H163 F165 | A40-F44 WeakPolarHBondContact O-CB 3.49Å; A40-F44 PolarHBondContact O-N 3.3Å; F41-F44 PolarHBondContact O-N 3.03Å; F44-S46 VanDerWaalsContact C-N 3.33Å; F44-S46 PolarHBondContact O-N 2.82Å; F44-I47 PolarHBondContact O-N 3.27Å; F44-F48 PolarHBondContact O-N 3.27Å; F44-W154 AromaticContact CE2-CH2 3.88Å; F44-W154 HydrophobicContact CE2-CH2 3.88Å; F44-W154 AromaticContact CE2-CZ3 3.9Å; F44-W154 HydrophobicContact CE2-CZ3 3.9Å; F44-W154 HydrophobicContact CZ-CZ3 4.39Å; F44-Y155 HydrophobicContact CD1-CE2 4.04Å; F44-Y155 AromaticContact CE1-CD2 3.68Å; F44-Y155 HydrophobicContact CE1-CD2 3.68Å; F44-Y155 AromaticContact CE1-CE2 3.25Å; F44-Y155 HydrophobicContact CE1-CE2 3.25Å; F44-Y155 AromaticContact CE1-CZ 3.83Å; F44-Y155 AromaticContact CZ-CD2 3.63Å; F44-Y155 HydrophobicContact CZ-CD2 3.63Å; F44-Y155 AromaticContact CZ-CE2 3.74Å; F44-Y155 HydrophobicContact CZ-CE2 3.74Å; F44-Y155 HydrophobicContact CZ-CG 4.4Å; F44-R158 HydrophobicContact CE2-CB 3.69Å; F44-R158 HydrophobicContact CE2-CG 4.5Å; F44-R158 HydrophobicContact CZ-CB 3.76Å; F44-H159 HydrophobicContact CE1-CB 4.03Å; F44-H159 HydrophobicContact CZ-CB 4.39Å; F44-H163 AromaticContact CD2-NE2 3.83Å; F44-F165 HydrophobicContact CB-CE2 4.37Å; F44-F165 HydrophobicContact CD1-CD2 4.35Å; F44-F165 AromaticContact CD1-CE2 3.99Å; F44-F165 HydrophobicContact CD1-CE2 3.99Å; F44-F165 HydrophobicContact CG-CE2 4.38Å |
| 45 | Q | 92 | Very high | 88.4 | Confident | 8 Ų | 8 | 44.3 Ų | 44.3 | 4% | 0.037 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.7 | -43.1 | 177.6 | -176.4 | -178.6 | 70 | 0 | 0 | 111.7 | F41 F48 L49 T173 | F41-Q45 WeakPolarHBondContact O-CB 3.46Å; F41-Q45 PolarHBondContact O-N 3Å; Q45-F48 PolarHBondContact O-N 3.45Å; Q45-L49 HydrophobicContact CG-CD1 3.93Å; Q45-L49 HydrophobicContact CG-CG 4.36Å; Q45-L49 WeakPolarHBondContact O-CB 3.38Å; Q45-L49 WeakPolarHBondContact O-CG 3.37Å; Q45-L49 PolarHBondContact O-N 3.48Å; Q45-T173 HydrophobicContact CG-CG2 3.97Å; Q45-T173 PolarHBondContact NE2-OG1 3.07Å |
| 46 | S | 91.9 | Very high | 90.2 | Very high | 50 Ų | 50 | 45 Ų | 45 | 35% | 0.35 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -64.5 | -41.4 | 178.4 | -173.8 | 0 | 0 | 0 | 0 | 112.2 | R42 R43 F44 L49 R50 | R42-S46 WeakPolarHBondContact O-CB 3.48Å; R42-S46 PolarHBondContact O-N 3.38Å; R43-S46 PolarHBondContact O-N 2.99Å; F44-S46 VanDerWaalsContact C-N 3.33Å; F44-S46 PolarHBondContact O-N 2.82Å; S46-L49 PolarHBondContact O-N 2.88Å; S46-R50 VanDerWaalsContact O-CG 3.28Å; S46-R50 WeakPolarHBondContact O-CG 3.48Å; S46-R50 PolarHBondContact O-N 2.86Å |
| 47 | I | 91.8 | Very high | 91.8 | Very high | 17 Ų | 17 | 45.6 Ų | 45.6 | 9% | 0.087 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.7 | -44.3 | 177.4 | -70.1 | 166.1 | 0 | 0 | 0 | 111 | R43 F44 D224 W225 | R43-I47 HydrophobicContact CG-CD1 4.03Å; R43-I47 WeakPolarHBondContact O-CG1 3.32Å; R43-I47 PolarHBondContact O-N 3.46Å; R43-I47 VanDerWaalsContact O-N 3.07Å; F44-I47 PolarHBondContact O-N 3.27Å; I47-D224 HydrophobicContact CG2-CB 3.95Å; I47-W225 HydrophobicContact CG2-CG 4.36Å; I47-W225 PolarHBondContact O-NE1 3.49Å |
| 48 | F | 93.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.7 | -49.7 | 175 | 170.7 | -110.5 | 0 | 0 | 0 | 111.9 | F44 Q45 R50 A51 Y52 F151 W154 Y155 T173 F174 V177 W225 | F44-F48 PolarHBondContact O-N 3.27Å; Q45-F48 PolarHBondContact O-N 3.45Å; F48-R50 VanDerWaalsContact C-N 3.31Å; F48-R50 PolarHBondContact O-N 3.34Å; F48-A51 PolarHBondContact O-N 3.05Å; F48-Y52 AromaticContact CE1-CD1 3.95Å; F48-Y52 HydrophobicContact CE1-CD1 3.95Å; F48-Y52 HydrophobicContact CE2-CD1 4.25Å; F48-Y52 HydrophobicContact CE2-CG 4.3Å; F48-Y52 AromaticContact CZ-CD1 3.5Å; F48-Y52 HydrophobicContact CZ-CD1 3.5Å; F48-Y52 HydrophobicContact CZ-CE1 4.15Å; F48-Y52 AromaticContact CZ-CG 3.99Å; F48-Y52 HydrophobicContact CZ-CG 3.99Å; F48-Y52 WeakPolarHBondContact O-CB 3.34Å; F48-Y52 PolarHBondContact O-N 2.85Å; F48-F151 HydrophobicContact CE2-CB 4.34Å; F48-W154 HydrophobicContact CB-CZ3 4.31Å; F48-W154 HydrophobicContact CD2-CE3 4.13Å; F48-W154 HydrophobicContact CD2-CZ3 4.07Å; F48-Y155 HydrophobicContact CB-CD2 3.88Å; F48-Y155 HydrophobicContact CB-CE2 4.3Å; F48-Y155 AromaticContact CD1-CD2 3.51Å; F48-Y155 HydrophobicContact CD1-CD2 3.51Å; F48-Y155 AromaticContact CD1-CE2 3.9Å; F48-Y155 HydrophobicContact CD1-CE2 3.9Å; F48-Y155 HydrophobicContact CD1-CG 4.24Å; F48-Y155 AromaticContact CD2-CD2 3.74Å; F48-Y155 HydrophobicContact CD2-CD2 3.74Å; F48-Y155 HydrophobicContact CD2-CG 4.18Å; F48-Y155 AromaticContact CE1-CD2 3.91Å; F48-Y155 HydrophobicContact CE1-CD2 3.91Å; F48-Y155 HydrophobicContact CE1-CE2 4.45Å; F48-Y155 HydrophobicContact CE1-CG 4.19Å; F48-Y155 HydrophobicContact CE2-CD2 4.14Å; F48-Y155 HydrophobicContact CE2-CG 4.15Å; F48-Y155 AromaticContact CG-CD2 3.4Å; F48-Y155 HydrophobicContact CG-CD2 3.4Å; F48-Y155 VanDerWaalsContact CG-CD2 3.4Å; F48-Y155 HydrophobicContact CG-CE2 4.09Å; F48-Y155 HydrophobicContact CG-CG 4.22Å; F48-Y155 HydrophobicContact CZ-CD2 4.2Å; F48-Y155 HydrophobicContact CZ-CG 4.14Å; F48-T173 HydrophobicContact CD1-CG2 3.67Å; F48-T173 HydrophobicContact CE1-CG2 3.81Å; F48-F174 HydrophobicContact CZ-CE1 4.26Å; F48-F174 HydrophobicContact CZ-CZ 4.31Å; F48-V177 HydrophobicContact CE1-CG2 4.01Å; F48-W225 HydrophobicContact CD2-CH2 4.4Å; F48-W225 HydrophobicContact CD2-CZ2 4.02Å |
| 49 | L | 94.5 | Very high | 93.4 | Very high | 21 Ų | 21 | 41.7 Ų | 41.7 | 11% | 0.11 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60 | -40.2 | -178.6 | -73.5 | 173.3 | 0 | 0 | 0 | 112 | Q45 S46 A51 Y52 L53 V177 | Q45-L49 HydrophobicContact CG-CD1 3.93Å; Q45-L49 HydrophobicContact CG-CG 4.36Å; Q45-L49 WeakPolarHBondContact O-CB 3.38Å; Q45-L49 WeakPolarHBondContact O-CG 3.37Å; Q45-L49 PolarHBondContact O-N 3.48Å; S46-L49 PolarHBondContact O-N 2.88Å; L49-A51 PolarHBondContact O-N 3.15Å; L49-Y52 PolarHBondContact O-N 2.82Å; L49-L53 HydrophobicContact CB-CD1 4.26Å; L49-L53 HydrophobicContact CD2-CD1 4.49Å; L49-L53 WeakPolarHBondContact O-CB 3.45Å; L49-L53 WeakPolarHBondContact O-CG 3.35Å; L49-L53 PolarHBondContact O-N 2.64Å; L49-V177 HydrophobicContact CD2-CG2 3.44Å; L49-V177 VanDerWaalsContact CD2-CG2 3.44Å |
| 50 | R | 94.4 | Very high | 93.8 | Very high | 142 Ų | 142 | 39.6 Ų | 39.6 | 54% | 0.536 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -57.2 | -48.7 | 178.8 | -76.1 | 170.8 | -176.1 | -165.6 | -1 | 112.3 | S46 F48 L54 V220 D224 | S46-R50 VanDerWaalsContact O-CG 3.28Å; S46-R50 WeakPolarHBondContact O-CG 3.48Å; S46-R50 PolarHBondContact O-N 2.86Å; F48-R50 VanDerWaalsContact C-N 3.31Å; F48-R50 PolarHBondContact O-N 3.34Å; R50-L54 WeakPolarHBondContact O-CD1 3.31Å; R50-L54 VanDerWaalsContact O-CG 3.27Å; R50-L54 WeakPolarHBondContact O-CG 3.49Å; R50-L54 PolarHBondContact O-N 2.94Å; R50-V220 HydrophobicContact CB-CG1 4.19Å; R50-D224 IonicContact NH1-OD2 3.81Å |
| 51 | A | 94.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -69.6 | -49.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | F48 L49 L53 L54 A55 C217 V220 V221 W225 | F48-A51 PolarHBondContact O-N 3.05Å; L49-A51 PolarHBondContact O-N 3.15Å; A51-L53 PolarHBondContact O-N 2.86Å; A51-L54 PolarHBondContact O-N 3.17Å; A51-A55 PolarHBondContact O-N 2.66Å; A51-A55 VanDerWaalsContact O-N 3.1Å; A51-C217 PolarHBondContact O-SG 3.48Å; A51-V220 HydrophobicContact CB-CB 4.39Å; A51-V220 HydrophobicContact CB-CG1 3.88Å; A51-V221 HydrophobicContact CB-CG2 3.91Å; A51-W225 HydrophobicContact CB-CZ2 3.64Å |
| 52 | Y | 95.8 | Very high | 94.3 | Very high | 29 Ų | 29 | 38.3 Ų | 38.3 | 11% | 0.114 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -69.4 | -37.7 | -171.8 | -169.4 | -145.8 | 0 | 0 | 0 | 112.9 | F48 L49 L54 A55 L56 L147 F151 F174 V177 | F48-Y52 AromaticContact CE1-CD1 3.95Å; F48-Y52 HydrophobicContact CE1-CD1 3.95Å; F48-Y52 HydrophobicContact CE2-CD1 4.25Å; F48-Y52 HydrophobicContact CE2-CG 4.3Å; F48-Y52 AromaticContact CZ-CD1 3.5Å; F48-Y52 HydrophobicContact CZ-CD1 3.5Å; F48-Y52 HydrophobicContact CZ-CE1 4.15Å; F48-Y52 AromaticContact CZ-CG 3.99Å; F48-Y52 HydrophobicContact CZ-CG 3.99Å; F48-Y52 WeakPolarHBondContact O-CB 3.34Å; F48-Y52 PolarHBondContact O-N 2.85Å; L49-Y52 PolarHBondContact O-N 2.82Å; Y52-L54 VanDerWaalsContact C-N 3.34Å; Y52-L54 PolarHBondContact O-N 3.13Å; Y52-A55 WeakPolarHBondContact O-CB 2.86Å; Y52-A55 PolarHBondContact O-N 3.47Å; Y52-L56 HydrophobicContact CD1-CD1 4.3Å; Y52-L56 HydrophobicContact CD2-CD1 4.48Å; Y52-L56 HydrophobicContact CD2-CG 4.36Å; Y52-L56 HydrophobicContact CE1-CD1 4.19Å; Y52-L56 HydrophobicContact CE2-CD1 4.33Å; Y52-L56 HydrophobicContact CE2-CD2 4.27Å; Y52-L56 HydrophobicContact CE2-CG 4.16Å; Y52-L56 HydrophobicContact CG-CD1 4.44Å; Y52-L56 WeakPolarHBondContact O-CG 3.39Å; Y52-L56 PolarHBondContact O-N 3.45Å; Y52-L147 HydrophobicContact CD2-CD1 4.34Å; Y52-L147 HydrophobicContact CE2-CD1 3.85Å; Y52-F151 HydrophobicContact CD2-CB 3.59Å; Y52-F151 AromaticContact CD2-CD1 3.82Å; Y52-F151 HydrophobicContact CD2-CD1 3.82Å; Y52-F151 HydrophobicContact CD2-CD2 4.03Å; Y52-F151 AromaticContact CD2-CG 3.54Å; Y52-F151 HydrophobicContact CD2-CG 3.54Å; Y52-F151 HydrophobicContact CE2-CB 3.75Å; Y52-F151 HydrophobicContact CE2-CD2 4.17Å; Y52-F151 AromaticContact CE2-CG 3.97Å; Y52-F151 HydrophobicContact CE2-CG 3.97Å; Y52-F151 HydrophobicContact CG-CB 4.19Å; Y52-F151 HydrophobicContact CG-CD1 4.36Å; Y52-F151 HydrophobicContact CG-CG 4.36Å; Y52-F174 HydrophobicContact CE1-CE1 4.47Å; Y52-V177 HydrophobicContact CD1-CG1 3.79Å; Y52-V177 HydrophobicContact CD1-CG2 3.9Å; Y52-V177 HydrophobicContact CE1-CG1 3.57Å; Y52-V177 HydrophobicContact CE1-CG2 4.25Å |
| 53 | L | 96.4 | Very high | 94.4 | Very high | 29 Ų | 29 | 33.1 Ų | 33.1 | 15% | 0.152 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.3 | -32.9 | 176 | -65.3 | -179.8 | 0 | 0 | 0 | 112.4 | L49 A51 L56 W57 W180 L184 | L49-L53 HydrophobicContact CB-CD1 4.26Å; L49-L53 HydrophobicContact CD2-CD1 4.49Å; L49-L53 WeakPolarHBondContact O-CB 3.45Å; L49-L53 WeakPolarHBondContact O-CG 3.35Å; L49-L53 PolarHBondContact O-N 2.64Å; A51-L53 PolarHBondContact O-N 2.86Å; L53-L56 HydrophobicContact CD2-CD1 4.32Å; L53-W57 VanDerWaalsContact O-CB 3.28Å; L53-W57 WeakPolarHBondContact O-CB 3.33Å; L53-W57 PolarHBondContact O-N 2.97Å; L53-W180 HydrophobicContact CD1-CB 4.08Å; L53-W180 HydrophobicContact CD1-CD2 4.49Å; L53-W180 HydrophobicContact CD1-CG 4.04Å; L53-W180 HydrophobicContact CD2-CB 3.66Å; L53-W180 HydrophobicContact CD2-CG 4.46Å; L53-L184 HydrophobicContact CB-CD1 3.96Å; L53-L184 HydrophobicContact CD2-CD1 3.8Å; L53-L184 HydrophobicContact CG-CD1 4.39Å |
| 54 | L | 96.8 | Very high | 94.6 | Very high | 51 Ų | 51 | 26.4 Ų | 26.4 | 27% | 0.267 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -66.9 | -40.2 | 172.8 | -75.8 | 170.7 | 0 | 0 | 0 | 111.9 | R50 A51 Y52 W57 A58 C216 C217 V220 | R50-L54 WeakPolarHBondContact O-CD1 3.31Å; R50-L54 VanDerWaalsContact O-CG 3.27Å; R50-L54 WeakPolarHBondContact O-CG 3.49Å; R50-L54 PolarHBondContact O-N 2.94Å; A51-L54 PolarHBondContact O-N 3.17Å; Y52-L54 VanDerWaalsContact C-N 3.34Å; Y52-L54 PolarHBondContact O-N 3.13Å; L54-W57 PolarHBondContact O-N 3.01Å; L54-A58 PolarHBondContact O-N 2.97Å; L54-C216 HydrophobicContact CD1-CB 4.11Å; L54-C217 HydrophobicContact CB-CB 3.92Å; L54-V220 HydrophobicContact CD1-CG2 4.36Å |
| 55 | A | 96.8 | Very high | 94.8 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -61.7 | -47 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | A51 Y52 A58 D59 F114 L147 F151 | A51-A55 PolarHBondContact O-N 2.66Å; A51-A55 VanDerWaalsContact O-N 3.1Å; Y52-A55 WeakPolarHBondContact O-CB 2.86Å; Y52-A55 PolarHBondContact O-N 3.47Å; A55-A58 PolarHBondContact O-N 3.41Å; A55-D59 PolarHBondContact O-N 3.44Å; A55-F114 HydrophobicContact CB-CE1 3.62Å; A55-F114 HydrophobicContact CB-CZ 4.09Å; A55-L147 HydrophobicContact CB-CD1 3.82Å; A55-F151 HydrophobicContact CB-CE1 4.34Å; A55-F151 HydrophobicContact CB-CE2 4.12Å; A55-F151 HydrophobicContact CB-CZ 3.8Å |
| 56 | L | 96.6 | Very high | 94.9 | Very high | 16 Ų | 16 | 27 Ų | 27 | 8% | 0.084 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63 | -41.9 | 176.3 | -68.4 | 169.3 | 0 | 0 | 0 | 111.8 | Y52 L53 A58 D59 W60 L147 V177 N181 L184 | Y52-L56 HydrophobicContact CD1-CD1 4.3Å; Y52-L56 HydrophobicContact CD2-CD1 4.48Å; Y52-L56 HydrophobicContact CD2-CG 4.36Å; Y52-L56 HydrophobicContact CE1-CD1 4.19Å; Y52-L56 HydrophobicContact CE2-CD1 4.33Å; Y52-L56 HydrophobicContact CE2-CD2 4.27Å; Y52-L56 HydrophobicContact CE2-CG 4.16Å; Y52-L56 HydrophobicContact CG-CD1 4.44Å; Y52-L56 WeakPolarHBondContact O-CG 3.39Å; Y52-L56 PolarHBondContact O-N 3.45Å; L53-L56 HydrophobicContact CD2-CD1 4.32Å; L56-A58 PolarHBondContact O-N 2.91Å; L56-D59 WeakPolarHBondContact O-CB 3.23Å; L56-D59 PolarHBondContact O-N 2.73Å; L56-W60 PolarHBondContact O-N 2.82Å; L56-L147 HydrophobicContact CD2-CD2 4.38Å; L56-V177 HydrophobicContact CD1-CG1 3.84Å; L56-N181 HydrophobicContact CD1-CB 4.48Å; L56-L184 HydrophobicContact CB-CD1 4.48Å |
| 57 | W | 97.3 | Very high | 95 | Very high | 47 Ų | 47 | 24.8 Ų | 24.8 | 18% | 0.178 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58.6 | -45.5 | 176.5 | 175.7 | -101.3 | 0 | 0 | 0 | 112.6 | L53 L54 D59 W60 L61 L184 A188 V191 | L53-W57 VanDerWaalsContact O-CB 3.28Å; L53-W57 WeakPolarHBondContact O-CB 3.33Å; L53-W57 PolarHBondContact O-N 2.97Å; L54-W57 PolarHBondContact O-N 3.01Å; W57-D59 VanDerWaalsContact C-N 3.29Å; W57-D59 PolarHBondContact O-N 3.47Å; W57-W60 PolarHBondContact O-N 3.3Å; W57-L61 HydrophobicContact CZ2-CD2 4.13Å; W57-L61 HydrophobicContact CZ2-CG 4.46Å; W57-L61 WeakPolarHBondContact O-CG 3.37Å; W57-L61 PolarHBondContact O-N 3.5Å; W57-L61 VanDerWaalsContact O-N 3.07Å; W57-L184 HydrophobicContact CB-CD2 4.46Å; W57-L184 HydrophobicContact CD2-CD2 4.37Å; W57-L184 HydrophobicContact CE3-CB 4.05Å; W57-L184 HydrophobicContact CE3-CD2 3.58Å; W57-L184 HydrophobicContact CE3-CG 4.39Å; W57-L184 HydrophobicContact CZ3-CD2 4.21Å; W57-L184 VanDerWaalsContact CZ3-O 3.3Å; W57-L184 WeakPolarHBondContact CZ3-O 3.42Å; W57-A188 HydrophobicContact CE3-CB 4.14Å; W57-A188 HydrophobicContact CH2-CB 4.3Å; W57-A188 HydrophobicContact CZ3-CB 3.94Å; W57-A188 VanDerWaalsContact CZ3-N 3.29Å; W57-V191 HydrophobicContact CH2-CB 4.22Å; W57-V191 HydrophobicContact CH2-CG2 3.76Å; W57-V191 HydrophobicContact CZ2-CB 4.12Å; W57-V191 HydrophobicContact CZ2-CG1 4.29Å; W57-V191 HydrophobicContact CZ2-CG2 3.87Å |
| 58 | A | 96.8 | Very high | 95 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -65 | -32.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L54 A55 L56 Q62 A210 C213 L214 | L54-A58 PolarHBondContact O-N 2.97Å; A55-A58 PolarHBondContact O-N 3.41Å; L56-A58 PolarHBondContact O-N 2.91Å; A58-Q62 PolarHBondContact O-NE2 3.32Å; A58-Q62 VanDerWaalsContact O-NE2 3.11Å; A58-A210 HydrophobicContact CB-CB 4.13Å; A58-C213 HydrophobicContact CB-CB 4.16Å; A58-L214 HydrophobicContact CB-CD1 4.34Å; A58-L214 HydrophobicContact CB-CD2 3.72Å; A58-L214 HydrophobicContact CB-CG 3.65Å |
| 59 | D | 95.8 | Very high | 95.1 | Very high | 42 Ų | 42 | 26.7 Ų | 26.7 | 23% | 0.225 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -67.4 | -50 | 173.4 | -169 | 62.9 | 0 | 0 | 0 | 111.2 | A55 L56 W57 L61 Q62 Y118 L147 | A55-D59 PolarHBondContact O-N 3.44Å; L56-D59 WeakPolarHBondContact O-CB 3.23Å; L56-D59 PolarHBondContact O-N 2.73Å; W57-D59 VanDerWaalsContact C-N 3.29Å; W57-D59 PolarHBondContact O-N 3.47Å; D59-L61 VanDerWaalsContact C-N 3.33Å; D59-L61 PolarHBondContact O-N 3Å; D59-Q62 PolarHBondContact O-N 3.49Å; D59-Y118 HydrophobicContact CB-CE1 4Å; D59-Y118 VanDerWaalsContact OD1-CZ 3.26Å; D59-Y118 PolarHBondContact OD1-OH 2.89Å; D59-L147 HydrophobicContact CB-CD2 4.05Å |
| 60 | W | 96.6 | Very high | 95.1 | Very high | 57 Ų | 57 | 25.7 Ų | 25.7 | 22% | 0.216 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -64.2 | -32.8 | -178.5 | -73.7 | 121.7 | 0 | 0 | 0 | 114.2 | L56 W57 Q62 G63 N181 A185 A188 F312 M316 | L56-W60 PolarHBondContact O-N 2.82Å; W57-W60 PolarHBondContact O-N 3.3Å; W60-Q62 PolarHBondContact O-N 2.8Å; W60-Q62 VanDerWaalsContact O-N 3.12Å; W60-G63 PolarHBondContact O-N 3.31Å; W60-N181 PolarHBondContact NE1-OD1 3.11Å; W60-A185 HydrophobicContact CD2-CB 3.59Å; W60-A185 HydrophobicContact CE3-CB 3.98Å; W60-A185 HydrophobicContact CG-CB 3.94Å; W60-A185 HydrophobicContact CH2-CB 4.34Å; W60-A185 HydrophobicContact CZ2-CB 4Å; W60-A185 HydrophobicContact CZ3-CB 4.33Å; W60-A188 HydrophobicContact CB-CB 3.52Å; W60-F312 HydrophobicContact CE3-CE1 4.15Å; W60-F312 AromaticContact CE3-CZ 3.67Å; W60-F312 HydrophobicContact CE3-CZ 3.67Å; W60-F312 AromaticContact CZ3-CZ 3.84Å; W60-F312 HydrophobicContact CZ3-CZ 3.84Å; W60-M316 HydrophobicContact CE3-SD 4.24Å; W60-M316 HydrophobicContact CH2-SD 3.78Å; W60-M316 HydrophobicContact CZ3-SD 3.54Å; W60-M316 VanDerWaalsContact CZ3-SD 3.54Å |
| 61 | L | 95.8 | Very high | 95 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 11% | 0.112 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -27.6 | 178.1 | -83.9 | 174 | 0 | 0 | 0 | 113.4 | W57 D59 A188 V191 P206 L209 | W57-L61 HydrophobicContact CZ2-CD2 4.13Å; W57-L61 HydrophobicContact CZ2-CG 4.46Å; W57-L61 WeakPolarHBondContact O-CG 3.37Å; W57-L61 PolarHBondContact O-N 3.5Å; W57-L61 VanDerWaalsContact O-N 3.07Å; D59-L61 VanDerWaalsContact C-N 3.33Å; D59-L61 PolarHBondContact O-N 3Å; L61-A188 HydrophobicContact CD2-CB 4.27Å; L61-A188 HydrophobicContact CG-CB 4.37Å; L61-V191 HydrophobicContact CD2-CB 4.13Å; L61-V191 HydrophobicContact CD2-CG1 3.87Å; L61-P206 VanDerWaalsContact O-CB 3.25Å; L61-P206 WeakPolarHBondContact O-CB 3.13Å; L61-L209 HydrophobicContact CD1-CB 4.33Å; L61-L209 HydrophobicContact CD1-CD2 3.9Å; L61-L209 HydrophobicContact CD1-CG 3.96Å; L61-L209 HydrophobicContact CD2-CD2 4.19Å |
| 62 | Q | 92.4 | Very high | 94.9 | Very high | 14 Ų | 14 | 28.8 Ų | 28.8 | 7% | 0.065 | 14% | 0.136 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -24.6 | -176.2 | -64.2 | 178 | 61.8 | 0 | 0 | 112.9 | A58 D59 W60 P64 Y65 L66 Y118 C122 F207 A210 | A58-Q62 PolarHBondContact O-NE2 3.32Å; A58-Q62 VanDerWaalsContact O-NE2 3.11Å; D59-Q62 PolarHBondContact O-N 3.49Å; W60-Q62 PolarHBondContact O-N 2.8Å; W60-Q62 VanDerWaalsContact O-N 3.12Å; Q62-P64 VanDerWaalsContact C-CD 3.48Å; Q62-Y65 PolarHBondContact O-N 3.02Å; Q62-L66 PolarHBondContact O-N 3.1Å; Q62-Y118 PolarHBondContact NE2-OH 3.31Å; Q62-C122 PolarHBondContact NE2-SG 2.69Å; Q62-F207 HydrophobicContact CB-CD1 3.96Å; Q62-F207 HydrophobicContact CB-CE1 3.54Å; Q62-F207 HydrophobicContact CB-CZ 4.12Å; Q62-F207 HydrophobicContact CG-CD1 3.5Å; Q62-F207 HydrophobicContact CG-CE1 3.65Å; Q62-F207 HydrophobicContact CG-CG 4.29Å; Q62-A210 HydrophobicContact CG-CB 4.47Å |
| 63 | G | 91.3 | Very high | 94.8 | Very high | 28 Ų | 28 | 29 Ų | 29 | 29% | 0.289 | 14% | 0.136 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -49.9 | -49.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115 | W60 Y65 | W60-G63 PolarHBondContact O-N 3.31Å; G63-Y65 PolarHBondContact O-N 3.3Å |
| 64 | P | 94.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 16% | 0.163 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -28.4 | -171.3 | -14.3 | 23.5 | 0 | 0 | 0 | 115.2 | Q62 A192 F312 | Q62-P64 VanDerWaalsContact C-CD 3.48Å; P64-A192 HydrophobicContact CG-CB 3.87Å; P64-F312 HydrophobicContact CB-CB 3.73Å; P64-F312 HydrophobicContact CB-CD2 4.38Å; P64-F312 HydrophobicContact CB-CG 3.97Å; P64-F312 HydrophobicContact CG-CB 3.78Å; P64-F312 HydrophobicContact CG-CD1 3.65Å; P64-F312 HydrophobicContact CG-CD2 4.18Å; P64-F312 HydrophobicContact CG-CE1 4.27Å; P64-F312 HydrophobicContact CG-CG 3.59Å |
| 65 | Y | 94.9 | Very high | 94.4 | Very high | 2 Ų | 2 | 31 Ų | 31 | 1% | 0.008 | 16% | 0.155 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -115 | -0.6 | -166.4 | -74.2 | -81.9 | 0 | 0 | 0 | 114.7 | Q62 G63 Y67 K68 L69 A192 A196 E197 P203 P206 L308 | Q62-Y65 PolarHBondContact O-N 3.02Å; G63-Y65 PolarHBondContact O-N 3.3Å; Y65-Y67 PolarHBondContact O-N 2.85Å; Y65-K68 HydrophobicContact CD1-CB 4.23Å; Y65-K68 HydrophobicContact CD1-CG 4.21Å; Y65-K68 PolarHBondContact O-N 3.4Å; Y65-L69 VanDerWaalsContact O-CB 3.24Å; Y65-L69 WeakPolarHBondContact O-CB 3.46Å; Y65-L69 PolarHBondContact O-N 3.28Å; Y65-A192 HydrophobicContact CD2-CB 4.02Å; Y65-A192 HydrophobicContact CE2-CB 3.91Å; Y65-A196 HydrophobicContact CD1-CB 4.17Å; Y65-A196 HydrophobicContact CD2-CB 4.22Å; Y65-A196 HydrophobicContact CE1-CB 3.6Å; Y65-A196 HydrophobicContact CE2-CB 3.68Å; Y65-A196 HydrophobicContact CG-CB 4.46Å; Y65-E197 VanDerWaalsContact OH-CG 3.26Å; Y65-E197 WeakPolarHBondContact OH-CG 3.26Å; Y65-E197 PolarHBondContact OH-OE1 3.36Å; Y65-P203 HydrophobicContact CD1-CB 3.85Å; Y65-P203 HydrophobicContact CG-CB 4.41Å; Y65-P206 HydrophobicContact CD2-CG 3.82Å; Y65-P206 HydrophobicContact CE2-CG 4.37Å; Y65-P206 HydrophobicContact CG-CG 4.45Å; Y65-L308 HydrophobicContact CD1-CD1 4.45Å; Y65-L308 HydrophobicContact CE1-CB 4.18Å; Y65-L308 HydrophobicContact CE1-CD1 4.31Å |
| 66 | L | 94 | Very high | 94.1 | Very high | 22 Ų | 22 | 36 Ų | 36 | 12% | 0.115 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.4 | -51 | -175.6 | -177.5 | 63.3 | 0 | 0 | 0 | 113.1 | Q62 Y70 Y84 F207 | Q62-L66 PolarHBondContact O-N 3.1Å; L66-Y70 HydrophobicContact CD1-CE2 3.69Å; L66-Y70 HydrophobicContact CG-CE2 3.92Å; L66-Y70 WeakPolarHBondContact O-CD2 3.16Å; L66-Y84 HydrophobicContact CD2-CE1 4.34Å; L66-Y84 HydrophobicContact CD2-CE2 4.25Å; L66-Y84 HydrophobicContact CG-CE2 4.28Å; L66-F207 HydrophobicContact CB-CZ 4.07Å; L66-F207 HydrophobicContact CD1-CE1 3.99Å; L66-F207 HydrophobicContact CD1-CZ 4.06Å |
| 67 | Y | 93.8 | Very high | 93.5 | Very high | 3 Ų | 3 | 38.4 Ų | 38.4 | 1% | 0.012 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.9 | -46.2 | 177 | -174.3 | -81.2 | 0 | 0 | 0 | 111.3 | Y65 L69 Y70 R71 E77 I80 Y84 F295 T298 P299 | Y65-Y67 PolarHBondContact O-N 2.85Å; Y67-L69 VanDerWaalsContact C-N 3.28Å; Y67-L69 PolarHBondContact O-N 2.97Å; Y67-Y70 PolarHBondContact O-N 3.17Å; Y67-Y70 VanDerWaalsContact O-N 3.13Å; Y67-R71 HydrophobicContact CD1-CG 3.81Å; Y67-R71 HydrophobicContact CE1-CG 3.32Å; Y67-R71 PolarHBondContact O-N 3.27Å; Y67-R71 VanDerWaalsContact O-N 3.09Å; Y67-E77 WeakPolarHBondContact OH-CG 3.45Å; Y67-I80 HydrophobicContact CD2-CG2 3.7Å; Y67-I80 HydrophobicContact CE1-CD1 4.42Å; Y67-I80 HydrophobicContact CE2-CB 4.35Å; Y67-I80 HydrophobicContact CE2-CD1 4.32Å; Y67-I80 HydrophobicContact CE2-CG2 3.76Å; Y67-I80 HydrophobicContact CG-CG2 4.46Å; Y67-Y84 HydrophobicContact CD2-CE2 4.42Å; Y67-Y84 PolarHBondContact N-OH 3.43Å; Y67-F295 HydrophobicContact CD2-CD2 4.14Å; Y67-F295 HydrophobicContact CD2-CE2 4.05Å; Y67-F295 HydrophobicContact CE2-CD2 4.16Å; Y67-F295 HydrophobicContact CE2-CE1 4.39Å; Y67-F295 AromaticContact CE2-CE2 3.67Å; Y67-F295 HydrophobicContact CE2-CE2 3.67Å; Y67-F295 AromaticContact CE2-CZ 3.8Å; Y67-F295 HydrophobicContact CE2-CZ 3.8Å; Y67-T298 HydrophobicContact CD1-CG2 3.64Å; Y67-T298 HydrophobicContact CG-CG2 4.1Å; Y67-P299 HydrophobicContact CE1-CB 3.87Å; Y67-P299 HydrophobicContact CE1-CG 4.12Å; Y67-P299 HydrophobicContact CE2-CB 4.41Å; Y67-P299 HydrophobicContact CE2-CG 3.92Å; Y67-P299 WeakPolarHBondContact OH-CB 3.11Å |
| 68 | K | 93.5 | Very high | 92.8 | Very high | 57 Ų | 57 | 36.9 Ų | 36.9 | 25% | 0.248 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.7 | -39.1 | -179.3 | -177.4 | 65.4 | 175.4 | -163 | 0 | 112.3 | Y65 Y70 R71 H72 P203 D302 L308 | Y65-K68 HydrophobicContact CD1-CB 4.23Å; Y65-K68 HydrophobicContact CD1-CG 4.21Å; Y65-K68 PolarHBondContact O-N 3.4Å; K68-Y70 VanDerWaalsContact C-N 3.32Å; K68-Y70 PolarHBondContact O-N 3.09Å; K68-R71 PolarHBondContact O-N 3.48Å; K68-H72 VanDerWaalsContact O-CB 3.32Å; K68-H72 WeakPolarHBondContact O-CB 3.49Å; K68-H72 PolarHBondContact O-N 3Å; K68-P203 HydrophobicContact CG-CB 4.32Å; K68-D302 WeakPolarHBondContact CD-OD1 3.44Å; K68-D302 WeakPolarHBondContact CD-OD2 3.36Å; K68-D302 WeakPolarHBondContact CE-OD1 3.22Å; K68-D302 IonicContact NZ-OD1 2.72Å; K68-D302 PolarHBondContact NZ-OD1 3.19Å; K68-D302 IonicContact NZ-OD2 3.26Å; K68-D302 PolarHBondContact NZ-OD2 3.4Å; K68-L308 HydrophobicContact CB-CD1 3.67Å; K68-L308 HydrophobicContact CD-CD1 3.9Å; K68-L308 HydrophobicContact CG-CD1 3.73Å |
| 69 | L | 95.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.5 | -44.1 | 177.3 | -178.9 | 148.4 | 0 | 0 | 0 | 111.3 | Y65 Y67 H72 Y73 K125 P203 V204 F207 | Y65-L69 VanDerWaalsContact O-CB 3.24Å; Y65-L69 WeakPolarHBondContact O-CB 3.46Å; Y65-L69 PolarHBondContact O-N 3.28Å; Y67-L69 VanDerWaalsContact C-N 3.28Å; Y67-L69 PolarHBondContact O-N 2.97Å; L69-H72 WeakPolarHBondContact O-CB 3.34Å; L69-H72 PolarHBondContact O-N 3.23Å; L69-Y73 HydrophobicContact CD2-CD2 4.03Å; L69-Y73 HydrophobicContact CD2-CE2 3.69Å; L69-Y73 HydrophobicContact CG-CE2 4.34Å; L69-Y73 PolarHBondContact O-N 3.08Å; L69-K125 HydrophobicContact CD1-CB 3.87Å; L69-K125 HydrophobicContact CD1-CG 4.39Å; L69-K125 HydrophobicContact CD2-CB 4.44Å; L69-K125 HydrophobicContact CD2-CD 4.27Å; L69-P203 HydrophobicContact CB-CB 4.31Å; L69-V204 HydrophobicContact CD1-CB 4.22Å; L69-V204 HydrophobicContact CD1-CG1 4.34Å; L69-V204 HydrophobicContact CD1-CG2 3.85Å; L69-V204 HydrophobicContact CG-CG2 4.35Å; L69-F207 HydrophobicContact CB-CE2 4.44Å; L69-F207 HydrophobicContact CD1-CD2 3.65Å; L69-F207 HydrophobicContact CD1-CE2 3.59Å; L69-F207 HydrophobicContact CD1-CG 4.4Å; L69-F207 HydrophobicContact CD1-CZ 4.3Å |
| 70 | Y | 94.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -69.1 | -39.5 | 178 | -59.9 | -49.7 | 0 | 0 | 0 | 112.8 | L66 Y67 K68 H72 Y73 S74 F75 I80 L83 Y84 K125 L133 R137 | L66-Y70 HydrophobicContact CD1-CE2 3.69Å; L66-Y70 HydrophobicContact CG-CE2 3.92Å; L66-Y70 WeakPolarHBondContact O-CD2 3.16Å; Y67-Y70 PolarHBondContact O-N 3.17Å; Y67-Y70 VanDerWaalsContact O-N 3.13Å; K68-Y70 VanDerWaalsContact C-N 3.32Å; K68-Y70 PolarHBondContact O-N 3.09Å; Y70-H72 VanDerWaalsContact C-N 3.28Å; Y70-H72 PolarHBondContact O-N 3.31Å; Y70-Y73 PolarHBondContact O-N 3.43Å; Y70-S74 PolarHBondContact O-N 3.33Å; Y70-F75 HydrophobicContact CD1-CD2 4.46Å; Y70-F75 WeakPolarHBondContact O-CD2 3.46Å; Y70-F75 PolarHBondContact O-N 3.47Å; Y70-I80 HydrophobicContact CD2-CG2 3.78Å; Y70-I80 HydrophobicContact CG-CG1 4.48Å; Y70-I80 HydrophobicContact CG-CG2 4.39Å; Y70-L83 HydrophobicContact CD1-CD1 3.84Å; Y70-L83 HydrophobicContact CD2-CD1 4.32Å; Y70-L83 HydrophobicContact CE1-CD1 3.73Å; Y70-L83 HydrophobicContact CE2-CB 4.36Å; Y70-L83 HydrophobicContact CE2-CD1 4.21Å; Y70-L83 HydrophobicContact CG-CD1 4.1Å; Y70-Y84 HydrophobicContact CD2-CE2 4.27Å; Y70-Y84 HydrophobicContact CE2-CE2 4.13Å; Y70-K125 PolarHBondContact OH-NZ 3.46Å; Y70-L133 HydrophobicContact CD1-CD1 4.04Å; Y70-L133 HydrophobicContact CE1-CB 4.3Å; Y70-L133 HydrophobicContact CE1-CD1 3.93Å; Y70-L133 HydrophobicContact CE1-CD2 4.1Å; Y70-L133 HydrophobicContact CE1-CG 4.33Å; Y70-R137 WeakPolarHBondContact OH-CD 3.37Å; Y70-R137 WeakPolarHBondContact OH-CG 3.42Å |
| 71 | R | 91.9 | Very high | 92 | Very high | 100 Ų | 100 | 35.4 Ų | 35.4 | 38% | 0.377 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63 | -35.3 | 171.6 | -70.9 | -64.7 | -67.2 | 143.5 | -2.9 | 112.4 | Y67 K68 Y73 S74 F75 I80 | Y67-R71 HydrophobicContact CD1-CG 3.81Å; Y67-R71 HydrophobicContact CE1-CG 3.32Å; Y67-R71 PolarHBondContact O-N 3.27Å; Y67-R71 VanDerWaalsContact O-N 3.09Å; K68-R71 PolarHBondContact O-N 3.48Å; R71-Y73 PolarHBondContact O-N 3.46Å; R71-S74 WeakPolarHBondContact O-CA 3.27Å; R71-S74 PolarHBondContact O-N 2.9Å; R71-F75 PolarHBondContact NH1-O 3.46Å; R71-I80 HydrophobicContact CG-CD1 3.6Å |
| 72 | H | 92.6 | Very high | 91.8 | Very high | 108 Ų | 108 | 37.9 Ų | 37.9 | 50% | 0.5 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -65 | -28.2 | 175.9 | -176.3 | 74.9 | 0 | 0 | 0 | 112.5 | K68 L69 Y70 S74 P203 | K68-H72 VanDerWaalsContact O-CB 3.32Å; K68-H72 WeakPolarHBondContact O-CB 3.49Å; K68-H72 PolarHBondContact O-N 3Å; L69-H72 WeakPolarHBondContact O-CB 3.34Å; L69-H72 PolarHBondContact O-N 3.23Å; Y70-H72 VanDerWaalsContact C-N 3.28Å; Y70-H72 PolarHBondContact O-N 3.31Å; H72-S74 PolarHBondContact O-N 3.1Å; H72-P203 HydrophobicContact CB-CG 3.91Å |
| 73 | Y | 94.1 | Very high | 91.8 | Very high | 32 Ų | 32 | 37.2 Ų | 37.2 | 13% | 0.125 | 19% | 0.192 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | 12.3 | 169.4 | -63.6 | -20.6 | 0 | 0 | 0 | 113.8 | L69 Y70 R71 F75 K125 S127 R128 L133 V204 | L69-Y73 HydrophobicContact CD2-CD2 4.03Å; L69-Y73 HydrophobicContact CD2-CE2 3.69Å; L69-Y73 HydrophobicContact CG-CE2 4.34Å; L69-Y73 PolarHBondContact O-N 3.08Å; Y70-Y73 PolarHBondContact O-N 3.43Å; R71-Y73 PolarHBondContact O-N 3.46Å; Y73-F75 HydrophobicContact CD2-CE2 4.12Å; Y73-F75 HydrophobicContact CG-CE2 4.38Å; Y73-F75 PolarHBondContact O-N 3.32Å; Y73-K125 WeakPolarHBondContact CE2-O 3.35Å; Y73-K125 PolarHBondContact OH-O 3.29Å; Y73-S127 VanDerWaalsContact CE2-O 3.32Å; Y73-S127 WeakPolarHBondContact CE2-O 3.44Å; Y73-R128 HydrophobicContact CD1-CG 3.89Å; Y73-R128 HydrophobicContact CD2-CG 4.39Å; Y73-R128 HydrophobicContact CE1-CG 3.9Å; Y73-R128 HydrophobicContact CE2-CG 4.4Å; Y73-R128 HydrophobicContact CG-CG 4.14Å; Y73-L133 HydrophobicContact CD2-CD1 4.2Å; Y73-V204 WeakPolarHBondContact OH-CG2 3.32Å |
| 74 | S | 92.4 | Very high | 91.8 | Very high | 102 Ų | 102 | 36.5 Ų | 36.5 | 71% | 0.713 | 18% | 0.181 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 64 | 23.1 | 177.1 | -54.2 | 0 | 0 | 0 | 0 | 114.7 | Y70 R71 H72 | Y70-S74 PolarHBondContact O-N 3.33Å; R71-S74 WeakPolarHBondContact O-CA 3.27Å; R71-S74 PolarHBondContact O-N 2.9Å; H72-S74 PolarHBondContact O-N 3.1Å |
| 75 | F | 92 | Very high | 91.7 | Very high | 21 Ų | 21 | 37.4 Ų | 37.4 | 9% | 0.092 | 19% | 0.186 | C | C | . | . | trans | -70.1 | 144.3 | 172.4 | -66.9 | -61.4 | 0 | 0 | 0 | 111.6 | Y70 R71 Y73 Q79 I80 R128 Y130 L133 | Y70-F75 HydrophobicContact CD1-CD2 4.46Å; Y70-F75 WeakPolarHBondContact O-CD2 3.46Å; Y70-F75 PolarHBondContact O-N 3.47Å; R71-F75 PolarHBondContact NH1-O 3.46Å; Y73-F75 HydrophobicContact CD2-CE2 4.12Å; Y73-F75 HydrophobicContact CG-CE2 4.38Å; Y73-F75 PolarHBondContact O-N 3.32Å; F75-Q79 HydrophobicContact CB-CB 4.44Å; F75-I80 HydrophobicContact CB-CD1 4.37Å; F75-I80 HydrophobicContact CB-CG1 3.94Å; F75-R128 WeakPolarHBondContact CZ-O 3.45Å; F75-Y130 AromaticContact CD1-CD2 4Å; F75-Y130 HydrophobicContact CD1-CD2 4Å; F75-Y130 AromaticContact CE1-CD2 3.64Å; F75-Y130 HydrophobicContact CE1-CD2 3.64Å; F75-Y130 HydrophobicContact CE1-CG 4.21Å; F75-Y130 HydrophobicContact CZ-CD2 4.04Å; F75-L133 HydrophobicContact CD2-CD1 4.39Å; F75-L133 HydrophobicContact CE2-CD1 3.42Å; F75-L133 VanDerWaalsContact CE2-CD1 3.42Å; F75-L133 HydrophobicContact CZ-CD1 3.91Å | ||
| 76 | L | 89.4 | Confident | 91.6 | Very high | 104 Ų | 104 | 39 Ų | 39 | 55% | 0.545 | 20% | 0.197 | S | C | . | . | trans | -71.3 | 150.9 | 174.2 | -63.3 | 171.6 | 0 | 0 | 0 | 110.3 | S78 Q79 I80 | L76-S78 PolarHBondContact O-N 3.19Å; L76-S78 VanDerWaalsContact O-N 3.17Å; L76-Q79 HydrophobicContact CB-CG 4.23Å; L76-Q79 WeakPolarHBondContact O-CB 3.5Å; L76-Q79 PolarHBondContact O-N 2.83Å; L76-I80 WeakPolarHBondContact O-CG1 3.35Å; L76-I80 PolarHBondContact O-N 2.9Å | ||
| 77 | E | 84.1 | Confident | 91.5 | Very high | 68 Ų | 68 | 38.1 Ų | 38.1 | 32% | 0.318 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -56.8 | -35.9 | 179 | -54.1 | -166.4 | 163.7 | 0 | 0 | 112.4 | Y67 Q79 I80 A81 I427 | Y67-E77 WeakPolarHBondContact OH-CG 3.45Å; E77-Q79 VanDerWaalsContact C-N 3.33Å; E77-Q79 PolarHBondContact O-N 3.24Å; E77-I80 PolarHBondContact O-N 3.35Å; E77-A81 WeakPolarHBondContact O-CB 3.42Å; E77-A81 PolarHBondContact O-N 2.99Å; E77-I427 HydrophobicContact CB-CD1 4.44Å |
| 78 | S | 84.2 | Confident | 91.3 | Very high | 15 Ų | 15 | 38.6 Ų | 38.6 | 11% | 0.105 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.8 | -34.3 | 175.7 | 61.2 | 0 | 0 | 0 | 0 | 113.2 | L76 I82 H424 | L76-S78 PolarHBondContact O-N 3.19Å; L76-S78 VanDerWaalsContact O-N 3.17Å; S78-I82 WeakPolarHBondContact O-CG1 3.45Å; S78-I82 PolarHBondContact O-N 3.48Å; S78-H424 PolarHBondContact O-ND1 2.96Å |
| 79 | Q | 90.3 | Very high | 91.1 | Very high | 66 Ų | 66 | 37.6 Ų | 37.6 | 31% | 0.308 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -75.7 | -38.7 | 174.7 | -66.9 | 171.5 | -30.4 | 0 | 0 | 111.1 | F75 L76 E77 A81 I82 L83 Y130 | F75-Q79 HydrophobicContact CB-CB 4.44Å; L76-Q79 HydrophobicContact CB-CG 4.23Å; L76-Q79 WeakPolarHBondContact O-CB 3.5Å; L76-Q79 PolarHBondContact O-N 2.83Å; E77-Q79 VanDerWaalsContact C-N 3.33Å; E77-Q79 PolarHBondContact O-N 3.24Å; Q79-A81 VanDerWaalsContact C-N 3.31Å; Q79-A81 PolarHBondContact O-N 3.17Å; Q79-I82 PolarHBondContact O-N 3.3Å; Q79-L83 PolarHBondContact O-N 3.29Å; Q79-L83 VanDerWaalsContact O-N 3.11Å; Q79-Y130 HydrophobicContact CB-CE2 3.95Å; Q79-Y130 PolarHBondContact O-OH 2.97Å |
| 80 | I | 91.9 | Very high | 91 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -63.8 | -40.6 | 175.5 | -57.9 | 174.8 | 0 | 0 | 0 | 110.2 | Y67 Y70 R71 F75 L76 E77 I82 L83 Y84 F295 | Y67-I80 HydrophobicContact CD2-CG2 3.7Å; Y67-I80 HydrophobicContact CE1-CD1 4.42Å; Y67-I80 HydrophobicContact CE2-CB 4.35Å; Y67-I80 HydrophobicContact CE2-CD1 4.32Å; Y67-I80 HydrophobicContact CE2-CG2 3.76Å; Y67-I80 HydrophobicContact CG-CG2 4.46Å; Y70-I80 HydrophobicContact CD2-CG2 3.78Å; Y70-I80 HydrophobicContact CG-CG1 4.48Å; Y70-I80 HydrophobicContact CG-CG2 4.39Å; R71-I80 HydrophobicContact CG-CD1 3.6Å; F75-I80 HydrophobicContact CB-CD1 4.37Å; F75-I80 HydrophobicContact CB-CG1 3.94Å; L76-I80 WeakPolarHBondContact O-CG1 3.35Å; L76-I80 PolarHBondContact O-N 2.9Å; E77-I80 PolarHBondContact O-N 3.35Å; I80-I82 VanDerWaalsContact C-N 3.32Å; I80-I82 PolarHBondContact O-N 2.87Å; I80-L83 WeakPolarHBondContact O-CB 3.49Å; I80-L83 PolarHBondContact O-N 3.41Å; I80-L83 VanDerWaalsContact O-N 3.16Å; I80-Y84 HydrophobicContact CG2-CD2 3.94Å; I80-Y84 HydrophobicContact CG2-CE2 3.87Å; I80-Y84 WeakPolarHBondContact O-CD2 3.28Å; I80-Y84 PolarHBondContact O-N 2.93Å; I80-F295 HydrophobicContact CB-CE2 4.34Å; I80-F295 HydrophobicContact CG2-CE2 3.94Å |
| 81 | A | 89.1 | Confident | 90.6 | Very high | 1 Ų | 1 | 38.3 Ų | 38.3 | 1% | 0.008 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -57.1 | -44.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | E77 Q79 L83 Y84 V85 F295 | E77-A81 WeakPolarHBondContact O-CB 3.42Å; E77-A81 PolarHBondContact O-N 2.99Å; Q79-A81 VanDerWaalsContact C-N 3.31Å; Q79-A81 PolarHBondContact O-N 3.17Å; A81-L83 PolarHBondContact O-N 3.35Å; A81-Y84 WeakPolarHBondContact O-CB 3.26Å; A81-Y84 PolarHBondContact O-N 3.24Å; A81-Y84 VanDerWaalsContact O-N 3.16Å; A81-V85 WeakPolarHBondContact O-CG2 3.45Å; A81-V85 PolarHBondContact O-N 2.84Å; A81-F295 HydrophobicContact CB-CE2 3.99Å; A81-F295 HydrophobicContact CB-CZ 3.87Å |
| 82 | I | 91.2 | Very high | 90.2 | Very high | 53 Ų | 53 | 34.8 Ų | 34.8 | 27% | 0.272 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -60.8 | -44.1 | 176.1 | -65.7 | 166.5 | 0 | 0 | 0 | 111 | S78 Q79 I80 Y84 V85 C86 Y130 | S78-I82 WeakPolarHBondContact O-CG1 3.45Å; S78-I82 PolarHBondContact O-N 3.48Å; Q79-I82 PolarHBondContact O-N 3.3Å; I80-I82 VanDerWaalsContact C-N 3.32Å; I80-I82 PolarHBondContact O-N 2.87Å; I82-Y84 VanDerWaalsContact C-N 3.28Å; I82-Y84 PolarHBondContact O-N 2.83Å; I82-V85 PolarHBondContact O-N 3.34Å; I82-C86 WeakPolarHBondContact O-CB 3.36Å; I82-C86 PolarHBondContact O-N 3.3Å; I82-C86 PolarHBondContact O-SG 3.42Å; I82-Y130 WeakPolarHBondContact CG2-OH 3.24Å |
| 83 | L | 93.4 | Very high | 90 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.2 | -39.3 | 175.8 | -72.6 | 168.5 | 0 | 0 | 0 | 112.1 | Y70 Q79 I80 A81 G87 Y130 L133 I134 R137 | Y70-L83 HydrophobicContact CD1-CD1 3.84Å; Y70-L83 HydrophobicContact CD2-CD1 4.32Å; Y70-L83 HydrophobicContact CE1-CD1 3.73Å; Y70-L83 HydrophobicContact CE2-CB 4.36Å; Y70-L83 HydrophobicContact CE2-CD1 4.21Å; Y70-L83 HydrophobicContact CG-CD1 4.1Å; Q79-L83 PolarHBondContact O-N 3.29Å; Q79-L83 VanDerWaalsContact O-N 3.11Å; I80-L83 WeakPolarHBondContact O-CB 3.49Å; I80-L83 PolarHBondContact O-N 3.41Å; I80-L83 VanDerWaalsContact O-N 3.16Å; A81-L83 PolarHBondContact O-N 3.35Å; L83-G87 PolarHBondContact O-N 2.91Å; L83-Y130 HydrophobicContact CD1-CD2 4.25Å; L83-Y130 HydrophobicContact CD1-CE2 3.79Å; L83-Y130 HydrophobicContact CD2-CE2 4.07Å; L83-Y130 HydrophobicContact CG-CE2 3.76Å; L83-L133 HydrophobicContact CD2-CB 4.02Å; L83-I134 HydrophobicContact CD2-CB 4.42Å; L83-I134 HydrophobicContact CD2-CG1 3.64Å; L83-R137 HydrophobicContact CB-CG 4.21Å; L83-R137 HydrophobicContact CD2-CG 4.19Å; L83-R137 VanDerWaalsContact O-CG 3.3Å; L83-R137 WeakPolarHBondContact O-CG 3.39Å; L83-R137 PolarHBondContact O-NE 3.46Å |
| 84 | Y | 91.8 | Very high | 89.7 | Confident | 12 Ų | 12 | 36.4 Ų | 36.4 | 5% | 0.047 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65 | -49.3 | 174.9 | -89.7 | -111.6 | 0 | 0 | 0 | 111.4 | L66 Y67 Y70 I80 A81 I82 C86 G87 L88 R137 V294 F295 | L66-Y84 HydrophobicContact CD2-CE1 4.34Å; L66-Y84 HydrophobicContact CD2-CE2 4.25Å; L66-Y84 HydrophobicContact CG-CE2 4.28Å; Y67-Y84 HydrophobicContact CD2-CE2 4.42Å; Y67-Y84 PolarHBondContact N-OH 3.43Å; Y70-Y84 HydrophobicContact CD2-CE2 4.27Å; Y70-Y84 HydrophobicContact CE2-CE2 4.13Å; I80-Y84 HydrophobicContact CG2-CD2 3.94Å; I80-Y84 HydrophobicContact CG2-CE2 3.87Å; I80-Y84 WeakPolarHBondContact O-CD2 3.28Å; I80-Y84 PolarHBondContact O-N 2.93Å; A81-Y84 WeakPolarHBondContact O-CB 3.26Å; A81-Y84 PolarHBondContact O-N 3.24Å; A81-Y84 VanDerWaalsContact O-N 3.16Å; I82-Y84 VanDerWaalsContact C-N 3.28Å; I82-Y84 PolarHBondContact O-N 2.83Å; Y84-C86 PolarHBondContact O-N 3.43Å; Y84-G87 PolarHBondContact O-N 3.17Å; Y84-G87 VanDerWaalsContact O-N 3.12Å; Y84-L88 WeakPolarHBondContact O-CG 3.37Å; Y84-L88 PolarHBondContact O-N 3.35Å; Y84-R137 PolarHBondContact O-NH2 2.88Å; Y84-V294 HydrophobicContact CE1-CG1 4.36Å; Y84-F295 HydrophobicContact CD1-CB 4.06Å; Y84-F295 AromaticContact CD1-CD2 3.95Å; Y84-F295 HydrophobicContact CD1-CD2 3.95Å; Y84-F295 AromaticContact CD2-CD2 3.81Å; Y84-F295 HydrophobicContact CD2-CD2 3.81Å; Y84-F295 HydrophobicContact CD2-CE2 4.28Å; Y84-F295 HydrophobicContact CE1-CB 4.19Å; Y84-F295 HydrophobicContact CE1-CD2 4.26Å; Y84-F295 HydrophobicContact CE2-CD2 4.14Å; Y84-F295 AromaticContact CG-CD2 3.7Å; Y84-F295 HydrophobicContact CG-CD2 3.7Å; Y84-F295 HydrophobicContact CG-CE2 4.46Å |
| 85 | V | 91.4 | Very high | 89.2 | Confident | 20 Ų | 20 | 32.5 Ų | 32.5 | 12% | 0.121 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -56.7 | -45.5 | 176.3 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | A81 I82 G87 L88 A89 C417 L420 L421 | A81-V85 WeakPolarHBondContact O-CG2 3.45Å; A81-V85 PolarHBondContact O-N 2.84Å; I82-V85 PolarHBondContact O-N 3.34Å; V85-G87 VanDerWaalsContact C-N 3.29Å; V85-G87 PolarHBondContact O-N 3.08Å; V85-L88 PolarHBondContact O-N 3.19Å; V85-A89 VanDerWaalsContact O-CB 3.25Å; V85-A89 WeakPolarHBondContact O-CB 3.33Å; V85-A89 PolarHBondContact O-N 3.47Å; V85-C417 HydrophobicContact CG1-CB 4.33Å; V85-L420 HydrophobicContact CG2-CB 3.57Å; V85-L420 HydrophobicContact CG2-CD1 3.96Å; V85-L420 HydrophobicContact CG2-CG 4.44Å; V85-L421 HydrophobicContact CG2-CG 4.43Å |
| 86 | C | 92.8 | Very high | 88.6 | Confident | 34 Ų | 34 | 34.1 Ų | 34.1 | 23% | 0.23 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -57.8 | -41.3 | 176.8 | -72.3 | 0 | 0 | 0 | 0 | 112.2 | I82 Y84 A90 R137 | I82-C86 WeakPolarHBondContact O-CB 3.36Å; I82-C86 PolarHBondContact O-N 3.3Å; I82-C86 PolarHBondContact O-SG 3.42Å; Y84-C86 PolarHBondContact O-N 3.43Å; C86-A90 WeakPolarHBondContact O-CB 3.4Å; C86-A90 PolarHBondContact O-N 3.12Å; C86-R137 HydrophobicContact CB-CB 4.45Å |
| 87 | G | 91.9 | Very high | 88.3 | Confident | 4 Ų | 4 | 34.3 Ų | 34.3 | 4% | 0.041 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -68.8 | -41.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L83 Y84 V85 A90 C91 R137 | L83-G87 PolarHBondContact O-N 2.91Å; Y84-G87 PolarHBondContact O-N 3.17Å; Y84-G87 VanDerWaalsContact O-N 3.12Å; V85-G87 VanDerWaalsContact C-N 3.29Å; V85-G87 PolarHBondContact O-N 3.08Å; G87-A90 PolarHBondContact O-N 2.89Å; G87-C91 WeakPolarHBondContact O-CB 3.36Å; G87-C91 PolarHBondContact O-N 2.95Å; G87-R137 WeakPolarHBondContact CA-O 3.39Å |
| 88 | L | 89 | Confident | 88.1 | Confident | 14 Ų | 14 | 31.1 Ų | 31.1 | 7% | 0.073 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.1 | -45.9 | 176.6 | -68 | 171.6 | 0 | 0 | 0 | 111.5 | Y84 V85 C91 V92 Y291 A416 L420 | Y84-L88 WeakPolarHBondContact O-CG 3.37Å; Y84-L88 PolarHBondContact O-N 3.35Å; V85-L88 PolarHBondContact O-N 3.19Å; L88-C91 WeakPolarHBondContact O-CB 3.28Å; L88-C91 PolarHBondContact O-N 3.29Å; L88-V92 WeakPolarHBondContact O-CG2 3.27Å; L88-V92 PolarHBondContact O-N 3.36Å; L88-V92 VanDerWaalsContact O-N 3.1Å; L88-Y291 HydrophobicContact CD2-CD1 3.37Å; L88-Y291 HydrophobicContact CD2-CE1 3.66Å; L88-Y291 HydrophobicContact CD2-CG 4Å; L88-A416 HydrophobicContact CD1-CB 4.25Å; L88-L420 HydrophobicContact CD1-CD1 3.77Å |
| 89 | A | 89.9 | Confident | 87.8 | Confident | 36 Ų | 36 | 32.1 Ų | 32.1 | 30% | 0.298 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -61.3 | -44.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | V85 C91 V92 L93 | V85-A89 VanDerWaalsContact O-CB 3.25Å; V85-A89 WeakPolarHBondContact O-CB 3.33Å; V85-A89 PolarHBondContact O-N 3.47Å; A89-C91 VanDerWaalsContact C-N 3.34Å; A89-C91 PolarHBondContact O-N 2.76Å; A89-V92 PolarHBondContact O-N 2.82Å; A89-L93 WeakPolarHBondContact O-CB 3.33Å; A89-L93 VanDerWaalsContact O-CG 3.25Å; A89-L93 WeakPolarHBondContact O-CG 3.16Å; A89-L93 PolarHBondContact O-N 2.91Å |
| 90 | A | 92.2 | Very high | 87.2 | Confident | 5 Ų | 5 | 33.2 Ų | 33.2 | 4% | 0.041 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -42.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | C86 G87 V92 L93 F94 I138 | C86-A90 WeakPolarHBondContact O-CB 3.4Å; C86-A90 PolarHBondContact O-N 3.12Å; G87-A90 PolarHBondContact O-N 2.89Å; A90-V92 PolarHBondContact O-N 3.4Å; A90-L93 PolarHBondContact O-N 3.36Å; A90-F94 HydrophobicContact CB-CD2 4.17Å; A90-F94 HydrophobicContact CB-CE2 4.14Å; A90-F94 WeakPolarHBondContact O-CB 3.22Å; A90-F94 WeakPolarHBondContact O-CD2 3.47Å; A90-F94 WeakPolarHBondContact O-CG 3.31Å; A90-F94 PolarHBondContact O-N 2.97Å; A90-I138 HydrophobicContact CB-CB 4.36Å; A90-I138 HydrophobicContact CB-CG1 4.46Å; A90-I138 HydrophobicContact CB-CG2 4.25Å |
| 91 | C | 87.6 | Confident | 86.7 | Confident | 10 Ų | 10 | 34.3 Ų | 34.3 | 7% | 0.068 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.8 | -48.3 | 175.7 | -174.5 | 0 | 0 | 0 | 0 | 111.5 | G87 L88 A89 F94 A95 S145 | G87-C91 WeakPolarHBondContact O-CB 3.36Å; G87-C91 PolarHBondContact O-N 2.95Å; L88-C91 WeakPolarHBondContact O-CB 3.28Å; L88-C91 PolarHBondContact O-N 3.29Å; A89-C91 VanDerWaalsContact C-N 3.34Å; A89-C91 PolarHBondContact O-N 2.76Å; C91-F94 PolarHBondContact O-N 3.46Å; C91-A95 WeakPolarHBondContact O-CB 3.42Å; C91-A95 PolarHBondContact O-N 3.42Å; C91-S145 WeakPolarHBondContact CA-OG 3.22Å; C91-S145 PolarHBondContact O-OG 3.28Å; C91-S145 PolarHBondContact SG-OG 3.47Å |
| 92 | V | 83.8 | Confident | 86.4 | Confident | 26 Ų | 26 | 34.9 Ų | 34.9 | 16% | 0.158 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.2 | -50.1 | 175.5 | 175.7 | 0 | 0 | 0 | 0 | 111.8 | L88 A89 A90 F94 A95 P96 L410 H413 | L88-V92 WeakPolarHBondContact O-CG2 3.27Å; L88-V92 PolarHBondContact O-N 3.36Å; L88-V92 VanDerWaalsContact O-N 3.1Å; A89-V92 PolarHBondContact O-N 2.82Å; A90-V92 PolarHBondContact O-N 3.4Å; V92-F94 VanDerWaalsContact C-N 3.26Å; V92-F94 PolarHBondContact O-N 2.89Å; V92-A95 PolarHBondContact O-N 2.82Å; V92-P96 VanDerWaalsContact O-CD 3.23Å; V92-P96 WeakPolarHBondContact O-CD 3.44Å; V92-L410 HydrophobicContact CG1-CD1 3.51Å; V92-H413 HydrophobicContact CG2-CB 3.07Å; V92-H413 WeakPolarHBondContact CG2-CD2 3.39Å |
| 93 | L | 86.6 | Confident | 85.7 | Confident | 115 Ų | 115 | 37.2 Ų | 37.2 | 60% | 0.602 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -60.8 | -39.3 | -177.2 | -71.4 | 171.8 | 0 | 0 | 0 | 110.9 | A89 A90 F97 | A89-L93 WeakPolarHBondContact O-CB 3.33Å; A89-L93 VanDerWaalsContact O-CG 3.25Å; A89-L93 WeakPolarHBondContact O-CG 3.16Å; A89-L93 PolarHBondContact O-N 2.91Å; A90-L93 PolarHBondContact O-N 3.36Å; L93-F97 WeakPolarHBondContact O-CD2 3.38Å; L93-F97 WeakPolarHBondContact O-CE2 3.19Å |
| 94 | F | 88.9 | Confident | 85 | Confident | 59 Ų | 59 | 41 Ų | 41 | 26% | 0.259 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -88 | -9.8 | -178.7 | -66.3 | -54.7 | 0 | 0 | 0 | 115.1 | A90 C91 V92 F97 S98 I138 L142 | A90-F94 HydrophobicContact CB-CD2 4.17Å; A90-F94 HydrophobicContact CB-CE2 4.14Å; A90-F94 WeakPolarHBondContact O-CB 3.22Å; A90-F94 WeakPolarHBondContact O-CD2 3.47Å; A90-F94 WeakPolarHBondContact O-CG 3.31Å; A90-F94 PolarHBondContact O-N 2.97Å; C91-F94 PolarHBondContact O-N 3.46Å; V92-F94 VanDerWaalsContact C-N 3.26Å; V92-F94 PolarHBondContact O-N 2.89Å; F94-F97 HydrophobicContact CD1-CD2 4.35Å; F94-F97 PolarHBondContact O-N 2.84Å; F94-F97 VanDerWaalsContact O-N 3.12Å; F94-S98 PolarHBondContact O-N 3.27Å; F94-I138 HydrophobicContact CE2-CG2 3.84Å; F94-I138 HydrophobicContact CZ-CG2 4.31Å; F94-L142 HydrophobicContact CB-CD1 3.96Å; F94-L142 HydrophobicContact CD1-CD1 4.1Å; F94-L142 HydrophobicContact CD2-CB 3.66Å; F94-L142 HydrophobicContact CD2-CD1 4.25Å; F94-L142 HydrophobicContact CE2-CB 4Å; F94-L142 HydrophobicContact CG-CB 4.16Å; F94-L142 HydrophobicContact CG-CD1 3.86Å |
| 95 | A | 82.6 | Confident | 84.5 | Confident | 19 Ų | 19 | 44.6 Ų | 44.6 | 16% | 0.157 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.6 | -44 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | C91 V92 F97 S98 | C91-A95 WeakPolarHBondContact O-CB 3.42Å; C91-A95 PolarHBondContact O-N 3.42Å; V92-A95 PolarHBondContact O-N 2.82Å; A95-F97 VanDerWaalsContact C-N 3.33Å; A95-F97 PolarHBondContact O-N 2.9Å; A95-S98 PolarHBondContact O-N 2.98Å; A95-S98 PolarHBondContact O-OG 3.19Å; A95-S98 VanDerWaalsContact O-OG 3.09Å |
| 96 | P | 79.1 | Confident | 84.1 | Confident | 56 Ų | 56 | 44.7 Ų | 44.7 | 36% | 0.364 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -54.9 | -45.5 | 167.4 | -33.6 | 41.4 | 0 | 0 | 0 | 113.6 | V92 G99 W100 F259 | V92-P96 VanDerWaalsContact O-CD 3.23Å; V92-P96 WeakPolarHBondContact O-CD 3.44Å; P96-G99 PolarHBondContact O-N 3Å; P96-W100 PolarHBondContact O-N 2.63Å; P96-F259 HydrophobicContact CB-CE1 4.16Å; P96-F259 HydrophobicContact CB-CE2 4.29Å; P96-F259 HydrophobicContact CB-CZ 3.51Å; P96-F259 HydrophobicContact CG-CZ 4.42Å; P96-F259 WeakPolarHBondContact O-CE2 3.46Å |
| 97 | F | 82.5 | Confident | 83.7 | Confident | 108 Ų | 108 | 47.2 Ų | 47.2 | 47% | 0.474 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -68.8 | -37.5 | -175.9 | -67.9 | -87.9 | 0 | 0 | 0 | 111.7 | L93 F94 A95 G99 W100 L101 | L93-F97 WeakPolarHBondContact O-CD2 3.38Å; L93-F97 WeakPolarHBondContact O-CE2 3.19Å; F94-F97 HydrophobicContact CD1-CD2 4.35Å; F94-F97 PolarHBondContact O-N 2.84Å; F94-F97 VanDerWaalsContact O-N 3.12Å; A95-F97 VanDerWaalsContact C-N 3.33Å; A95-F97 PolarHBondContact O-N 2.9Å; F97-G99 PolarHBondContact O-N 3.31Å; F97-W100 HydrophobicContact CD1-CE3 4.48Å; F97-W100 PolarHBondContact O-N 2.68Å; F97-L101 HydrophobicContact CB-CD1 3.98Å; F97-L101 WeakPolarHBondContact O-CD1 3.38Å; F97-L101 PolarHBondContact O-N 3.18Å |
| 98 | S | 80.9 | Confident | 83.5 | Confident | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.007 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64 | -26 | 179.7 | 74 | 0 | 0 | 0 | 0 | 113 | F94 A95 P102 S145 T149 | F94-S98 PolarHBondContact O-N 3.27Å; A95-S98 PolarHBondContact O-N 2.98Å; A95-S98 PolarHBondContact O-OG 3.19Å; A95-S98 VanDerWaalsContact O-OG 3.09Å; S98-P102 WeakPolarHBondContact O-CD 3.3Å; S98-P102 WeakPolarHBondContact O-CG 3.31Å; S98-S145 VanDerWaalsContact CB-O 3.23Å; S98-S145 WeakPolarHBondContact CB-O 3.44Å; S98-S145 PolarHBondContact OG-O 3.04Å; S98-T149 WeakPolarHBondContact CB-OG1 3.21Å; S98-T149 PolarHBondContact OG-OG1 2.88Å |
| 99 | G | 75.9 | Confident | 83.6 | Confident | 36 Ų | 36 | 53.4 Ų | 53.4 | 37% | 0.371 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -78.4 | -25.1 | 171 | 0 | 0 | 0 | 0 | 0 | 114.3 | P96 F97 | P96-G99 PolarHBondContact O-N 3Å; F97-G99 PolarHBondContact O-N 3.31Å |
| 100 | W | 79.1 | Confident | 83.7 | Confident | 89 Ų | 89 | 51.7 Ų | 51.7 | 34% | 0.337 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -88.8 | -37.9 | 179.5 | 174.5 | 76 | 0 | 0 | 0 | 113.1 | P96 F97 P102 Q103 V104 | P96-W100 PolarHBondContact O-N 2.63Å; F97-W100 HydrophobicContact CD1-CE3 4.48Å; F97-W100 PolarHBondContact O-N 2.68Å; W100-P102 VanDerWaalsContact C-CD 3.46Å; W100-Q103 VanDerWaalsContact O-CB 3.31Å; W100-Q103 WeakPolarHBondContact O-CB 3.5Å; W100-Q103 PolarHBondContact O-N 2.94Å; W100-V104 HydrophobicContact CD2-CG2 4.17Å; W100-V104 HydrophobicContact CH2-CB 4.48Å; W100-V104 HydrophobicContact CH2-CG1 4.49Å; W100-V104 HydrophobicContact CH2-CG2 3.94Å; W100-V104 HydrophobicContact CZ2-CB 4.42Å; W100-V104 HydrophobicContact CZ2-CG2 3.42Å; W100-V104 VanDerWaalsContact CZ2-CG2 3.42Å |
| 101 | L | 80.6 | Confident | 83.7 | Confident | 22 Ų | 22 | 51.4 Ų | 51.4 | 12% | 0.115 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -50.2 | -45.8 | -178.4 | -103.4 | 73.7 | 0 | 0 | 0 | 114.3 | F97 Q103 V104 L105 T110 L113 L146 | F97-L101 HydrophobicContact CB-CD1 3.98Å; F97-L101 WeakPolarHBondContact O-CD1 3.38Å; F97-L101 PolarHBondContact O-N 3.18Å; L101-Q103 PolarHBondContact O-N 3.18Å; L101-Q103 VanDerWaalsContact O-N 3.11Å; L101-V104 PolarHBondContact O-N 2.75Å; L101-L105 HydrophobicContact CD2-CD1 3.97Å; L101-L105 HydrophobicContact CG-CD1 3.96Å; L101-L105 PolarHBondContact O-N 2.78Å; L101-T110 HydrophobicContact CB-CG2 3.9Å; L101-T110 HydrophobicContact CD2-CG2 4.29Å; L101-L113 HydrophobicContact CD2-CD2 3.41Å; L101-L113 VanDerWaalsContact CD2-CD2 3.41Å; L101-L146 HydrophobicContact CD2-CD2 4.06Å |
| 102 | P | 82.1 | Confident | 84.1 | Confident | 14 Ų | 14 | 52.7 Ų | 52.7 | 9% | 0.091 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.1 | -23.3 | 179.2 | -23.6 | 32.6 | 0 | 0 | 0 | 114 | S98 W100 G106 R107 T110 T150 | S98-P102 WeakPolarHBondContact O-CD 3.3Å; S98-P102 WeakPolarHBondContact O-CG 3.31Å; W100-P102 VanDerWaalsContact C-CD 3.46Å; P102-G106 CarbonylContact O-C 3.35Å; P102-G106 WeakPolarHBondContact O-CA 3.39Å; P102-G106 PolarHBondContact O-N 3.45Å; P102-R107 HydrophobicContact CB-CB 4.49Å; P102-R107 HydrophobicContact CB-CG 3.94Å; P102-T110 WeakPolarHBondContact CA-OG1 3.46Å; P102-T110 HydrophobicContact CG-CG2 4.08Å; P102-T150 HydrophobicContact CG-CG2 4.33Å |
| 103 | Q | 78.6 | Confident | 84.6 | Confident | 101 Ų | 101 | 54 Ų | 54 | 47% | 0.472 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -80.8 | -18.7 | 178.3 | -53.6 | -178.4 | 8.8 | 0 | 0 | 113 | W100 L101 A255 | W100-Q103 VanDerWaalsContact O-CB 3.31Å; W100-Q103 WeakPolarHBondContact O-CB 3.5Å; W100-Q103 PolarHBondContact O-N 2.94Å; L101-Q103 PolarHBondContact O-N 3.18Å; L101-Q103 VanDerWaalsContact O-N 3.11Å; Q103-A255 HydrophobicContact CB-CB 4.34Å; Q103-A255 VanDerWaalsContact OE1-CB 3.32Å |
| 104 | V | 78.4 | Confident | 85.1 | Confident | 81 Ų | 81 | 48.6 Ų | 48.6 | 49% | 0.491 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -109.6 | -47.8 | -176.2 | 177.2 | 0 | 0 | 0 | 0 | 111.9 | W100 L101 | W100-V104 HydrophobicContact CD2-CG2 4.17Å; W100-V104 HydrophobicContact CH2-CB 4.48Å; W100-V104 HydrophobicContact CH2-CG1 4.49Å; W100-V104 HydrophobicContact CH2-CG2 3.94Å; W100-V104 HydrophobicContact CZ2-CB 4.42Å; W100-V104 HydrophobicContact CZ2-CG2 3.42Å; W100-V104 VanDerWaalsContact CZ2-CG2 3.42Å; L101-V104 PolarHBondContact O-N 2.75Å |
| 105 | L | 79.7 | Confident | 85.5 | Confident | 87 Ų | 87 | 46.1 Ų | 46.1 | 46% | 0.455 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -16.6 | -177.8 | -65.3 | 175 | 0 | 0 | 0 | 112.6 | L101 Q109 L113 | L101-L105 HydrophobicContact CD2-CD1 3.97Å; L101-L105 HydrophobicContact CG-CD1 3.96Å; L101-L105 PolarHBondContact O-N 2.78Å; L105-Q109 HydrophobicContact CB-CB 4.45Å; L105-Q109 VanDerWaalsContact O-CB 3.26Å; L105-Q109 WeakPolarHBondContact O-CB 3.45Å; L105-Q109 VanDerWaalsContact O-CG 3.28Å; L105-Q109 WeakPolarHBondContact O-CG 3.28Å; L105-Q109 PolarHBondContact O-OE1 2.83Å; L105-L113 HydrophobicContact CD1-CD2 4.26Å |
| 106 | G | 83 | Confident | 86.2 | Confident | 21 Ų | 21 | 49.9 Ų | 49.9 | 22% | 0.216 | 26% | 0.261 | C | S | . | . | trans | 90 | 147.2 | -167.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | P102 R108 T110 | P102-G106 CarbonylContact O-C 3.35Å; P102-G106 WeakPolarHBondContact O-CA 3.39Å; P102-G106 PolarHBondContact O-N 3.45Å; G106-R108 PolarHBondContact O-N 2.78Å; G106-T110 WeakPolarHBondContact O-CB 3.18Å; G106-T110 PolarHBondContact O-N 3.46Å; G106-T110 PolarHBondContact O-OG1 3.11Å | ||
| 107 | R | 84.8 | Confident | 87 | Confident | 88 Ų | 88 | 47.8 Ų | 47.8 | 33% | 0.332 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.6 | -41.2 | -172.7 | -59.5 | -167.2 | 175.2 | 91.4 | -12.9 | 112.3 | P102 T110 C111 W154 H157 | P102-R107 HydrophobicContact CB-CB 4.49Å; P102-R107 HydrophobicContact CB-CG 3.94Å; R107-T110 PolarHBondContact O-N 2.92Å; R107-C111 PolarHBondContact O-N 3.32Å; R107-C111 PolarHBondContact O-SG 2.93Å; R107-C111 VanDerWaalsContact O-SG 3.34Å; R107-W154 HydrophobicContact CB-CB 4.27Å; R107-W154 HydrophobicContact CB-CG 4.48Å; R107-H157 PolarHBondContact NH1-CD2 3.17Å; R107-H157 PolarHBondContact NH1-CE1 3.32Å; R107-H157 PolarHBondContact NH1-ND1 3.27Å; R107-H157 VanDerWaalsContact NH1-ND1 3.17Å; R107-H157 PolarHBondContact NH1-NE2 3.26Å; R107-H157 PolarHBondContact NH2-CD2 3.33Å |
| 108 | R | 88.9 | Confident | 87.7 | Confident | 63 Ų | 63 | 43.3 Ų | 43.3 | 24% | 0.238 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -67.9 | -47 | 179.5 | -171.6 | -177.6 | 70.9 | -176.4 | 7.2 | 111.7 | G106 T110 C111 L112 V221 E229 | G106-R108 PolarHBondContact O-N 2.78Å; R108-T110 PolarHBondContact O-N 3.37Å; R108-C111 WeakPolarHBondContact O-CB 3.45Å; R108-C111 PolarHBondContact O-N 3.36Å; R108-C111 VanDerWaalsContact O-N 3.08Å; R108-L112 PolarHBondContact O-N 2.91Å; R108-L112 VanDerWaalsContact O-N 3.15Å; R108-V221 HydrophobicContact CG-CG1 3.74Å; R108-E229 WeakPolarHBondContact CD-OE2 3.36Å; R108-E229 IonicContact CZ-OE2 2.68Å; R108-E229 VanDerWaalsContact CZ-OE2 3.26Å; R108-E229 IonicContact NE-OE2 2.78Å; R108-E229 PolarHBondContact NE-OE2 3.36Å; R108-E229 IonicContact NH1-OE2 3.18Å; R108-E229 PolarHBondContact NH1-OE2 3.49Å |
| 109 | Q | 90.2 | Very high | 88.5 | Confident | 84 Ų | 84 | 44.2 Ų | 44.2 | 39% | 0.393 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -59.7 | -35.7 | 177.4 | -64.9 | 82.4 | -13.9 | 0 | 0 | 111.2 | L105 C111 L112 L113 | L105-Q109 HydrophobicContact CB-CB 4.45Å; L105-Q109 VanDerWaalsContact O-CB 3.26Å; L105-Q109 WeakPolarHBondContact O-CB 3.45Å; L105-Q109 VanDerWaalsContact O-CG 3.28Å; L105-Q109 WeakPolarHBondContact O-CG 3.28Å; L105-Q109 PolarHBondContact O-OE1 2.83Å; Q109-C111 VanDerWaalsContact C-N 3.34Å; Q109-C111 PolarHBondContact O-N 3.36Å; Q109-L112 WeakPolarHBondContact O-CB 3.28Å; Q109-L112 PolarHBondContact O-N 3.48Å; Q109-L113 PolarHBondContact O-N 2.79Å |
| 110 | T | 91.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -67.1 | -34.2 | 177.2 | -51.5 | 0 | 0 | 0 | 0 | 112.3 | L101 P102 G106 R107 R108 L112 L113 F114 L146 T150 | L101-T110 HydrophobicContact CB-CG2 3.9Å; L101-T110 HydrophobicContact CD2-CG2 4.29Å; P102-T110 WeakPolarHBondContact CA-OG1 3.46Å; P102-T110 HydrophobicContact CG-CG2 4.08Å; G106-T110 WeakPolarHBondContact O-CB 3.18Å; G106-T110 PolarHBondContact O-N 3.46Å; G106-T110 PolarHBondContact O-OG1 3.11Å; R107-T110 PolarHBondContact O-N 2.92Å; R108-T110 PolarHBondContact O-N 3.37Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L113 WeakPolarHBondContact O-CB 3.28Å; T110-L113 PolarHBondContact O-N 3.47Å; T110-F114 PolarHBondContact O-N 3.32Å; T110-F114 VanDerWaalsContact O-N 3.11Å; T110-L146 HydrophobicContact CG2-CD2 3.69Å; T110-T150 HydrophobicContact CG2-CG2 3.4Å |
| 111 | C | 93.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68.8 | -33.3 | 172.6 | -60.6 | 0 | 0 | 0 | 0 | 112.2 | R107 R108 Q109 F114 C115 F151 V221 W225 | R107-C111 PolarHBondContact O-N 3.32Å; R107-C111 PolarHBondContact O-SG 2.93Å; R107-C111 VanDerWaalsContact O-SG 3.34Å; R108-C111 WeakPolarHBondContact O-CB 3.45Å; R108-C111 PolarHBondContact O-N 3.36Å; R108-C111 VanDerWaalsContact O-N 3.08Å; Q109-C111 VanDerWaalsContact C-N 3.34Å; Q109-C111 PolarHBondContact O-N 3.36Å; C111-F114 WeakPolarHBondContact O-CB 3.36Å; C111-F114 PolarHBondContact O-N 3.2Å; C111-C115 PolarHBondContact O-N 2.83Å; C111-C115 PolarHBondContact O-SG 3.38Å; C111-F151 HydrophobicContact CB-CE1 4.37Å; C111-F151 HydrophobicContact CB-CZ 4.33Å; C111-V221 HydrophobicContact CB-CG1 4.16Å; C111-W225 HydrophobicContact CB-CZ3 4.37Å |
| 112 | L | 95.1 | Very high | 91.2 | Very high | 36 Ų | 36 | 39.1 Ų | 39.1 | 19% | 0.188 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -70.7 | -38.7 | 173 | -63.2 | 173.4 | 0 | 0 | 0 | 111.9 | R108 Q109 T110 F114 C115 V116 V221 L222 | R108-L112 PolarHBondContact O-N 2.91Å; R108-L112 VanDerWaalsContact O-N 3.15Å; Q109-L112 WeakPolarHBondContact O-CB 3.28Å; Q109-L112 PolarHBondContact O-N 3.48Å; T110-L112 VanDerWaalsContact C-N 3.35Å; L112-F114 VanDerWaalsContact C-N 3.26Å; L112-F114 PolarHBondContact O-N 3.33Å; L112-C115 WeakPolarHBondContact O-CB 3.46Å; L112-C115 PolarHBondContact O-N 3.48Å; L112-C115 VanDerWaalsContact O-N 3.07Å; L112-V116 WeakPolarHBondContact O-CG2 3.26Å; L112-V116 PolarHBondContact O-N 3.06Å; L112-V221 HydrophobicContact CD2-CB 3.93Å; L112-V221 HydrophobicContact CD2-CG1 3.7Å; L112-V221 HydrophobicContact CG-CG1 3.93Å; L112-L222 HydrophobicContact CD1-CD2 3.49Å; L112-L222 VanDerWaalsContact CD1-CD2 3.49Å; L112-L222 HydrophobicContact CD1-CG 4.05Å; L112-L222 HydrophobicContact CD2-CD1 4.41Å; L112-L222 HydrophobicContact CD2-CD2 4.22Å; L112-L222 HydrophobicContact CD2-CG 3.81Å; L112-L222 HydrophobicContact CG-CD2 4.5Å |
| 113 | L | 95.4 | Very high | 91.9 | Very high | 55 Ų | 55 | 42.7 Ų | 42.7 | 29% | 0.288 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -55.9 | -45.3 | 172.7 | -179.6 | 66.2 | 0 | 0 | 0 | 110.2 | L101 L105 Q109 T110 C115 V116 T117 L146 | L101-L113 HydrophobicContact CD2-CD2 3.41Å; L101-L113 VanDerWaalsContact CD2-CD2 3.41Å; L105-L113 HydrophobicContact CD1-CD2 4.26Å; Q109-L113 PolarHBondContact O-N 2.79Å; T110-L113 WeakPolarHBondContact O-CB 3.28Å; T110-L113 PolarHBondContact O-N 3.47Å; L113-C115 PolarHBondContact O-N 3.34Å; L113-V116 PolarHBondContact O-N 3.44Å; L113-T117 HydrophobicContact CD1-CG2 3.74Å; L113-T117 HydrophobicContact CG-CG2 4.04Å; L113-T117 WeakPolarHBondContact O-CB 3.5Å; L113-T117 VanDerWaalsContact O-CG2 3.31Å; L113-T117 WeakPolarHBondContact O-CG2 3.49Å; L113-T117 PolarHBondContact O-N 3.42Å; L113-T117 PolarHBondContact O-OG1 2.9Å; L113-L146 HydrophobicContact CD2-CD1 4.16Å; L113-L146 HydrophobicContact CG-CD1 4.13Å |
| 114 | F | 96.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -53.7 | -49.8 | 172.4 | 161.8 | -96.8 | 0 | 0 | 0 | 112.3 | A55 T110 C111 L112 V116 T117 Y118 S143 L146 L147 F151 L214 | A55-F114 HydrophobicContact CB-CE1 3.62Å; A55-F114 HydrophobicContact CB-CZ 4.09Å; T110-F114 PolarHBondContact O-N 3.32Å; T110-F114 VanDerWaalsContact O-N 3.11Å; C111-F114 WeakPolarHBondContact O-CB 3.36Å; C111-F114 PolarHBondContact O-N 3.2Å; L112-F114 VanDerWaalsContact C-N 3.26Å; L112-F114 PolarHBondContact O-N 3.33Å; F114-V116 VanDerWaalsContact C-N 3.31Å; F114-V116 PolarHBondContact O-N 3.34Å; F114-T117 PolarHBondContact O-N 3.46Å; F114-T117 PolarHBondContact O-OG1 2.72Å; F114-Y118 AromaticContact CE2-CD1 3.83Å; F114-Y118 HydrophobicContact CE2-CD1 3.83Å; F114-Y118 HydrophobicContact CE2-CE1 4.49Å; F114-Y118 HydrophobicContact CE2-CG 4.18Å; F114-Y118 AromaticContact CZ-CD1 3.73Å; F114-Y118 HydrophobicContact CZ-CD1 3.73Å; F114-Y118 HydrophobicContact CZ-CE1 4.39Å; F114-Y118 HydrophobicContact CZ-CG 4.44Å; F114-Y118 WeakPolarHBondContact O-CB 3.16Å; F114-Y118 PolarHBondContact O-N 3.18Å; F114-S143 WeakPolarHBondContact CD2-O 3.5Å; F114-S143 WeakPolarHBondContact CE2-O 3.36Å; F114-L146 HydrophobicContact CB-CB 3.95Å; F114-L146 HydrophobicContact CB-CD1 4.13Å; F114-L146 HydrophobicContact CD2-CB 4.24Å; F114-L147 HydrophobicContact CD2-CB 4.08Å; F114-L147 HydrophobicContact CE1-CD1 4.29Å; F114-L147 HydrophobicContact CE2-CB 3.64Å; F114-L147 HydrophobicContact CE2-CD1 4.14Å; F114-L147 HydrophobicContact CE2-CD2 4.32Å; F114-L147 HydrophobicContact CE2-CG 4.25Å; F114-L147 HydrophobicContact CZ-CB 4.22Å; F114-L147 HydrophobicContact CZ-CD1 3.82Å; F114-L147 HydrophobicContact CZ-CD2 4.32Å; F114-L147 HydrophobicContact CZ-CG 4.35Å; F114-F151 AromaticContact CD1-CE2 3.52Å; F114-F151 HydrophobicContact CD1-CE2 3.52Å; F114-F151 AromaticContact CD1-CZ 3.71Å; F114-F151 HydrophobicContact CD1-CZ 3.71Å; F114-F151 AromaticContact CE1-CE2 3.88Å; F114-F151 HydrophobicContact CE1-CE2 3.88Å; F114-F151 HydrophobicContact CE1-CZ 4.02Å; F114-F151 HydrophobicContact CG-CE2 4.01Å; F114-L214 HydrophobicContact CE1-CD2 3.79Å; F114-L214 HydrophobicContact CZ-CD2 4.04Å |
| 115 | C | 97.1 | Very high | 93.6 | Very high | 7 Ų | 7 | 35 Ų | 35 | 5% | 0.047 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.5 | -42.2 | -178.7 | -61.7 | 0 | 0 | 0 | 0 | 111.5 | C111 L112 L113 S119 | C111-C115 PolarHBondContact O-N 2.83Å; C111-C115 PolarHBondContact O-SG 3.38Å; L112-C115 WeakPolarHBondContact O-CB 3.46Å; L112-C115 PolarHBondContact O-N 3.48Å; L112-C115 VanDerWaalsContact O-N 3.07Å; L113-C115 PolarHBondContact O-N 3.34Å; C115-S119 VanDerWaalsContact O-CB 3.26Å; C115-S119 WeakPolarHBondContact O-CB 3.01Å; C115-S119 PolarHBondContact O-N 3.36Å; C115-S119 PolarHBondContact O-OG 2.86Å |
| 116 | V | 97.4 | Very high | 94.3 | Very high | 98 Ų | 98 | 35.5 Ų | 35.5 | 59% | 0.594 | 19% | 0.19 | S | C | * | . | H | α-helix | trans | -69.7 | -50.5 | 179.8 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | L112 L113 F114 Y118 S119 A120 | L112-V116 WeakPolarHBondContact O-CG2 3.26Å; L112-V116 PolarHBondContact O-N 3.06Å; L113-V116 PolarHBondContact O-N 3.44Å; F114-V116 VanDerWaalsContact C-N 3.31Å; F114-V116 PolarHBondContact O-N 3.34Å; V116-Y118 VanDerWaalsContact C-N 3.27Å; V116-Y118 PolarHBondContact O-N 3.27Å; V116-S119 PolarHBondContact O-N 3.2Å; V116-A120 WeakPolarHBondContact O-CB 3.49Å; V116-A120 PolarHBondContact O-N 3.31Å |
| 117 | T | 96.8 | Very high | 94.9 | Very high | 13 Ų | 13 | 36.2 Ų | 36.2 | 8% | 0.08 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.9 | -36 | -178.4 | 56.9 | 0 | 0 | 0 | 0 | 111.3 | L113 F114 A120 C121 L142 S143 | L113-T117 HydrophobicContact CD1-CG2 3.74Å; L113-T117 HydrophobicContact CG-CG2 4.04Å; L113-T117 WeakPolarHBondContact O-CB 3.5Å; L113-T117 VanDerWaalsContact O-CG2 3.31Å; L113-T117 WeakPolarHBondContact O-CG2 3.49Å; L113-T117 PolarHBondContact O-N 3.42Å; L113-T117 PolarHBondContact O-OG1 2.9Å; F114-T117 PolarHBondContact O-N 3.46Å; F114-T117 PolarHBondContact O-OG1 2.72Å; T117-A120 PolarHBondContact O-N 2.84Å; T117-C121 WeakPolarHBondContact O-CB 3.42Å; T117-C121 PolarHBondContact O-N 3.42Å; T117-L142 HydrophobicContact CG2-CD2 3.87Å; T117-S143 WeakPolarHBondContact CB-OG 3.48Å; T117-S143 PolarHBondContact OG1-OG 3.21Å |
| 118 | Y | 97.1 | Very high | 95.4 | Very high | 13 Ų | 13 | 41 Ų | 41 | 5% | 0.051 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -78.4 | -34 | -179.2 | -153.2 | -151.6 | 0 | 0 | 0 | 112.7 | D59 Q62 F114 V116 A120 C121 C122 S143 L214 | D59-Y118 HydrophobicContact CB-CE1 4Å; D59-Y118 VanDerWaalsContact OD1-CZ 3.26Å; D59-Y118 PolarHBondContact OD1-OH 2.89Å; Q62-Y118 PolarHBondContact NE2-OH 3.31Å; F114-Y118 AromaticContact CE2-CD1 3.83Å; F114-Y118 HydrophobicContact CE2-CD1 3.83Å; F114-Y118 HydrophobicContact CE2-CE1 4.49Å; F114-Y118 HydrophobicContact CE2-CG 4.18Å; F114-Y118 AromaticContact CZ-CD1 3.73Å; F114-Y118 HydrophobicContact CZ-CD1 3.73Å; F114-Y118 HydrophobicContact CZ-CE1 4.39Å; F114-Y118 HydrophobicContact CZ-CG 4.44Å; F114-Y118 WeakPolarHBondContact O-CB 3.16Å; F114-Y118 PolarHBondContact O-N 3.18Å; V116-Y118 VanDerWaalsContact C-N 3.27Å; V116-Y118 PolarHBondContact O-N 3.27Å; Y118-A120 VanDerWaalsContact C-N 3.35Å; Y118-C121 HydrophobicContact CD2-CB 4.05Å; Y118-C121 WeakPolarHBondContact O-CB 3.26Å; Y118-C121 PolarHBondContact O-N 2.99Å; Y118-C122 PolarHBondContact O-N 3.38Å; Y118-C122 PolarHBondContact O-SG 3.36Å; Y118-S143 WeakPolarHBondContact CA-OG 3.2Å; Y118-S143 WeakPolarHBondContact CB-OG 3.42Å; Y118-S143 VanDerWaalsContact CD2-CB 3.49Å; Y118-S143 PolarHBondContact N-OG 2.86Å; Y118-L214 HydrophobicContact CD1-CD1 3.86Å; Y118-L214 HydrophobicContact CD1-CD2 3.9Å; Y118-L214 HydrophobicContact CD1-CG 4.49Å; Y118-L214 HydrophobicContact CG-CD1 4.09Å |
| 119 | S | 98 | Very high | 95.7 | Very high | 20 Ų | 20 | 41.6 Ų | 41.6 | 14% | 0.14 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.6 | -44.4 | 169.7 | -61.8 | 0 | 0 | 0 | 0 | 110.8 | C115 V116 C121 C122 L123 L214 | C115-S119 VanDerWaalsContact O-CB 3.26Å; C115-S119 WeakPolarHBondContact O-CB 3.01Å; C115-S119 PolarHBondContact O-N 3.36Å; C115-S119 PolarHBondContact O-OG 2.86Å; V116-S119 PolarHBondContact O-N 3.2Å; S119-C121 PolarHBondContact O-N 2.87Å; S119-C122 WeakPolarHBondContact O-CB 3.4Å; S119-C122 PolarHBondContact O-N 3.39Å; S119-L123 WeakPolarHBondContact O-CG 3.44Å; S119-L123 PolarHBondContact O-N 3.29Å; S119-L214 WeakPolarHBondContact OG-CB 3.43Å |
| 120 | A | 97.8 | Very high | 95.9 | Very high | 37 Ų | 37 | 39.9 Ų | 39.9 | 31% | 0.306 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.9 | -44.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | V116 T117 Y118 C122 L123 T124 L139 | V116-A120 WeakPolarHBondContact O-CB 3.49Å; V116-A120 PolarHBondContact O-N 3.31Å; T117-A120 PolarHBondContact O-N 2.84Å; Y118-A120 VanDerWaalsContact C-N 3.35Å; A120-C122 VanDerWaalsContact C-N 3.34Å; A120-C122 PolarHBondContact O-N 2.95Å; A120-L123 PolarHBondContact O-N 3.26Å; A120-T124 VanDerWaalsContact O-CG2 3.29Å; A120-T124 WeakPolarHBondContact O-CG2 3.43Å; A120-T124 PolarHBondContact O-N 2.97Å; A120-L139 HydrophobicContact CB-CD1 4.01Å |
| 121 | C | 97.2 | Very high | 96.1 | Very high | 4 Ų | 4 | 46.9 Ų | 46.9 | 3% | 0.027 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -54.5 | -47 | 172.7 | 170.6 | 0 | 0 | 0 | 0 | 112 | T117 Y118 S119 T124 G136 L139 | T117-C121 WeakPolarHBondContact O-CB 3.42Å; T117-C121 PolarHBondContact O-N 3.42Å; Y118-C121 HydrophobicContact CD2-CB 4.05Å; Y118-C121 WeakPolarHBondContact O-CB 3.26Å; Y118-C121 PolarHBondContact O-N 2.99Å; S119-C121 PolarHBondContact O-N 2.87Å; C121-T124 PolarHBondContact O-N 3.29Å; C121-T124 PolarHBondContact O-OG1 3.42Å; C121-G136 PolarHBondContact SG-O 3.42Å; C121-L139 HydrophobicContact CB-CB 4.11Å |
| 122 | C | 96.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 177.6 | -65.2 | 0 | 0 | 0 | 0 | 112.1 | Q62 Y118 S119 A120 T124 K125 F207 V211 | Q62-C122 PolarHBondContact NE2-SG 2.69Å; Y118-C122 PolarHBondContact O-N 3.38Å; Y118-C122 PolarHBondContact O-SG 3.36Å; S119-C122 WeakPolarHBondContact O-CB 3.4Å; S119-C122 PolarHBondContact O-N 3.39Å; A120-C122 VanDerWaalsContact C-N 3.34Å; A120-C122 PolarHBondContact O-N 2.95Å; C122-T124 VanDerWaalsContact C-N 3.31Å; C122-T124 PolarHBondContact O-N 3.02Å; C122-K125 VanDerWaalsContact O-CB 3.25Å; C122-K125 WeakPolarHBondContact O-CB 3.44Å; C122-K125 WeakPolarHBondContact O-CG 3.43Å; C122-K125 PolarHBondContact O-N 3.07Å; C122-K125 VanDerWaalsContact O-N 3.09Å; C122-F207 HydrophobicContact CB-CB 4.49Å; C122-F207 WeakPolarHBondContact CB-O 3.33Å; C122-V211 HydrophobicContact CB-CG2 3.65Å |
| 123 | L | 97.4 | Very high | 96.3 | Very high | 88 Ų | 88 | 47.8 Ų | 47.8 | 46% | 0.461 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -64.9 | -32.2 | 179.2 | -69.2 | 172.7 | 0 | 0 | 0 | 112.7 | S119 A120 K125 L126 V211 | S119-L123 WeakPolarHBondContact O-CG 3.44Å; S119-L123 PolarHBondContact O-N 3.29Å; A120-L123 PolarHBondContact O-N 3.26Å; L123-K125 PolarHBondContact O-N 3.24Å; L123-K125 VanDerWaalsContact O-N 3.1Å; L123-L126 HydrophobicContact CD2-CD1 4.17Å; L123-L126 WeakPolarHBondContact O-CB 3.49Å; L123-L126 PolarHBondContact O-N 3.11Å; L123-L126 VanDerWaalsContact O-N 3.09Å; L123-V211 HydrophobicContact CD2-CG2 4.18Å; L123-V211 HydrophobicContact CG-CG2 4.19Å |
| 124 | T | 96.8 | Very high | 96.4 | Very high | 19 Ų | 19 | 46.8 Ų | 46.8 | 12% | 0.117 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.2 | -25.4 | 174.3 | 67.3 | 0 | 0 | 0 | 0 | 112.9 | A120 C121 C122 L126 S127 V132 L133 G136 | A120-T124 VanDerWaalsContact O-CG2 3.29Å; A120-T124 WeakPolarHBondContact O-CG2 3.43Å; A120-T124 PolarHBondContact O-N 2.97Å; C121-T124 PolarHBondContact O-N 3.29Å; C121-T124 PolarHBondContact O-OG1 3.42Å; C122-T124 VanDerWaalsContact C-N 3.31Å; C122-T124 PolarHBondContact O-N 3.02Å; T124-L126 PolarHBondContact O-N 3.39Å; T124-S127 WeakPolarHBondContact O-CB 3.31Å; T124-S127 PolarHBondContact O-N 3.2Å; T124-V132 HydrophobicContact CG2-CG1 4.16Å; T124-L133 WeakPolarHBondContact O-CD2 3.36Å; T124-G136 VanDerWaalsContact OG1-CA 3.26Å; T124-G136 WeakPolarHBondContact OG1-CA 3.49Å |
| 125 | K | 94.9 | Very high | 96.4 | Very high | 2 Ų | 2 | 50.5 Ų | 50.5 | 1% | 0.009 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | -14.2 | 179.7 | -54.9 | -53.7 | -180 | -163.8 | 0 | 113.8 | L69 Y70 Y73 C122 L123 S127 L133 V204 F207 | L69-K125 HydrophobicContact CD1-CB 3.87Å; L69-K125 HydrophobicContact CD1-CG 4.39Å; L69-K125 HydrophobicContact CD2-CB 4.44Å; L69-K125 HydrophobicContact CD2-CD 4.27Å; Y70-K125 PolarHBondContact OH-NZ 3.46Å; Y73-K125 WeakPolarHBondContact CE2-O 3.35Å; Y73-K125 PolarHBondContact OH-O 3.29Å; C122-K125 VanDerWaalsContact O-CB 3.25Å; C122-K125 WeakPolarHBondContact O-CB 3.44Å; C122-K125 WeakPolarHBondContact O-CG 3.43Å; C122-K125 PolarHBondContact O-N 3.07Å; C122-K125 VanDerWaalsContact O-N 3.09Å; L123-K125 PolarHBondContact O-N 3.24Å; L123-K125 VanDerWaalsContact O-N 3.1Å; K125-S127 VanDerWaalsContact C-N 3.25Å; K125-L133 HydrophobicContact CD-CD2 3.98Å; K125-V204 HydrophobicContact CB-CG1 4.41Å; K125-F207 HydrophobicContact CB-CB 4.46Å; K125-F207 HydrophobicContact CB-CG 4.39Å; K125-F207 HydrophobicContact CG-CB 4.4Å; K125-F207 HydrophobicContact CG-CD1 3.77Å; K125-F207 HydrophobicContact CG-CE1 4.29Å; K125-F207 HydrophobicContact CG-CG 4.07Å |
| 126 | L | 94.9 | Very high | 96.4 | Very high | 97 Ų | 97 | 50.2 Ų | 50.2 | 51% | 0.508 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.9 | -25 | 169.3 | -70.5 | 168.4 | 0 | 0 | 0 | 112.3 | L123 T124 V204 L208 | L123-L126 HydrophobicContact CD2-CD1 4.17Å; L123-L126 WeakPolarHBondContact O-CB 3.49Å; L123-L126 PolarHBondContact O-N 3.11Å; L123-L126 VanDerWaalsContact O-N 3.09Å; T124-L126 PolarHBondContact O-N 3.39Å; L126-V204 HydrophobicContact CD2-CG1 4.06Å; L126-L208 HydrophobicContact CD1-CD2 3.9Å; L126-L208 HydrophobicContact CD2-CD1 3.94Å; L126-L208 HydrophobicContact CD2-CD2 3.87Å; L126-L208 HydrophobicContact CD2-CG 4.37Å; L126-L208 HydrophobicContact CG-CD2 3.87Å |
| 127 | S | 95.2 | Very high | 96.3 | Very high | 37 Ų | 37 | 47.2 Ų | 47.2 | 26% | 0.259 | 24% | 0.239 | S | C | . | . | trans | -82.8 | 139.6 | 180 | -171.3 | 0 | 0 | 0 | 0 | 111.3 | Y73 T124 K125 D129 | Y73-S127 VanDerWaalsContact CE2-O 3.32Å; Y73-S127 WeakPolarHBondContact CE2-O 3.44Å; T124-S127 WeakPolarHBondContact O-CB 3.31Å; T124-S127 PolarHBondContact O-N 3.2Å; K125-S127 VanDerWaalsContact C-N 3.25Å; S127-D129 VanDerWaalsContact C-N 3.35Å; S127-D129 WeakPolarHBondContact OG-CB 3.29Å; S127-D129 PolarHBondContact OG-N 3.38Å; S127-D129 VanDerWaalsContact OG-N 3.12Å | ||
| 128 | R | 94.3 | Very high | 96.3 | Very high | 188 Ų | 188 | 49.9 Ų | 49.9 | 71% | 0.709 | 25% | 0.252 | S | S | * | . | trans | -88.6 | -5.8 | 169.1 | -62.1 | -178 | -179.1 | 173.1 | -0.6 | 112.5 | Y73 F75 Y130 | Y73-R128 HydrophobicContact CD1-CG 3.89Å; Y73-R128 HydrophobicContact CD2-CG 4.39Å; Y73-R128 HydrophobicContact CE1-CG 3.9Å; Y73-R128 HydrophobicContact CE2-CG 4.4Å; Y73-R128 HydrophobicContact CG-CG 4.14Å; F75-R128 WeakPolarHBondContact CZ-O 3.45Å; R128-Y130 PolarHBondContact O-N 3.15Å | ||
| 129 | D | 95.9 | Very high | 96.3 | Very high | 76 Ų | 76 | 51.4 Ų | 51.4 | 41% | 0.406 | 26% | 0.261 | S | S | . | . | trans | -72.5 | 127.2 | 179 | -177.8 | -89.9 | 0 | 0 | 0 | 111.1 | S127 F131 V132 L133 | S127-D129 VanDerWaalsContact C-N 3.35Å; S127-D129 WeakPolarHBondContact OG-CB 3.29Å; S127-D129 PolarHBondContact OG-N 3.38Å; S127-D129 VanDerWaalsContact OG-N 3.12Å; D129-F131 VanDerWaalsContact C-N 3.35Å; D129-F131 PolarHBondContact O-N 3.08Å; D129-F131 WeakPolarHBondContact OD1-CA 3.35Å; D129-F131 WeakPolarHBondContact OD1-CB 3.28Å; D129-F131 PolarHBondContact OD1-N 2.85Å; D129-V132 HydrophobicContact CB-CB 4.13Å; D129-V132 HydrophobicContact CB-CG2 3.89Å; D129-V132 PolarHBondContact O-N 3.48Å; D129-V132 PolarHBondContact OD1-N 2.73Å; D129-L133 WeakPolarHBondContact O-CG 3.41Å; D129-L133 PolarHBondContact O-N 3.06Å; D129-L133 VanDerWaalsContact O-N 3.14Å | ||
| 130 | Y | 94.3 | Very high | 96.2 | Very high | 48 Ų | 48 | 50.7 Ų | 50.7 | 19% | 0.188 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.6 | -38 | -175.3 | -175.6 | -109.1 | 0 | 0 | 0 | 112.8 | F75 Q79 I82 L83 R128 L133 I134 | F75-Y130 AromaticContact CD1-CD2 4Å; F75-Y130 HydrophobicContact CD1-CD2 4Å; F75-Y130 AromaticContact CE1-CD2 3.64Å; F75-Y130 HydrophobicContact CE1-CD2 3.64Å; F75-Y130 HydrophobicContact CE1-CG 4.21Å; F75-Y130 HydrophobicContact CZ-CD2 4.04Å; Q79-Y130 HydrophobicContact CB-CE2 3.95Å; Q79-Y130 PolarHBondContact O-OH 2.97Å; I82-Y130 WeakPolarHBondContact CG2-OH 3.24Å; L83-Y130 HydrophobicContact CD1-CD2 4.25Å; L83-Y130 HydrophobicContact CD1-CE2 3.79Å; L83-Y130 HydrophobicContact CD2-CE2 4.07Å; L83-Y130 HydrophobicContact CG-CE2 3.76Å; R128-Y130 PolarHBondContact O-N 3.15Å; Y130-L133 PolarHBondContact O-N 3.42Å; Y130-I134 HydrophobicContact CD1-CD1 3.84Å; Y130-I134 HydrophobicContact CD1-CG1 4.48Å; Y130-I134 HydrophobicContact CE1-CD1 3.49Å; Y130-I134 VanDerWaalsContact CE1-CD1 3.49Å; Y130-I134 HydrophobicContact CE1-CG1 4.2Å; Y130-I134 PolarHBondContact O-N 2.89Å |
| 131 | F | 95.7 | Very high | 96 | Very high | 146 Ų | 146 | 49 Ų | 49 | 64% | 0.64 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -71.9 | -38.1 | -179.7 | -64.9 | -77 | 0 | 0 | 0 | 111.7 | D129 L133 I134 V135 | D129-F131 VanDerWaalsContact C-N 3.35Å; D129-F131 PolarHBondContact O-N 3.08Å; D129-F131 WeakPolarHBondContact OD1-CA 3.35Å; D129-F131 WeakPolarHBondContact OD1-CB 3.28Å; D129-F131 PolarHBondContact OD1-N 2.85Å; F131-L133 PolarHBondContact O-N 3.11Å; F131-I134 HydrophobicContact CD1-CD1 4.34Å; F131-I134 WeakPolarHBondContact O-CB 3.3Å; F131-I134 PolarHBondContact O-N 3.01Å; F131-I134 VanDerWaalsContact O-N 3.15Å; F131-V135 WeakPolarHBondContact O-CG2 3.19Å; F131-V135 PolarHBondContact O-N 3.36Å |
| 132 | V | 96.9 | Very high | 95.8 | Very high | 55 Ų | 55 | 50.1 Ų | 50.1 | 33% | 0.333 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -59 | -39.1 | 171.5 | 176 | 0 | 0 | 0 | 0 | 110.8 | T124 D129 V135 G136 | T124-V132 HydrophobicContact CG2-CG1 4.16Å; D129-V132 HydrophobicContact CB-CB 4.13Å; D129-V132 HydrophobicContact CB-CG2 3.89Å; D129-V132 PolarHBondContact O-N 3.48Å; D129-V132 PolarHBondContact OD1-N 2.73Å; V132-V135 PolarHBondContact O-N 3.44Å; V132-G136 PolarHBondContact O-N 3.24Å |
| 133 | L | 96.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -70 | -33.1 | 176.2 | -65.2 | 173.4 | 0 | 0 | 0 | 113.1 | Y70 Y73 F75 L83 T124 K125 D129 Y130 F131 G136 R137 | Y70-L133 HydrophobicContact CD1-CD1 4.04Å; Y70-L133 HydrophobicContact CE1-CB 4.3Å; Y70-L133 HydrophobicContact CE1-CD1 3.93Å; Y70-L133 HydrophobicContact CE1-CD2 4.1Å; Y70-L133 HydrophobicContact CE1-CG 4.33Å; Y73-L133 HydrophobicContact CD2-CD1 4.2Å; F75-L133 HydrophobicContact CD2-CD1 4.39Å; F75-L133 HydrophobicContact CE2-CD1 3.42Å; F75-L133 VanDerWaalsContact CE2-CD1 3.42Å; F75-L133 HydrophobicContact CZ-CD1 3.91Å; L83-L133 HydrophobicContact CD2-CB 4.02Å; T124-L133 WeakPolarHBondContact O-CD2 3.36Å; K125-L133 HydrophobicContact CD-CD2 3.98Å; D129-L133 WeakPolarHBondContact O-CG 3.41Å; D129-L133 PolarHBondContact O-N 3.06Å; D129-L133 VanDerWaalsContact O-N 3.14Å; Y130-L133 PolarHBondContact O-N 3.42Å; F131-L133 PolarHBondContact O-N 3.11Å; L133-G136 PolarHBondContact O-N 3.03Å; L133-R137 WeakPolarHBondContact O-CG 3.4Å; L133-R137 PolarHBondContact O-N 2.97Å |
| 134 | I | 96.8 | Very high | 95.5 | Very high | 34 Ų | 34 | 48.5 Ų | 48.5 | 17% | 0.174 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.3 | -49.9 | 170.3 | -71.4 | 171.4 | 0 | 0 | 0 | 110.1 | L83 Y130 F131 G136 R137 I138 | L83-I134 HydrophobicContact CD2-CB 4.42Å; L83-I134 HydrophobicContact CD2-CG1 3.64Å; Y130-I134 HydrophobicContact CD1-CD1 3.84Å; Y130-I134 HydrophobicContact CD1-CG1 4.48Å; Y130-I134 HydrophobicContact CE1-CD1 3.49Å; Y130-I134 VanDerWaalsContact CE1-CD1 3.49Å; Y130-I134 HydrophobicContact CE1-CG1 4.2Å; Y130-I134 PolarHBondContact O-N 2.89Å; F131-I134 HydrophobicContact CD1-CD1 4.34Å; F131-I134 WeakPolarHBondContact O-CB 3.3Å; F131-I134 PolarHBondContact O-N 3.01Å; F131-I134 VanDerWaalsContact O-N 3.15Å; I134-G136 PolarHBondContact O-N 3.48Å; I134-R137 WeakPolarHBondContact O-CA 3.35Å; I134-R137 WeakPolarHBondContact O-CB 3.47Å; I134-R137 PolarHBondContact O-N 3.14Å; I134-I138 HydrophobicContact CG2-CD1 4.01Å; I134-I138 WeakPolarHBondContact O-CG1 3.18Å; I134-I138 PolarHBondContact O-N 3.31Å |
| 135 | V | 97.4 | Very high | 95.2 | Very high | 79 Ų | 79 | 47.6 Ų | 47.6 | 48% | 0.479 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -57.2 | -43.5 | 176.1 | 173.4 | 0 | 0 | 0 | 0 | 110.1 | F131 V132 R137 I138 L139 | F131-V135 WeakPolarHBondContact O-CG2 3.19Å; F131-V135 PolarHBondContact O-N 3.36Å; V132-V135 PolarHBondContact O-N 3.44Å; V135-R137 VanDerWaalsContact C-N 3.32Å; V135-R137 PolarHBondContact O-N 3.05Å; V135-I138 PolarHBondContact O-N 3.44Å; V135-L139 HydrophobicContact CG1-CD1 4.2Å; V135-L139 HydrophobicContact CG1-CG 4.44Å; V135-L139 WeakPolarHBondContact O-CG 3.49Å; V135-L139 PolarHBondContact O-N 3.28Å |
| 136 | G | 96.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -55.2 | -43.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | C121 T124 V132 L133 I134 L139 G140 | C121-G136 PolarHBondContact SG-O 3.42Å; T124-G136 VanDerWaalsContact OG1-CA 3.26Å; T124-G136 WeakPolarHBondContact OG1-CA 3.49Å; V132-G136 PolarHBondContact O-N 3.24Å; L133-G136 PolarHBondContact O-N 3.03Å; I134-G136 PolarHBondContact O-N 3.48Å; G136-L139 PolarHBondContact O-N 2.79Å; G136-G140 PolarHBondContact O-N 2.95Å |
| 137 | R | 95.8 | Very high | 95 | Very high | 36 Ų | 36 | 43.4 Ų | 43.4 | 14% | 0.136 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68.4 | -35.4 | 177.2 | -72.3 | -65.8 | -64.7 | 161.7 | -4.5 | 113 | Y70 L83 Y84 C86 G87 L133 I134 V135 G140 G141 | Y70-R137 WeakPolarHBondContact OH-CD 3.37Å; Y70-R137 WeakPolarHBondContact OH-CG 3.42Å; L83-R137 HydrophobicContact CB-CG 4.21Å; L83-R137 HydrophobicContact CD2-CG 4.19Å; L83-R137 VanDerWaalsContact O-CG 3.3Å; L83-R137 WeakPolarHBondContact O-CG 3.39Å; L83-R137 PolarHBondContact O-NE 3.46Å; Y84-R137 PolarHBondContact O-NH2 2.88Å; C86-R137 HydrophobicContact CB-CB 4.45Å; G87-R137 WeakPolarHBondContact CA-O 3.39Å; L133-R137 WeakPolarHBondContact O-CG 3.4Å; L133-R137 PolarHBondContact O-N 2.97Å; I134-R137 WeakPolarHBondContact O-CA 3.35Å; I134-R137 WeakPolarHBondContact O-CB 3.47Å; I134-R137 PolarHBondContact O-N 3.14Å; V135-R137 VanDerWaalsContact C-N 3.32Å; V135-R137 PolarHBondContact O-N 3.05Å; R137-G140 PolarHBondContact O-N 3.04Å; R137-G141 PolarHBondContact O-N 3.31Å |
| 138 | I | 96.8 | Very high | 94.6 | Very high | 68 Ų | 68 | 43.3 Ų | 43.3 | 35% | 0.349 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -65.1 | -46.7 | 174 | -64.8 | 169.6 | 0 | 0 | 0 | 110.4 | A90 F94 I134 V135 G140 G141 L142 | A90-I138 HydrophobicContact CB-CB 4.36Å; A90-I138 HydrophobicContact CB-CG1 4.46Å; A90-I138 HydrophobicContact CB-CG2 4.25Å; F94-I138 HydrophobicContact CE2-CG2 3.84Å; F94-I138 HydrophobicContact CZ-CG2 4.31Å; I134-I138 HydrophobicContact CG2-CD1 4.01Å; I134-I138 WeakPolarHBondContact O-CG1 3.18Å; I134-I138 PolarHBondContact O-N 3.31Å; V135-I138 PolarHBondContact O-N 3.44Å; I138-G140 VanDerWaalsContact C-N 3.3Å; I138-G140 PolarHBondContact O-N 3.27Å; I138-G141 PolarHBondContact O-N 3.41Å; I138-L142 PolarHBondContact O-N 2.89Å |
| 139 | L | 96.6 | Very high | 94.2 | Very high | 46 Ų | 46 | 36.1 Ų | 36.1 | 24% | 0.241 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.3 | -37.8 | 174.7 | -68.3 | 176.3 | 0 | 0 | 0 | 112.1 | A120 C121 V135 G136 L142 S143 | A120-L139 HydrophobicContact CB-CD1 4.01Å; C121-L139 HydrophobicContact CB-CB 4.11Å; V135-L139 HydrophobicContact CG1-CD1 4.2Å; V135-L139 HydrophobicContact CG1-CG 4.44Å; V135-L139 WeakPolarHBondContact O-CG 3.49Å; V135-L139 PolarHBondContact O-N 3.28Å; G136-L139 PolarHBondContact O-N 2.79Å; L139-L142 PolarHBondContact O-N 3.34Å; L139-S143 WeakPolarHBondContact O-CB 3.49Å; L139-S143 PolarHBondContact O-N 3.09Å; L139-S143 PolarHBondContact O-OG 3.42Å |
| 140 | G | 95.1 | Very high | 93.9 | Very high | 4 Ų | 4 | 32.5 Ų | 32.5 | 4% | 0.041 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.1 | -48.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G136 R137 I138 L142 S143 T144 | G136-G140 PolarHBondContact O-N 2.95Å; R137-G140 PolarHBondContact O-N 3.04Å; I138-G140 VanDerWaalsContact C-N 3.3Å; I138-G140 PolarHBondContact O-N 3.27Å; G140-L142 PolarHBondContact O-N 3.47Å; G140-S143 WeakPolarHBondContact O-CB 3.48Å; G140-S143 PolarHBondContact O-N 3.29Å; G140-S143 VanDerWaalsContact O-N 3.09Å; G140-T144 PolarHBondContact O-N 3.02Å; G140-T144 PolarHBondContact O-OG1 3.02Å; G140-T144 VanDerWaalsContact O-OG1 3.08Å |
| 141 | G | 93.7 | Very high | 93.8 | Very high | 2 Ų | 2 | 30.2 Ų | 30.2 | 2% | 0.021 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | R137 I138 S143 S145 | R137-G141 PolarHBondContact O-N 3.31Å; I138-G141 PolarHBondContact O-N 3.41Å; G141-S143 VanDerWaalsContact C-N 3.34Å; G141-S143 PolarHBondContact O-N 3.42Å; G141-S145 PolarHBondContact O-N 2.89Å; G141-S145 VanDerWaalsContact O-N 3.07Å; G141-S145 PolarHBondContact O-OG 3.13Å |
| 142 | L | 94.4 | Very high | 93.5 | Very high | 27 Ų | 27 | 27.7 Ų | 27.7 | 14% | 0.141 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -58.3 | -47.8 | 171.2 | 173.5 | 60.3 | 0 | 0 | 0 | 111.1 | F94 T117 I138 L139 G140 S145 L146 | F94-L142 HydrophobicContact CB-CD1 3.96Å; F94-L142 HydrophobicContact CD1-CD1 4.1Å; F94-L142 HydrophobicContact CD2-CB 3.66Å; F94-L142 HydrophobicContact CD2-CD1 4.25Å; F94-L142 HydrophobicContact CE2-CB 4Å; F94-L142 HydrophobicContact CG-CB 4.16Å; F94-L142 HydrophobicContact CG-CD1 3.86Å; T117-L142 HydrophobicContact CG2-CD2 3.87Å; I138-L142 PolarHBondContact O-N 2.89Å; L139-L142 PolarHBondContact O-N 3.34Å; G140-L142 PolarHBondContact O-N 3.47Å; L142-S145 PolarHBondContact O-N 3.22Å; L142-L146 HydrophobicContact CD1-CD1 4.05Å; L142-L146 HydrophobicContact CD1-CG 4.1Å; L142-L146 HydrophobicContact CG-CD1 3.99Å; L142-L146 HydrophobicContact CG-CG 4.44Å; L142-L146 VanDerWaalsContact O-CG 3.29Å; L142-L146 WeakPolarHBondContact O-CG 3.39Å; L142-L146 PolarHBondContact O-N 3.43Å |
| 143 | S | 95.5 | Very high | 93 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64 | -43.3 | -177.6 | -55.8 | 0 | 0 | 0 | 0 | 112 | F114 T117 Y118 L139 G140 G141 S145 L146 L147 | F114-S143 WeakPolarHBondContact CD2-O 3.5Å; F114-S143 WeakPolarHBondContact CE2-O 3.36Å; T117-S143 WeakPolarHBondContact CB-OG 3.48Å; T117-S143 PolarHBondContact OG1-OG 3.21Å; Y118-S143 WeakPolarHBondContact CA-OG 3.2Å; Y118-S143 WeakPolarHBondContact CB-OG 3.42Å; Y118-S143 VanDerWaalsContact CD2-CB 3.49Å; Y118-S143 PolarHBondContact N-OG 2.86Å; L139-S143 WeakPolarHBondContact O-CB 3.49Å; L139-S143 PolarHBondContact O-N 3.09Å; L139-S143 PolarHBondContact O-OG 3.42Å; G140-S143 WeakPolarHBondContact O-CB 3.48Å; G140-S143 PolarHBondContact O-N 3.29Å; G140-S143 VanDerWaalsContact O-N 3.09Å; G141-S143 VanDerWaalsContact C-N 3.34Å; G141-S143 PolarHBondContact O-N 3.42Å; S143-S145 VanDerWaalsContact C-N 3.34Å; S143-S145 PolarHBondContact O-N 2.83Å; S143-L146 PolarHBondContact O-N 3.34Å; S143-L147 WeakPolarHBondContact O-CB 3.46Å; S143-L147 PolarHBondContact O-N 2.85Å |
| 144 | T | 92.1 | Very high | 92.7 | Very high | 55 Ų | 55 | 27 Ų | 27 | 34% | 0.337 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -60.3 | -43.4 | 174.1 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | G140 L146 L147 A148 | G140-T144 PolarHBondContact O-N 3.02Å; G140-T144 PolarHBondContact O-OG1 3.02Å; G140-T144 VanDerWaalsContact O-OG1 3.08Å; T144-L146 VanDerWaalsContact C-N 3.31Å; T144-L146 PolarHBondContact O-N 3.26Å; T144-L147 PolarHBondContact O-N 3.39Å; T144-A148 WeakPolarHBondContact O-CB 3.39Å; T144-A148 PolarHBondContact O-N 3.26Å; T144-A148 VanDerWaalsContact O-N 3.08Å |
| 145 | S | 90.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.4 | -33.7 | 176 | -71.6 | 0 | 0 | 0 | 0 | 113.3 | C91 S98 G141 L142 S143 T149 | C91-S145 WeakPolarHBondContact CA-OG 3.22Å; C91-S145 PolarHBondContact O-OG 3.28Å; C91-S145 PolarHBondContact SG-OG 3.47Å; S98-S145 VanDerWaalsContact CB-O 3.23Å; S98-S145 WeakPolarHBondContact CB-O 3.44Å; S98-S145 PolarHBondContact OG-O 3.04Å; G141-S145 PolarHBondContact O-N 2.89Å; G141-S145 VanDerWaalsContact O-N 3.07Å; G141-S145 PolarHBondContact O-OG 3.13Å; L142-S145 PolarHBondContact O-N 3.22Å; S143-S145 VanDerWaalsContact C-N 3.34Å; S143-S145 PolarHBondContact O-N 2.83Å; S145-T149 PolarHBondContact O-OG1 3.35Å; S145-T149 VanDerWaalsContact O-OG1 3.1Å |
| 146 | L | 92.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -73.6 | -42.9 | 174.1 | -66.5 | 171.3 | 0 | 0 | 0 | 111.7 | L101 T110 L113 F114 L142 S143 T144 A148 T149 T150 | L101-L146 HydrophobicContact CD2-CD2 4.06Å; T110-L146 HydrophobicContact CG2-CD2 3.69Å; L113-L146 HydrophobicContact CD2-CD1 4.16Å; L113-L146 HydrophobicContact CG-CD1 4.13Å; F114-L146 HydrophobicContact CB-CB 3.95Å; F114-L146 HydrophobicContact CB-CD1 4.13Å; F114-L146 HydrophobicContact CD2-CB 4.24Å; L142-L146 HydrophobicContact CD1-CD1 4.05Å; L142-L146 HydrophobicContact CD1-CG 4.1Å; L142-L146 HydrophobicContact CG-CD1 3.99Å; L142-L146 HydrophobicContact CG-CG 4.44Å; L142-L146 VanDerWaalsContact O-CG 3.29Å; L142-L146 WeakPolarHBondContact O-CG 3.39Å; L142-L146 PolarHBondContact O-N 3.43Å; S143-L146 PolarHBondContact O-N 3.34Å; T144-L146 VanDerWaalsContact C-N 3.31Å; T144-L146 PolarHBondContact O-N 3.26Å; L146-A148 VanDerWaalsContact C-N 3.25Å; L146-A148 PolarHBondContact O-N 3.46Å; L146-T149 PolarHBondContact O-N 2.76Å; L146-T150 HydrophobicContact CB-CG2 3.94Å; L146-T150 HydrophobicContact CD2-CG2 3.63Å; L146-T150 HydrophobicContact CG-CG2 4.41Å; L146-T150 VanDerWaalsContact O-CB 3.25Å; L146-T150 WeakPolarHBondContact O-CB 3.4Å; L146-T150 WeakPolarHBondContact O-CG2 3.47Å; L146-T150 PolarHBondContact O-N 3.35Å; L146-T150 PolarHBondContact O-OG1 3.43Å |
| 147 | L | 93.3 | Very high | 91.6 | Very high | 10 Ų | 10 | 25.9 Ų | 25.9 | 5% | 0.052 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.4 | -42.9 | 178.1 | -177.4 | 58.9 | 0 | 0 | 0 | 111.2 | Y52 A55 L56 D59 F114 S143 T144 T149 F151 | Y52-L147 HydrophobicContact CD2-CD1 4.34Å; Y52-L147 HydrophobicContact CE2-CD1 3.85Å; A55-L147 HydrophobicContact CB-CD1 3.82Å; L56-L147 HydrophobicContact CD2-CD2 4.38Å; D59-L147 HydrophobicContact CB-CD2 4.05Å; F114-L147 HydrophobicContact CD2-CB 4.08Å; F114-L147 HydrophobicContact CE1-CD1 4.29Å; F114-L147 HydrophobicContact CE2-CB 3.64Å; F114-L147 HydrophobicContact CE2-CD1 4.14Å; F114-L147 HydrophobicContact CE2-CD2 4.32Å; F114-L147 HydrophobicContact CE2-CG 4.25Å; F114-L147 HydrophobicContact CZ-CB 4.22Å; F114-L147 HydrophobicContact CZ-CD1 3.82Å; F114-L147 HydrophobicContact CZ-CD2 4.32Å; F114-L147 HydrophobicContact CZ-CG 4.35Å; S143-L147 WeakPolarHBondContact O-CB 3.46Å; S143-L147 PolarHBondContact O-N 2.85Å; T144-L147 PolarHBondContact O-N 3.39Å; L147-T149 VanDerWaalsContact C-N 3.26Å; L147-T149 PolarHBondContact O-N 2.95Å; L147-F151 HydrophobicContact CD1-CD2 3.95Å; L147-F151 HydrophobicContact CD1-CE2 3.89Å |
| 148 | A | 86.5 | Confident | 91.3 | Very high | 36 Ų | 36 | 25.1 Ų | 25.1 | 30% | 0.298 | 14% | 0.143 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -9.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115 | T144 L146 | T144-A148 WeakPolarHBondContact O-CB 3.39Å; T144-A148 PolarHBondContact O-N 3.26Å; T144-A148 VanDerWaalsContact O-N 3.08Å; L146-A148 VanDerWaalsContact C-N 3.25Å; L146-A148 PolarHBondContact O-N 3.46Å |
| 149 | T | 85.8 | Confident | 90.9 | Very high | 36 Ų | 36 | 21.9 Ų | 21.9 | 22% | 0.221 | 13% | 0.127 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -134.6 | -36.1 | -174.8 | 62.6 | 0 | 0 | 0 | 0 | 114 | S98 S145 L146 L147 A153 | S98-T149 WeakPolarHBondContact CB-OG1 3.21Å; S98-T149 PolarHBondContact OG-OG1 2.88Å; S145-T149 PolarHBondContact O-OG1 3.35Å; S145-T149 VanDerWaalsContact O-OG1 3.1Å; L146-T149 PolarHBondContact O-N 2.76Å; L147-T149 VanDerWaalsContact C-N 3.26Å; L147-T149 PolarHBondContact O-N 2.95Å; T149-A153 WeakPolarHBondContact O-CB 3.49Å; T149-A153 PolarHBondContact O-N 3.07Å |
| 150 | T | 90.1 | Very high | 90.5 | Very high | 1 Ų | 1 | 21.7 Ų | 21.7 | 1% | 0.006 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -78.9 | -42.1 | -163.6 | 62.8 | 0 | 0 | 0 | 0 | 112.6 | P102 T110 L146 A153 W154 | P102-T150 HydrophobicContact CG-CG2 4.33Å; T110-T150 HydrophobicContact CG2-CG2 3.4Å; L146-T150 HydrophobicContact CB-CG2 3.94Å; L146-T150 HydrophobicContact CD2-CG2 3.63Å; L146-T150 HydrophobicContact CG-CG2 4.41Å; L146-T150 VanDerWaalsContact O-CB 3.25Å; L146-T150 WeakPolarHBondContact O-CB 3.4Å; L146-T150 WeakPolarHBondContact O-CG2 3.47Å; L146-T150 PolarHBondContact O-N 3.35Å; L146-T150 PolarHBondContact O-OG1 3.43Å; T150-A153 PolarHBondContact O-N 3.22Å; T150-W154 WeakPolarHBondContact O-CB 3.39Å; T150-W154 PolarHBondContact O-N 3.39Å |
| 151 | F | 91.8 | Very high | 90 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.6 | -44.3 | 176.4 | -72.6 | -90.1 | 0 | 0 | 0 | 111.8 | F48 Y52 A55 C111 F114 L147 W154 Y155 W225 | F48-F151 HydrophobicContact CE2-CB 4.34Å; Y52-F151 HydrophobicContact CD2-CB 3.59Å; Y52-F151 AromaticContact CD2-CD1 3.82Å; Y52-F151 HydrophobicContact CD2-CD1 3.82Å; Y52-F151 HydrophobicContact CD2-CD2 4.03Å; Y52-F151 AromaticContact CD2-CG 3.54Å; Y52-F151 HydrophobicContact CD2-CG 3.54Å; Y52-F151 HydrophobicContact CE2-CB 3.75Å; Y52-F151 HydrophobicContact CE2-CD2 4.17Å; Y52-F151 AromaticContact CE2-CG 3.97Å; Y52-F151 HydrophobicContact CE2-CG 3.97Å; Y52-F151 HydrophobicContact CG-CB 4.19Å; Y52-F151 HydrophobicContact CG-CD1 4.36Å; Y52-F151 HydrophobicContact CG-CG 4.36Å; A55-F151 HydrophobicContact CB-CE1 4.34Å; A55-F151 HydrophobicContact CB-CE2 4.12Å; A55-F151 HydrophobicContact CB-CZ 3.8Å; C111-F151 HydrophobicContact CB-CE1 4.37Å; C111-F151 HydrophobicContact CB-CZ 4.33Å; F114-F151 AromaticContact CD1-CE2 3.52Å; F114-F151 HydrophobicContact CD1-CE2 3.52Å; F114-F151 AromaticContact CD1-CZ 3.71Å; F114-F151 HydrophobicContact CD1-CZ 3.71Å; F114-F151 AromaticContact CE1-CE2 3.88Å; F114-F151 HydrophobicContact CE1-CE2 3.88Å; F114-F151 HydrophobicContact CE1-CZ 4.02Å; F114-F151 HydrophobicContact CG-CE2 4.01Å; L147-F151 HydrophobicContact CD1-CD2 3.95Å; L147-F151 HydrophobicContact CD1-CE2 3.89Å; F151-W154 PolarHBondContact O-N 3.31Å; F151-Y155 WeakPolarHBondContact O-CB 3.41Å; F151-Y155 PolarHBondContact O-N 3.45Å; F151-W225 AromaticContact CD1-CH2 3.84Å; F151-W225 HydrophobicContact CD1-CH2 3.84Å; F151-W225 HydrophobicContact CD1-CZ2 4.44Å; F151-W225 HydrophobicContact CE1-CH2 4.28Å |
| 152 | E | 89.5 | Confident | 89.5 | Confident | 93 Ų | 93 | 29.2 Ų | 29.2 | 44% | 0.435 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -63.5 | -46.4 | 175.4 | 176.6 | 171.8 | 174 | 0 | 0 | 111.2 | W154 Y155 V156 F174 | E152-W154 VanDerWaalsContact C-N 3.3Å; E152-W154 PolarHBondContact O-N 3.25Å; E152-Y155 PolarHBondContact O-N 3.24Å; E152-Y155 VanDerWaalsContact O-N 3.17Å; E152-V156 HydrophobicContact CG-CG2 4.18Å; E152-V156 WeakPolarHBondContact O-CG2 3.39Å; E152-V156 PolarHBondContact O-N 3.5Å; E152-F174 HydrophobicContact CB-CE1 4.24Å; E152-F174 HydrophobicContact CB-CZ 4.02Å; E152-F174 HydrophobicContact CG-CE1 4.17Å; E152-F174 HydrophobicContact CG-CE2 4.41Å; E152-F174 HydrophobicContact CG-CZ 3.67Å |
| 153 | A | 86 | Confident | 89 | Confident | 37 Ų | 37 | 29 Ų | 29 | 31% | 0.306 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -61.9 | -36.4 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | T149 T150 H157 | T149-A153 WeakPolarHBondContact O-CB 3.49Å; T149-A153 PolarHBondContact O-N 3.07Å; T150-A153 PolarHBondContact O-N 3.22Å; A153-H157 WeakPolarHBondContact O-CB 3.29Å; A153-H157 PolarHBondContact O-N 2.87Å |
| 154 | W | 90.3 | Very high | 88.5 | Confident | 3 Ų | 3 | 35.9 Ų | 35.9 | 1% | 0.011 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.4 | -47.9 | 172.9 | -179 | 92.3 | 0 | 0 | 0 | 111.2 | F44 F48 R107 T150 F151 E152 H157 R158 W225 E228 | F44-W154 AromaticContact CE2-CH2 3.88Å; F44-W154 HydrophobicContact CE2-CH2 3.88Å; F44-W154 AromaticContact CE2-CZ3 3.9Å; F44-W154 HydrophobicContact CE2-CZ3 3.9Å; F44-W154 HydrophobicContact CZ-CZ3 4.39Å; F48-W154 HydrophobicContact CB-CZ3 4.31Å; F48-W154 HydrophobicContact CD2-CE3 4.13Å; F48-W154 HydrophobicContact CD2-CZ3 4.07Å; R107-W154 HydrophobicContact CB-CB 4.27Å; R107-W154 HydrophobicContact CB-CG 4.48Å; T150-W154 WeakPolarHBondContact O-CB 3.39Å; T150-W154 PolarHBondContact O-N 3.39Å; F151-W154 PolarHBondContact O-N 3.31Å; E152-W154 VanDerWaalsContact C-N 3.3Å; E152-W154 PolarHBondContact O-N 3.25Å; W154-H157 PolarHBondContact O-N 2.97Å; W154-R158 HydrophobicContact CD2-CG 4.07Å; W154-R158 HydrophobicContact CE3-CG 4.5Å; W154-R158 HydrophobicContact CH2-CG 4.26Å; W154-R158 HydrophobicContact CZ2-CG 3.81Å; W154-R158 WeakPolarHBondContact O-CG 3.26Å; W154-R158 PolarHBondContact O-N 2.91Å; W154-W225 HydrophobicContact CB-CH2 4.44Å; W154-W225 HydrophobicContact CB-CZ3 4.03Å; W154-W225 AromaticContact CD1-CE3 3.93Å; W154-W225 AromaticContact CD1-CZ3 3.79Å; W154-W225 HydrophobicContact CD2-CD2 4.07Å; W154-W225 AromaticContact CD2-CE3 3.41Å; W154-W225 HydrophobicContact CD2-CE3 3.41Å; W154-W225 VanDerWaalsContact CD2-CE3 3.41Å; W154-W225 AromaticContact CD2-CH2 3.59Å; W154-W225 HydrophobicContact CD2-CH2 3.59Å; W154-W225 HydrophobicContact CD2-CZ2 4.24Å; W154-W225 AromaticContact CD2-CZ3 3.15Å; W154-W225 HydrophobicContact CD2-CZ3 3.15Å; W154-W225 AromaticContact CE2-CD2 3.7Å; W154-W225 AromaticContact CE2-CE3 3.18Å; W154-W225 AromaticContact CE2-CZ3 3.51Å; W154-W225 HydrophobicContact CE3-CD2 4.14Å; W154-W225 AromaticContact CE3-CE3 3.86Å; W154-W225 HydrophobicContact CE3-CE3 3.86Å; W154-W225 AromaticContact CE3-CH2 3.35Å; W154-W225 HydrophobicContact CE3-CH2 3.35Å; W154-W225 AromaticContact CE3-CZ2 3.68Å; W154-W225 HydrophobicContact CE3-CZ2 3.68Å; W154-W225 AromaticContact CE3-CZ3 3.47Å; W154-W225 HydrophobicContact CE3-CZ3 3.47Å; W154-W225 VanDerWaalsContact CE3-CZ3 3.47Å; W154-W225 AromaticContact CG-CE3 3.91Å; W154-W225 HydrophobicContact CG-CE3 3.91Å; W154-W225 HydrophobicContact CG-CH2 4.07Å; W154-W225 AromaticContact CG-CZ3 3.4Å; W154-W225 HydrophobicContact CG-CZ3 3.4Å; W154-W225 HydrophobicContact CH2-CB 4.39Å; W154-W225 AromaticContact CH2-CD2 3.54Å; W154-W225 HydrophobicContact CH2-CD2 3.54Å; W154-W225 AromaticContact CH2-CE2 3.69Å; W154-W225 AromaticContact CH2-CE3 3.92Å; W154-W225 HydrophobicContact CH2-CE3 3.92Å; W154-W225 AromaticContact CH2-CG 3.8Å; W154-W225 HydrophobicContact CH2-CG 3.8Å; W154-W225 HydrophobicContact CH2-CH2 4.45Å; W154-W225 HydrophobicContact CH2-CZ2 4.15Å; W154-W225 HydrophobicContact CH2-CZ3 4.36Å; W154-W225 HydrophobicContact CZ2-CB 3.85Å; W154-W225 AromaticContact CZ2-CD2 3.44Å; W154-W225 HydrophobicContact CZ2-CD2 3.44Å; W154-W225 VanDerWaalsContact CZ2-CD2 3.44Å; W154-W225 AromaticContact CZ2-CE3 3.47Å; W154-W225 HydrophobicContact CZ2-CE3 3.47Å; W154-W225 VanDerWaalsContact CZ2-CE3 3.47Å; W154-W225 AromaticContact CZ2-CG 3.66Å; W154-W225 HydrophobicContact CZ2-CG 3.66Å; W154-W225 HydrophobicContact CZ2-CZ3 4.12Å; W154-W225 AromaticContact CZ3-CD2 3.89Å; W154-W225 HydrophobicContact CZ3-CD2 3.89Å; W154-W225 AromaticContact CZ3-CE2 3.67Å; W154-W225 HydrophobicContact CZ3-CE3 4.09Å; W154-W225 AromaticContact CZ3-CH2 3.83Å; W154-W225 HydrophobicContact CZ3-CH2 3.83Å; W154-W225 AromaticContact CZ3-CZ2 3.63Å; W154-W225 HydrophobicContact CZ3-CZ2 3.63Å; W154-W225 HydrophobicContact CZ3-CZ3 4.07Å; W154-W225 AromaticContact NE1-CE3 3.52Å; W154-W225 AromaticContact NE1-CZ3 3.86Å; W154-E228 WeakPolarHBondContact CZ2-OE2 3.42Å |
| 155 | Y | 91.8 | Very high | 88.4 | Confident | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.1 | -51.1 | 180 | 177.8 | -92 | 0 | 0 | 0 | 112 | F44 F48 F151 E152 H157 R158 H159 I170 T173 F174 | F44-Y155 HydrophobicContact CD1-CE2 4.04Å; F44-Y155 AromaticContact CE1-CD2 3.68Å; F44-Y155 HydrophobicContact CE1-CD2 3.68Å; F44-Y155 AromaticContact CE1-CE2 3.25Å; F44-Y155 HydrophobicContact CE1-CE2 3.25Å; F44-Y155 AromaticContact CE1-CZ 3.83Å; F44-Y155 AromaticContact CZ-CD2 3.63Å; F44-Y155 HydrophobicContact CZ-CD2 3.63Å; F44-Y155 AromaticContact CZ-CE2 3.74Å; F44-Y155 HydrophobicContact CZ-CE2 3.74Å; F44-Y155 HydrophobicContact CZ-CG 4.4Å; F48-Y155 HydrophobicContact CB-CD2 3.88Å; F48-Y155 HydrophobicContact CB-CE2 4.3Å; F48-Y155 AromaticContact CD1-CD2 3.51Å; F48-Y155 HydrophobicContact CD1-CD2 3.51Å; F48-Y155 AromaticContact CD1-CE2 3.9Å; F48-Y155 HydrophobicContact CD1-CE2 3.9Å; F48-Y155 HydrophobicContact CD1-CG 4.24Å; F48-Y155 AromaticContact CD2-CD2 3.74Å; F48-Y155 HydrophobicContact CD2-CD2 3.74Å; F48-Y155 HydrophobicContact CD2-CG 4.18Å; F48-Y155 AromaticContact CE1-CD2 3.91Å; F48-Y155 HydrophobicContact CE1-CD2 3.91Å; F48-Y155 HydrophobicContact CE1-CE2 4.45Å; F48-Y155 HydrophobicContact CE1-CG 4.19Å; F48-Y155 HydrophobicContact CE2-CD2 4.14Å; F48-Y155 HydrophobicContact CE2-CG 4.15Å; F48-Y155 AromaticContact CG-CD2 3.4Å; F48-Y155 HydrophobicContact CG-CD2 3.4Å; F48-Y155 VanDerWaalsContact CG-CD2 3.4Å; F48-Y155 HydrophobicContact CG-CE2 4.09Å; F48-Y155 HydrophobicContact CG-CG 4.22Å; F48-Y155 HydrophobicContact CZ-CD2 4.2Å; F48-Y155 HydrophobicContact CZ-CG 4.14Å; F151-Y155 WeakPolarHBondContact O-CB 3.41Å; F151-Y155 PolarHBondContact O-N 3.45Å; E152-Y155 PolarHBondContact O-N 3.24Å; E152-Y155 VanDerWaalsContact O-N 3.17Å; Y155-H157 VanDerWaalsContact C-N 3.34Å; Y155-H157 PolarHBondContact O-N 3.26Å; Y155-R158 PolarHBondContact O-N 2.92Å; Y155-H159 HydrophobicContact CE1-CB 4.19Å; Y155-H159 AromaticContact CZ-ND1 3.79Å; Y155-H159 WeakPolarHBondContact O-CB 3.25Å; Y155-H159 PolarHBondContact O-N 2.92Å; Y155-H159 PolarHBondContact OH-ND1 2.99Å; Y155-I170 HydrophobicContact CE1-CB 4.5Å; Y155-I170 HydrophobicContact CE1-CG1 4.22Å; Y155-I170 HydrophobicContact CE1-CG2 4.23Å; Y155-T173 HydrophobicContact CD2-CG2 4.46Å; Y155-T173 HydrophobicContact CE1-CG2 4.44Å; Y155-T173 HydrophobicContact CE2-CG2 3.72Å; Y155-T173 WeakPolarHBondContact OH-CB 3.23Å; Y155-T173 PolarHBondContact OH-OG1 3.12Å; Y155-F174 AromaticContact CD1-CE2 3.62Å; Y155-F174 HydrophobicContact CD1-CE2 3.62Å; Y155-F174 AromaticContact CD1-CZ 3.98Å; Y155-F174 HydrophobicContact CD1-CZ 3.98Å; Y155-F174 AromaticContact CE1-CE2 3.95Å; Y155-F174 HydrophobicContact CE1-CE2 3.95Å; Y155-F174 HydrophobicContact CG-CE2 4.46Å; Y155-F174 HydrophobicContact CG-CZ 4.43Å |
| 156 | V | 89.1 | Confident | 88.3 | Confident | 43 Ų | 43 | 36.8 Ų | 36.8 | 26% | 0.261 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -60.8 | -44.2 | -177.4 | 172 | 0 | 0 | 0 | 0 | 111 | E152 H159 L160 | E152-V156 HydrophobicContact CG-CG2 4.18Å; E152-V156 WeakPolarHBondContact O-CG2 3.39Å; E152-V156 PolarHBondContact O-N 3.5Å; V156-H159 PolarHBondContact O-N 3.42Å; V156-L160 HydrophobicContact CG1-CD1 3.79Å; V156-L160 WeakPolarHBondContact O-CB 3.44Å; V156-L160 WeakPolarHBondContact O-CG 3.3Å; V156-L160 PolarHBondContact O-N 2.74Å |
| 157 | H | 87.3 | Confident | 87.9 | Confident | 46 Ų | 46 | 44.2 Ų | 44.2 | 21% | 0.213 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.1 | -49 | 176.8 | 171 | -102.8 | 0 | 0 | 0 | 112.5 | R107 A153 W154 Y155 H159 D161 | R107-H157 PolarHBondContact NH1-CD2 3.17Å; R107-H157 PolarHBondContact NH1-CE1 3.32Å; R107-H157 PolarHBondContact NH1-ND1 3.27Å; R107-H157 VanDerWaalsContact NH1-ND1 3.17Å; R107-H157 PolarHBondContact NH1-NE2 3.26Å; R107-H157 PolarHBondContact NH2-CD2 3.33Å; A153-H157 WeakPolarHBondContact O-CB 3.29Å; A153-H157 PolarHBondContact O-N 2.87Å; W154-H157 PolarHBondContact O-N 2.97Å; Y155-H157 VanDerWaalsContact C-N 3.34Å; Y155-H157 PolarHBondContact O-N 3.26Å; H157-H159 VanDerWaalsContact C-N 3.32Å; H157-H159 PolarHBondContact O-N 3.45Å; H157-D161 IonicContact CD2-OD2 2.74Å; H157-D161 PolarHBondContact CD2-OD2 2.98Å; H157-D161 IonicContact CG-OD2 3.14Å; H157-D161 IonicContact NE2-OD2 3.34Å; H157-D161 WeakPolarHBondContact O-CA 3.32Å; H157-D161 WeakPolarHBondContact O-CB 3.29Å; H157-D161 PolarHBondContact O-N 3.17Å |
| 158 | R | 87.6 | Confident | 87.5 | Confident | 21 Ų | 21 | 51.6 Ų | 51.6 | 8% | 0.079 | 27% | 0.273 | C | S | . | . | I | π-helix | trans | -64.5 | -41.4 | 179.9 | -67.4 | -66.8 | -69.5 | 179.6 | 3.9 | 110.7 | F44 W154 Y155 V162 H163 E228 | F44-R158 HydrophobicContact CE2-CB 3.69Å; F44-R158 HydrophobicContact CE2-CG 4.5Å; F44-R158 HydrophobicContact CZ-CB 3.76Å; W154-R158 HydrophobicContact CD2-CG 4.07Å; W154-R158 HydrophobicContact CE3-CG 4.5Å; W154-R158 HydrophobicContact CH2-CG 4.26Å; W154-R158 HydrophobicContact CZ2-CG 3.81Å; W154-R158 WeakPolarHBondContact O-CG 3.26Å; W154-R158 PolarHBondContact O-N 2.91Å; Y155-R158 PolarHBondContact O-N 2.92Å; R158-V162 WeakPolarHBondContact O-CB 3.16Å; R158-V162 PolarHBondContact O-N 3.45Å; R158-H163 PolarHBondContact O-CD2 3.36Å; R158-H163 VanDerWaalsContact O-CD2 3.27Å; R158-H163 PolarHBondContact O-N 3.16Å; R158-E228 IonicContact CZ-OE1 2.82Å; R158-E228 IonicContact CZ-OE2 3.77Å; R158-E228 IonicContact NE-OE1 3.86Å; R158-E228 PolarHBondContact NE-OE1 3.4Å; R158-E228 IonicContact NE-OE2 3.4Å; R158-E228 PolarHBondContact NE-OE2 3.22Å; R158-E228 PolarHBondContact NH2-O 3.46Å; R158-E228 IonicContact NH2-OE1 2.95Å; R158-E228 PolarHBondContact NH2-OE1 3.14Å; R158-E228 IonicContact NH2-OE2 2.69Å; R158-E228 PolarHBondContact NH2-OE2 3.32Å; R158-E228 VanDerWaalsContact NH2-OE2 3.14Å |
| 159 | H | 89.4 | Confident | 87.6 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 26% | 0.264 | C | S | . | . | I | π-helix | trans | -60.2 | -46.9 | 179.9 | -174 | 96.3 | 0 | 0 | 0 | 112.2 | F41 F44 Y155 V156 H157 D164 F165 P166 I170 | F41-H159 AromaticContact CE2-CE1 3.59Å; F41-H159 AromaticContact CE2-ND1 3.79Å; F44-H159 HydrophobicContact CE1-CB 4.03Å; F44-H159 HydrophobicContact CZ-CB 4.39Å; Y155-H159 HydrophobicContact CE1-CB 4.19Å; Y155-H159 AromaticContact CZ-ND1 3.79Å; Y155-H159 WeakPolarHBondContact O-CB 3.25Å; Y155-H159 PolarHBondContact O-N 2.92Å; Y155-H159 PolarHBondContact OH-ND1 2.99Å; V156-H159 PolarHBondContact O-N 3.42Å; H157-H159 VanDerWaalsContact C-N 3.32Å; H157-H159 PolarHBondContact O-N 3.45Å; H159-D164 PolarHBondContact O-N 3.31Å; H159-F165 WeakPolarHBondContact CE1-CB 3.41Å; H159-F165 AromaticContact CE1-CD2 3.99Å; H159-F165 AromaticContact ND1-CD2 3.79Å; H159-F165 VanDerWaalsContact NE2-CB 3.31Å; H159-F165 WeakPolarHBondContact NE2-CB 3.49Å; H159-F165 PolarHBondContact NE2-O 3.48Å; H159-F165 PolarHBondContact O-N 3.45Å; H159-P166 PolarHBondContact NE2-O 3.02Å; H159-I170 VanDerWaalsContact CD2-CG1 3.5Å; H159-I170 WeakPolarHBondContact CD2-CG1 3.44Å |
| 160 | L | 88.4 | Confident | 87.7 | Confident | 41 Ų | 41 | 50.9 Ų | 50.9 | 22% | 0.215 | 26% | 0.26 | C | S | . | . | I | π-helix | trans | -89.6 | -50.5 | -175 | -62.7 | 175.6 | 0 | 0 | 0 | 113.1 | V156 D164 K167 I170 | V156-L160 HydrophobicContact CG1-CD1 3.79Å; V156-L160 WeakPolarHBondContact O-CB 3.44Å; V156-L160 WeakPolarHBondContact O-CG 3.3Å; V156-L160 PolarHBondContact O-N 2.74Å; L160-D164 VanDerWaalsContact O-CA 3.31Å; L160-D164 WeakPolarHBondContact O-CA 3.41Å; L160-D164 PolarHBondContact O-N 3.46Å; L160-K167 HydrophobicContact CD2-CB 4.43Å; L160-K167 HydrophobicContact CD2-CG 3.44Å; L160-K167 VanDerWaalsContact CD2-CG 3.44Å; L160-I170 HydrophobicContact CD1-CD1 4.25Å; L160-I170 HydrophobicContact CD2-CD1 4.15Å; L160-I170 HydrophobicContact CG-CD1 4.2Å |
| 161 | D | 83.6 | Confident | 87.5 | Confident | 116 Ų | 116 | 54.2 Ų | 54.2 | 62% | 0.62 | 28% | 0.282 | S | S | * | . | I | π-helix | trans | -89 | -21.7 | -166.7 | -56.7 | -43.4 | 0 | 0 | 0 | 112.7 | H157 | H157-D161 IonicContact CD2-OD2 2.74Å; H157-D161 PolarHBondContact CD2-OD2 2.98Å; H157-D161 IonicContact CG-OD2 3.14Å; H157-D161 IonicContact NE2-OD2 3.34Å; H157-D161 WeakPolarHBondContact O-CA 3.32Å; H157-D161 WeakPolarHBondContact O-CB 3.29Å; H157-D161 PolarHBondContact O-N 3.17Å |
| 162 | V | 84.2 | Confident | 87.2 | Confident | 49 Ų | 49 | 55.7 Ų | 55.7 | 30% | 0.297 | 29% | 0.292 | S | S | . | . | I | π-helix | trans | -110.3 | -43.6 | -176.9 | -177 | 0 | 0 | 0 | 0 | 112.9 | R158 | R158-V162 WeakPolarHBondContact O-CB 3.16Å; R158-V162 PolarHBondContact O-N 3.45Å |
| 163 | H | 83.1 | Confident | 87.3 | Confident | 23 Ų | 23 | 51.2 Ų | 51.2 | 11% | 0.106 | 27% | 0.271 | C | S | . | . | S | Bend | trans | -91.8 | -17 | 178.5 | -74.3 | -90.3 | 0 | 0 | 0 | 113.6 | F44 R158 F165 E228 R232 | F44-H163 AromaticContact CD2-NE2 3.83Å; R158-H163 PolarHBondContact O-CD2 3.36Å; R158-H163 VanDerWaalsContact O-CD2 3.27Å; R158-H163 PolarHBondContact O-N 3.16Å; H163-F165 HydrophobicContact CB-CD1 4.12Å; H163-F165 HydrophobicContact CB-CD2 3.31Å; H163-F165 HydrophobicContact CB-CE1 4.08Å; H163-F165 HydrophobicContact CB-CE2 3.27Å; H163-F165 HydrophobicContact CB-CG 3.75Å; H163-F165 HydrophobicContact CB-CZ 3.67Å; H163-F165 AromaticContact CG-CD2 3.89Å; H163-F165 AromaticContact CG-CE2 3.34Å; H163-F165 AromaticContact CG-CZ 3.73Å; H163-F165 AromaticContact ND1-CE2 3.43Å; H163-F165 WeakPolarHBondContact ND1-CE2 3.43Å; H163-F165 AromaticContact ND1-CZ 3.38Å; H163-F165 WeakPolarHBondContact ND1-CZ 3.45Å; H163-F165 PolarHBondContact O-N 3.17Å; H163-E228 IonicContact CD2-OE1 2.89Å; H163-E228 IonicContact CE1-OE1 3.48Å; H163-E228 IonicContact NE2-OE1 2.66Å; H163-E228 PolarHBondContact NE2-OE1 2.86Å; H163-R232 PolarHBondContact CE1-NH1 3.35Å; H163-R232 VanDerWaalsContact ND1-CZ 3.25Å; H163-R232 PolarHBondContact ND1-NH1 2.92Å; H163-R232 PolarHBondContact ND1-NH2 3.45Å |
| 164 | D | 86.6 | Confident | 87.5 | Confident | 143 Ų | 143 | 51.4 Ų | 51.4 | 77% | 0.765 | 27% | 0.265 | S | S | * | . | trans | 50.4 | 39.3 | -174.9 | -161.5 | 28 | 0 | 0 | 0 | 112.1 | H159 L160 | H159-D164 PolarHBondContact O-N 3.31Å; L160-D164 VanDerWaalsContact O-CA 3.31Å; L160-D164 WeakPolarHBondContact O-CA 3.41Å; L160-D164 PolarHBondContact O-N 3.46Å | ||
| 165 | F | 88.2 | Confident | 87.3 | Confident | 18 Ų | 18 | 56.5 Ų | 56.5 | 8% | 0.079 | 29% | 0.293 | C | S | . | . | trans | -77.4 | 149.4 | 177.3 | -69.4 | -40.1 | 0 | 0 | 0 | 110.6 | A40 F41 F44 H159 H163 K167 W169 | A40-F165 HydrophobicContact CB-CZ 4.33Å; F41-F165 HydrophobicContact CB-CE1 4.29Å; F41-F165 HydrophobicContact CB-CE2 4.24Å; F41-F165 HydrophobicContact CB-CZ 4.04Å; F41-F165 AromaticContact CD2-CD2 3.84Å; F41-F165 HydrophobicContact CD2-CD2 3.84Å; F41-F165 AromaticContact CD2-CE2 3.99Å; F41-F165 HydrophobicContact CD2-CE2 3.99Å; F41-F165 HydrophobicContact CD2-CG 4.31Å; F44-F165 HydrophobicContact CB-CE2 4.37Å; F44-F165 HydrophobicContact CD1-CD2 4.35Å; F44-F165 AromaticContact CD1-CE2 3.99Å; F44-F165 HydrophobicContact CD1-CE2 3.99Å; F44-F165 HydrophobicContact CG-CE2 4.38Å; H159-F165 WeakPolarHBondContact CE1-CB 3.41Å; H159-F165 AromaticContact CE1-CD2 3.99Å; H159-F165 AromaticContact ND1-CD2 3.79Å; H159-F165 VanDerWaalsContact NE2-CB 3.31Å; H159-F165 WeakPolarHBondContact NE2-CB 3.49Å; H159-F165 PolarHBondContact NE2-O 3.48Å; H159-F165 PolarHBondContact O-N 3.45Å; H163-F165 HydrophobicContact CB-CD1 4.12Å; H163-F165 HydrophobicContact CB-CD2 3.31Å; H163-F165 HydrophobicContact CB-CE1 4.08Å; H163-F165 HydrophobicContact CB-CE2 3.27Å; H163-F165 HydrophobicContact CB-CG 3.75Å; H163-F165 HydrophobicContact CB-CZ 3.67Å; H163-F165 AromaticContact CG-CD2 3.89Å; H163-F165 AromaticContact CG-CE2 3.34Å; H163-F165 AromaticContact CG-CZ 3.73Å; H163-F165 AromaticContact ND1-CE2 3.43Å; H163-F165 WeakPolarHBondContact ND1-CE2 3.43Å; H163-F165 AromaticContact ND1-CZ 3.38Å; H163-F165 WeakPolarHBondContact ND1-CZ 3.45Å; H163-F165 PolarHBondContact O-N 3.17Å; F165-K167 PolarHBondContact O-N 3.4Å; F165-W169 HydrophobicContact CB-CE3 4.15Å; F165-W169 HydrophobicContact CB-CZ3 4.48Å; F165-W169 HydrophobicContact CD1-CE3 4.34Å; F165-W169 AromaticContact CD1-CZ3 3.89Å; F165-W169 HydrophobicContact CD1-CZ3 3.89Å; F165-W169 HydrophobicContact CE1-CZ3 4.45Å; F165-W169 HydrophobicContact CG-CE3 4.29Å; F165-W169 HydrophobicContact CG-CZ3 4.3Å | ||
| 166 | P | 88.4 | Confident | 87.2 | Confident | 56 Ų | 56 | 60.1 Ų | 60.1 | 36% | 0.364 | 31% | 0.308 | S | S | . | . | trans | -55.4 | 135.6 | 177.4 | -26.6 | 34.8 | 0 | 0 | 0 | 112.9 | H159 E168 W169 | H159-P166 PolarHBondContact NE2-O 3.02Å; P166-E168 PolarHBondContact O-N 3.03Å; P166-W169 HydrophobicContact CB-CD2 4.23Å; P166-W169 HydrophobicContact CB-CG 4.19Å; P166-W169 HydrophobicContact CG-CD2 4.07Å; P166-W169 HydrophobicContact CG-CH2 4.33Å; P166-W169 HydrophobicContact CG-CZ2 3.8Å; P166-W169 WeakPolarHBondContact O-CB 3.42Å; P166-W169 PolarHBondContact O-N 2.99Å | ||
| 167 | K | 85.3 | Confident | 87.3 | Confident | 156 Ų | 156 | 58.5 Ų | 58.5 | 68% | 0.678 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -55.5 | -34.1 | 177.5 | -73.3 | 177.8 | 179.5 | -175.5 | 0 | 112.6 | L160 F165 W169 I170 | L160-K167 HydrophobicContact CD2-CB 4.43Å; L160-K167 HydrophobicContact CD2-CG 3.44Å; L160-K167 VanDerWaalsContact CD2-CG 3.44Å; F165-K167 PolarHBondContact O-N 3.4Å; K167-W169 PolarHBondContact O-N 3.36Å; K167-I170 WeakPolarHBondContact O-CB 3.21Å; K167-I170 PolarHBondContact O-N 2.97Å; K167-I170 VanDerWaalsContact O-N 3.09Å |
| 168 | E | 85.2 | Confident | 87.4 | Confident | 166 Ų | 166 | 58.4 Ų | 58.4 | 78% | 0.776 | 31% | 0.306 | S | S | * | . | G | 310 helix | trans | -59.5 | -18.3 | 178.5 | -62.6 | 172.2 | -166 | 0 | 0 | 113.8 | P166 P171 | P166-E168 PolarHBondContact O-N 3.03Å; E168-P171 WeakPolarHBondContact O-CD 3.18Å |
| 169 | W | 87.5 | Confident | 87.4 | Confident | 28 Ų | 28 | 61.3 Ų | 61.3 | 11% | 0.106 | 33% | 0.326 | C | S | . | . | G | 310 helix | trans | -86.5 | -16 | -178.9 | -61.3 | 5.7 | 0 | 0 | 0 | 112.6 | A35 N38 F41 F165 P166 K167 S172 | A35-W169 VanDerWaalsContact CA-CD2 3.49Å; A35-W169 HydrophobicContact CB-CB 4.03Å; A35-W169 VanDerWaalsContact CB-CD1 3.47Å; A35-W169 HydrophobicContact CB-CD2 3.4Å; A35-W169 VanDerWaalsContact CB-CD2 3.4Å; A35-W169 HydrophobicContact CB-CE3 4.06Å; A35-W169 HydrophobicContact CB-CG 3.36Å; A35-W169 HydrophobicContact CB-CZ2 4.31Å; N38-W169 HydrophobicContact CB-CH2 4Å; N38-W169 HydrophobicContact CB-CZ3 4.08Å; F41-W169 HydrophobicContact CB-CE3 4.12Å; F41-W169 HydrophobicContact CB-CZ3 3.88Å; F41-W169 HydrophobicContact CD1-CE3 4.15Å; F41-W169 AromaticContact CD2-CE3 3.7Å; F41-W169 HydrophobicContact CD2-CE3 3.7Å; F41-W169 HydrophobicContact CD2-CZ3 4.29Å; F41-W169 HydrophobicContact CE2-CB 4.04Å; F41-W169 HydrophobicContact CE2-CE3 4.12Å; F41-W169 AromaticContact CG-CE3 3.7Å; F41-W169 HydrophobicContact CG-CE3 3.7Å; F41-W169 AromaticContact CG-CZ3 3.99Å; F41-W169 HydrophobicContact CG-CZ3 3.99Å; F41-W169 HydrophobicContact CZ-CB 3.94Å; F41-W169 HydrophobicContact CZ-CE3 4.49Å; F165-W169 HydrophobicContact CB-CE3 4.15Å; F165-W169 HydrophobicContact CB-CZ3 4.48Å; F165-W169 HydrophobicContact CD1-CE3 4.34Å; F165-W169 AromaticContact CD1-CZ3 3.89Å; F165-W169 HydrophobicContact CD1-CZ3 3.89Å; F165-W169 HydrophobicContact CE1-CZ3 4.45Å; F165-W169 HydrophobicContact CG-CE3 4.29Å; F165-W169 HydrophobicContact CG-CZ3 4.3Å; P166-W169 HydrophobicContact CB-CD2 4.23Å; P166-W169 HydrophobicContact CB-CG 4.19Å; P166-W169 HydrophobicContact CG-CD2 4.07Å; P166-W169 HydrophobicContact CG-CH2 4.33Å; P166-W169 HydrophobicContact CG-CZ2 3.8Å; P166-W169 WeakPolarHBondContact O-CB 3.42Å; P166-W169 PolarHBondContact O-N 2.99Å; K167-W169 PolarHBondContact O-N 3.36Å; W169-S172 VanDerWaalsContact O-CB 3.3Å; W169-S172 WeakPolarHBondContact O-CB 3.25Å; W169-S172 PolarHBondContact O-N 3.45Å |
| 170 | I | 87.4 | Confident | 87.5 | Confident | 28 Ų | 28 | 68.8 Ų | 68.8 | 14% | 0.144 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.2 | -50.4 | 179.2 | -64.3 | 174.5 | 0 | 0 | 0 | 111.3 | Y155 H159 L160 K167 S172 T173 F174 | Y155-I170 HydrophobicContact CE1-CB 4.5Å; Y155-I170 HydrophobicContact CE1-CG1 4.22Å; Y155-I170 HydrophobicContact CE1-CG2 4.23Å; H159-I170 VanDerWaalsContact CD2-CG1 3.5Å; H159-I170 WeakPolarHBondContact CD2-CG1 3.44Å; L160-I170 HydrophobicContact CD1-CD1 4.25Å; L160-I170 HydrophobicContact CD2-CD1 4.15Å; L160-I170 HydrophobicContact CG-CD1 4.2Å; K167-I170 WeakPolarHBondContact O-CB 3.21Å; K167-I170 PolarHBondContact O-N 2.97Å; K167-I170 VanDerWaalsContact O-N 3.09Å; I170-S172 PolarHBondContact O-N 3.16Å; I170-T173 PolarHBondContact O-N 3.36Å; I170-T173 VanDerWaalsContact O-N 3.08Å; I170-F174 HydrophobicContact CG2-CD2 3.67Å; I170-F174 HydrophobicContact CG2-CE2 3.71Å; I170-F174 WeakPolarHBondContact O-CD2 3.34Å; I170-F174 PolarHBondContact O-N 3.16Å |
| 171 | P | 86.5 | Confident | 87.7 | Confident | 71 Ų | 71 | 68.6 Ų | 68.6 | 46% | 0.461 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -57.1 | -32.3 | 176.8 | -25.9 | 35.2 | 0 | 0 | 0 | 113.5 | E168 T173 F174 N175 | E168-P171 WeakPolarHBondContact O-CD 3.18Å; P171-T173 VanDerWaalsContact C-N 3.32Å; P171-T173 PolarHBondContact O-N 3.49Å; P171-F174 PolarHBondContact O-N 3.23Å; P171-N175 VanDerWaalsContact O-CB 3.23Å; P171-N175 WeakPolarHBondContact O-CB 3.38Å; P171-N175 PolarHBondContact O-N 2.87Å; P171-N175 PolarHBondContact O-ND2 2.98Å |
| 172 | S | 86 | Confident | 88 | Confident | 31 Ų | 31 | 65.2 Ų | 65.2 | 22% | 0.217 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -60.6 | -41.4 | 177.4 | -172.3 | 0 | 0 | 0 | 0 | 112.1 | W169 I170 K176 | W169-S172 VanDerWaalsContact O-CB 3.3Å; W169-S172 WeakPolarHBondContact O-CB 3.25Å; W169-S172 PolarHBondContact O-N 3.45Å; I170-S172 PolarHBondContact O-N 3.16Å; S172-K176 WeakPolarHBondContact O-CG 3.39Å; S172-K176 PolarHBondContact O-N 2.82Å |
| 173 | T | 90.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -69.6 | -47.4 | 177.2 | -61.2 | 0 | 0 | 0 | 0 | 111.7 | Q45 F48 Y155 I170 P171 N175 K176 V177 | Q45-T173 HydrophobicContact CG-CG2 3.97Å; Q45-T173 PolarHBondContact NE2-OG1 3.07Å; F48-T173 HydrophobicContact CD1-CG2 3.67Å; F48-T173 HydrophobicContact CE1-CG2 3.81Å; Y155-T173 HydrophobicContact CD2-CG2 4.46Å; Y155-T173 HydrophobicContact CE1-CG2 4.44Å; Y155-T173 HydrophobicContact CE2-CG2 3.72Å; Y155-T173 WeakPolarHBondContact OH-CB 3.23Å; Y155-T173 PolarHBondContact OH-OG1 3.12Å; I170-T173 PolarHBondContact O-N 3.36Å; I170-T173 VanDerWaalsContact O-N 3.08Å; P171-T173 VanDerWaalsContact C-N 3.32Å; P171-T173 PolarHBondContact O-N 3.49Å; T173-N175 VanDerWaalsContact C-N 3.33Å; T173-N175 PolarHBondContact O-N 2.93Å; T173-K176 WeakPolarHBondContact O-CB 3.5Å; T173-K176 PolarHBondContact O-N 3.32Å; T173-K176 VanDerWaalsContact O-N 3.1Å; T173-V177 PolarHBondContact O-N 2.88Å |
| 174 | F | 90 | Very high | 89.1 | Confident | 41 Ų | 41 | 65 Ų | 65 | 18% | 0.18 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -69.5 | -29.2 | -178.8 | -75.2 | -76.3 | 0 | 0 | 0 | 113.1 | F48 Y52 E152 Y155 I170 P171 K176 V177 A178 | F48-F174 HydrophobicContact CZ-CE1 4.26Å; F48-F174 HydrophobicContact CZ-CZ 4.31Å; Y52-F174 HydrophobicContact CE1-CE1 4.47Å; E152-F174 HydrophobicContact CB-CE1 4.24Å; E152-F174 HydrophobicContact CB-CZ 4.02Å; E152-F174 HydrophobicContact CG-CE1 4.17Å; E152-F174 HydrophobicContact CG-CE2 4.41Å; E152-F174 HydrophobicContact CG-CZ 3.67Å; Y155-F174 AromaticContact CD1-CE2 3.62Å; Y155-F174 HydrophobicContact CD1-CE2 3.62Å; Y155-F174 AromaticContact CD1-CZ 3.98Å; Y155-F174 HydrophobicContact CD1-CZ 3.98Å; Y155-F174 AromaticContact CE1-CE2 3.95Å; Y155-F174 HydrophobicContact CE1-CE2 3.95Å; Y155-F174 HydrophobicContact CG-CE2 4.46Å; Y155-F174 HydrophobicContact CG-CZ 4.43Å; I170-F174 HydrophobicContact CG2-CD2 3.67Å; I170-F174 HydrophobicContact CG2-CE2 3.71Å; I170-F174 WeakPolarHBondContact O-CD2 3.34Å; I170-F174 PolarHBondContact O-N 3.16Å; P171-F174 PolarHBondContact O-N 3.23Å; F174-K176 VanDerWaalsContact C-N 3.33Å; F174-K176 PolarHBondContact O-N 3.07Å; F174-V177 PolarHBondContact O-N 3.46Å; F174-A178 WeakPolarHBondContact O-CB 3.45Å; F174-A178 PolarHBondContact O-N 3.12Å |
| 175 | N | 86.9 | Confident | 89.5 | Confident | 109 Ų | 109 | 58.3 Ų | 58.3 | 58% | 0.583 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -63.3 | -38.8 | 169.2 | -75.3 | -17.3 | 0 | 0 | 0 | 111.9 | P171 T173 T179 | P171-N175 VanDerWaalsContact O-CB 3.23Å; P171-N175 WeakPolarHBondContact O-CB 3.38Å; P171-N175 PolarHBondContact O-N 2.87Å; P171-N175 PolarHBondContact O-ND2 2.98Å; T173-N175 VanDerWaalsContact C-N 3.33Å; T173-N175 PolarHBondContact O-N 2.93Å; N175-T179 PolarHBondContact O-N 3.42Å; N175-T179 PolarHBondContact O-OG1 3.08Å |
| 176 | K | 89.1 | Confident | 90 | Very high | 76 Ų | 76 | 58 Ų | 58 | 33% | 0.33 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.8 | -45.6 | 172.5 | -71.3 | 179.2 | -174.8 | -175.9 | 0 | 111.2 | S172 T173 F174 A178 T179 W180 | S172-K176 WeakPolarHBondContact O-CG 3.39Å; S172-K176 PolarHBondContact O-N 2.82Å; T173-K176 WeakPolarHBondContact O-CB 3.5Å; T173-K176 PolarHBondContact O-N 3.32Å; T173-K176 VanDerWaalsContact O-N 3.1Å; F174-K176 VanDerWaalsContact C-N 3.33Å; F174-K176 PolarHBondContact O-N 3.07Å; K176-A178 PolarHBondContact O-N 3.17Å; K176-T179 PolarHBondContact O-N 3.12Å; K176-W180 VanDerWaalsContact O-CD1 3.26Å; K176-W180 PolarHBondContact O-N 2.82Å |
| 177 | V | 92.3 | Very high | 90.4 | Very high | 9 Ų | 9 | 56.2 Ų | 56.2 | 6% | 0.055 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.2 | -52.1 | 175.3 | 174.4 | 0 | 0 | 0 | 0 | 110.4 | F48 L49 Y52 L56 T173 F174 T179 W180 N181 | F48-V177 HydrophobicContact CE1-CG2 4.01Å; L49-V177 HydrophobicContact CD2-CG2 3.44Å; L49-V177 VanDerWaalsContact CD2-CG2 3.44Å; Y52-V177 HydrophobicContact CD1-CG1 3.79Å; Y52-V177 HydrophobicContact CD1-CG2 3.9Å; Y52-V177 HydrophobicContact CE1-CG1 3.57Å; Y52-V177 HydrophobicContact CE1-CG2 4.25Å; L56-V177 HydrophobicContact CD1-CG1 3.84Å; T173-V177 PolarHBondContact O-N 2.88Å; F174-V177 PolarHBondContact O-N 3.46Å; V177-T179 VanDerWaalsContact C-N 3.29Å; V177-T179 PolarHBondContact O-N 3.34Å; V177-W180 PolarHBondContact O-N 3.41Å; V177-N181 VanDerWaalsContact O-CB 3.28Å; V177-N181 WeakPolarHBondContact O-CB 3.37Å; V177-N181 PolarHBondContact O-N 3.12Å |
| 178 | A | 88.8 | Confident | 90.9 | Very high | 45 Ų | 45 | 48.8 Ų | 48.8 | 37% | 0.372 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -57.1 | -44 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | F174 K176 N181 H182 | F174-A178 WeakPolarHBondContact O-CB 3.45Å; F174-A178 PolarHBondContact O-N 3.12Å; K176-A178 PolarHBondContact O-N 3.17Å; A178-N181 WeakPolarHBondContact O-CB 3.22Å; A178-N181 PolarHBondContact O-N 2.97Å; A178-H182 PolarHBondContact O-CE1 3.47Å; A178-H182 PolarHBondContact O-N 2.98Å; A178-H182 PolarHBondContact O-ND1 2.81Å |
| 179 | T | 87.1 | Confident | 91.5 | Very high | 82 Ų | 82 | 40.9 Ų | 40.9 | 50% | 0.503 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.8 | -48.8 | 177.3 | -54.5 | 0 | 0 | 0 | 0 | 111.8 | N175 K176 V177 N181 | N175-T179 PolarHBondContact O-N 3.42Å; N175-T179 PolarHBondContact O-OG1 3.08Å; K176-T179 PolarHBondContact O-N 3.12Å; V177-T179 VanDerWaalsContact C-N 3.29Å; V177-T179 PolarHBondContact O-N 3.34Å; T179-N181 VanDerWaalsContact C-N 3.33Å; T179-N181 PolarHBondContact O-N 3.14Å |
| 180 | W | 91.9 | Very high | 92 | Very high | 156 Ų | 156 | 42.3 Ų | 42.3 | 59% | 0.591 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -66 | -35.9 | 177.9 | -82 | 105.5 | 0 | 0 | 0 | 112.5 | L53 K176 V177 H182 G183 L184 | L53-W180 HydrophobicContact CD1-CB 4.08Å; L53-W180 HydrophobicContact CD1-CD2 4.49Å; L53-W180 HydrophobicContact CD1-CG 4.04Å; L53-W180 HydrophobicContact CD2-CB 3.66Å; L53-W180 HydrophobicContact CD2-CG 4.46Å; K176-W180 VanDerWaalsContact O-CD1 3.26Å; K176-W180 PolarHBondContact O-N 2.82Å; V177-W180 PolarHBondContact O-N 3.41Å; W180-H182 VanDerWaalsContact C-N 3.32Å; W180-H182 PolarHBondContact O-N 2.52Å; W180-G183 PolarHBondContact O-N 3.23Å; W180-G183 VanDerWaalsContact O-N 3.11Å; W180-L184 VanDerWaalsContact O-CG 3.31Å; W180-L184 WeakPolarHBondContact O-CG 3.49Å; W180-L184 PolarHBondContact O-N 3.24Å |
| 181 | N | 93.4 | Very high | 92.5 | Very high | 38 Ų | 38 | 42.9 Ų | 42.9 | 20% | 0.203 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -58.4 | -42.3 | -179.3 | -170.6 | 60 | 0 | 0 | 0 | 112.2 | L56 W60 V177 A178 T179 G183 L184 A185 | L56-N181 HydrophobicContact CD1-CB 4.48Å; W60-N181 PolarHBondContact NE1-OD1 3.11Å; V177-N181 VanDerWaalsContact O-CB 3.28Å; V177-N181 WeakPolarHBondContact O-CB 3.37Å; V177-N181 PolarHBondContact O-N 3.12Å; A178-N181 WeakPolarHBondContact O-CB 3.22Å; A178-N181 PolarHBondContact O-N 2.97Å; T179-N181 VanDerWaalsContact C-N 3.33Å; T179-N181 PolarHBondContact O-N 3.14Å; N181-G183 PolarHBondContact O-N 3.48Å; N181-L184 PolarHBondContact O-N 3.14Å; N181-A185 WeakPolarHBondContact O-CB 3.29Å; N181-A185 PolarHBondContact O-N 3.24Å |
| 182 | H | 90.3 | Very high | 93 | Very high | 44 Ų | 44 | 39.5 Ų | 39.5 | 20% | 0.204 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.8 | -45.7 | 175 | -64.8 | 95 | 0 | 0 | 0 | 111.8 | A178 W180 A185 V186 M320 S323 | A178-H182 PolarHBondContact O-CE1 3.47Å; A178-H182 PolarHBondContact O-N 2.98Å; A178-H182 PolarHBondContact O-ND1 2.81Å; W180-H182 VanDerWaalsContact C-N 3.32Å; W180-H182 PolarHBondContact O-N 2.52Å; H182-A185 PolarHBondContact O-N 3.18Å; H182-V186 WeakPolarHBondContact O-CG2 3.43Å; H182-V186 PolarHBondContact O-N 3.34Å; H182-M320 HydrophobicContact CB-CB 4.08Å; H182-M320 HydrophobicContact CB-CG 3.88Å; H182-M320 HydrophobicContact CB-SD 4.03Å; H182-S323 PolarHBondContact NE2-OG 2.89Å |
| 183 | G | 93.5 | Very high | 93.5 | Very high | 37 Ų | 37 | 38 Ų | 38 | 38% | 0.381 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -66.2 | -40.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | W180 N181 V186 G187 | W180-G183 PolarHBondContact O-N 3.23Å; W180-G183 VanDerWaalsContact O-N 3.11Å; N181-G183 PolarHBondContact O-N 3.48Å; G183-V186 PolarHBondContact O-N 3.34Å; G183-G187 PolarHBondContact O-N 3.23Å |
| 184 | L | 95.9 | Very high | 93.8 | Very high | 31 Ų | 31 | 41.1 Ų | 41.1 | 16% | 0.162 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62 | -43.1 | 175.1 | -70.4 | 174.5 | 0 | 0 | 0 | 111.2 | L53 L56 W57 W180 N181 G187 A188 | L53-L184 HydrophobicContact CB-CD1 3.96Å; L53-L184 HydrophobicContact CD2-CD1 3.8Å; L53-L184 HydrophobicContact CG-CD1 4.39Å; L56-L184 HydrophobicContact CB-CD1 4.48Å; W57-L184 HydrophobicContact CB-CD2 4.46Å; W57-L184 HydrophobicContact CD2-CD2 4.37Å; W57-L184 HydrophobicContact CE3-CB 4.05Å; W57-L184 HydrophobicContact CE3-CD2 3.58Å; W57-L184 HydrophobicContact CE3-CG 4.39Å; W57-L184 HydrophobicContact CZ3-CD2 4.21Å; W57-L184 VanDerWaalsContact CZ3-O 3.3Å; W57-L184 WeakPolarHBondContact CZ3-O 3.42Å; W180-L184 VanDerWaalsContact O-CG 3.31Å; W180-L184 WeakPolarHBondContact O-CG 3.49Å; W180-L184 PolarHBondContact O-N 3.24Å; N181-L184 PolarHBondContact O-N 3.14Å; L184-G187 PolarHBondContact O-N 3.06Å; L184-A188 WeakPolarHBondContact O-CB 3.08Å; L184-A188 PolarHBondContact O-N 3.02Å |
| 185 | A | 95.8 | Very high | 94 | Very high | 3 Ų | 3 | 40.3 Ų | 40.3 | 3% | 0.025 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.1 | -45.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | W60 N181 H182 A188 G189 M316 | W60-A185 HydrophobicContact CD2-CB 3.59Å; W60-A185 HydrophobicContact CE3-CB 3.98Å; W60-A185 HydrophobicContact CG-CB 3.94Å; W60-A185 HydrophobicContact CH2-CB 4.34Å; W60-A185 HydrophobicContact CZ2-CB 4Å; W60-A185 HydrophobicContact CZ3-CB 4.33Å; N181-A185 WeakPolarHBondContact O-CB 3.29Å; N181-A185 PolarHBondContact O-N 3.24Å; H182-A185 PolarHBondContact O-N 3.18Å; A185-A188 PolarHBondContact O-N 3.27Å; A185-G189 PolarHBondContact O-N 3.33Å; A185-M316 HydrophobicContact CB-CB 3.95Å; A185-M316 HydrophobicContact CB-CG 3.74Å; A185-M316 HydrophobicContact CB-SD 3.85Å |
| 186 | V | 97.1 | Very high | 94.4 | Very high | 10 Ų | 10 | 35.5 Ų | 35.5 | 6% | 0.061 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.1 | -47.7 | 174.9 | 176.6 | 0 | 0 | 0 | 0 | 111 | I9 L13 H182 G183 A188 G189 L190 S313 M316 A317 | I9-V186 HydrophobicContact CD1-CG1 4.4Å; L13-V186 HydrophobicContact CD2-CG1 4.08Å; H182-V186 WeakPolarHBondContact O-CG2 3.43Å; H182-V186 PolarHBondContact O-N 3.34Å; G183-V186 PolarHBondContact O-N 3.34Å; V186-A188 VanDerWaalsContact C-N 3.34Å; V186-A188 PolarHBondContact O-N 3.24Å; V186-G189 PolarHBondContact O-N 3.08Å; V186-L190 PolarHBondContact O-N 2.61Å; V186-S313 PolarHBondContact O-OG 3.47Å; V186-M316 HydrophobicContact CG2-CB 3.77Å; V186-A317 HydrophobicContact CG2-CB 3.99Å |
| 187 | G | 97.3 | Very high | 94.5 | Very high | 19 Ų | 19 | 35.6 Ų | 35.6 | 20% | 0.196 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.4 | -37.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | G183 L184 G189 L190 V191 | G183-G187 PolarHBondContact O-N 3.23Å; L184-G187 PolarHBondContact O-N 3.06Å; G187-G189 VanDerWaalsContact C-N 3.33Å; G187-G189 PolarHBondContact O-N 3.45Å; G187-L190 PolarHBondContact O-N 3.19Å; G187-V191 WeakPolarHBondContact O-CG2 3.31Å; G187-V191 PolarHBondContact O-N 2.81Å |
| 188 | A | 97.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64 | -38.9 | 179 | 0 | 0 | 0 | 0 | 0 | 111.5 | W57 W60 L61 L184 A185 V186 V191 A192 | W57-A188 HydrophobicContact CE3-CB 4.14Å; W57-A188 HydrophobicContact CH2-CB 4.3Å; W57-A188 HydrophobicContact CZ3-CB 3.94Å; W57-A188 VanDerWaalsContact CZ3-N 3.29Å; W60-A188 HydrophobicContact CB-CB 3.52Å; L61-A188 HydrophobicContact CD2-CB 4.27Å; L61-A188 HydrophobicContact CG-CB 4.37Å; L184-A188 WeakPolarHBondContact O-CB 3.08Å; L184-A188 PolarHBondContact O-N 3.02Å; A185-A188 PolarHBondContact O-N 3.27Å; V186-A188 VanDerWaalsContact C-N 3.34Å; V186-A188 PolarHBondContact O-N 3.24Å; A188-V191 PolarHBondContact O-N 2.87Å; A188-A192 WeakPolarHBondContact O-CB 3.39Å; A188-A192 PolarHBondContact O-N 3.1Å |
| 189 | G | 97.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.8 | -41.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | A185 V186 G187 A192 N193 G309 S313 | A185-G189 PolarHBondContact O-N 3.33Å; V186-G189 PolarHBondContact O-N 3.08Å; G187-G189 VanDerWaalsContact C-N 3.33Å; G187-G189 PolarHBondContact O-N 3.45Å; G189-A192 PolarHBondContact O-N 3.34Å; G189-N193 WeakPolarHBondContact O-CB 3.29Å; G189-N193 PolarHBondContact O-N 3.32Å; G189-G309 CarbonylContact C-O 3.47Å; G189-G309 WeakPolarHBondContact CA-O 3.46Å; G189-G309 CarbonylContact O-C 3.43Å; G189-G309 VanDerWaalsContact O-CA 3.29Å; G189-G309 WeakPolarHBondContact O-CA 3.1Å; G189-S313 VanDerWaalsContact CA-OG 3.26Å; G189-S313 WeakPolarHBondContact CA-OG 3.37Å |
| 190 | L | 97.4 | Very high | 95 | Very high | 59 Ų | 59 | 47.5 Ų | 47.5 | 31% | 0.309 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -66 | -45.5 | 177.6 | -62.8 | 178.7 | 0 | 0 | 0 | 111.3 | V186 G187 N193 L194 I310 S313 | V186-L190 PolarHBondContact O-N 2.61Å; G187-L190 PolarHBondContact O-N 3.19Å; L190-N193 WeakPolarHBondContact O-CB 3.4Å; L190-N193 PolarHBondContact O-N 2.92Å; L190-L194 WeakPolarHBondContact O-CB 3.2Å; L190-L194 PolarHBondContact O-N 2.93Å; L190-I310 HydrophobicContact CD2-CD1 3.54Å; L190-S313 PolarHBondContact N-OG 3.34Å |
| 191 | V | 97.8 | Very high | 95.1 | Very high | 39 Ų | 39 | 45.2 Ų | 45.2 | 24% | 0.236 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.1 | -42.3 | 178 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | W57 L61 G187 A188 N193 L194 L195 L209 | W57-V191 HydrophobicContact CH2-CB 4.22Å; W57-V191 HydrophobicContact CH2-CG2 3.76Å; W57-V191 HydrophobicContact CZ2-CB 4.12Å; W57-V191 HydrophobicContact CZ2-CG1 4.29Å; W57-V191 HydrophobicContact CZ2-CG2 3.87Å; L61-V191 HydrophobicContact CD2-CB 4.13Å; L61-V191 HydrophobicContact CD2-CG1 3.87Å; G187-V191 WeakPolarHBondContact O-CG2 3.31Å; G187-V191 PolarHBondContact O-N 2.81Å; A188-V191 PolarHBondContact O-N 2.87Å; V191-N193 VanDerWaalsContact C-N 3.3Å; V191-N193 PolarHBondContact O-N 3.5Å; V191-L194 WeakPolarHBondContact O-CB 3.25Å; V191-L194 PolarHBondContact O-N 3.36Å; V191-L195 HydrophobicContact CG1-CD1 4.46Å; V191-L195 WeakPolarHBondContact O-CG 3.42Å; V191-L195 PolarHBondContact O-N 2.95Å; V191-L209 HydrophobicContact CG1-CD2 3.6Å |
| 192 | A | 96.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.1 | -41 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | P64 Y65 A188 G189 L195 A196 P206 | P64-A192 HydrophobicContact CG-CB 3.87Å; Y65-A192 HydrophobicContact CD2-CB 4.02Å; Y65-A192 HydrophobicContact CE2-CB 3.91Å; A188-A192 WeakPolarHBondContact O-CB 3.39Å; A188-A192 PolarHBondContact O-N 3.1Å; G189-A192 PolarHBondContact O-N 3.34Å; A192-L195 PolarHBondContact O-N 3.3Å; A192-A196 VanDerWaalsContact O-CB 3.29Å; A192-A196 WeakPolarHBondContact O-CB 3.39Å; A192-A196 PolarHBondContact O-N 3.18Å; A192-P206 HydrophobicContact CB-CB 3.91Å; A192-P206 HydrophobicContact CB-CG 3.81Å |
| 193 | N | 96.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.9 | -44.4 | 175 | -161.9 | 82.6 | 0 | 0 | 0 | 112.3 | G189 L190 V191 L195 E197 W198 P307 G309 I310 | G189-N193 WeakPolarHBondContact O-CB 3.29Å; G189-N193 PolarHBondContact O-N 3.32Å; L190-N193 WeakPolarHBondContact O-CB 3.4Å; L190-N193 PolarHBondContact O-N 2.92Å; V191-N193 VanDerWaalsContact C-N 3.3Å; V191-N193 PolarHBondContact O-N 3.5Å; N193-L195 VanDerWaalsContact C-N 3.32Å; N193-L195 PolarHBondContact O-N 3.19Å; N193-E197 WeakPolarHBondContact O-CB 3.3Å; N193-E197 PolarHBondContact O-N 3.47Å; N193-W198 PolarHBondContact ND2-NE1 3.04Å; N193-W198 PolarHBondContact O-N 2.94Å; N193-P307 WeakPolarHBondContact OD1-CB 3.35Å; N193-G309 PolarHBondContact OD1-N 3.38Å; N193-I310 HydrophobicContact CB-CD1 4.05Å; N193-I310 HydrophobicContact CB-CG1 4.24Å |
| 194 | L | 96.7 | Very high | 95.3 | Very high | 65 Ų | 65 | 42.3 Ų | 42.3 | 34% | 0.34 | 22% | 0.221 | S | C | . | . | I | π-helix | trans | -55.5 | -48.5 | 175.6 | 162.3 | 67.4 | 0 | 0 | 0 | 110.7 | L190 V191 W198 L199 | L190-L194 WeakPolarHBondContact O-CB 3.2Å; L190-L194 PolarHBondContact O-N 2.93Å; V191-L194 WeakPolarHBondContact O-CB 3.25Å; V191-L194 PolarHBondContact O-N 3.36Å; L194-W198 HydrophobicContact CB-CD2 4.39Å; L194-W198 HydrophobicContact CB-CE3 3.67Å; L194-W198 HydrophobicContact CB-CZ3 4.03Å; L194-W198 HydrophobicContact CD1-CB 4.22Å; L194-W198 HydrophobicContact CD1-CD2 4.43Å; L194-W198 HydrophobicContact CD1-CE3 3.52Å; L194-W198 HydrophobicContact CD1-CZ3 4.27Å; L194-W198 HydrophobicContact CG-CE3 4.16Å; L194-W198 WeakPolarHBondContact O-CB 3.42Å; L194-W198 PolarHBondContact O-N 3.47Å; L194-L199 HydrophobicContact CD1-CD1 4.29Å; L194-L199 HydrophobicContact CD1-CG 4.03Å; L194-L199 HydrophobicContact CG-CD1 4.44Å; L194-L199 WeakPolarHBondContact O-CG 3.41Å; L194-L199 PolarHBondContact O-N 3.37Å |
| 195 | L | 95.9 | Very high | 95.3 | Very high | 25 Ų | 25 | 41.3 Ų | 41.3 | 13% | 0.131 | 22% | 0.217 | C | C | . | . | I | π-helix | trans | -68.2 | -51.3 | -178.9 | -67.1 | -178.3 | 0 | 0 | 0 | 112.6 | V191 A192 N193 L199 L201 A205 L209 | V191-L195 HydrophobicContact CG1-CD1 4.46Å; V191-L195 WeakPolarHBondContact O-CG 3.42Å; V191-L195 PolarHBondContact O-N 2.95Å; A192-L195 PolarHBondContact O-N 3.3Å; N193-L195 VanDerWaalsContact C-N 3.32Å; N193-L195 PolarHBondContact O-N 3.19Å; L195-L199 HydrophobicContact CD2-CD1 4.05Å; L195-L201 HydrophobicContact CD2-CD1 4.17Å; L195-L201 WeakPolarHBondContact O-CB 3.38Å; L195-L201 PolarHBondContact O-N 2.83Å; L195-L201 VanDerWaalsContact O-N 3.16Å; L195-A205 HydrophobicContact CB-CB 4.01Å; L195-L209 HydrophobicContact CD1-CB 3.75Å; L195-L209 HydrophobicContact CD1-CD2 3.61Å; L195-L209 HydrophobicContact CD1-CG 4.24Å |
| 196 | A | 94.4 | Very high | 95.4 | Very high | 7 Ų | 7 | 41.2 Ų | 41.2 | 6% | 0.058 | 22% | 0.216 | C | C | . | . | I | π-helix | trans | -75.5 | -43.8 | -170.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y65 A192 G202 P206 | Y65-A196 HydrophobicContact CD1-CB 4.17Å; Y65-A196 HydrophobicContact CD2-CB 4.22Å; Y65-A196 HydrophobicContact CE1-CB 3.6Å; Y65-A196 HydrophobicContact CE2-CB 3.68Å; Y65-A196 HydrophobicContact CG-CB 4.46Å; A192-A196 VanDerWaalsContact O-CB 3.29Å; A192-A196 WeakPolarHBondContact O-CB 3.39Å; A192-A196 PolarHBondContact O-N 3.18Å; A196-G202 WeakPolarHBondContact CA-O 3.34Å; A196-G202 WeakPolarHBondContact CB-O 3.42Å; A196-G202 PolarHBondContact O-N 2.71Å; A196-P206 HydrophobicContact CB-CG 4.38Å |
| 197 | E | 91.9 | Very high | 95.3 | Very high | 79 Ų | 79 | 40.7 Ų | 40.7 | 37% | 0.369 | 21% | 0.213 | S | C | . | . | I | π-helix | trans | -100.1 | -56.2 | -174 | -55.6 | -67.6 | 163.5 | 0 | 0 | 111.9 | Y65 N193 H200 | Y65-E197 VanDerWaalsContact OH-CG 3.26Å; Y65-E197 WeakPolarHBondContact OH-CG 3.26Å; Y65-E197 PolarHBondContact OH-OE1 3.36Å; N193-E197 WeakPolarHBondContact O-CB 3.3Å; N193-E197 PolarHBondContact O-N 3.47Å; E197-H200 PolarHBondContact O-CE1 3.24Å; E197-H200 PolarHBondContact O-N 2.84Å; E197-H200 PolarHBondContact O-ND1 2.91Å |
| 198 | W | 92.1 | Very high | 95.3 | Very high | 131 Ų | 131 | 43 Ų | 43 | 50% | 0.496 | 22% | 0.221 | S | C | . | . | I | π-helix | trans | -70.6 | -40.7 | -171.5 | -59.9 | -17.4 | 0 | 0 | 0 | 112.7 | Y6 N193 L194 H200 I310 | Y6-W198 HydrophobicContact CE1-CZ2 4.11Å; Y6-W198 PolarHBondContact OH-NE1 2.93Å; Y6-W198 VanDerWaalsContact OH-NE1 3.07Å; N193-W198 PolarHBondContact ND2-NE1 3.04Å; N193-W198 PolarHBondContact O-N 2.94Å; L194-W198 HydrophobicContact CB-CD2 4.39Å; L194-W198 HydrophobicContact CB-CE3 3.67Å; L194-W198 HydrophobicContact CB-CZ3 4.03Å; L194-W198 HydrophobicContact CD1-CB 4.22Å; L194-W198 HydrophobicContact CD1-CD2 4.43Å; L194-W198 HydrophobicContact CD1-CE3 3.52Å; L194-W198 HydrophobicContact CD1-CZ3 4.27Å; L194-W198 HydrophobicContact CG-CE3 4.16Å; L194-W198 WeakPolarHBondContact O-CB 3.42Å; L194-W198 PolarHBondContact O-N 3.47Å; W198-H200 VanDerWaalsContact C-N 3.33Å; W198-H200 PolarHBondContact O-CE1 2.97Å; W198-H200 PolarHBondContact O-ND1 3.22Å; W198-I310 HydrophobicContact CZ2-CD1 4.41Å |
| 199 | L | 94.7 | Very high | 95.3 | Very high | 95 Ų | 95 | 45.7 Ų | 45.7 | 50% | 0.497 | 24% | 0.235 | S | C | . | . | S | Bend | trans | -87.9 | -2.6 | 174.7 | -63.1 | -179.3 | 0 | 0 | 0 | 113.1 | L194 L195 L201 | L194-L199 HydrophobicContact CD1-CD1 4.29Å; L194-L199 HydrophobicContact CD1-CG 4.03Å; L194-L199 HydrophobicContact CG-CD1 4.44Å; L194-L199 WeakPolarHBondContact O-CG 3.41Å; L194-L199 PolarHBondContact O-N 3.37Å; L195-L199 HydrophobicContact CD2-CD1 4.05Å; L199-L201 HydrophobicContact CB-CD1 4.09Å; L199-L201 HydrophobicContact CB-CG 3.87Å; L199-L201 HydrophobicContact CD1-CD1 4.23Å; L199-L201 PolarHBondContact O-N 2.82Å; L199-L201 VanDerWaalsContact O-N 3.12Å |
| 200 | H | 92.1 | Very high | 95.3 | Very high | 160 Ų | 160 | 45.7 Ų | 45.7 | 74% | 0.741 | 24% | 0.235 | S | C | * | . | trans | 54.9 | 28.9 | 178.1 | -53.9 | 74.3 | 0 | 0 | 0 | 113.8 | E197 W198 G202 | E197-H200 PolarHBondContact O-CE1 3.24Å; E197-H200 PolarHBondContact O-N 2.84Å; E197-H200 PolarHBondContact O-ND1 2.91Å; W198-H200 VanDerWaalsContact C-N 3.33Å; W198-H200 PolarHBondContact O-CE1 2.97Å; W198-H200 PolarHBondContact O-ND1 3.22Å; H200-G202 PolarHBondContact O-N 2.97Å | ||
| 201 | L | 93.3 | Very high | 95.3 | Very high | 108 Ų | 108 | 44.5 Ų | 44.5 | 57% | 0.565 | 23% | 0.23 | S | C | * | . | trans | -79.9 | -6 | 178.8 | -57 | 175.1 | 0 | 0 | 0 | 112.5 | L195 L199 A205 | L195-L201 HydrophobicContact CD2-CD1 4.17Å; L195-L201 WeakPolarHBondContact O-CB 3.38Å; L195-L201 PolarHBondContact O-N 2.83Å; L195-L201 VanDerWaalsContact O-N 3.16Å; L199-L201 HydrophobicContact CB-CD1 4.09Å; L199-L201 HydrophobicContact CB-CG 3.87Å; L199-L201 HydrophobicContact CD1-CD1 4.23Å; L199-L201 PolarHBondContact O-N 2.82Å; L199-L201 VanDerWaalsContact O-N 3.12Å; L201-A205 HydrophobicContact CB-CB 3.52Å; L201-A205 HydrophobicContact CD1-CB 4.33Å | ||
| 202 | G | 93 | Very high | 95.3 | Very high | 23 Ų | 23 | 46 Ų | 46 | 24% | 0.237 | 24% | 0.24 | C | C | . | . | trans | 83 | 175 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | A196 H200 V204 A205 | A196-G202 WeakPolarHBondContact CA-O 3.34Å; A196-G202 WeakPolarHBondContact CB-O 3.42Å; A196-G202 PolarHBondContact O-N 2.71Å; H200-G202 PolarHBondContact O-N 2.97Å; G202-V204 PolarHBondContact O-N 3.07Å; G202-V204 VanDerWaalsContact O-N 3.12Å; G202-A205 WeakPolarHBondContact O-CB 3.48Å; G202-A205 PolarHBondContact O-N 3.01Å | ||
| 203 | P | 93.3 | Very high | 95.3 | Very high | 13 Ų | 13 | 46.9 Ų | 46.9 | 8% | 0.084 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | -12 | -170.4 | 28.5 | -36.1 | 0 | 0 | 0 | 114 | Y65 K68 L69 H72 F207 | Y65-P203 HydrophobicContact CD1-CB 3.85Å; Y65-P203 HydrophobicContact CG-CB 4.41Å; K68-P203 HydrophobicContact CG-CB 4.32Å; L69-P203 HydrophobicContact CB-CB 4.31Å; H72-P203 HydrophobicContact CB-CG 3.91Å; P203-F207 WeakPolarHBondContact O-CD2 3.25Å; P203-F207 WeakPolarHBondContact O-CE2 3.49Å |
| 204 | V | 95.7 | Very high | 95.3 | Very high | 21 Ų | 21 | 46.9 Ų | 46.9 | 13% | 0.127 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82 | -24.3 | 178 | -166.3 | 0 | 0 | 0 | 0 | 111.6 | L69 Y73 K125 L126 G202 F207 L208 | L69-V204 HydrophobicContact CD1-CB 4.22Å; L69-V204 HydrophobicContact CD1-CG1 4.34Å; L69-V204 HydrophobicContact CD1-CG2 3.85Å; L69-V204 HydrophobicContact CG-CG2 4.35Å; Y73-V204 WeakPolarHBondContact OH-CG2 3.32Å; K125-V204 HydrophobicContact CB-CG1 4.41Å; L126-V204 HydrophobicContact CD2-CG1 4.06Å; G202-V204 PolarHBondContact O-N 3.07Å; G202-V204 VanDerWaalsContact O-N 3.12Å; V204-F207 WeakPolarHBondContact O-CB 3.41Å; V204-F207 PolarHBondContact O-N 3.28Å; V204-F207 VanDerWaalsContact O-N 3.08Å; V204-L208 HydrophobicContact CG1-CD1 4.43Å; V204-L208 HydrophobicContact CG1-CG 4.26Å; V204-L208 PolarHBondContact O-N 3.3Å |
| 205 | A | 96.2 | Very high | 95.4 | Very high | 11 Ų | 11 | 45.9 Ų | 45.9 | 9% | 0.091 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.4 | -41.2 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | L195 L201 G202 F207 L208 L209 | L195-A205 HydrophobicContact CB-CB 4.01Å; L201-A205 HydrophobicContact CB-CB 3.52Å; L201-A205 HydrophobicContact CD1-CB 4.33Å; G202-A205 WeakPolarHBondContact O-CB 3.48Å; G202-A205 PolarHBondContact O-N 3.01Å; A205-F207 VanDerWaalsContact C-N 3.28Å; A205-F207 PolarHBondContact O-N 3.17Å; A205-L208 PolarHBondContact O-N 3.12Å; A205-L208 VanDerWaalsContact O-N 3.14Å; A205-L209 PolarHBondContact O-N 2.91Å |
| 206 | P | 96.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62 | -34.4 | 176.3 | -22.6 | 34.7 | 0 | 0 | 0 | 113.2 | L61 Y65 A192 A196 L209 A210 | L61-P206 VanDerWaalsContact O-CB 3.25Å; L61-P206 WeakPolarHBondContact O-CB 3.13Å; Y65-P206 HydrophobicContact CD2-CG 3.82Å; Y65-P206 HydrophobicContact CE2-CG 4.37Å; Y65-P206 HydrophobicContact CG-CG 4.45Å; A192-P206 HydrophobicContact CB-CB 3.91Å; A192-P206 HydrophobicContact CB-CG 3.81Å; A196-P206 HydrophobicContact CB-CG 4.38Å; P206-L209 PolarHBondContact O-N 2.85Å; P206-A210 PolarHBondContact O-N 3.47Å; P206-A210 VanDerWaalsContact O-N 3.12Å |
| 207 | F | 96.4 | Very high | 95.5 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.4 | -38.3 | 174.9 | -60.8 | -92.4 | 0 | 0 | 0 | 111.5 | Q62 L66 L69 C122 K125 P203 V204 A205 A210 | Q62-F207 HydrophobicContact CB-CD1 3.96Å; Q62-F207 HydrophobicContact CB-CE1 3.54Å; Q62-F207 HydrophobicContact CB-CZ 4.12Å; Q62-F207 HydrophobicContact CG-CD1 3.5Å; Q62-F207 HydrophobicContact CG-CE1 3.65Å; Q62-F207 HydrophobicContact CG-CG 4.29Å; L66-F207 HydrophobicContact CB-CZ 4.07Å; L66-F207 HydrophobicContact CD1-CE1 3.99Å; L66-F207 HydrophobicContact CD1-CZ 4.06Å; L69-F207 HydrophobicContact CB-CE2 4.44Å; L69-F207 HydrophobicContact CD1-CD2 3.65Å; L69-F207 HydrophobicContact CD1-CE2 3.59Å; L69-F207 HydrophobicContact CD1-CG 4.4Å; L69-F207 HydrophobicContact CD1-CZ 4.3Å; C122-F207 HydrophobicContact CB-CB 4.49Å; C122-F207 WeakPolarHBondContact CB-O 3.33Å; K125-F207 HydrophobicContact CB-CB 4.46Å; K125-F207 HydrophobicContact CB-CG 4.39Å; K125-F207 HydrophobicContact CG-CB 4.4Å; K125-F207 HydrophobicContact CG-CD1 3.77Å; K125-F207 HydrophobicContact CG-CE1 4.29Å; K125-F207 HydrophobicContact CG-CG 4.07Å; P203-F207 WeakPolarHBondContact O-CD2 3.25Å; P203-F207 WeakPolarHBondContact O-CE2 3.49Å; V204-F207 WeakPolarHBondContact O-CB 3.41Å; V204-F207 PolarHBondContact O-N 3.28Å; V204-F207 VanDerWaalsContact O-N 3.08Å; A205-F207 VanDerWaalsContact C-N 3.28Å; A205-F207 PolarHBondContact O-N 3.17Å; F207-A210 WeakPolarHBondContact O-CB 3.4Å; F207-A210 PolarHBondContact O-N 3Å |
| 208 | L | 96.9 | Very high | 95.7 | Very high | 67 Ų | 67 | 44.2 Ų | 44.2 | 35% | 0.351 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -70.6 | -33.7 | 176.5 | -63.1 | 179.5 | 0 | 0 | 0 | 112.4 | L126 V204 A205 A210 V211 P212 | L126-L208 HydrophobicContact CD1-CD2 3.9Å; L126-L208 HydrophobicContact CD2-CD1 3.94Å; L126-L208 HydrophobicContact CD2-CD2 3.87Å; L126-L208 HydrophobicContact CD2-CG 4.37Å; L126-L208 HydrophobicContact CG-CD2 3.87Å; V204-L208 HydrophobicContact CG1-CD1 4.43Å; V204-L208 HydrophobicContact CG1-CG 4.26Å; V204-L208 PolarHBondContact O-N 3.3Å; A205-L208 PolarHBondContact O-N 3.12Å; A205-L208 VanDerWaalsContact O-N 3.14Å; L208-A210 VanDerWaalsContact C-N 3.29Å; L208-V211 PolarHBondContact O-N 3.14Å; L208-P212 WeakPolarHBondContact O-CD 3.35Å |
| 209 | L | 96.8 | Very high | 95.9 | Very high | 57 Ų | 57 | 46.2 Ų | 46.2 | 30% | 0.298 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -67 | -31.2 | 172.6 | -178 | 64.4 | 0 | 0 | 0 | 112 | L61 V191 L195 A205 P206 V211 P212 C213 | L61-L209 HydrophobicContact CD1-CB 4.33Å; L61-L209 HydrophobicContact CD1-CD2 3.9Å; L61-L209 HydrophobicContact CD1-CG 3.96Å; L61-L209 HydrophobicContact CD2-CD2 4.19Å; V191-L209 HydrophobicContact CG1-CD2 3.6Å; L195-L209 HydrophobicContact CD1-CB 3.75Å; L195-L209 HydrophobicContact CD1-CD2 3.61Å; L195-L209 HydrophobicContact CD1-CG 4.24Å; A205-L209 PolarHBondContact O-N 2.91Å; P206-L209 PolarHBondContact O-N 2.85Å; L209-V211 VanDerWaalsContact C-N 3.26Å; L209-V211 PolarHBondContact O-N 2.89Å; L209-P212 HydrophobicContact CD1-CG 4.48Å; L209-P212 WeakPolarHBondContact O-CD 3.21Å; L209-P212 VanDerWaalsContact O-CG 3.28Å; L209-P212 WeakPolarHBondContact O-CG 3.34Å; L209-C213 PolarHBondContact O-N 3.43Å; L209-C213 PolarHBondContact O-SG 3.4Å; L209-C213 VanDerWaalsContact O-SG 3.36Å |
| 210 | A | 96.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.4 | -32.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A58 Q62 P206 F207 L208 C213 L214 | A58-A210 HydrophobicContact CB-CB 4.13Å; Q62-A210 HydrophobicContact CG-CB 4.47Å; P206-A210 PolarHBondContact O-N 3.47Å; P206-A210 VanDerWaalsContact O-N 3.12Å; F207-A210 WeakPolarHBondContact O-CB 3.4Å; F207-A210 PolarHBondContact O-N 3Å; L208-A210 VanDerWaalsContact C-N 3.29Å; A210-C213 WeakPolarHBondContact O-CB 3.26Å; A210-C213 PolarHBondContact O-N 3.47Å; A210-L214 WeakPolarHBondContact O-CB 3.1Å; A210-L214 VanDerWaalsContact O-CG 3.26Å; A210-L214 WeakPolarHBondContact O-CG 3.21Å; A210-L214 PolarHBondContact O-N 3.19Å |
| 211 | V | 97.9 | Very high | 96 | Very high | 34 Ų | 34 | 35 Ų | 35 | 21% | 0.206 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.4 | -55 | -179.4 | 178.8 | 0 | 0 | 0 | 0 | 113.5 | C122 L123 L208 L209 C213 L214 G215 | C122-V211 HydrophobicContact CB-CG2 3.65Å; L123-V211 HydrophobicContact CD2-CG2 4.18Å; L123-V211 HydrophobicContact CG-CG2 4.19Å; L208-V211 PolarHBondContact O-N 3.14Å; L209-V211 VanDerWaalsContact C-N 3.26Å; L209-V211 PolarHBondContact O-N 2.89Å; V211-C213 VanDerWaalsContact C-N 3.28Å; V211-C213 PolarHBondContact O-N 3.5Å; V211-L214 PolarHBondContact O-N 3.21Å; V211-G215 PolarHBondContact O-N 3.36Å |
| 212 | P | 97.3 | Very high | 96 | Very high | 70 Ų | 70 | 34.3 Ų | 34.3 | 46% | 0.455 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64 | -32.3 | 175.5 | 24.8 | -33.4 | 0 | 0 | 0 | 112.3 | L208 L209 G215 C216 | L208-P212 WeakPolarHBondContact O-CD 3.35Å; L209-P212 HydrophobicContact CD1-CG 4.48Å; L209-P212 WeakPolarHBondContact O-CD 3.21Å; L209-P212 VanDerWaalsContact O-CG 3.28Å; L209-P212 WeakPolarHBondContact O-CG 3.34Å; P212-G215 PolarHBondContact O-N 2.88Å; P212-C216 PolarHBondContact O-N 3.41Å; P212-C216 PolarHBondContact O-SG 3.37Å |
| 213 | C | 96.8 | Very high | 95.9 | Very high | 19 Ų | 19 | 34.7 Ų | 34.7 | 13% | 0.128 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.3 | -41.7 | 172.7 | -66.1 | 0 | 0 | 0 | 0 | 112.2 | A58 L209 A210 V211 C216 C217 | A58-C213 HydrophobicContact CB-CB 4.16Å; L209-C213 PolarHBondContact O-N 3.43Å; L209-C213 PolarHBondContact O-SG 3.4Å; L209-C213 VanDerWaalsContact O-SG 3.36Å; A210-C213 WeakPolarHBondContact O-CB 3.26Å; A210-C213 PolarHBondContact O-N 3.47Å; V211-C213 VanDerWaalsContact C-N 3.28Å; V211-C213 PolarHBondContact O-N 3.5Å; C213-C216 PolarHBondContact O-N 3.15Å; C213-C217 PolarHBondContact O-N 2.92Å |
| 214 | L | 97.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -67.6 | -36.2 | 173.6 | -69.5 | 165.6 | 0 | 0 | 0 | 111.9 | A58 F114 Y118 S119 A210 V211 C217 G218 | A58-L214 HydrophobicContact CB-CD1 4.34Å; A58-L214 HydrophobicContact CB-CD2 3.72Å; A58-L214 HydrophobicContact CB-CG 3.65Å; F114-L214 HydrophobicContact CE1-CD2 3.79Å; F114-L214 HydrophobicContact CZ-CD2 4.04Å; Y118-L214 HydrophobicContact CD1-CD1 3.86Å; Y118-L214 HydrophobicContact CD1-CD2 3.9Å; Y118-L214 HydrophobicContact CD1-CG 4.49Å; Y118-L214 HydrophobicContact CG-CD1 4.09Å; S119-L214 WeakPolarHBondContact OG-CB 3.43Å; A210-L214 WeakPolarHBondContact O-CB 3.1Å; A210-L214 VanDerWaalsContact O-CG 3.26Å; A210-L214 WeakPolarHBondContact O-CG 3.21Å; A210-L214 PolarHBondContact O-N 3.19Å; V211-L214 PolarHBondContact O-N 3.21Å; L214-C217 WeakPolarHBondContact O-CB 3.28Å; L214-C217 PolarHBondContact O-N 3.42Å; L214-G218 PolarHBondContact O-N 3.22Å |
| 215 | G | 97.4 | Very high | 95.4 | Very high | 44 Ų | 44 | 34.9 Ų | 34.9 | 45% | 0.454 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -60.1 | -45.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V211 P212 G218 W219 | V211-G215 PolarHBondContact O-N 3.36Å; P212-G215 PolarHBondContact O-N 2.88Å; G215-G218 PolarHBondContact O-N 2.88Å; G215-W219 WeakPolarHBondContact O-CB 3.3Å; G215-W219 PolarHBondContact O-N 3.03Å |
| 216 | C | 97 | Very high | 94.8 | Very high | 68 Ų | 68 | 35 Ų | 35 | 46% | 0.459 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.2 | -41.7 | 173.6 | -68.5 | 0 | 0 | 0 | 0 | 112 | L54 P212 C213 W219 V220 | L54-C216 HydrophobicContact CD1-CB 4.11Å; P212-C216 PolarHBondContact O-N 3.41Å; P212-C216 PolarHBondContact O-SG 3.37Å; C213-C216 PolarHBondContact O-N 3.15Å; C216-W219 WeakPolarHBondContact O-CB 3.4Å; C216-W219 PolarHBondContact O-N 3.03Å; C216-V220 WeakPolarHBondContact O-CG2 3.48Å; C216-V220 PolarHBondContact O-N 2.89Å |
| 217 | C | 96.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.3 | -51.2 | 173.4 | 177.9 | 0 | 0 | 0 | 0 | 111 | A51 L54 C213 L214 W219 V220 V221 | A51-C217 PolarHBondContact O-SG 3.48Å; L54-C217 HydrophobicContact CB-CB 3.92Å; C213-C217 PolarHBondContact O-N 2.92Å; L214-C217 WeakPolarHBondContact O-CB 3.28Å; L214-C217 PolarHBondContact O-N 3.42Å; C217-W219 VanDerWaalsContact C-N 3.28Å; C217-W219 PolarHBondContact O-N 2.98Å; C217-V220 PolarHBondContact O-N 3.33Å; C217-V221 WeakPolarHBondContact O-CG2 3.43Å; C217-V221 PolarHBondContact O-N 2.96Å |
| 218 | G | 96.3 | Very high | 93.4 | Very high | 8 Ų | 8 | 41.5 Ų | 41.5 | 8% | 0.082 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.4 | -38.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L214 G215 V221 L222 | L214-G218 PolarHBondContact O-N 3.22Å; G215-G218 PolarHBondContact O-N 2.88Å; G218-V221 PolarHBondContact O-N 2.96Å; G218-L222 WeakPolarHBondContact O-CB 3.39Å; G218-L222 WeakPolarHBondContact O-CG 3.36Å; G218-L222 PolarHBondContact O-N 3.01Å |
| 219 | W | 96.3 | Very high | 92.5 | Very high | 172 Ų | 172 | 40.5 Ų | 40.5 | 65% | 0.652 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -62.7 | -45.6 | 175 | -179.8 | -98.1 | 0 | 0 | 0 | 112.3 | G215 C216 C217 V221 L222 T223 | G215-W219 WeakPolarHBondContact O-CB 3.3Å; G215-W219 PolarHBondContact O-N 3.03Å; C216-W219 WeakPolarHBondContact O-CB 3.4Å; C216-W219 PolarHBondContact O-N 3.03Å; C217-W219 VanDerWaalsContact C-N 3.28Å; C217-W219 PolarHBondContact O-N 2.98Å; W219-V221 VanDerWaalsContact C-N 3.33Å; W219-V221 PolarHBondContact O-N 3.48Å; W219-L222 PolarHBondContact O-N 3.23Å; W219-T223 HydrophobicContact CD2-CG2 3.97Å; W219-T223 HydrophobicContact CE3-CG2 4.38Å; W219-T223 HydrophobicContact CG-CG2 4.49Å; W219-T223 HydrophobicContact CH2-CG2 4.18Å; W219-T223 HydrophobicContact CZ2-CG2 3.74Å; W219-T223 HydrophobicContact CZ3-CG2 4.47Å; W219-T223 WeakPolarHBondContact O-CB 3.39Å; W219-T223 WeakPolarHBondContact O-CG2 3.33Å; W219-T223 PolarHBondContact O-N 2.84Å; W219-T223 PolarHBondContact O-OG1 2.91Å |
| 220 | V | 94.7 | Very high | 91.6 | Very high | 19 Ų | 19 | 41.1 Ų | 41.1 | 12% | 0.115 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.2 | -42 | 175.4 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | R50 A51 L54 C216 C217 L222 T223 D224 W225 | R50-V220 HydrophobicContact CB-CG1 4.19Å; A51-V220 HydrophobicContact CB-CB 4.39Å; A51-V220 HydrophobicContact CB-CG1 3.88Å; L54-V220 HydrophobicContact CD1-CG2 4.36Å; C216-V220 WeakPolarHBondContact O-CG2 3.48Å; C216-V220 PolarHBondContact O-N 2.89Å; C217-V220 PolarHBondContact O-N 3.33Å; V220-L222 VanDerWaalsContact C-N 3.34Å; V220-L222 PolarHBondContact O-N 3.19Å; V220-T223 PolarHBondContact O-N 3.08Å; V220-D224 HydrophobicContact CG1-CB 4.15Å; V220-D224 WeakPolarHBondContact O-CB 3.34Å; V220-D224 PolarHBondContact O-N 3.37Å; V220-W225 PolarHBondContact O-N 3.16Å |
| 221 | V | 93.3 | Very high | 90.3 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.2 | -35.9 | 176.6 | 173.7 | 0 | 0 | 0 | 0 | 111.8 | A51 R108 C111 L112 C217 G218 W219 W225 | A51-V221 HydrophobicContact CB-CG2 3.91Å; R108-V221 HydrophobicContact CG-CG1 3.74Å; C111-V221 HydrophobicContact CB-CG1 4.16Å; L112-V221 HydrophobicContact CD2-CB 3.93Å; L112-V221 HydrophobicContact CD2-CG1 3.7Å; L112-V221 HydrophobicContact CG-CG1 3.93Å; C217-V221 WeakPolarHBondContact O-CG2 3.43Å; C217-V221 PolarHBondContact O-N 2.96Å; G218-V221 PolarHBondContact O-N 2.96Å; W219-V221 VanDerWaalsContact C-N 3.33Å; W219-V221 PolarHBondContact O-N 3.48Å; V221-W225 HydrophobicContact CB-CD2 4.48Å; V221-W225 HydrophobicContact CB-CE3 4.44Å; V221-W225 HydrophobicContact CG1-CD2 4.39Å; V221-W225 HydrophobicContact CG1-CE3 3.92Å; V221-W225 HydrophobicContact CG1-CZ3 4.42Å; V221-W225 HydrophobicContact CG2-CD2 4.17Å; V221-W225 HydrophobicContact CG2-CE3 4.15Å; V221-W225 HydrophobicContact CG2-CH2 4.47Å; V221-W225 HydrophobicContact CG2-CZ2 4.47Å; V221-W225 HydrophobicContact CG2-CZ3 4.29Å; V221-W225 WeakPolarHBondContact O-CB 3.46Å |
| 222 | L | 93 | Very high | 88.7 | Confident | 94 Ų | 94 | 51.7 Ų | 51.7 | 49% | 0.492 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -73.5 | -41.5 | 176.6 | -77.6 | 169.4 | 0 | 0 | 0 | 112.5 | L112 G218 W219 V220 | L112-L222 HydrophobicContact CD1-CD2 3.49Å; L112-L222 VanDerWaalsContact CD1-CD2 3.49Å; L112-L222 HydrophobicContact CD1-CG 4.05Å; L112-L222 HydrophobicContact CD2-CD1 4.41Å; L112-L222 HydrophobicContact CD2-CD2 4.22Å; L112-L222 HydrophobicContact CD2-CG 3.81Å; L112-L222 HydrophobicContact CG-CD2 4.5Å; G218-L222 WeakPolarHBondContact O-CB 3.39Å; G218-L222 WeakPolarHBondContact O-CG 3.36Å; G218-L222 PolarHBondContact O-N 3.01Å; W219-L222 PolarHBondContact O-N 3.23Å; V220-L222 VanDerWaalsContact C-N 3.34Å; V220-L222 PolarHBondContact O-N 3.19Å |
| 223 | T | 92.3 | Very high | 86.5 | Confident | 32 Ų | 32 | 50.2 Ų | 50.2 | 20% | 0.196 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -92.7 | -64.4 | -170.1 | 55.7 | 0 | 0 | 0 | 0 | 112.4 | W219 V220 G226 K227 | W219-T223 HydrophobicContact CD2-CG2 3.97Å; W219-T223 HydrophobicContact CE3-CG2 4.38Å; W219-T223 HydrophobicContact CG-CG2 4.49Å; W219-T223 HydrophobicContact CH2-CG2 4.18Å; W219-T223 HydrophobicContact CZ2-CG2 3.74Å; W219-T223 HydrophobicContact CZ3-CG2 4.47Å; W219-T223 WeakPolarHBondContact O-CB 3.39Å; W219-T223 WeakPolarHBondContact O-CG2 3.33Å; W219-T223 PolarHBondContact O-N 2.84Å; W219-T223 PolarHBondContact O-OG1 2.91Å; V220-T223 PolarHBondContact O-N 3.08Å; T223-G226 PolarHBondContact O-N 3.4Å; T223-K227 WeakPolarHBondContact O-CB 3.42Å; T223-K227 WeakPolarHBondContact O-CG 3.4Å; T223-K227 PolarHBondContact O-N 3.31Å |
| 224 | D | 88.6 | Confident | 84 | Confident | 37 Ų | 37 | 55 Ų | 55 | 20% | 0.198 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -68.9 | -43.9 | -174 | -72 | -9.5 | 0 | 0 | 0 | 111 | I47 R50 V220 E228 | I47-D224 HydrophobicContact CG2-CB 3.95Å; R50-D224 IonicContact NH1-OD2 3.81Å; V220-D224 HydrophobicContact CG1-CB 4.15Å; V220-D224 WeakPolarHBondContact O-CB 3.34Å; V220-D224 PolarHBondContact O-N 3.37Å; D224-E228 VanDerWaalsContact O-CB 3.31Å; D224-E228 WeakPolarHBondContact O-CB 3.24Å; D224-E228 PolarHBondContact O-N 3.21Å |
| 225 | W | 88.4 | Confident | 81.4 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -73.5 | -35.7 | 177.3 | -59.9 | 16.3 | 0 | 0 | 0 | 111 | I47 F48 A51 C111 F151 W154 V220 V221 K227 E228 E229 | I47-W225 HydrophobicContact CG2-CG 4.36Å; I47-W225 PolarHBondContact O-NE1 3.49Å; F48-W225 HydrophobicContact CD2-CH2 4.4Å; F48-W225 HydrophobicContact CD2-CZ2 4.02Å; A51-W225 HydrophobicContact CB-CZ2 3.64Å; C111-W225 HydrophobicContact CB-CZ3 4.37Å; F151-W225 AromaticContact CD1-CH2 3.84Å; F151-W225 HydrophobicContact CD1-CH2 3.84Å; F151-W225 HydrophobicContact CD1-CZ2 4.44Å; F151-W225 HydrophobicContact CE1-CH2 4.28Å; W154-W225 HydrophobicContact CB-CH2 4.44Å; W154-W225 HydrophobicContact CB-CZ3 4.03Å; W154-W225 AromaticContact CD1-CE3 3.93Å; W154-W225 AromaticContact CD1-CZ3 3.79Å; W154-W225 HydrophobicContact CD2-CD2 4.07Å; W154-W225 AromaticContact CD2-CE3 3.41Å; W154-W225 HydrophobicContact CD2-CE3 3.41Å; W154-W225 VanDerWaalsContact CD2-CE3 3.41Å; W154-W225 AromaticContact CD2-CH2 3.59Å; W154-W225 HydrophobicContact CD2-CH2 3.59Å; W154-W225 HydrophobicContact CD2-CZ2 4.24Å; W154-W225 AromaticContact CD2-CZ3 3.15Å; W154-W225 HydrophobicContact CD2-CZ3 3.15Å; W154-W225 AromaticContact CE2-CD2 3.7Å; W154-W225 AromaticContact CE2-CE3 3.18Å; W154-W225 AromaticContact CE2-CZ3 3.51Å; W154-W225 HydrophobicContact CE3-CD2 4.14Å; W154-W225 AromaticContact CE3-CE3 3.86Å; W154-W225 HydrophobicContact CE3-CE3 3.86Å; W154-W225 AromaticContact CE3-CH2 3.35Å; W154-W225 HydrophobicContact CE3-CH2 3.35Å; W154-W225 AromaticContact CE3-CZ2 3.68Å; W154-W225 HydrophobicContact CE3-CZ2 3.68Å; W154-W225 AromaticContact CE3-CZ3 3.47Å; W154-W225 HydrophobicContact CE3-CZ3 3.47Å; W154-W225 VanDerWaalsContact CE3-CZ3 3.47Å; W154-W225 AromaticContact CG-CE3 3.91Å; W154-W225 HydrophobicContact CG-CE3 3.91Å; W154-W225 HydrophobicContact CG-CH2 4.07Å; W154-W225 AromaticContact CG-CZ3 3.4Å; W154-W225 HydrophobicContact CG-CZ3 3.4Å; W154-W225 HydrophobicContact CH2-CB 4.39Å; W154-W225 AromaticContact CH2-CD2 3.54Å; W154-W225 HydrophobicContact CH2-CD2 3.54Å; W154-W225 AromaticContact CH2-CE2 3.69Å; W154-W225 AromaticContact CH2-CE3 3.92Å; W154-W225 HydrophobicContact CH2-CE3 3.92Å; W154-W225 AromaticContact CH2-CG 3.8Å; W154-W225 HydrophobicContact CH2-CG 3.8Å; W154-W225 HydrophobicContact CH2-CH2 4.45Å; W154-W225 HydrophobicContact CH2-CZ2 4.15Å; W154-W225 HydrophobicContact CH2-CZ3 4.36Å; W154-W225 HydrophobicContact CZ2-CB 3.85Å; W154-W225 AromaticContact CZ2-CD2 3.44Å; W154-W225 HydrophobicContact CZ2-CD2 3.44Å; W154-W225 VanDerWaalsContact CZ2-CD2 3.44Å; W154-W225 AromaticContact CZ2-CE3 3.47Å; W154-W225 HydrophobicContact CZ2-CE3 3.47Å; W154-W225 VanDerWaalsContact CZ2-CE3 3.47Å; W154-W225 AromaticContact CZ2-CG 3.66Å; W154-W225 HydrophobicContact CZ2-CG 3.66Å; W154-W225 HydrophobicContact CZ2-CZ3 4.12Å; W154-W225 AromaticContact CZ3-CD2 3.89Å; W154-W225 HydrophobicContact CZ3-CD2 3.89Å; W154-W225 AromaticContact CZ3-CE2 3.67Å; W154-W225 HydrophobicContact CZ3-CE3 4.09Å; W154-W225 AromaticContact CZ3-CH2 3.83Å; W154-W225 HydrophobicContact CZ3-CH2 3.83Å; W154-W225 AromaticContact CZ3-CZ2 3.63Å; W154-W225 HydrophobicContact CZ3-CZ2 3.63Å; W154-W225 HydrophobicContact CZ3-CZ3 4.07Å; W154-W225 AromaticContact NE1-CE3 3.52Å; W154-W225 AromaticContact NE1-CZ3 3.86Å; V220-W225 PolarHBondContact O-N 3.16Å; V221-W225 HydrophobicContact CB-CD2 4.48Å; V221-W225 HydrophobicContact CB-CE3 4.44Å; V221-W225 HydrophobicContact CG1-CD2 4.39Å; V221-W225 HydrophobicContact CG1-CE3 3.92Å; V221-W225 HydrophobicContact CG1-CZ3 4.42Å; V221-W225 HydrophobicContact CG2-CD2 4.17Å; V221-W225 HydrophobicContact CG2-CE3 4.15Å; V221-W225 HydrophobicContact CG2-CH2 4.47Å; V221-W225 HydrophobicContact CG2-CZ2 4.47Å; V221-W225 HydrophobicContact CG2-CZ3 4.29Å; V221-W225 WeakPolarHBondContact O-CB 3.46Å; W225-K227 PolarHBondContact O-N 3.42Å; W225-E228 PolarHBondContact O-N 3.18Å; W225-E229 WeakPolarHBondContact O-CG 3.39Å; W225-E229 PolarHBondContact O-N 3.4Å |
| 226 | G | 83.4 | Confident | 78.5 | Confident | 13 Ų | 13 | 64.3 Ų | 64.3 | 13% | 0.134 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -63.7 | -39.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | T223 E229 A230 | T223-G226 PolarHBondContact O-N 3.4Å; G226-E229 PolarHBondContact O-N 3.31Å; G226-A230 WeakPolarHBondContact O-CB 3.4Å; G226-A230 PolarHBondContact O-N 3.04Å |
| 227 | K | 83.8 | Confident | 75.6 | Confident | 123 Ų | 123 | 67.2 Ų | 67.2 | 54% | 0.535 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.7 | -41.7 | 171.7 | -74.5 | 169.9 | -176.9 | 176.1 | 0 | 111.9 | T223 W225 E229 A230 E231 | T223-K227 WeakPolarHBondContact O-CB 3.42Å; T223-K227 WeakPolarHBondContact O-CG 3.4Å; T223-K227 PolarHBondContact O-N 3.31Å; W225-K227 PolarHBondContact O-N 3.42Å; K227-E229 VanDerWaalsContact C-N 3.28Å; K227-E229 PolarHBondContact O-N 3.26Å; K227-A230 PolarHBondContact O-N 3.03Å; K227-E231 WeakPolarHBondContact O-CB 3.25Å; K227-E231 WeakPolarHBondContact O-CG 3.47Å; K227-E231 PolarHBondContact O-N 3.29Å |
| 228 | E | 80.1 | Confident | 72.5 | Confident | 15 Ų | 15 | 74.6 Ų | 74.6 | 7% | 0.07 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -64.5 | -33.4 | 178.2 | -165.7 | -98.3 | 147.2 | 0 | 0 | 112.3 | W154 R158 H163 D224 W225 | W154-E228 WeakPolarHBondContact CZ2-OE2 3.42Å; R158-E228 IonicContact CZ-OE1 2.82Å; R158-E228 IonicContact CZ-OE2 3.77Å; R158-E228 IonicContact NE-OE1 3.86Å; R158-E228 PolarHBondContact NE-OE1 3.4Å; R158-E228 IonicContact NE-OE2 3.4Å; R158-E228 PolarHBondContact NE-OE2 3.22Å; R158-E228 PolarHBondContact NH2-O 3.46Å; R158-E228 IonicContact NH2-OE1 2.95Å; R158-E228 PolarHBondContact NH2-OE1 3.14Å; R158-E228 IonicContact NH2-OE2 2.69Å; R158-E228 PolarHBondContact NH2-OE2 3.32Å; R158-E228 VanDerWaalsContact NH2-OE2 3.14Å; H163-E228 IonicContact CD2-OE1 2.89Å; H163-E228 IonicContact CE1-OE1 3.48Å; H163-E228 IonicContact NE2-OE1 2.66Å; H163-E228 PolarHBondContact NE2-OE1 2.86Å; D224-E228 VanDerWaalsContact O-CB 3.31Å; D224-E228 WeakPolarHBondContact O-CB 3.24Å; D224-E228 PolarHBondContact O-N 3.21Å; W225-E228 PolarHBondContact O-N 3.18Å |
| 229 | E | 78.8 | Confident | 69.7 | Low | 45 Ų | 45 | 78 Ų | 78 | 21% | 0.21 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -71 | -45 | 169.5 | -73 | 171.3 | 178.7 | 0 | 0 | 111.9 | R108 W225 G226 K227 R232 G233 | R108-E229 WeakPolarHBondContact CD-OE2 3.36Å; R108-E229 IonicContact CZ-OE2 2.68Å; R108-E229 VanDerWaalsContact CZ-OE2 3.26Å; R108-E229 IonicContact NE-OE2 2.78Å; R108-E229 PolarHBondContact NE-OE2 3.36Å; R108-E229 IonicContact NH1-OE2 3.18Å; R108-E229 PolarHBondContact NH1-OE2 3.49Å; W225-E229 WeakPolarHBondContact O-CG 3.39Å; W225-E229 PolarHBondContact O-N 3.4Å; G226-E229 PolarHBondContact O-N 3.31Å; K227-E229 VanDerWaalsContact C-N 3.28Å; K227-E229 PolarHBondContact O-N 3.26Å; E229-R232 PolarHBondContact O-N 3.47Å; E229-G233 PolarHBondContact O-N 2.95Å |
| 230 | A | 76.8 | Confident | 66.6 | Low | 71 Ų | 71 | 74.5 Ų | 74.5 | 59% | 0.587 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -68 | -40.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | G226 K227 R232 G233 | G226-A230 WeakPolarHBondContact O-CB 3.4Å; G226-A230 PolarHBondContact O-N 3.04Å; K227-A230 PolarHBondContact O-N 3.03Å; A230-R232 PolarHBondContact O-N 2.9Å; A230-G233 PolarHBondContact O-N 3.46Å |
| 231 | E | 69.7 | Low | 63.6 | Low | 124 Ų | 124 | 81 Ų | 81 | 58% | 0.579 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -21.9 | 179.5 | -78.7 | 177.7 | -163.7 | 0 | 0 | 112.8 | R43 K227 | R43-E231 IonicContact CZ-OE2 3.62Å; R43-E231 IonicContact NH1-OE2 3.38Å; R43-E231 PolarHBondContact NH1-OE2 3.44Å; R43-E231 IonicContact NH2-OE1 3.2Å; R43-E231 PolarHBondContact NH2-OE1 2.84Å; R43-E231 IonicContact NH2-OE2 3.07Å; R43-E231 PolarHBondContact NH2-OE2 3.34Å; R43-E231 VanDerWaalsContact NH2-OE2 3.07Å; K227-E231 WeakPolarHBondContact O-CB 3.25Å; K227-E231 WeakPolarHBondContact O-CG 3.47Å; K227-E231 PolarHBondContact O-N 3.29Å |
| 232 | R | 64.9 | Low | 60.9 | Low | 131 Ų | 131 | 86.4 Ų | 86.4 | 49% | 0.494 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115 | 20 | 179.2 | -71.6 | -167.4 | 176.4 | -173 | 8.6 | 114.1 | H163 E229 A230 | H163-R232 PolarHBondContact CE1-NH1 3.35Å; H163-R232 VanDerWaalsContact ND1-CZ 3.25Å; H163-R232 PolarHBondContact ND1-NH1 2.92Å; H163-R232 PolarHBondContact ND1-NH2 3.45Å; E229-R232 PolarHBondContact O-N 3.47Å; A230-R232 PolarHBondContact O-N 2.9Å |
| 233 | G | 50.8 | Low | 58.3 | Low | 39 Ų | 39 | 90.7 Ų | 90.7 | 40% | 0.402 | 50% | 0.503 | S | S | . | . | trans | 90.7 | 140.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E229 A230 | E229-G233 PolarHBondContact O-N 2.95Å; A230-G233 PolarHBondContact O-N 3.46Å | ||
| 234 | P | 44.9 | Very low | 55.2 | Low | 120 Ų | 120 | 92.1 Ų | 92.1 | 78% | 0.779 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -63.6 | 137.9 | 171.2 | 28.9 | -31.5 | 0 | 0 | 0 | 108.4 | G236 | P234-G236 PolarHBondContact O-N 2.89Š|
| 235 | E | 41.9 | Very low | 52.5 | Low | 166 Ų | 166 | 95.3 Ų | 95.3 | 78% | 0.776 | 56% | 0.555 | S | S | * | * | trans | 7.3 | 88.8 | 159 | -77.2 | 170.9 | 148.6 | 0 | 0 | 114.4 | D237 | E235-D237 HydrophobicContact CB-CB 4.25Å; E235-D237 PolarHBondContact O-N 2.8Å | ||
| 236 | G | 36.3 | Very low | 49.9 | Very low | 73 Ų | 73 | 99.4 Ų | 99.4 | 75% | 0.753 | 59% | 0.589 | S | S | * | * | trans | -69 | 59.9 | 132.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | P234 K238 | P234-G236 PolarHBondContact O-N 2.89Å; G236-K238 PolarHBondContact O-N 3.16Å | ||
| 237 | D | 37.6 | Very low | 47.6 | Very low | 129 Ų | 129 | 105.9 Ų | 105.9 | 69% | 0.69 | 63% | 0.626 | S | S | * | * | trans | -65 | 81.4 | 139.8 | -160 | 29.3 | 0 | 0 | 0 | 102.8 | E235 P239 | E235-D237 HydrophobicContact CB-CB 4.25Å; E235-D237 PolarHBondContact O-N 2.8Å; D237-P239 WeakPolarHBondContact O-CD 3.48Å | ||
| 238 | K | 30.3 | Very low | 45.1 | Very low | 156 Ų | 156 | 103.2 Ų | 103.2 | 68% | 0.678 | 63% | 0.634 | S | S | * | * | trans | -64.8 | 109.9 | 157.4 | -77.3 | -177.7 | 177.4 | 177.2 | 0 | 102.2 | G236 T240 | G236-K238 PolarHBondContact O-N 3.16Å; K238-T240 PolarHBondContact O-N 3.37Å | ||
| 239 | P | 37.2 | Very low | 42.7 | Very low | 80 Ų | 80 | 106.4 Ų | 106.4 | 52% | 0.519 | 67% | 0.671 | S | S | . | * | trans | -58 | 101.9 | 140.7 | 27.8 | -28.6 | 0 | 0 | 0 | 102.8 | D237 L241 R252 | D237-P239 WeakPolarHBondContact O-CD 3.48Å; P239-L241 VanDerWaalsContact C-N 3.3Å; P239-L241 PolarHBondContact O-N 3.11Å; P239-R252 VanDerWaalsContact CA-NH2 3.29Å | ||
| 240 | T | 31.8 | Very low | 40.8 | Very low | 97 Ų | 97 | 110.4 Ų | 110.4 | 60% | 0.595 | 70% | 0.698 | S | S | * | * | trans | -36.4 | 94 | -170 | -40.9 | 0 | 0 | 0 | 0 | 110.1 | K238 I242 | K238-T240 PolarHBondContact O-N 3.37Å; T240-I242 HydrophobicContact CG2-CG1 3.74Å; T240-I242 PolarHBondContact O-N 2.83Å | ||
| 241 | L | 31.4 | Very low | 39.2 | Very low | 156 Ų | 156 | 113.7 Ų | 113.7 | 82% | 0.817 | 70% | 0.704 | S | S | * | * | trans | -72.9 | 85.3 | 162.3 | -94.9 | 171.6 | 0 | 0 | 0 | 102.5 | P239 L243 | P239-L241 VanDerWaalsContact C-N 3.3Å; P239-L241 PolarHBondContact O-N 3.11Å; L241-L243 PolarHBondContact O-N 2.84Å; L241-L243 VanDerWaalsContact O-N 3.12Å | ||
| 242 | I | 37 | Very low | 37.9 | Very low | 114 Ų | 114 | 117 Ų | 117 | 59% | 0.585 | 71% | 0.711 | S | S | * | * | trans | -56.4 | 109.3 | 163.6 | -62.4 | 175.8 | 0 | 0 | 0 | 104.8 | T240 | T240-I242 HydrophobicContact CG2-CG1 3.74Å; T240-I242 PolarHBondContact O-N 2.83Å | ||
| 243 | L | 38.5 | Very low | 37.5 | Very low | 184 Ų | 184 | 112.5 Ų | 112.5 | 96% | 0.963 | 70% | 0.697 | S | S | * | * | trans | -120.5 | 99.1 | 150.1 | -141.9 | 84.7 | 0 | 0 | 0 | 107.4 | L241 | L241-L243 PolarHBondContact O-N 2.84Å; L241-L243 VanDerWaalsContact O-N 3.12Å | ||
| 244 | G | 27.7 | Very low | 38.3 | Very low | 61 Ų | 61 | 113.8 Ų | 113.8 | 63% | 0.629 | 70% | 0.7 | S | S | * | * | trans | 172 | 75.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 245 | A | 30.7 | Very low | 39.2 | Very low | 104 Ų | 104 | 109 Ų | 109 | 86% | 0.86 | 67% | 0.67 | S | S | * | * | trans | -64.2 | 134.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 246 | A | 34.5 | Very low | 40.5 | Very low | 86 Ų | 86 | 108.5 Ų | 108.5 | 71% | 0.711 | 67% | 0.666 | S | S | * | * | S | Bend | trans | 145.8 | 113.5 | 131 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 247 | T | 34.5 | Very low | 42.2 | Very low | 149 Ų | 149 | 109.8 Ų | 109.8 | 91% | 0.914 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 59.3 | 86.4 | 160.7 | 54.5 | 0 | 0 | 0 | 0 | 118.2 | ||
| 248 | G | 31.5 | Very low | 43.7 | Very low | 68 Ų | 68 | 110.6 Ų | 110.6 | 70% | 0.701 | 65% | 0.645 | S | S | * | * | trans | 168.7 | 93 | 162.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | V250 | G248-V250 PolarHBondContact O-N 2.61Å; G248-V250 VanDerWaalsContact O-N 3.12Å | ||
| 249 | G | 29.6 | Very low | 45.6 | Very low | 82 Ų | 82 | 106.3 Ų | 106.3 | 85% | 0.845 | 63% | 0.627 | S | S | * | * | trans | -63.2 | 110.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | I251 | G249-I251 PolarHBondContact O-N 3.39Š| ||
| 250 | V | 39.6 | Very low | 47.5 | Very low | 129 Ų | 129 | 105.8 Ų | 105.8 | 78% | 0.782 | 63% | 0.625 | S | S | * | * | trans | -86.2 | 106.7 | 170.9 | -179.2 | 0 | 0 | 0 | 0 | 108.5 | G248 R252 | G248-V250 PolarHBondContact O-N 2.61Å; G248-V250 VanDerWaalsContact O-N 3.12Å; V250-R252 PolarHBondContact O-N 3.42Å | ||
| 251 | I | 43.2 | Very low | 49.6 | Very low | 140 Ų | 140 | 106.9 Ų | 106.9 | 72% | 0.718 | 62% | 0.618 | S | S | * | * | trans | -71.7 | 112.6 | 176.3 | -58.2 | 175 | 0 | 0 | 0 | 108.7 | G249 L253 | G249-I251 PolarHBondContact O-N 3.39Å; I251-L253 HydrophobicContact CG2-CG 4.24Å; I251-L253 PolarHBondContact O-N 3.38Å | ||
| 252 | R | 41.9 | Very low | 51.6 | Low | 192 Ų | 192 | 102 Ų | 102 | 73% | 0.725 | 60% | 0.597 | S | S | * | * | trans | -76.1 | 87.3 | 175.6 | -134.4 | -177.9 | -175.6 | -157.4 | -4.3 | 109.3 | P239 V250 | P239-R252 VanDerWaalsContact CA-NH2 3.29Å; V250-R252 PolarHBondContact O-N 3.42Å | ||
| 253 | L | 57.1 | Low | 53.4 | Low | 38 Ų | 38 | 97.9 Ų | 97.9 | 20% | 0.199 | 58% | 0.578 | C | S | . | * | trans | -69.2 | 133.3 | 178.2 | -75.2 | 140.8 | 0 | 0 | 0 | 111.2 | I251 E257 R258 R261 | I251-L253 HydrophobicContact CG2-CG 4.24Å; I251-L253 PolarHBondContact O-N 3.38Å; L253-E257 WeakPolarHBondContact CA-OE2 3.26Å; L253-E257 HydrophobicContact CB-CB 4.26Å; L253-E257 HydrophobicContact CD2-CB 3.64Å; L253-E257 HydrophobicContact CD2-CG 4.45Å; L253-R258 HydrophobicContact CB-CG 3.83Å; L253-R258 PolarHBondContact O-NE 2.9Å; L253-R258 PolarHBondContact O-NH2 3.31Å; L253-R261 VanDerWaalsContact CD1-NH1 3.34Å; L253-R261 VanDerWaalsContact CD2-NH2 3.34Å | ||
| 254 | S | 67.2 | Low | 55.5 | Low | 66 Ų | 66 | 95.7 Ų | 95.7 | 46% | 0.462 | 56% | 0.563 | S | S | . | * | trans | -58.3 | 150.6 | 171.7 | 176.4 | 0 | 0 | 0 | 0 | 110.6 | K256 E257 R258 | S254-K256 PolarHBondContact O-N 3.12Å; S254-K256 VanDerWaalsContact O-N 3.12Å; S254-E257 PolarHBondContact N-OE2 3.18Å; S254-E257 PolarHBondContact O-N 3.41Å; S254-R258 PolarHBondContact O-N 3.4Å | ||
| 255 | A | 64.3 | Low | 58.1 | Low | 18 Ų | 18 | 97.2 Ų | 97.2 | 15% | 0.149 | 55% | 0.554 | C | S | . | * | H | α-helix | trans | -51 | -36.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | Q103 F259 | Q103-A255 HydrophobicContact CB-CB 4.34Å; Q103-A255 VanDerWaalsContact OE1-CB 3.32Å; A255-F259 WeakPolarHBondContact O-CB 3.48Å; A255-F259 PolarHBondContact O-N 3.18Å |
| 256 | K | 69.1 | Low | 60.5 | Low | 157 Ų | 157 | 92.3 Ų | 92.3 | 68% | 0.683 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.7 | -41 | 175 | -175.3 | 178.4 | 177.9 | -177.4 | 0 | 112.9 | S254 F259 S260 | S254-K256 PolarHBondContact O-N 3.12Å; S254-K256 VanDerWaalsContact O-N 3.12Å; K256-F259 PolarHBondContact O-N 3.37Å; K256-S260 WeakPolarHBondContact O-CB 3.39Å; K256-S260 PolarHBondContact O-N 3.08Å |
| 257 | E | 71.2 | Confident | 62.9 | Low | 99 Ų | 99 | 91.1 Ų | 91.1 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -72.8 | -38.8 | -178.7 | -65.8 | 169.8 | 156.6 | 0 | 0 | 111.6 | L253 S254 S260 R261 | L253-E257 WeakPolarHBondContact CA-OE2 3.26Å; L253-E257 HydrophobicContact CB-CB 4.26Å; L253-E257 HydrophobicContact CD2-CB 3.64Å; L253-E257 HydrophobicContact CD2-CG 4.45Å; S254-E257 PolarHBondContact N-OE2 3.18Å; S254-E257 PolarHBondContact O-N 3.41Å; E257-S260 PolarHBondContact O-N 2.83Å; E257-R261 WeakPolarHBondContact O-CB 3.36Å; E257-R261 PolarHBondContact O-N 3.09Å |
| 258 | R | 69.1 | Low | 65.3 | Low | 146 Ų | 146 | 93.1 Ų | 93.1 | 55% | 0.551 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.1 | -45.1 | 172.2 | -77.8 | -174.5 | -83 | -160.1 | -1.1 | 111.5 | L253 S254 S262 | L253-R258 HydrophobicContact CB-CG 3.83Å; L253-R258 PolarHBondContact O-NE 2.9Å; L253-R258 PolarHBondContact O-NH2 3.31Å; S254-R258 PolarHBondContact O-N 3.4Å; R258-S262 WeakPolarHBondContact O-CB 3.48Å; R258-S262 PolarHBondContact O-N 3.3Å |
| 259 | F | 70.7 | Confident | 67.8 | Low | 66 Ų | 66 | 90.7 Ų | 90.7 | 29% | 0.289 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.5 | -51.4 | 175.9 | 179.6 | -98.3 | 0 | 0 | 0 | 111.9 | P96 A255 K256 R261 S262 C263 | P96-F259 HydrophobicContact CB-CE1 4.16Å; P96-F259 HydrophobicContact CB-CE2 4.29Å; P96-F259 HydrophobicContact CB-CZ 3.51Å; P96-F259 HydrophobicContact CG-CZ 4.42Å; P96-F259 WeakPolarHBondContact O-CE2 3.46Å; A255-F259 WeakPolarHBondContact O-CB 3.48Å; A255-F259 PolarHBondContact O-N 3.18Å; K256-F259 PolarHBondContact O-N 3.37Å; F259-R261 VanDerWaalsContact C-N 3.31Å; F259-R261 PolarHBondContact O-N 3.44Å; F259-S262 PolarHBondContact O-N 3.24Å; F259-C263 VanDerWaalsContact CE1-SG 3.55Å; F259-C263 WeakPolarHBondContact CZ-SG 3.29Å; F259-C263 PolarHBondContact O-N 3.41Å |
| 260 | S | 76.5 | Confident | 70.4 | Confident | 70 Ų | 70 | 87.7 Ų | 87.7 | 49% | 0.49 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.7 | -40.9 | -179.3 | 179.6 | 0 | 0 | 0 | 0 | 112.4 | K256 E257 C263 Q264 | K256-S260 WeakPolarHBondContact O-CB 3.39Å; K256-S260 PolarHBondContact O-N 3.08Å; E257-S260 PolarHBondContact O-N 2.83Å; S260-C263 PolarHBondContact O-N 3.13Å; S260-Q264 WeakPolarHBondContact O-CB 3.29Å; S260-Q264 PolarHBondContact O-N 2.99Å |
| 261 | R | 77.2 | Confident | 72.6 | Confident | 120 Ų | 120 | 87.2 Ų | 87.2 | 45% | 0.453 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -64.8 | -45.8 | 176.2 | -172.7 | -178.6 | -64.2 | 174.4 | -1.8 | 111.9 | L253 E257 F259 C263 Q264 E265 | L253-R261 VanDerWaalsContact CD1-NH1 3.34Å; L253-R261 VanDerWaalsContact CD2-NH2 3.34Å; E257-R261 WeakPolarHBondContact O-CB 3.36Å; E257-R261 PolarHBondContact O-N 3.09Å; F259-R261 VanDerWaalsContact C-N 3.31Å; F259-R261 PolarHBondContact O-N 3.44Å; R261-C263 VanDerWaalsContact C-N 3.33Å; R261-C263 PolarHBondContact O-N 3.43Å; R261-Q264 PolarHBondContact O-N 3.3Å; R261-Q264 VanDerWaalsContact O-N 3.16Å; R261-E265 WeakPolarHBondContact CD-OE1 3.39Å; R261-E265 HydrophobicContact CG-CG 4.4Å; R261-E265 VanDerWaalsContact CG-OE1 3.29Å; R261-E265 WeakPolarHBondContact CG-OE1 3.29Å; R261-E265 WeakPolarHBondContact O-CB 3.47Å; R261-E265 WeakPolarHBondContact O-CG 3.48Å; R261-E265 PolarHBondContact O-N 2.75Å |
| 262 | S | 73.4 | Confident | 74.7 | Confident | 52 Ų | 52 | 84.9 Ų | 84.9 | 36% | 0.364 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61 | -41.2 | 177.3 | -174.3 | 0 | 0 | 0 | 0 | 112.1 | R258 F259 E265 G266 | R258-S262 WeakPolarHBondContact O-CB 3.48Å; R258-S262 PolarHBondContact O-N 3.3Å; F259-S262 PolarHBondContact O-N 3.24Å; S262-E265 PolarHBondContact O-N 3.07Å; S262-G266 PolarHBondContact O-N 3.15Å |
| 263 | C | 74.3 | Confident | 76.8 | Confident | 29 Ų | 29 | 78.3 Ų | 78.3 | 20% | 0.196 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 173.4 | -74.1 | 0 | 0 | 0 | 0 | 112.4 | F259 S260 R261 G266 L267 W407 | F259-C263 VanDerWaalsContact CE1-SG 3.55Å; F259-C263 WeakPolarHBondContact CZ-SG 3.29Å; F259-C263 PolarHBondContact O-N 3.41Å; S260-C263 PolarHBondContact O-N 3.13Å; R261-C263 VanDerWaalsContact C-N 3.33Å; R261-C263 PolarHBondContact O-N 3.43Å; C263-G266 PolarHBondContact O-N 3.09Å; C263-L267 WeakPolarHBondContact O-CB 3.46Å; C263-L267 PolarHBondContact O-N 3.1Å; C263-W407 PolarHBondContact O-NE1 2.92Å |
| 264 | Q | 81.7 | Confident | 78.3 | Confident | 137 Ų | 137 | 83.8 Ų | 83.8 | 64% | 0.64 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -66.1 | -42.5 | 179.3 | -171.8 | -180 | 5.4 | 0 | 0 | 111.8 | S260 R261 L267 R268 | S260-Q264 WeakPolarHBondContact O-CB 3.29Å; S260-Q264 PolarHBondContact O-N 2.99Å; R261-Q264 PolarHBondContact O-N 3.3Å; R261-Q264 VanDerWaalsContact O-N 3.16Å; Q264-L267 PolarHBondContact O-N 3.09Å; Q264-R268 WeakPolarHBondContact O-CB 3.39Å; Q264-R268 PolarHBondContact O-N 3.38Å |
| 265 | E | 82.4 | Confident | 79.3 | Confident | 93 Ų | 93 | 84.3 Ų | 84.3 | 44% | 0.435 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -66.6 | -40.8 | 177 | -73.5 | 174.4 | -169.2 | 0 | 0 | 112 | R261 S262 R268 C269 | R261-E265 WeakPolarHBondContact CD-OE1 3.39Å; R261-E265 HydrophobicContact CG-CG 4.4Å; R261-E265 VanDerWaalsContact CG-OE1 3.29Å; R261-E265 WeakPolarHBondContact CG-OE1 3.29Å; R261-E265 WeakPolarHBondContact O-CB 3.47Å; R261-E265 WeakPolarHBondContact O-CG 3.48Å; R261-E265 PolarHBondContact O-N 2.75Å; S262-E265 PolarHBondContact O-N 3.07Å; E265-R268 PolarHBondContact O-N 3.35Å; E265-C269 WeakPolarHBondContact O-CB 3.33Å; E265-C269 PolarHBondContact O-N 3.21Å |
| 266 | G | 80.9 | Confident | 80.5 | Confident | 1 Ų | 1 | 83.4 Ų | 83.4 | 1% | 0.01 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.6 | -46.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S262 C263 C269 L270 | S262-G266 PolarHBondContact O-N 3.15Å; C263-G266 PolarHBondContact O-N 3.09Å; G266-C269 WeakPolarHBondContact O-CB 3.44Å; G266-C269 PolarHBondContact O-N 3.23Å; G266-L270 WeakPolarHBondContact O-CB 3.42Å; G266-L270 PolarHBondContact O-N 3.45Å |
| 267 | L | 84.7 | Confident | 81.5 | Confident | 62 Ų | 62 | 80.1 Ų | 80.1 | 33% | 0.325 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64.3 | -42.6 | 177.2 | -177.6 | 60.2 | 0 | 0 | 0 | 111.7 | C263 Q264 C269 L270 L271 W407 | C263-L267 WeakPolarHBondContact O-CB 3.46Å; C263-L267 PolarHBondContact O-N 3.1Å; Q264-L267 PolarHBondContact O-N 3.09Å; L267-C269 VanDerWaalsContact C-N 3.34Å; L267-C269 PolarHBondContact O-N 2.62Å; L267-L270 HydrophobicContact CD1-CD2 4.45Å; L267-L270 WeakPolarHBondContact O-CB 3.45Å; L267-L270 PolarHBondContact O-N 2.91Å; L267-L271 HydrophobicContact CD1-CD1 4.05Å; L267-L271 HydrophobicContact CD1-CG 4.26Å; L267-L271 HydrophobicContact CG-CD1 4.13Å; L267-L271 WeakPolarHBondContact O-CG 3.2Å; L267-L271 PolarHBondContact O-N 3.45Å; L267-W407 HydrophobicContact CB-CZ2 4.16Å; L267-W407 HydrophobicContact CD1-CD2 4.27Å; L267-W407 HydrophobicContact CD1-CE3 4.44Å; L267-W407 HydrophobicContact CD2-CH2 4.35Å; L267-W407 HydrophobicContact CD2-CZ2 4.11Å |
| 268 | R | 86.6 | Confident | 82.5 | Confident | 191 Ų | 191 | 77.3 Ų | 77.3 | 72% | 0.721 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -62.2 | -43.4 | 176.6 | -172.2 | 176.4 | -178.3 | 173.7 | 1.8 | 111.1 | Q264 E265 L271 S272 | Q264-R268 WeakPolarHBondContact O-CB 3.39Å; Q264-R268 PolarHBondContact O-N 3.38Å; E265-R268 PolarHBondContact O-N 3.35Å; R268-L271 PolarHBondContact O-N 3.21Å; R268-S272 VanDerWaalsContact O-CB 3.24Å; R268-S272 WeakPolarHBondContact O-CB 3.46Å; R268-S272 PolarHBondContact O-N 3.5Å; R268-S272 PolarHBondContact O-OG 2.99Å |
| 269 | C | 82.9 | Confident | 83.6 | Confident | 16 Ų | 16 | 70.4 Ų | 70.4 | 11% | 0.108 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 176.3 | -167 | 0 | 0 | 0 | 0 | 111.4 | E265 G266 L267 L271 S272 D273 K400 V404 | E265-C269 WeakPolarHBondContact O-CB 3.33Å; E265-C269 PolarHBondContact O-N 3.21Å; G266-C269 WeakPolarHBondContact O-CB 3.44Å; G266-C269 PolarHBondContact O-N 3.23Å; L267-C269 VanDerWaalsContact C-N 3.34Å; L267-C269 PolarHBondContact O-N 2.62Å; C269-L271 VanDerWaalsContact C-N 3.34Å; C269-L271 PolarHBondContact O-N 3.4Å; C269-S272 PolarHBondContact O-N 3.37Å; C269-D273 PolarHBondContact O-N 2.84Å; C269-K400 HydrophobicContact CB-CD 3.99Å; C269-V404 HydrophobicContact CB-CG2 4.02Å |
| 270 | L | 84.9 | Confident | 84.6 | Confident | 19 Ų | 19 | 67.5 Ų | 67.5 | 10% | 0.099 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -56.4 | -45.5 | 178.2 | 176.2 | 60.8 | 0 | 0 | 0 | 112.6 | G266 L267 V276 L277 W407 F408 | G266-L270 WeakPolarHBondContact O-CB 3.42Å; G266-L270 PolarHBondContact O-N 3.45Å; L267-L270 HydrophobicContact CD1-CD2 4.45Å; L267-L270 WeakPolarHBondContact O-CB 3.45Å; L267-L270 PolarHBondContact O-N 2.91Å; L270-V276 HydrophobicContact CD1-CG1 3.97Å; L270-L277 HydrophobicContact CD1-CD1 4.17Å; L270-L277 HydrophobicContact CG-CD1 4.42Å; L270-W407 HydrophobicContact CD2-CB 4.03Å; L270-F408 HydrophobicContact CD1-CD1 4.11Å; L270-F408 HydrophobicContact CD1-CE1 3.43Å; L270-F408 VanDerWaalsContact CD1-CE1 3.43Å; L270-F408 HydrophobicContact CD1-CZ 4.42Å |
| 271 | L | 85.3 | Confident | 85.3 | Confident | 120 Ų | 120 | 65.5 Ų | 65.5 | 63% | 0.628 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -81.1 | -22.4 | -177.1 | -66.9 | 176.2 | 0 | 0 | 0 | 113.5 | L267 R268 C269 | L267-L271 HydrophobicContact CD1-CD1 4.05Å; L267-L271 HydrophobicContact CD1-CG 4.26Å; L267-L271 HydrophobicContact CG-CD1 4.13Å; L267-L271 WeakPolarHBondContact O-CG 3.2Å; L267-L271 PolarHBondContact O-N 3.45Å; R268-L271 PolarHBondContact O-N 3.21Å; C269-L271 VanDerWaalsContact C-N 3.34Å; C269-L271 PolarHBondContact O-N 3.4Å |
| 272 | S | 86.9 | Confident | 86.2 | Confident | 90 Ų | 90 | 59.8 Ų | 59.8 | 63% | 0.629 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -84 | -32.4 | -177.5 | -56.6 | 0 | 0 | 0 | 0 | 112.6 | R268 C269 | R268-S272 VanDerWaalsContact O-CB 3.24Å; R268-S272 WeakPolarHBondContact O-CB 3.46Å; R268-S272 PolarHBondContact O-N 3.5Å; R268-S272 PolarHBondContact O-OG 2.99Å; C269-S272 PolarHBondContact O-N 3.37Å |
| 273 | D | 87.1 | Confident | 87.1 | Confident | 55 Ų | 55 | 58 Ų | 58 | 29% | 0.294 | 29% | 0.291 | S | S | . | . | trans | -107.1 | 112.4 | -178.1 | -169.5 | -20.4 | 0 | 0 | 0 | 111.6 | C269 R275 V276 L277 | C269-D273 PolarHBondContact O-N 2.84Å; D273-R275 PolarHBondContact O-N 3.12Å; D273-R275 VanDerWaalsContact OD1-CB 3.27Å; D273-R275 WeakPolarHBondContact OD1-CB 3.47Å; D273-R275 PolarHBondContact OD1-N 2.99Å; D273-V276 HydrophobicContact CB-CB 4.09Å; D273-V276 HydrophobicContact CB-CG2 3.73Å; D273-V276 PolarHBondContact O-N 3.42Å; D273-L277 PolarHBondContact O-N 3.47Å | ||
| 274 | K | 88.1 | Confident | 88 | Confident | 153 Ų | 153 | 56.8 Ų | 56.8 | 67% | 0.665 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -58.3 | -29.6 | 177.7 | -69.6 | -176.2 | 178.2 | -179.5 | 0 | 112.8 | L278 | K274-L278 WeakPolarHBondContact O-CB 3.44Å; K274-L278 VanDerWaalsContact O-CG 3.28Å; K274-L278 WeakPolarHBondContact O-CG 3.28Å; K274-L278 PolarHBondContact O-N 2.94Å |
| 275 | R | 88.4 | Confident | 88.6 | Confident | 76 Ų | 76 | 52 Ų | 52 | 29% | 0.287 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -72.3 | -44.5 | 179.8 | -59.6 | 165.5 | 174.7 | -172.8 | -10.4 | 110.8 | D273 L277 L278 L279 V395 L460 D467 | D273-R275 PolarHBondContact O-N 3.12Å; D273-R275 VanDerWaalsContact OD1-CB 3.27Å; D273-R275 WeakPolarHBondContact OD1-CB 3.47Å; D273-R275 PolarHBondContact OD1-N 2.99Å; R275-L277 VanDerWaalsContact C-N 3.3Å; R275-L277 PolarHBondContact O-N 2.84Å; R275-L278 PolarHBondContact O-N 3.09Å; R275-L279 WeakPolarHBondContact O-CB 3.12Å; R275-L279 PolarHBondContact O-N 3.49Å; R275-V395 HydrophobicContact CB-CG1 3.87Å; R275-L460 HydrophobicContact CB-CD1 3.85Å; R275-L460 HydrophobicContact CG-CD1 4.25Å; R275-D467 IonicContact CZ-OD2 2.83Å; R275-D467 IonicContact NH1-OD2 2.65Å; R275-D467 PolarHBondContact NH1-OD2 3.05Å; R275-D467 IonicContact NH2-OD2 2.61Å; R275-D467 PolarHBondContact NH2-OD2 3.05Å |
| 276 | V | 89.5 | Confident | 89.3 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61 | -43 | 173.9 | -179.5 | 0 | 0 | 0 | 0 | 109.8 | L270 D273 G280 V395 V404 F408 | L270-V276 HydrophobicContact CD1-CG1 3.97Å; D273-V276 HydrophobicContact CB-CB 4.09Å; D273-V276 HydrophobicContact CB-CG2 3.73Å; D273-V276 PolarHBondContact O-N 3.42Å; V276-G280 PolarHBondContact O-N 3.46Å; V276-V395 HydrophobicContact CG2-CG1 3.81Å; V276-V404 HydrophobicContact CG1-CG1 3.65Å; V276-F408 HydrophobicContact CG1-CE1 4.23Å; V276-F408 HydrophobicContact CG1-CZ 3.9Å; V276-F408 WeakPolarHBondContact O-CZ 3.44Å |
| 277 | L | 90.5 | Very high | 89.9 | Confident | 88 Ų | 88 | 49.1 Ų | 49.1 | 46% | 0.461 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -63.3 | -46.3 | 177.3 | -174.3 | 65.5 | 0 | 0 | 0 | 112.7 | L270 D273 R275 G280 G281 | L270-L277 HydrophobicContact CD1-CD1 4.17Å; L270-L277 HydrophobicContact CG-CD1 4.42Å; D273-L277 PolarHBondContact O-N 3.47Å; R275-L277 VanDerWaalsContact C-N 3.3Å; R275-L277 PolarHBondContact O-N 2.84Å; L277-G280 PolarHBondContact O-N 3.16Å; L277-G281 PolarHBondContact O-N 3.33Å |
| 278 | L | 91.5 | Very high | 90.3 | Very high | 40 Ų | 40 | 46.1 Ų | 46.1 | 21% | 0.209 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.3 | -44.1 | 178.4 | -75.7 | 169 | 0 | 0 | 0 | 111.7 | K274 R275 G280 G281 V282 A456 L460 L463 | K274-L278 WeakPolarHBondContact O-CB 3.44Å; K274-L278 VanDerWaalsContact O-CG 3.28Å; K274-L278 WeakPolarHBondContact O-CG 3.28Å; K274-L278 PolarHBondContact O-N 2.94Å; R275-L278 PolarHBondContact O-N 3.09Å; L278-G280 VanDerWaalsContact C-N 3.32Å; L278-G280 PolarHBondContact O-N 3.42Å; L278-G281 PolarHBondContact O-N 3.49Å; L278-V282 VanDerWaalsContact O-CG2 3.24Å; L278-V282 WeakPolarHBondContact O-CG2 3.44Å; L278-V282 PolarHBondContact O-N 3.19Å; L278-A456 HydrophobicContact CD2-CB 4.33Å; L278-L460 HydrophobicContact CB-CB 4.2Å; L278-L460 HydrophobicContact CB-CD1 4.09Å; L278-L460 HydrophobicContact CD1-CB 4.35Å; L278-L463 HydrophobicContact CD1-CD1 3.42Å; L278-L463 VanDerWaalsContact CD1-CD1 3.42Å |
| 279 | L | 91.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.9 | -43 | 175.3 | -176.7 | 62.8 | 0 | 0 | 0 | 111.2 | R275 V282 Q283 L391 Q392 V395 L460 | R275-L279 WeakPolarHBondContact O-CB 3.12Å; R275-L279 PolarHBondContact O-N 3.49Å; L279-V282 PolarHBondContact O-N 3.05Å; L279-Q283 WeakPolarHBondContact O-CB 3.29Å; L279-Q283 PolarHBondContact O-N 2.86Å; L279-L391 HydrophobicContact CD1-CB 4.04Å; L279-L391 HydrophobicContact CD1-CD1 4.35Å; L279-L391 HydrophobicContact CD2-CB 4.22Å; L279-Q392 HydrophobicContact CD2-CB 4.48Å; L279-Q392 HydrophobicContact CD2-CG 3.94Å; L279-V395 HydrophobicContact CD2-CB 4.14Å; L279-V395 HydrophobicContact CD2-CG1 4.45Å; L279-V395 HydrophobicContact CD2-CG2 4.35Å; L279-L460 HydrophobicContact CB-CD2 4.27Å; L279-L460 HydrophobicContact CD1-CD2 4.28Å |
| 280 | G | 91.3 | Very high | 91.1 | Very high | 5 Ų | 5 | 37.8 Ų | 37.8 | 5% | 0.052 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.7 | -38.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | V276 L277 L278 Q283 A284 F408 | V276-G280 PolarHBondContact O-N 3.46Å; L277-G280 PolarHBondContact O-N 3.16Å; L278-G280 VanDerWaalsContact C-N 3.32Å; L278-G280 PolarHBondContact O-N 3.42Å; G280-Q283 PolarHBondContact O-N 3.46Å; G280-A284 WeakPolarHBondContact O-CB 3.48Å; G280-A284 PolarHBondContact O-N 3.5Å; G280-F408 VanDerWaalsContact CA-CZ 3.41Å |
| 281 | G | 92.6 | Very high | 91.4 | Very high | 28 Ų | 28 | 40 Ų | 40 | 29% | 0.289 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -66.1 | -44.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L277 L278 Q283 A284 L285 | L277-G281 PolarHBondContact O-N 3.33Å; L278-G281 PolarHBondContact O-N 3.49Å; G281-Q283 VanDerWaalsContact C-N 3.27Å; G281-Q283 PolarHBondContact O-N 2.91Å; G281-A284 PolarHBondContact O-N 3.5Å; G281-L285 WeakPolarHBondContact O-CB 3.24Å; G281-L285 VanDerWaalsContact O-CG 3.28Å; G281-L285 WeakPolarHBondContact O-CG 3.44Å; G281-L285 PolarHBondContact O-N 3.17Å |
| 282 | V | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -58.3 | -44.5 | 173.2 | 171.1 | 0 | 0 | 0 | 0 | 110.4 | L278 L279 L285 F286 L342 I346 A456 V457 | L278-V282 VanDerWaalsContact O-CG2 3.24Å; L278-V282 WeakPolarHBondContact O-CG2 3.44Å; L278-V282 PolarHBondContact O-N 3.19Å; L279-V282 PolarHBondContact O-N 3.05Å; V282-L285 PolarHBondContact O-N 2.95Å; V282-F286 WeakPolarHBondContact O-CB 3.37Å; V282-F286 PolarHBondContact O-N 3.44Å; V282-L342 HydrophobicContact CG1-CD2 4.45Å; V282-I346 HydrophobicContact CG1-CD1 3.8Å; V282-A456 HydrophobicContact CG2-CB 3.6Å; V282-V457 HydrophobicContact CB-CG2 3.97Å; V282-V457 HydrophobicContact CG1-CG2 3.4Å; V282-V457 HydrophobicContact CG2-CB 4.28Å; V282-V457 HydrophobicContact CG2-CG2 3.3Å |
| 283 | Q | 93.9 | Very high | 92 | Very high | 14 Ų | 14 | 30.2 Ų | 30.2 | 7% | 0.065 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.2 | -48.6 | 177.5 | -170.5 | -180 | -23.3 | 0 | 0 | 112.3 | L279 G280 G281 L285 F286 E287 Y384 | L279-Q283 WeakPolarHBondContact O-CB 3.29Å; L279-Q283 PolarHBondContact O-N 2.86Å; G280-Q283 PolarHBondContact O-N 3.46Å; G281-Q283 VanDerWaalsContact C-N 3.27Å; G281-Q283 PolarHBondContact O-N 2.91Å; Q283-L285 VanDerWaalsContact C-N 3.32Å; Q283-L285 PolarHBondContact O-N 3.26Å; Q283-F286 PolarHBondContact O-N 3.19Å; Q283-E287 VanDerWaalsContact CD-OE1 3.28Å; Q283-E287 HydrophobicContact CG-CG 4.26Å; Q283-E287 WeakPolarHBondContact CG-OE1 3.32Å; Q283-E287 PolarHBondContact NE2-OE1 3.49Å; Q283-E287 WeakPolarHBondContact O-CB 3.41Å; Q283-E287 PolarHBondContact O-N 2.97Å; Q283-Y384 WeakPolarHBondContact CA-OH 3.44Å |
| 284 | A | 92.8 | Very high | 92.3 | Very high | 5 Ų | 5 | 30.3 Ų | 30.3 | 4% | 0.041 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.4 | -41.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G280 G281 S288 P411 L412 L415 | G280-A284 WeakPolarHBondContact O-CB 3.48Å; G280-A284 PolarHBondContact O-N 3.5Å; G281-A284 PolarHBondContact O-N 3.5Å; A284-S288 WeakPolarHBondContact O-CB 3.26Å; A284-S288 PolarHBondContact O-N 2.95Å; A284-S288 VanDerWaalsContact O-N 3.15Å; A284-S288 PolarHBondContact O-OG 2.98Å; A284-P411 HydrophobicContact CB-CB 4.15Å; A284-P411 HydrophobicContact CB-CG 4.04Å; A284-L412 HydrophobicContact CB-CB 4.23Å; A284-L415 HydrophobicContact CB-CD1 4.37Å |
| 285 | L | 94.8 | Very high | 92.4 | Very high | 36 Ų | 36 | 23.1 Ų | 23.1 | 19% | 0.188 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -69.5 | -46.4 | 178.4 | -68.8 | 168.7 | 0 | 0 | 0 | 112.3 | G281 V282 Q283 S288 V289 L415 M449 M450 A452 A453 | G281-L285 WeakPolarHBondContact O-CB 3.24Å; G281-L285 VanDerWaalsContact O-CG 3.28Å; G281-L285 WeakPolarHBondContact O-CG 3.44Å; G281-L285 PolarHBondContact O-N 3.17Å; V282-L285 PolarHBondContact O-N 2.95Å; Q283-L285 VanDerWaalsContact C-N 3.32Å; Q283-L285 PolarHBondContact O-N 3.26Å; L285-S288 PolarHBondContact O-OG 3.26Å; L285-V289 WeakPolarHBondContact O-CG2 3.35Å; L285-V289 PolarHBondContact O-N 3.44Å; L285-L415 HydrophobicContact CD2-CD1 4.37Å; L285-M449 HydrophobicContact CD2-CB 4.32Å; L285-M449 HydrophobicContact CD2-CG 4.34Å; L285-M450 VanDerWaalsContact O-CE 3.32Å; L285-M450 WeakPolarHBondContact O-CE 3.37Å; L285-A452 HydrophobicContact CD1-CB 4.01Å; L285-A453 HydrophobicContact CB-CB 3.84Å; L285-A453 HydrophobicContact CD1-CB 4.06Å |
| 286 | F | 95.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 19.5 Ų | 19.5 | 1% | 0.013 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -68 | -51.8 | -177.8 | -168.6 | -83.1 | 0 | 0 | 0 | 112.4 | V282 Q283 S288 V289 L290 I346 A349 Y384 M450 | V282-F286 WeakPolarHBondContact O-CB 3.37Å; V282-F286 PolarHBondContact O-N 3.44Å; Q283-F286 PolarHBondContact O-N 3.19Å; F286-S288 PolarHBondContact O-N 3Å; F286-V289 PolarHBondContact O-N 2.96Å; F286-L290 PolarHBondContact O-N 3.2Å; F286-L290 VanDerWaalsContact O-N 3.16Å; F286-I346 HydrophobicContact CD2-CG1 3.99Å; F286-I346 HydrophobicContact CE2-CG1 4.35Å; F286-A349 HydrophobicContact CE2-CB 3.7Å; F286-A349 HydrophobicContact CZ-CB 4.29Å; F286-Y384 HydrophobicContact CB-CD2 4.27Å; F286-Y384 HydrophobicContact CB-CE2 3.54Å; F286-Y384 AromaticContact CD1-CD1 3.53Å; F286-Y384 HydrophobicContact CD1-CD1 3.53Å; F286-Y384 AromaticContact CD1-CD2 3.6Å; F286-Y384 HydrophobicContact CD1-CD2 3.6Å; F286-Y384 AromaticContact CD1-CE1 3.47Å; F286-Y384 HydrophobicContact CD1-CE1 3.47Å; F286-Y384 VanDerWaalsContact CD1-CE1 3.47Å; F286-Y384 AromaticContact CD1-CE2 3.52Å; F286-Y384 HydrophobicContact CD1-CE2 3.52Å; F286-Y384 AromaticContact CD1-CG 3.6Å; F286-Y384 HydrophobicContact CD1-CG 3.6Å; F286-Y384 AromaticContact CD1-CZ 3.46Å; F286-Y384 VanDerWaalsContact CD1-CZ 3.46Å; F286-Y384 AromaticContact CD2-CD2 3.77Å; F286-Y384 HydrophobicContact CD2-CD2 3.77Å; F286-Y384 AromaticContact CD2-CE2 3.92Å; F286-Y384 HydrophobicContact CD2-CE2 3.92Å; F286-Y384 HydrophobicContact CD2-CG 4.37Å; F286-Y384 AromaticContact CE1-CD1 3.45Å; F286-Y384 HydrophobicContact CE1-CD1 3.45Å; F286-Y384 VanDerWaalsContact CE1-CD1 3.45Å; F286-Y384 AromaticContact CE1-CD2 3.77Å; F286-Y384 HydrophobicContact CE1-CD2 3.77Å; F286-Y384 AromaticContact CE1-CE1 3.91Å; F286-Y384 HydrophobicContact CE1-CE1 3.91Å; F286-Y384 HydrophobicContact CE1-CE2 4.18Å; F286-Y384 AromaticContact CE1-CG 3.39Å; F286-Y384 HydrophobicContact CE1-CG 3.39Å; F286-Y384 AromaticContact CE2-CD2 3.91Å; F286-Y384 HydrophobicContact CE2-CD2 3.91Å; F286-Y384 HydrophobicContact CE2-CG 4.17Å; F286-Y384 HydrophobicContact CG-CD1 4.36Å; F286-Y384 AromaticContact CG-CD2 3.59Å; F286-Y384 HydrophobicContact CG-CD2 3.59Å; F286-Y384 HydrophobicContact CG-CE1 4.2Å; F286-Y384 AromaticContact CG-CE2 3.36Å; F286-Y384 HydrophobicContact CG-CE2 3.36Å; F286-Y384 HydrophobicContact CG-CG 4.09Å; F286-Y384 AromaticContact CG-CZ 3.7Å; F286-Y384 HydrophobicContact CZ-CD1 4.22Å; F286-Y384 AromaticContact CZ-CD2 3.92Å; F286-Y384 HydrophobicContact CZ-CD2 3.92Å; F286-Y384 AromaticContact CZ-CG 3.69Å; F286-Y384 HydrophobicContact CZ-CG 3.69Å; F286-M450 HydrophobicContact CB-CE 4.41Å; F286-M450 HydrophobicContact CD2-CE 4.37Å; F286-M450 HydrophobicContact CD2-SD 3.71Å; F286-M450 HydrophobicContact CE2-SD 4.16Å; F286-M450 HydrophobicContact CG-SD 4.48Å |
| 287 | E | 93.9 | Very high | 92.7 | Very high | 30 Ų | 30 | 19.9 Ų | 19.9 | 14% | 0.14 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -73.1 | -29.9 | -175.8 | -67.5 | -174 | -139.6 | 0 | 0 | 112.1 | Q283 V289 L290 Y291 Y384 F385 L412 | Q283-E287 VanDerWaalsContact CD-OE1 3.28Å; Q283-E287 HydrophobicContact CG-CG 4.26Å; Q283-E287 WeakPolarHBondContact CG-OE1 3.32Å; Q283-E287 PolarHBondContact NE2-OE1 3.49Å; Q283-E287 WeakPolarHBondContact O-CB 3.41Å; Q283-E287 PolarHBondContact O-N 2.97Å; E287-V289 VanDerWaalsContact C-N 3.3Å; E287-V289 PolarHBondContact O-N 2.9Å; E287-L290 WeakPolarHBondContact O-CB 3.35Å; E287-L290 PolarHBondContact O-N 3.28Å; E287-L290 VanDerWaalsContact O-N 3.13Å; E287-Y291 WeakPolarHBondContact O-CD2 3.44Å; E287-Y291 PolarHBondContact O-N 3.43Å; E287-Y384 HydrophobicContact CG-CE1 4.01Å; E287-F385 HydrophobicContact CG-CE1 4.46Å; E287-L412 HydrophobicContact CB-CD1 3.3Å; E287-L412 HydrophobicContact CB-CG 3.91Å; E287-L412 HydrophobicContact CG-CD1 4.03Å; E287-L412 VanDerWaalsContact OE2-CD1 3.26Å; E287-L412 WeakPolarHBondContact OE2-CD1 3.42Å |
| 288 | S | 92.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.4 | -40.4 | 173.3 | 60.7 | 0 | 0 | 0 | 0 | 112 | A284 L285 F286 L290 Y291 I292 L412 | A284-S288 WeakPolarHBondContact O-CB 3.26Å; A284-S288 PolarHBondContact O-N 2.95Å; A284-S288 VanDerWaalsContact O-N 3.15Å; A284-S288 PolarHBondContact O-OG 2.98Å; L285-S288 PolarHBondContact O-OG 3.26Å; F286-S288 PolarHBondContact O-N 3Å; S288-L290 VanDerWaalsContact C-N 3.32Å; S288-L290 PolarHBondContact O-N 3.34Å; S288-Y291 PolarHBondContact O-N 2.99Å; S288-I292 WeakPolarHBondContact O-CG1 3.27Å; S288-I292 PolarHBondContact O-N 3.33Å; S288-L412 VanDerWaalsContact CB-O 3.28Å; S288-L412 WeakPolarHBondContact CB-O 3.33Å |
| 289 | V | 94 | Very high | 92.8 | Very high | 2 Ų | 2 | 14.7 Ų | 14.7 | 1% | 0.012 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.3 | -36.5 | 173.5 | 165.8 | 0 | 0 | 0 | 0 | 111.8 | L285 F286 E287 I292 F293 F353 C446 M449 M450 | L285-V289 WeakPolarHBondContact O-CG2 3.35Å; L285-V289 PolarHBondContact O-N 3.44Å; F286-V289 PolarHBondContact O-N 2.96Å; E287-V289 VanDerWaalsContact C-N 3.3Å; E287-V289 PolarHBondContact O-N 2.9Å; V289-I292 PolarHBondContact O-N 3.02Å; V289-F293 WeakPolarHBondContact O-CB 3.26Å; V289-F293 PolarHBondContact O-N 2.93Å; V289-F353 HydrophobicContact CB-CE2 4.47Å; V289-F353 HydrophobicContact CG1-CD2 3.83Å; V289-F353 HydrophobicContact CG1-CE1 4.04Å; V289-F353 HydrophobicContact CG1-CE2 2.99Å; V289-F353 HydrophobicContact CG1-CZ 3.11Å; V289-C446 HydrophobicContact CG1-CB 3.85Å; V289-C446 HydrophobicContact CG2-CB 4.06Å; V289-M449 HydrophobicContact CG2-CB 3.86Å; V289-M449 HydrophobicContact CG2-CE 3.53Å; V289-M449 HydrophobicContact CG2-SD 4.16Å; V289-M450 HydrophobicContact CB-CE 3.7Å; V289-M450 HydrophobicContact CG1-CE 4.05Å; V289-M450 HydrophobicContact CG1-SD 4.47Å; V289-M450 HydrophobicContact CG2-CE 3.52Å |
| 290 | L | 93.6 | Very high | 92.9 | Very high | 30 Ų | 30 | 15.5 Ų | 15.5 | 16% | 0.157 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -61.4 | -44.1 | 172.7 | -172.6 | 155.9 | 0 | 0 | 0 | 111.4 | F286 E287 S288 I292 F293 V294 C381 F385 | F286-L290 PolarHBondContact O-N 3.2Å; F286-L290 VanDerWaalsContact O-N 3.16Å; E287-L290 WeakPolarHBondContact O-CB 3.35Å; E287-L290 PolarHBondContact O-N 3.28Å; E287-L290 VanDerWaalsContact O-N 3.13Å; S288-L290 VanDerWaalsContact C-N 3.32Å; S288-L290 PolarHBondContact O-N 3.34Å; L290-I292 VanDerWaalsContact C-N 3.32Å; L290-I292 PolarHBondContact O-N 3.25Å; L290-F293 WeakPolarHBondContact O-CB 2.99Å; L290-F293 PolarHBondContact O-N 3.48Å; L290-F293 VanDerWaalsContact O-N 3.17Å; L290-V294 HydrophobicContact CD2-CG2 3.94Å; L290-V294 WeakPolarHBondContact O-CG2 3.39Å; L290-V294 PolarHBondContact O-N 2.99Å; L290-C381 HydrophobicContact CD1-CB 4.49Å; L290-F385 HydrophobicContact CD1-CE2 4.03Å; L290-F385 HydrophobicContact CD1-CZ 3.87Å |
| 291 | Y | 91.3 | Very high | 93 | Very high | 65 Ų | 65 | 15.2 Ų | 15.2 | 26% | 0.255 | 9% | 0.085 | S | C | . | . | H | α-helix | trans | -62.7 | -37.7 | 175.7 | -77.2 | -70.1 | 0 | 0 | 0 | 113 | L88 E287 S288 L412 H413 A416 | L88-Y291 HydrophobicContact CD2-CD1 3.37Å; L88-Y291 HydrophobicContact CD2-CE1 3.66Å; L88-Y291 HydrophobicContact CD2-CG 4Å; E287-Y291 WeakPolarHBondContact O-CD2 3.44Å; E287-Y291 PolarHBondContact O-N 3.43Å; S288-Y291 PolarHBondContact O-N 2.99Å; Y291-L412 HydrophobicContact CD2-CD2 3.74Å; Y291-L412 HydrophobicContact CD2-CG 4.5Å; Y291-L412 HydrophobicContact CE2-CD2 3.38Å; Y291-L412 HydrophobicContact CE2-CG 4.29Å; Y291-H413 AromaticContact CE2-CE1 3.81Å; Y291-H413 AromaticContact CZ-CE1 3.51Å; Y291-H413 PolarHBondContact OH-CE1 3.49Å; Y291-A416 HydrophobicContact CG-CB 4.43Å |
| 292 | I | 91.3 | Very high | 92.9 | Very high | 3 Ų | 3 | 15.1 Ų | 15.1 | 2% | 0.015 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -64.3 | -45.1 | 173 | -68.8 | 166.6 | 0 | 0 | 0 | 110.2 | S288 V289 L290 V294 F295 L296 M442 M449 | S288-I292 WeakPolarHBondContact O-CG1 3.27Å; S288-I292 PolarHBondContact O-N 3.33Å; V289-I292 PolarHBondContact O-N 3.02Å; L290-I292 VanDerWaalsContact C-N 3.32Å; L290-I292 PolarHBondContact O-N 3.25Å; I292-V294 PolarHBondContact O-N 3.31Å; I292-F295 WeakPolarHBondContact O-CB 3.34Å; I292-F295 PolarHBondContact O-N 3.17Å; I292-F295 VanDerWaalsContact O-N 3.14Å; I292-L296 HydrophobicContact CG2-CD1 3.59Å; I292-L296 HydrophobicContact CG2-CG 4.22Å; I292-L296 WeakPolarHBondContact O-CG 3.41Å; I292-L296 PolarHBondContact O-N 2.87Å; I292-L296 VanDerWaalsContact O-N 3.08Å; I292-M442 HydrophobicContact CG2-CE 3.53Å; I292-M449 HydrophobicContact CD1-CE 3.91Å |
| 293 | F | 93.9 | Very high | 92.7 | Very high | 2 Ų | 2 | 19.9 Ų | 19.9 | 1% | 0.009 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59 | -43.5 | 176.8 | 160.2 | -102.5 | 0 | 0 | 0 | 112.6 | V289 L290 F295 L296 W297 L315 F353 F374 L377 E378 | V289-F293 WeakPolarHBondContact O-CB 3.26Å; V289-F293 PolarHBondContact O-N 2.93Å; L290-F293 WeakPolarHBondContact O-CB 2.99Å; L290-F293 PolarHBondContact O-N 3.48Å; L290-F293 VanDerWaalsContact O-N 3.17Å; F293-F295 PolarHBondContact O-N 3.38Å; F293-F295 VanDerWaalsContact O-N 3.1Å; F293-L296 PolarHBondContact O-N 3.48Å; F293-W297 HydrophobicContact CD2-CB 4.07Å; F293-W297 HydrophobicContact CE2-CB 3.48Å; F293-W297 VanDerWaalsContact CE2-CB 3.48Å; F293-W297 HydrophobicContact CE2-CG 4.32Å; F293-W297 HydrophobicContact CZ-CB 3.88Å; F293-W297 HydrophobicContact CZ-CG 4.28Å; F293-W297 PolarHBondContact O-N 3.17Å; F293-L315 HydrophobicContact CZ-CD1 4.02Å; F293-L315 HydrophobicContact CZ-CD2 4.3Å; F293-F353 HydrophobicContact CB-CE1 4.47Å; F293-F353 HydrophobicContact CB-CZ 4.17Å; F293-F374 AromaticContact CD2-CD1 3.91Å; F293-F374 HydrophobicContact CD2-CD1 3.91Å; F293-F374 HydrophobicContact CD2-CE1 4.02Å; F293-F374 HydrophobicContact CE2-CB 4Å; F293-F374 AromaticContact CE2-CD1 3.35Å; F293-F374 HydrophobicContact CE2-CD1 3.35Å; F293-F374 HydrophobicContact CE2-CD2 4.41Å; F293-F374 AromaticContact CE2-CE1 3.79Å; F293-F374 HydrophobicContact CE2-CE1 3.79Å; F293-F374 AromaticContact CE2-CG 3.69Å; F293-F374 HydrophobicContact CE2-CG 3.69Å; F293-F374 HydrophobicContact CZ-CB 4.3Å; F293-F374 HydrophobicContact CZ-CD1 4.41Å; F293-F374 HydrophobicContact CZ-CG 4.42Å; F293-L377 HydrophobicContact CB-CD2 3.93Å; F293-L377 HydrophobicContact CD1-CD2 3.85Å; F293-L377 HydrophobicContact CD2-CD2 3.51Å; F293-L377 HydrophobicContact CE1-CD2 4.26Å; F293-L377 HydrophobicContact CE2-CD2 3.95Å; F293-L377 HydrophobicContact CG-CD2 3.44Å; F293-L377 VanDerWaalsContact CG-CD2 3.44Å; F293-L377 HydrophobicContact CZ-CD2 4.3Å; F293-E378 VanDerWaalsContact CE1-OE1 3.26Å; F293-E378 WeakPolarHBondContact CE1-OE1 3.42Å |
| 294 | V | 91.8 | Very high | 92.6 | Very high | 57 Ų | 57 | 22.8 Ų | 22.8 | 35% | 0.345 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -56.7 | -28.1 | 177.5 | 169.1 | 0 | 0 | 0 | 0 | 112.1 | Y84 L290 I292 W297 | Y84-V294 HydrophobicContact CE1-CG1 4.36Å; L290-V294 HydrophobicContact CD2-CG2 3.94Å; L290-V294 WeakPolarHBondContact O-CG2 3.39Å; L290-V294 PolarHBondContact O-N 2.99Å; I292-V294 PolarHBondContact O-N 3.31Å; V294-W297 PolarHBondContact O-NE1 2.91Å |
| 295 | F | 90.8 | Very high | 92.4 | Very high | 1 Ų | 1 | 25.1 Ų | 25.1 | 0% | 0.004 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -81.6 | -40.3 | 171.7 | 174.4 | -90.7 | 0 | 0 | 0 | 112.9 | Y67 I80 A81 Y84 I292 F293 P299 L420 L423 | Y67-F295 HydrophobicContact CD2-CD2 4.14Å; Y67-F295 HydrophobicContact CD2-CE2 4.05Å; Y67-F295 HydrophobicContact CE2-CD2 4.16Å; Y67-F295 HydrophobicContact CE2-CE1 4.39Å; Y67-F295 AromaticContact CE2-CE2 3.67Å; Y67-F295 HydrophobicContact CE2-CE2 3.67Å; Y67-F295 AromaticContact CE2-CZ 3.8Å; Y67-F295 HydrophobicContact CE2-CZ 3.8Å; I80-F295 HydrophobicContact CB-CE2 4.34Å; I80-F295 HydrophobicContact CG2-CE2 3.94Å; A81-F295 HydrophobicContact CB-CE2 3.99Å; A81-F295 HydrophobicContact CB-CZ 3.87Å; Y84-F295 HydrophobicContact CD1-CB 4.06Å; Y84-F295 AromaticContact CD1-CD2 3.95Å; Y84-F295 HydrophobicContact CD1-CD2 3.95Å; Y84-F295 AromaticContact CD2-CD2 3.81Å; Y84-F295 HydrophobicContact CD2-CD2 3.81Å; Y84-F295 HydrophobicContact CD2-CE2 4.28Å; Y84-F295 HydrophobicContact CE1-CB 4.19Å; Y84-F295 HydrophobicContact CE1-CD2 4.26Å; Y84-F295 HydrophobicContact CE2-CD2 4.14Å; Y84-F295 AromaticContact CG-CD2 3.7Å; Y84-F295 HydrophobicContact CG-CD2 3.7Å; Y84-F295 HydrophobicContact CG-CE2 4.46Å; I292-F295 WeakPolarHBondContact O-CB 3.34Å; I292-F295 PolarHBondContact O-N 3.17Å; I292-F295 VanDerWaalsContact O-N 3.14Å; F293-F295 PolarHBondContact O-N 3.38Å; F293-F295 VanDerWaalsContact O-N 3.1Å; F295-P299 WeakPolarHBondContact O-CD 3.32Å; F295-P299 WeakPolarHBondContact O-CG 3.32Å; F295-L420 HydrophobicContact CB-CD2 3.85Å; F295-L420 HydrophobicContact CD1-CD2 3.71Å; F295-L420 HydrophobicContact CD2-CD2 4.28Å; F295-L420 HydrophobicContact CE1-CD2 4.37Å; F295-L420 HydrophobicContact CG-CD2 3.67Å; F295-L423 HydrophobicContact CD1-CD2 4.2Å; F295-L423 HydrophobicContact CE1-CD2 3.32Å; F295-L423 HydrophobicContact CZ-CD2 3.91Å |
| 296 | L | 90.8 | Very high | 92.3 | Very high | 1 Ų | 1 | 23.7 Ų | 23.7 | 1% | 0.005 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -83.5 | -25.4 | -169.7 | -70.1 | 178 | 0 | 0 | 0 | 115.7 | I292 F293 T298 P299 V300 T439 M442 F443 | I292-L296 HydrophobicContact CG2-CD1 3.59Å; I292-L296 HydrophobicContact CG2-CG 4.22Å; I292-L296 WeakPolarHBondContact O-CG 3.41Å; I292-L296 PolarHBondContact O-N 2.87Å; I292-L296 VanDerWaalsContact O-N 3.08Å; F293-L296 PolarHBondContact O-N 3.48Å; L296-T298 PolarHBondContact O-N 3.05Å; L296-P299 VanDerWaalsContact O-CD 3.28Å; L296-P299 WeakPolarHBondContact O-CD 3.24Å; L296-P299 WeakPolarHBondContact O-CG 3.41Å; L296-V300 VanDerWaalsContact O-CG2 3.26Å; L296-V300 WeakPolarHBondContact O-CG2 3.49Å; L296-V300 PolarHBondContact O-N 2.94Å; L296-T439 HydrophobicContact CD2-CG2 4.32Å; L296-M442 HydrophobicContact CD1-CB 3.86Å; L296-M442 HydrophobicContact CD1-CE 4.08Å; L296-M442 HydrophobicContact CD1-SD 3.89Å; L296-M442 HydrophobicContact CD2-CE 4.44Å; L296-M442 HydrophobicContact CD2-SD 3.7Å; L296-M442 HydrophobicContact CG-CE 4.45Å; L296-M442 HydrophobicContact CG-SD 4.23Å; L296-F443 HydrophobicContact CB-CE1 4.02Å; L296-F443 HydrophobicContact CB-CZ 3.99Å; L296-F443 HydrophobicContact CD1-CD1 4.03Å; L296-F443 HydrophobicContact CD1-CE1 3.62Å; L296-F443 HydrophobicContact CD1-CZ 4.09Å; L296-F443 HydrophobicContact CG-CE1 4.48Å |
| 297 | W | 94.3 | Very high | 92.2 | Very high | 7 Ų | 7 | 24 Ų | 24 | 3% | 0.027 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.9 | -38.8 | -173.5 | 75.9 | -87.4 | 0 | 0 | 0 | 112.9 | F293 V294 L301 L308 V311 F312 L315 F374 | F293-W297 HydrophobicContact CD2-CB 4.07Å; F293-W297 HydrophobicContact CE2-CB 3.48Å; F293-W297 VanDerWaalsContact CE2-CB 3.48Å; F293-W297 HydrophobicContact CE2-CG 4.32Å; F293-W297 HydrophobicContact CZ-CB 3.88Å; F293-W297 HydrophobicContact CZ-CG 4.28Å; F293-W297 PolarHBondContact O-N 3.17Å; V294-W297 PolarHBondContact O-NE1 2.91Å; W297-L301 PolarHBondContact O-N 3.1Å; W297-L308 HydrophobicContact CH2-CD2 4.18Å; W297-L308 HydrophobicContact CZ3-CD2 3.84Å; W297-V311 HydrophobicContact CE3-CG1 3.99Å; W297-V311 HydrophobicContact CZ3-CB 4.3Å; W297-V311 HydrophobicContact CZ3-CG1 3.71Å; W297-F312 HydrophobicContact CH2-CB 4.5Å; W297-F312 HydrophobicContact CZ2-CD2 4.34Å; W297-L315 HydrophobicContact CD2-CD1 4.26Å; W297-L315 HydrophobicContact CE3-CD1 4.31Å; W297-F374 HydrophobicContact CB-CD2 4.26Å; W297-F374 HydrophobicContact CB-CE2 4Å; W297-F374 HydrophobicContact CB-CZ 4.15Å |
| 298 | T | 93 | Very high | 92.2 | Very high | 1 Ų | 1 | 22.5 Ų | 22.5 | 1% | 0.006 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -65.8 | -54.3 | 179.3 | -47.9 | 0 | 0 | 0 | 0 | 112.2 | Y67 L296 V300 L301 D302 L308 | Y67-T298 HydrophobicContact CD1-CG2 3.64Å; Y67-T298 HydrophobicContact CG-CG2 4.1Å; L296-T298 PolarHBondContact O-N 3.05Å; T298-V300 PolarHBondContact O-N 3.21Å; T298-L301 PolarHBondContact O-N 3.03Å; T298-L301 VanDerWaalsContact O-N 3.12Å; T298-D302 HydrophobicContact CG2-CB 4.1Å; T298-D302 WeakPolarHBondContact O-CB 3.32Å; T298-D302 PolarHBondContact O-N 2.96Å; T298-L308 HydrophobicContact CG2-CD1 4.11Å; T298-L308 HydrophobicContact CG2-CD2 4.14Å |
| 299 | P | 91.1 | Very high | 92.4 | Very high | 18 Ų | 18 | 22.5 Ų | 22.5 | 12% | 0.117 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.3 | -26.4 | 179.5 | 19.9 | -30.1 | 0 | 0 | 0 | 113.8 | Y67 F295 L296 P303 | Y67-P299 HydrophobicContact CE1-CB 3.87Å; Y67-P299 HydrophobicContact CE1-CG 4.12Å; Y67-P299 HydrophobicContact CE2-CB 4.41Å; Y67-P299 HydrophobicContact CE2-CG 3.92Å; Y67-P299 WeakPolarHBondContact OH-CB 3.11Å; F295-P299 WeakPolarHBondContact O-CD 3.32Å; F295-P299 WeakPolarHBondContact O-CG 3.32Å; L296-P299 VanDerWaalsContact O-CD 3.28Å; L296-P299 WeakPolarHBondContact O-CD 3.24Å; L296-P299 WeakPolarHBondContact O-CG 3.41Å; P299-P303 WeakPolarHBondContact O-CD 3.3Å; P299-P303 WeakPolarHBondContact O-CG 3.37Å |
| 300 | V | 92.3 | Very high | 92.6 | Very high | 17 Ų | 17 | 22.5 Ų | 22.5 | 10% | 0.103 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -71.1 | -37.9 | 175.6 | 170.6 | 0 | 0 | 0 | 0 | 112.3 | L296 T298 T360 F374 T439 F443 | L296-V300 VanDerWaalsContact O-CG2 3.26Å; L296-V300 WeakPolarHBondContact O-CG2 3.49Å; L296-V300 PolarHBondContact O-N 2.94Å; T298-V300 PolarHBondContact O-N 3.21Å; V300-T360 HydrophobicContact CG1-CG2 3.97Å; V300-T360 HydrophobicContact CG2-CG2 4.26Å; V300-F374 HydrophobicContact CB-CE2 4.22Å; V300-F374 HydrophobicContact CB-CZ 3.99Å; V300-F374 HydrophobicContact CG1-CE2 3.99Å; V300-F374 HydrophobicContact CG1-CZ 3.86Å; V300-F374 HydrophobicContact CG2-CZ 4.33Å; V300-T439 HydrophobicContact CG2-CG2 3.76Å; V300-F443 HydrophobicContact CG2-CE2 3.94Å; V300-F443 HydrophobicContact CG2-CZ 3.94Å |
| 301 | L | 93.7 | Very high | 92.8 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -100.6 | -34.2 | -174.4 | -58.1 | 179.5 | 0 | 0 | 0 | 113.7 | M1 W297 T298 H304 P306 V311 P367 F371 F374 | M1-L301 HydrophobicContact CE-CD2 4Å; W297-L301 PolarHBondContact O-N 3.1Å; T298-L301 PolarHBondContact O-N 3.03Å; T298-L301 VanDerWaalsContact O-N 3.12Å; L301-H304 WeakPolarHBondContact O-CB 3.37Å; L301-H304 PolarHBondContact O-N 2.89Å; L301-P306 HydrophobicContact CB-CG 3.92Å; L301-P306 WeakPolarHBondContact O-CD 3.46Å; L301-P306 WeakPolarHBondContact O-CG 3.45Å; L301-V311 HydrophobicContact CD1-CG1 3.74Å; L301-P367 HydrophobicContact CD2-CB 4.41Å; L301-F371 HydrophobicContact CD1-CD2 4.16Å; L301-F371 HydrophobicContact CD2-CB 4.33Å; L301-F374 HydrophobicContact CD1-CD2 3.85Å; L301-F374 HydrophobicContact CD1-CE2 3.92Å; L301-F374 HydrophobicContact CD2-CE2 4.14Å; L301-F374 HydrophobicContact CG-CD2 4.26Å; L301-F374 HydrophobicContact CG-CE2 3.83Å |
| 302 | D | 91.1 | Very high | 93 | Very high | 26 Ų | 26 | 18.6 Ų | 18.6 | 14% | 0.139 | 12% | 0.118 | C | C | . | . | G | 310 helix | trans | -54 | -39.8 | -174.7 | -170.6 | 52.8 | 0 | 0 | 0 | 114.6 | K68 T298 H304 G305 | K68-D302 WeakPolarHBondContact CD-OD1 3.44Å; K68-D302 WeakPolarHBondContact CD-OD2 3.36Å; K68-D302 WeakPolarHBondContact CE-OD1 3.22Å; K68-D302 IonicContact NZ-OD1 2.72Å; K68-D302 PolarHBondContact NZ-OD1 3.19Å; K68-D302 IonicContact NZ-OD2 3.26Å; K68-D302 PolarHBondContact NZ-OD2 3.4Å; T298-D302 HydrophobicContact CG2-CB 4.1Å; T298-D302 WeakPolarHBondContact O-CB 3.32Å; T298-D302 PolarHBondContact O-N 2.96Å; D302-H304 PolarHBondContact O-N 2.96Å; D302-G305 PolarHBondContact O-N 3.43Å |
| 303 | P | 90.4 | Very high | 93.3 | Very high | 100 Ų | 100 | 18.5 Ų | 18.5 | 65% | 0.649 | 12% | 0.118 | S | C | * | . | G | 310 helix | trans | -57.8 | -19.5 | 175.5 | -26.2 | 36.3 | 0 | 0 | 0 | 114.3 | P299 | P299-P303 WeakPolarHBondContact O-CD 3.3Å; P299-P303 WeakPolarHBondContact O-CG 3.37Å |
| 304 | H | 90.9 | Very high | 93.6 | Very high | 74 Ų | 74 | 18.4 Ų | 18.4 | 34% | 0.343 | 12% | 0.117 | S | C | . | . | G | 310 helix | trans | -98.7 | 10.8 | -179.5 | -55.6 | -71.1 | 0 | 0 | 0 | 113.5 | M1 L301 D302 P306 P367 | M1-H304 HydrophobicContact CG-CB 3.87Å; L301-H304 WeakPolarHBondContact O-CB 3.37Å; L301-H304 PolarHBondContact O-N 2.89Å; D302-H304 PolarHBondContact O-N 2.96Å; H304-P306 VanDerWaalsContact C-CD 3.44Å; H304-P367 HydrophobicContact CB-CB 4.33Å; H304-P367 HydrophobicContact CB-CG 4.41Å; H304-P367 VanDerWaalsContact CD2-CB 3.47Å; H304-P367 WeakPolarHBondContact CD2-CB 3.36Å |
| 305 | G | 89.1 | Confident | 93.8 | Very high | 55 Ų | 55 | 15.8 Ų | 15.8 | 57% | 0.567 | 10% | 0.101 | S | C | * | . | trans | 58.2 | 42 | 175.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | D302 | D302-G305 PolarHBondContact O-N 3.43Š| ||
| 306 | P | 92.1 | Very high | 94.1 | Very high | 6 Ų | 6 | 16.6 Ų | 16.6 | 4% | 0.039 | 11% | 0.105 | C | C | . | . | trans | -73.8 | 152.9 | 173.2 | 35.2 | -38.8 | 0 | 0 | 0 | 111.3 | M1 L301 H304 L308 V311 | M1-P306 HydrophobicContact CB-CB 4.17Å; L301-P306 HydrophobicContact CB-CG 3.92Å; L301-P306 WeakPolarHBondContact O-CD 3.46Å; L301-P306 WeakPolarHBondContact O-CG 3.45Å; H304-P306 VanDerWaalsContact C-CD 3.44Å; P306-L308 HydrophobicContact CG-CD2 4Å; P306-L308 PolarHBondContact O-N 2.89Å; P306-V311 HydrophobicContact CB-CG2 3.83Å; P306-V311 HydrophobicContact CG-CG2 4.48Å | ||
| 307 | P | 94.2 | Very high | 94.5 | Very high | 8 Ų | 8 | 16.5 Ų | 16.5 | 5% | 0.052 | 11% | 0.105 | C | C | . | . | trans | -67.9 | 96.8 | 165.9 | 28.7 | -33.6 | 0 | 0 | 0 | 109.8 | L2 A5 Y6 N193 G309 I310 V311 | L2-P307 HydrophobicContact CG-CG 4.42Å; A5-P307 HydrophobicContact CB-CG 4.1Å; Y6-P307 HydrophobicContact CD2-CG 4.34Å; Y6-P307 HydrophobicContact CE2-CB 4.35Å; Y6-P307 HydrophobicContact CE2-CG 3.81Å; N193-P307 WeakPolarHBondContact OD1-CB 3.35Å; P307-G309 VanDerWaalsContact C-N 3.32Å; P307-G309 PolarHBondContact O-N 3.48Å; P307-I310 HydrophobicContact CB-CB 4.07Å; P307-I310 HydrophobicContact CB-CG1 3.84Å; P307-I310 HydrophobicContact CG-CB 3.94Å; P307-I310 HydrophobicContact CG-CG1 4.07Å; P307-I310 PolarHBondContact O-N 3.21Å; P307-V311 PolarHBondContact O-N 2.8Å | ||
| 308 | L | 94.7 | Very high | 94.6 | Very high | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -59.2 | -38.6 | -169.9 | -71.1 | 176.3 | 0 | 0 | 0 | 113.2 | Y65 K68 W297 T298 P306 I310 V311 F312 | Y65-L308 HydrophobicContact CD1-CD1 4.45Å; Y65-L308 HydrophobicContact CE1-CB 4.18Å; Y65-L308 HydrophobicContact CE1-CD1 4.31Å; K68-L308 HydrophobicContact CB-CD1 3.67Å; K68-L308 HydrophobicContact CD-CD1 3.9Å; K68-L308 HydrophobicContact CG-CD1 3.73Å; W297-L308 HydrophobicContact CH2-CD2 4.18Å; W297-L308 HydrophobicContact CZ3-CD2 3.84Å; T298-L308 HydrophobicContact CG2-CD1 4.11Å; T298-L308 HydrophobicContact CG2-CD2 4.14Å; P306-L308 HydrophobicContact CG-CD2 4Å; P306-L308 PolarHBondContact O-N 2.89Å; L308-I310 VanDerWaalsContact C-N 3.35Å; L308-I310 PolarHBondContact O-N 2.81Å; L308-V311 PolarHBondContact O-N 3.32Å; L308-F312 WeakPolarHBondContact O-CB 3.39Å; L308-F312 PolarHBondContact O-N 2.92Å |
| 309 | G | 96.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.6 | -36 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | G189 N193 P307 F312 S313 | G189-G309 CarbonylContact C-O 3.47Å; G189-G309 WeakPolarHBondContact CA-O 3.46Å; G189-G309 CarbonylContact O-C 3.43Å; G189-G309 VanDerWaalsContact O-CA 3.29Å; G189-G309 WeakPolarHBondContact O-CA 3.1Å; N193-G309 PolarHBondContact OD1-N 3.38Å; P307-G309 VanDerWaalsContact C-N 3.32Å; P307-G309 PolarHBondContact O-N 3.48Å; G309-F312 PolarHBondContact O-N 3.36Å; G309-S313 PolarHBondContact O-N 3.41Å; G309-S313 PolarHBondContact O-OG 3.43Å |
| 310 | I | 97.5 | Very high | 95 | Very high | 1 Ų | 1 | 18 Ų | 18 | 1% | 0.005 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -70 | -40.6 | 173.7 | -55.2 | -57.3 | 0 | 0 | 0 | 111.3 | A5 Y6 I9 L190 N193 W198 P307 L308 F312 S313 C314 | A5-I310 HydrophobicContact CB-CG2 4.15Å; Y6-I310 HydrophobicContact CD1-CG1 4.43Å; Y6-I310 HydrophobicContact CD1-CG2 4.32Å; Y6-I310 HydrophobicContact CE1-CD1 3.9Å; Y6-I310 HydrophobicContact CE1-CG1 3.76Å; Y6-I310 HydrophobicContact CE1-CG2 4.46Å; I9-I310 HydrophobicContact CB-CG2 4.26Å; I9-I310 HydrophobicContact CG2-CG2 3.91Å; L190-I310 HydrophobicContact CD2-CD1 3.54Å; N193-I310 HydrophobicContact CB-CD1 4.05Å; N193-I310 HydrophobicContact CB-CG1 4.24Å; W198-I310 HydrophobicContact CZ2-CD1 4.41Å; P307-I310 HydrophobicContact CB-CB 4.07Å; P307-I310 HydrophobicContact CB-CG1 3.84Å; P307-I310 HydrophobicContact CG-CB 3.94Å; P307-I310 HydrophobicContact CG-CG1 4.07Å; P307-I310 PolarHBondContact O-N 3.21Å; L308-I310 VanDerWaalsContact C-N 3.35Å; L308-I310 PolarHBondContact O-N 2.81Å; I310-F312 VanDerWaalsContact C-N 3.32Å; I310-F312 PolarHBondContact O-N 3.27Å; I310-S313 WeakPolarHBondContact O-CB 3.44Å; I310-S313 PolarHBondContact O-N 3.17Å; I310-C314 PolarHBondContact O-N 3.31Å; I310-C314 PolarHBondContact O-SG 3.09Å |
| 311 | V | 97.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -57.4 | -49 | 173.6 | 169.5 | 0 | 0 | 0 | 0 | 109.7 | A5 W297 L301 P306 P307 L308 S313 C314 L315 F371 | A5-V311 HydrophobicContact CB-CG2 4.18Å; W297-V311 HydrophobicContact CE3-CG1 3.99Å; W297-V311 HydrophobicContact CZ3-CB 4.3Å; W297-V311 HydrophobicContact CZ3-CG1 3.71Å; L301-V311 HydrophobicContact CD1-CG1 3.74Å; P306-V311 HydrophobicContact CB-CG2 3.83Å; P306-V311 HydrophobicContact CG-CG2 4.48Å; P307-V311 PolarHBondContact O-N 2.8Å; L308-V311 PolarHBondContact O-N 3.32Å; V311-S313 VanDerWaalsContact C-N 3.34Å; V311-S313 PolarHBondContact O-N 3.28Å; V311-C314 WeakPolarHBondContact O-CA 3.38Å; V311-C314 VanDerWaalsContact O-CB 3.32Å; V311-C314 WeakPolarHBondContact O-CB 3.49Å; V311-C314 PolarHBondContact O-N 3.05Å; V311-L315 HydrophobicContact CG1-CD1 4.48Å; V311-L315 WeakPolarHBondContact O-CG 3.32Å; V311-L315 PolarHBondContact O-N 3.44Å; V311-F371 HydrophobicContact CB-CE2 4.45Å; V311-F371 HydrophobicContact CG1-CD2 4.21Å; V311-F371 HydrophobicContact CG1-CE2 3.93Å; V311-F371 HydrophobicContact CG2-CE2 4.33Å |
| 312 | F | 97.1 | Very high | 95.4 | Very high | 14 Ų | 14 | 17.3 Ų | 17.3 | 6% | 0.061 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -58.6 | -43.3 | 175.9 | -174.6 | -91.1 | 0 | 0 | 0 | 112.5 | W60 P64 W297 L308 G309 I310 C314 L315 M316 | W60-F312 HydrophobicContact CE3-CE1 4.15Å; W60-F312 AromaticContact CE3-CZ 3.67Å; W60-F312 HydrophobicContact CE3-CZ 3.67Å; W60-F312 AromaticContact CZ3-CZ 3.84Å; W60-F312 HydrophobicContact CZ3-CZ 3.84Å; P64-F312 HydrophobicContact CB-CB 3.73Å; P64-F312 HydrophobicContact CB-CD2 4.38Å; P64-F312 HydrophobicContact CB-CG 3.97Å; P64-F312 HydrophobicContact CG-CB 3.78Å; P64-F312 HydrophobicContact CG-CD1 3.65Å; P64-F312 HydrophobicContact CG-CD2 4.18Å; P64-F312 HydrophobicContact CG-CE1 4.27Å; P64-F312 HydrophobicContact CG-CG 3.59Å; W297-F312 HydrophobicContact CH2-CB 4.5Å; W297-F312 HydrophobicContact CZ2-CD2 4.34Å; L308-F312 WeakPolarHBondContact O-CB 3.39Å; L308-F312 PolarHBondContact O-N 2.92Å; G309-F312 PolarHBondContact O-N 3.36Å; I310-F312 VanDerWaalsContact C-N 3.32Å; I310-F312 PolarHBondContact O-N 3.27Å; F312-C314 VanDerWaalsContact C-N 3.29Å; F312-C314 PolarHBondContact O-N 3.5Å; F312-L315 WeakPolarHBondContact O-CB 3.49Å; F312-L315 PolarHBondContact O-N 3.37Å; F312-M316 HydrophobicContact CD1-CG 3.94Å; F312-M316 HydrophobicContact CE1-CG 3.52Å; F312-M316 HydrophobicContact CE1-SD 4.25Å; F312-M316 HydrophobicContact CE2-CE 4.44Å; F312-M316 HydrophobicContact CZ-CE 4.38Å; F312-M316 HydrophobicContact CZ-CG 3.86Å; F312-M316 HydrophobicContact CZ-SD 4Å; F312-M316 WeakPolarHBondContact O-CG 3.06Å; F312-M316 PolarHBondContact O-N 2.93Å |
| 313 | S | 97.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -60.2 | -36.9 | 173.1 | -67 | 0 | 0 | 0 | 0 | 112.7 | V186 G189 L190 G309 I310 V311 A317 | V186-S313 PolarHBondContact O-OG 3.47Å; G189-S313 VanDerWaalsContact CA-OG 3.26Å; G189-S313 WeakPolarHBondContact CA-OG 3.37Å; L190-S313 PolarHBondContact N-OG 3.34Å; G309-S313 PolarHBondContact O-N 3.41Å; G309-S313 PolarHBondContact O-OG 3.43Å; I310-S313 WeakPolarHBondContact O-CB 3.44Å; I310-S313 PolarHBondContact O-N 3.17Å; V311-S313 VanDerWaalsContact C-N 3.34Å; V311-S313 PolarHBondContact O-N 3.28Å; S313-A317 WeakPolarHBondContact O-CB 3.19Å; S313-A317 PolarHBondContact O-N 3.31Å |
| 314 | C | 98.2 | Very high | 95.6 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -65.1 | -43.2 | 174.8 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | A5 L12 I310 V311 F312 A317 A318 F371 L375 | A5-C314 PolarHBondContact O-SG 3.2Å; A5-C314 VanDerWaalsContact O-SG 3.4Å; L12-C314 HydrophobicContact CD1-CB 3.86Å; L12-C314 WeakPolarHBondContact CD1-O 3.15Å; I310-C314 PolarHBondContact O-N 3.31Å; I310-C314 PolarHBondContact O-SG 3.09Å; V311-C314 WeakPolarHBondContact O-CA 3.38Å; V311-C314 VanDerWaalsContact O-CB 3.32Å; V311-C314 WeakPolarHBondContact O-CB 3.49Å; V311-C314 PolarHBondContact O-N 3.05Å; F312-C314 VanDerWaalsContact C-N 3.29Å; F312-C314 PolarHBondContact O-N 3.5Å; C314-A317 PolarHBondContact O-N 3.4Å; C314-A318 WeakPolarHBondContact O-CB 3.47Å; C314-A318 PolarHBondContact O-N 2.77Å; C314-F371 HydrophobicContact CB-CE2 4.14Å; C314-F371 HydrophobicContact CB-CZ 3.82Å; C314-L375 HydrophobicContact CB-CD2 3.69Å |
| 315 | L | 97.7 | Very high | 95.8 | Very high | 2 Ų | 2 | 12 Ų | 12 | 1% | 0.01 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -57.3 | -51.6 | 175.6 | -65.7 | 179.1 | 0 | 0 | 0 | 110.5 | F293 W297 V311 F312 A317 A318 S319 F374 L375 E378 | F293-L315 HydrophobicContact CZ-CD1 4.02Å; F293-L315 HydrophobicContact CZ-CD2 4.3Å; W297-L315 HydrophobicContact CD2-CD1 4.26Å; W297-L315 HydrophobicContact CE3-CD1 4.31Å; V311-L315 HydrophobicContact CG1-CD1 4.48Å; V311-L315 WeakPolarHBondContact O-CG 3.32Å; V311-L315 PolarHBondContact O-N 3.44Å; F312-L315 WeakPolarHBondContact O-CB 3.49Å; F312-L315 PolarHBondContact O-N 3.37Å; L315-A317 VanDerWaalsContact C-N 3.33Å; L315-A317 PolarHBondContact O-N 2.63Å; L315-A318 PolarHBondContact O-N 3.28Å; L315-S319 PolarHBondContact O-N 3.33Å; L315-F374 HydrophobicContact CD2-CB 3.65Å; L315-L375 HydrophobicContact CD2-CD2 4.26Å; L315-E378 HydrophobicContact CB-CG 3.72Å; L315-E378 HydrophobicContact CD2-CG 3.71Å; L315-E378 HydrophobicContact CG-CG 4.21Å; L315-E378 WeakPolarHBondContact O-CB 3.44Å |
| 316 | M | 97 | Very high | 96 | Very high | 18 Ų | 18 | 10.6 Ų | 10.6 | 9% | 0.089 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -65.6 | -34.9 | 179 | -62.5 | -59.4 | 98.1 | 0 | 0 | 112.8 | W60 A185 V186 F312 S319 M320 | W60-M316 HydrophobicContact CE3-SD 4.24Å; W60-M316 HydrophobicContact CH2-SD 3.78Å; W60-M316 HydrophobicContact CZ3-SD 3.54Å; W60-M316 VanDerWaalsContact CZ3-SD 3.54Å; A185-M316 HydrophobicContact CB-CB 3.95Å; A185-M316 HydrophobicContact CB-CG 3.74Å; A185-M316 HydrophobicContact CB-SD 3.85Å; V186-M316 HydrophobicContact CG2-CB 3.77Å; F312-M316 HydrophobicContact CD1-CG 3.94Å; F312-M316 HydrophobicContact CE1-CG 3.52Å; F312-M316 HydrophobicContact CE1-SD 4.25Å; F312-M316 HydrophobicContact CE2-CE 4.44Å; F312-M316 HydrophobicContact CZ-CE 4.38Å; F312-M316 HydrophobicContact CZ-CG 3.86Å; F312-M316 HydrophobicContact CZ-SD 4Å; F312-M316 WeakPolarHBondContact O-CG 3.06Å; F312-M316 PolarHBondContact O-N 2.93Å; M316-S319 PolarHBondContact O-N 3.18Å; M316-M320 PolarHBondContact O-N 2.97Å |
| 317 | A | 97.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -69 | -39 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | I9 L12 V186 S313 C314 L315 M320 V321 | I9-A317 HydrophobicContact CD1-CB 4.04Å; L12-A317 HydrophobicContact CB-CB 3.89Å; L12-A317 HydrophobicContact CD1-CB 4.35Å; V186-A317 HydrophobicContact CG2-CB 3.99Å; S313-A317 WeakPolarHBondContact O-CB 3.19Å; S313-A317 PolarHBondContact O-N 3.31Å; C314-A317 PolarHBondContact O-N 3.4Å; L315-A317 VanDerWaalsContact C-N 3.33Å; L315-A317 PolarHBondContact O-N 2.63Å; A317-M320 WeakPolarHBondContact O-CB 3.47Å; A317-M320 PolarHBondContact O-N 3.1Å; A317-V321 WeakPolarHBondContact O-CG2 3.43Å; A317-V321 PolarHBondContact O-N 2.96Å |
| 318 | A | 97.9 | Very high | 95.7 | Very high | 1 Ų | 1 | 14.8 Ų | 14.8 | 1% | 0.008 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -63.2 | -41.3 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | L12 C314 L315 M320 V321 G322 L375 E378 L379 | L12-A318 HydrophobicContact CD2-CB 4.29Å; C314-A318 WeakPolarHBondContact O-CB 3.47Å; C314-A318 PolarHBondContact O-N 2.77Å; L315-A318 PolarHBondContact O-N 3.28Å; A318-M320 PolarHBondContact O-N 2.86Å; A318-V321 WeakPolarHBondContact O-CB 3.23Å; A318-V321 PolarHBondContact O-N 3.47Å; A318-G322 PolarHBondContact O-N 3.46Å; A318-L375 HydrophobicContact CB-CB 4.46Å; A318-L375 HydrophobicContact CB-CD2 4.17Å; A318-E378 HydrophobicContact CB-CB 4.03Å; A318-L379 HydrophobicContact CB-CB 4.44Å; A318-L379 WeakPolarHBondContact O-CA 3.41Å |
| 319 | S | 96.5 | Very high | 95.5 | Very high | 15 Ų | 15 | 15.6 Ų | 15.6 | 11% | 0.105 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -61.4 | -41.4 | 172.2 | -176.5 | 0 | 0 | 0 | 0 | 112.4 | L315 M316 G322 S323 E378 G382 | L315-S319 PolarHBondContact O-N 3.33Å; M316-S319 PolarHBondContact O-N 3.18Å; S319-G322 PolarHBondContact O-N 2.9Å; S319-S323 PolarHBondContact O-N 3.48Å; S319-E378 VanDerWaalsContact CA-O 3.25Å; S319-E378 WeakPolarHBondContact CA-O 3.37Å; S319-G382 WeakPolarHBondContact O-CA 3.4Å |
| 320 | M | 95.7 | Very high | 95.1 | Very high | 42 Ų | 42 | 17 Ų | 17 | 21% | 0.207 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -62.1 | -42.7 | 171.9 | -173.8 | 178.5 | 174.2 | 0 | 0 | 112.4 | C16 H182 M316 A317 A318 G322 S323 L324 | C16-M320 HydrophobicContact CB-CE 4.48Å; C16-M320 HydrophobicContact CB-SD 4.44Å; H182-M320 HydrophobicContact CB-CB 4.08Å; H182-M320 HydrophobicContact CB-CG 3.88Å; H182-M320 HydrophobicContact CB-SD 4.03Å; M316-M320 PolarHBondContact O-N 2.97Å; A317-M320 WeakPolarHBondContact O-CB 3.47Å; A317-M320 PolarHBondContact O-N 3.1Å; A318-M320 PolarHBondContact O-N 2.86Å; M320-G322 VanDerWaalsContact C-N 3.29Å; M320-G322 PolarHBondContact O-N 3.29Å; M320-S323 PolarHBondContact O-N 3.44Å; M320-S323 PolarHBondContact O-OG 3.25Å; M320-L324 HydrophobicContact CE-CD1 4.4Å; M320-L324 HydrophobicContact CG-CD1 4.3Å; M320-L324 VanDerWaalsContact O-CG 3.22Å; M320-L324 WeakPolarHBondContact O-CG 3.13Å; M320-L324 PolarHBondContact O-N 2.86Å |
| 321 | V | 96.9 | Very high | 94.5 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.006 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -56.8 | -46.1 | 172.7 | 169.2 | 0 | 0 | 0 | 0 | 110.3 | L12 L15 C16 L19 A317 A318 S323 L324 L325 L379 | L12-V321 HydrophobicContact CD2-CG2 4.31Å; L15-V321 HydrophobicContact CB-CG2 4.39Å; L15-V321 HydrophobicContact CD2-CB 4.48Å; L15-V321 HydrophobicContact CD2-CG1 3.69Å; L15-V321 HydrophobicContact CD2-CG2 3.89Å; L15-V321 HydrophobicContact CG-CG1 4.26Å; L15-V321 HydrophobicContact CG-CG2 4.07Å; C16-V321 WeakPolarHBondContact SG-CG2 3.45Å; L19-V321 HydrophobicContact CD1-CG1 3.79Å; A317-V321 WeakPolarHBondContact O-CG2 3.43Å; A317-V321 PolarHBondContact O-N 2.96Å; A318-V321 WeakPolarHBondContact O-CB 3.23Å; A318-V321 PolarHBondContact O-N 3.47Å; V321-S323 PolarHBondContact O-N 3.32Å; V321-L324 PolarHBondContact O-N 2.99Å; V321-L325 HydrophobicContact CG1-CD1 3.9Å; V321-L325 HydrophobicContact CG1-CG 4.27Å; V321-L325 WeakPolarHBondContact O-CB 3.34Å; V321-L325 VanDerWaalsContact O-CG 3.28Å; V321-L325 WeakPolarHBondContact O-CG 3.43Å; V321-L325 PolarHBondContact O-N 2.92Å; V321-L379 HydrophobicContact CB-CD1 4.3Å; V321-L379 HydrophobicContact CG1-CD1 3.68Å |
| 322 | G | 96.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -56.8 | -45.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | A318 S319 M320 L324 L325 Y326 G382 L383 | A318-G322 PolarHBondContact O-N 3.46Å; S319-G322 PolarHBondContact O-N 2.9Å; M320-G322 VanDerWaalsContact C-N 3.29Å; M320-G322 PolarHBondContact O-N 3.29Å; G322-L324 PolarHBondContact O-N 3.39Å; G322-L325 WeakPolarHBondContact O-CB 2.92Å; G322-L325 PolarHBondContact O-N 3.26Å; G322-Y326 PolarHBondContact O-N 3.36Å; G322-G382 VanDerWaalsContact C-C 3.45Å; G322-G382 CarbonylContact C-O 3.57Å; G322-L383 VanDerWaalsContact O-CD2 3.26Å; G322-L383 WeakPolarHBondContact O-CD2 3.48Å |
| 323 | S | 93.5 | Very high | 92.4 | Very high | 19 Ų | 19 | 29.9 Ų | 29.9 | 13% | 0.133 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -69.3 | -33.6 | 179.8 | 69.8 | 0 | 0 | 0 | 0 | 113 | H182 S319 M320 V321 Y326 R327 G382 | H182-S323 PolarHBondContact NE2-OG 2.89Å; S319-S323 PolarHBondContact O-N 3.48Å; M320-S323 PolarHBondContact O-N 3.44Å; M320-S323 PolarHBondContact O-OG 3.25Å; V321-S323 PolarHBondContact O-N 3.32Å; S323-Y326 PolarHBondContact O-N 2.92Å; S323-R327 PolarHBondContact O-N 3.49Å; S323-R327 VanDerWaalsContact O-N 3.13Å; S323-G382 VanDerWaalsContact CA-O 3.22Å; S323-G382 WeakPolarHBondContact CA-O 3.4Å; S323-G382 PolarHBondContact N-O 3.44Å |
| 324 | L | 93.3 | Very high | 91.5 | Very high | 8 Ų | 8 | 35.9 Ų | 35.9 | 4% | 0.042 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.6 | -41.2 | 171 | -64.1 | 171.1 | 0 | 0 | 0 | 111.7 | C16 L19 E20 M320 V321 G322 R327 L328 | C16-L324 HydrophobicContact CB-CD1 4.28Å; L19-L324 HydrophobicContact CB-CB 4.14Å; L19-L324 HydrophobicContact CB-CD1 4.02Å; L19-L324 HydrophobicContact CD1-CB 4.36Å; E20-L324 HydrophobicContact CB-CD2 4.45Å; E20-L324 WeakPolarHBondContact OE2-CD2 3.36Å; M320-L324 HydrophobicContact CE-CD1 4.4Å; M320-L324 HydrophobicContact CG-CD1 4.3Å; M320-L324 VanDerWaalsContact O-CG 3.22Å; M320-L324 WeakPolarHBondContact O-CG 3.13Å; M320-L324 PolarHBondContact O-N 2.86Å; V321-L324 PolarHBondContact O-N 2.99Å; G322-L324 PolarHBondContact O-N 3.39Å; L324-R327 PolarHBondContact O-N 2.88Å; L324-L328 WeakPolarHBondContact O-CG 3.44Å; L324-L328 PolarHBondContact O-N 3.34Å |
| 325 | L | 94.6 | Very high | 90.7 | Very high | 61 Ų | 61 | 41.3 Ų | 41.3 | 32% | 0.319 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64.8 | -40.2 | 175.2 | -71.9 | 174 | 0 | 0 | 0 | 111.6 | L19 V321 G322 R327 L328 A329 L379 L383 | L19-L325 HydrophobicContact CD1-CD2 4.08Å; L19-L325 HydrophobicContact CD1-CG 4.16Å; L19-L325 HydrophobicContact CD2-CD2 4.11Å; V321-L325 HydrophobicContact CG1-CD1 3.9Å; V321-L325 HydrophobicContact CG1-CG 4.27Å; V321-L325 WeakPolarHBondContact O-CB 3.34Å; V321-L325 VanDerWaalsContact O-CG 3.28Å; V321-L325 WeakPolarHBondContact O-CG 3.43Å; V321-L325 PolarHBondContact O-N 2.92Å; G322-L325 WeakPolarHBondContact O-CB 2.92Å; G322-L325 PolarHBondContact O-N 3.26Å; L325-R327 VanDerWaalsContact C-N 3.35Å; L325-R327 PolarHBondContact O-N 2.95Å; L325-L328 PolarHBondContact O-N 3Å; L325-A329 VanDerWaalsContact O-CB 3.24Å; L325-A329 WeakPolarHBondContact O-CB 3.38Å; L325-A329 PolarHBondContact O-N 2.91Å; L325-L379 HydrophobicContact CD1-CD1 4.29Å; L325-L379 HydrophobicContact CD1-CD2 4.41Å; L325-L383 HydrophobicContact CB-CD2 3.98Å |
| 326 | Y | 93.1 | Very high | 90.2 | Very high | 26 Ų | 26 | 44.8 Ų | 44.8 | 10% | 0.102 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -57.4 | -47.8 | 173.1 | 173.5 | -87.8 | 0 | 0 | 0 | 111.4 | G322 S323 L328 A329 T330 P338 V341 P386 A387 | G322-Y326 PolarHBondContact O-N 3.36Å; S323-Y326 PolarHBondContact O-N 2.92Å; Y326-L328 VanDerWaalsContact C-N 3.29Å; Y326-L328 PolarHBondContact O-N 3.37Å; Y326-A329 PolarHBondContact O-N 3.29Å; Y326-T330 HydrophobicContact CD1-CG2 4.48Å; Y326-T330 HydrophobicContact CD2-CG2 4.31Å; Y326-T330 HydrophobicContact CE1-CG2 4.08Å; Y326-T330 HydrophobicContact CE2-CG2 3.87Å; Y326-T330 WeakPolarHBondContact O-CB 3.46Å; Y326-T330 WeakPolarHBondContact O-CG2 3.5Å; Y326-T330 PolarHBondContact O-N 3.14Å; Y326-T330 PolarHBondContact O-OG1 3.44Å; Y326-P338 HydrophobicContact CE2-CB 4.38Å; Y326-V341 HydrophobicContact CD2-CB 4.27Å; Y326-V341 HydrophobicContact CD2-CG1 3.7Å; Y326-V341 HydrophobicContact CE2-CB 4.48Å; Y326-V341 HydrophobicContact CE2-CG1 4.37Å; Y326-P386 HydrophobicContact CD1-CB 3.37Å; Y326-P386 HydrophobicContact CD1-CG 4.13Å; Y326-P386 HydrophobicContact CD2-CB 3.96Å; Y326-P386 HydrophobicContact CE1-CB 3.45Å; Y326-P386 VanDerWaalsContact CE1-CB 3.45Å; Y326-P386 HydrophobicContact CE2-CB 4.06Å; Y326-P386 HydrophobicContact CG-CB 3.65Å; Y326-P386 HydrophobicContact CG-CG 4.16Å; Y326-P386 PolarHBondContact OH-O 2.92Å; Y326-A387 HydrophobicContact CD2-CB 4.18Å; Y326-A387 HydrophobicContact CE2-CB 3.68Å |
| 327 | R | 89.8 | Confident | 89.7 | Confident | 87 Ų | 87 | 47.2 Ų | 47.2 | 33% | 0.328 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62 | -37.7 | 179.1 | -174.6 | 179.2 | 62 | -169.4 | -1.1 | 112 | E20 S323 L324 L325 S331 | E20-R327 IonicContact OE2-CZ 3.29Å; E20-R327 IonicContact OE2-NH1 3.05Å; E20-R327 PolarHBondContact OE2-NH1 3.18Å; E20-R327 IonicContact OE2-NH2 3.42Å; E20-R327 PolarHBondContact OE2-NH2 2.9Å; S323-R327 PolarHBondContact O-N 3.49Å; S323-R327 VanDerWaalsContact O-N 3.13Å; L324-R327 PolarHBondContact O-N 2.88Å; L325-R327 VanDerWaalsContact C-N 3.35Å; L325-R327 PolarHBondContact O-N 2.95Å; R327-S331 PolarHBondContact O-N 3.37Å |
| 328 | L | 90.6 | Very high | 89.3 | Confident | 16 Ų | 16 | 47.3 Ų | 47.3 | 8% | 0.084 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -70 | -47.1 | 174.6 | -72.4 | 171.2 | 0 | 0 | 0 | 111.5 | L19 T22 A23 L26 L324 L325 Y326 T330 S331 Y334 | L19-L328 HydrophobicContact CD2-CD1 3.77Å; T22-L328 HydrophobicContact CG2-CD2 4.48Å; A23-L328 HydrophobicContact CB-CD2 3.76Å; A23-L328 HydrophobicContact CB-CG 4.21Å; L26-L328 HydrophobicContact CD1-CD2 3.75Å; L324-L328 WeakPolarHBondContact O-CG 3.44Å; L324-L328 PolarHBondContact O-N 3.34Å; L325-L328 PolarHBondContact O-N 3Å; Y326-L328 VanDerWaalsContact C-N 3.29Å; Y326-L328 PolarHBondContact O-N 3.37Å; L328-T330 VanDerWaalsContact C-N 3.29Å; L328-T330 PolarHBondContact O-N 3.22Å; L328-S331 VanDerWaalsContact O-CB 3.27Å; L328-S331 WeakPolarHBondContact O-CB 3.42Å; L328-S331 PolarHBondContact O-N 3.44Å; L328-S331 VanDerWaalsContact O-N 3.09Å; L328-S331 PolarHBondContact O-OG 3.34Å; L328-Y334 VanDerWaalsContact O-CD2 3.29Å; L328-Y334 WeakPolarHBondContact O-CD2 3.31Å |
| 329 | A | 90 | Very high | 88.8 | Confident | 17 Ų | 17 | 47.5 Ų | 47.5 | 14% | 0.14 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -57.7 | -41.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L325 Y326 S331 Y334 L336 V341 | L325-A329 VanDerWaalsContact O-CB 3.24Å; L325-A329 WeakPolarHBondContact O-CB 3.38Å; L325-A329 PolarHBondContact O-N 2.91Å; Y326-A329 PolarHBondContact O-N 3.29Å; A329-S331 VanDerWaalsContact C-N 3.32Å; A329-Y334 WeakPolarHBondContact O-CB 2.99Å; A329-L336 HydrophobicContact CB-CB 4.3Å; A329-L336 HydrophobicContact CB-CD1 3.7Å; A329-L336 WeakPolarHBondContact O-CB 3.39Å; A329-L336 PolarHBondContact O-N 3.19Å; A329-V341 HydrophobicContact CB-CG2 4.15Å |
| 330 | T | 88.1 | Confident | 88.6 | Confident | 29 Ų | 29 | 51.8 Ų | 51.8 | 18% | 0.178 | 25% | 0.249 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | -0.3 | -179.9 | 55.7 | 0 | 0 | 0 | 0 | 113.8 | Y326 L328 P338 | Y326-T330 HydrophobicContact CD1-CG2 4.48Å; Y326-T330 HydrophobicContact CD2-CG2 4.31Å; Y326-T330 HydrophobicContact CE1-CG2 4.08Å; Y326-T330 HydrophobicContact CE2-CG2 3.87Å; Y326-T330 WeakPolarHBondContact O-CB 3.46Å; Y326-T330 WeakPolarHBondContact O-CG2 3.5Å; Y326-T330 PolarHBondContact O-N 3.14Å; Y326-T330 PolarHBondContact O-OG1 3.44Å; L328-T330 VanDerWaalsContact C-N 3.29Å; L328-T330 PolarHBondContact O-N 3.22Å; T330-P338 HydrophobicContact CG2-CG 4.18Å |
| 331 | S | 84.8 | Confident | 88.5 | Confident | 19 Ų | 19 | 50 Ų | 50 | 13% | 0.133 | 24% | 0.24 | C | C | . | . | S | Bend | trans | -67.7 | 161.8 | 177.7 | 71.7 | 0 | 0 | 0 | 0 | 112 | R327 L328 A329 R333 Y334 H335 | R327-S331 PolarHBondContact O-N 3.37Å; L328-S331 VanDerWaalsContact O-CB 3.27Å; L328-S331 WeakPolarHBondContact O-CB 3.42Å; L328-S331 PolarHBondContact O-N 3.44Å; L328-S331 VanDerWaalsContact O-N 3.09Å; L328-S331 PolarHBondContact O-OG 3.34Å; A329-S331 VanDerWaalsContact C-N 3.32Å; S331-R333 PolarHBondContact O-N 2.99Å; S331-Y334 PolarHBondContact O-N 3.39Å; S331-Y334 VanDerWaalsContact O-N 3.14Å; S331-H335 PolarHBondContact O-N 2.88Å |
| 332 | T | 74.4 | Confident | 88.4 | Confident | 105 Ų | 105 | 50 Ų | 50 | 64% | 0.644 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -2.8 | 175.9 | 53 | 0 | 0 | 0 | 0 | 114.6 | H335 | T332-H335 PolarHBondContact O-CD2 3.28Å; T332-H335 PolarHBondContact O-NE2 2.94Å |
| 333 | R | 77.5 | Confident | 88.4 | Confident | 161 Ų | 161 | 51.4 Ų | 51.4 | 61% | 0.608 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -95.5 | -37.9 | 175.6 | -171.3 | 175 | -167.8 | -170.1 | 6 | 112.8 | S331 | S331-R333 PolarHBondContact O-N 2.99Š|
| 334 | Y | 78.4 | Confident | 88.5 | Confident | 126 Ų | 126 | 54.7 Ų | 54.7 | 49% | 0.494 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.6 | -21.9 | -171.6 | -66.3 | -76.7 | 0 | 0 | 0 | 112.8 | L328 A329 S331 L336 | L328-Y334 VanDerWaalsContact O-CD2 3.29Å; L328-Y334 WeakPolarHBondContact O-CD2 3.31Å; A329-Y334 WeakPolarHBondContact O-CB 2.99Å; S331-Y334 PolarHBondContact O-N 3.39Å; S331-Y334 VanDerWaalsContact O-N 3.14Å; Y334-L336 PolarHBondContact O-N 3.45Å |
| 335 | H | 81.1 | Confident | 88.7 | Confident | 115 Ų | 115 | 54.3 Ų | 54.3 | 53% | 0.532 | 26% | 0.263 | S | S | . | . | trans | 50.4 | 26.5 | 171.1 | -68 | -77.5 | 0 | 0 | 0 | 115.6 | S331 T332 Q337 | S331-H335 PolarHBondContact O-N 2.88Å; T332-H335 PolarHBondContact O-CD2 3.28Å; T332-H335 PolarHBondContact O-NE2 2.94Å; H335-Q337 PolarHBondContact O-N 2.95Å | ||
| 336 | L | 86.4 | Confident | 88.8 | Confident | 74 Ų | 74 | 51.4 Ų | 51.4 | 39% | 0.387 | 25% | 0.248 | S | C | . | . | trans | -70.6 | 133 | 176.7 | -70.6 | 164.5 | 0 | 0 | 0 | 109.5 | A329 Y334 V341 L472 | A329-L336 HydrophobicContact CB-CB 4.3Å; A329-L336 HydrophobicContact CB-CD1 3.7Å; A329-L336 WeakPolarHBondContact O-CB 3.39Å; A329-L336 PolarHBondContact O-N 3.19Å; Y334-L336 PolarHBondContact O-N 3.45Å; L336-V341 HydrophobicContact CB-CG2 4.2Å; L336-L472 WeakPolarHBondContact O-CD1 3.15Å | ||
| 337 | Q | 88.4 | Confident | 89 | Confident | 70 Ų | 70 | 53.3 Ų | 53.3 | 33% | 0.327 | 26% | 0.26 | S | S | . | . | trans | -70.8 | 138.7 | 178.2 | -66.6 | -176.5 | -5.9 | 0 | 0 | 109.7 | H335 G339 Q340 V341 | H335-Q337 PolarHBondContact O-N 2.95Å; Q337-G339 PolarHBondContact O-N 2.95Å; Q337-Q340 HydrophobicContact CB-CG 4.21Å; Q337-Q340 VanDerWaalsContact N-OE1 3.07Å; Q337-Q340 WeakPolarHBondContact O-CB 3.2Å; Q337-Q340 PolarHBondContact O-N 3.29Å; Q337-V341 PolarHBondContact O-N 3.08Å | ||
| 338 | P | 87.9 | Confident | 89.4 | Confident | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.006 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -54.1 | -30.3 | 178.1 | -30.6 | 38.7 | 0 | 0 | 0 | 113.1 | Y326 T330 V341 L342 F390 L472 | Y326-P338 HydrophobicContact CE2-CB 4.38Å; T330-P338 HydrophobicContact CG2-CG 4.18Å; P338-V341 PolarHBondContact O-N 3.06Å; P338-L342 PolarHBondContact O-N 3.31Å; P338-F390 HydrophobicContact CB-CB 4.45Å; P338-F390 HydrophobicContact CB-CD1 3.64Å; P338-F390 HydrophobicContact CB-CE1 4.16Å; P338-F390 HydrophobicContact CB-CG 4.15Å; P338-F390 HydrophobicContact CG-CD1 3.59Å; P338-F390 HydrophobicContact CG-CD2 4.47Å; P338-F390 HydrophobicContact CG-CE1 3.69Å; P338-F390 HydrophobicContact CG-CG 4.01Å; P338-F390 HydrophobicContact CG-CZ 4.18Å; P338-L472 HydrophobicContact CG-CD1 4.32Å; P338-L472 HydrophobicContact CG-CD2 4.38Å; P338-L472 HydrophobicContact CG-CG 4.21Å |
| 339 | G | 88.6 | Confident | 89.8 | Confident | 6 Ų | 6 | 50 Ų | 50 | 6% | 0.062 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.6 | -39.9 | 174 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q337 V341 L342 C343 F461 | Q337-G339 PolarHBondContact O-N 2.95Å; G339-V341 VanDerWaalsContact C-N 3.31Å; G339-V341 PolarHBondContact O-N 2.91Å; G339-L342 WeakPolarHBondContact O-CB 3.47Å; G339-L342 PolarHBondContact O-N 3.47Å; G339-C343 PolarHBondContact O-N 3.13Å; G339-F461 VanDerWaalsContact C-CZ 3.42Å; G339-F461 WeakPolarHBondContact O-CE2 3.46Å; G339-F461 VanDerWaalsContact O-CZ 3.28Å; G339-F461 WeakPolarHBondContact O-CZ 3.19Å |
| 340 | Q | 90.9 | Very high | 90.1 | Very high | 104 Ų | 104 | 51.1 Ų | 51.1 | 49% | 0.486 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -65.4 | -38.8 | 174.7 | -65.5 | 171.4 | -43 | 0 | 0 | 111 | Q337 L342 C343 L344 | Q337-Q340 HydrophobicContact CB-CG 4.21Å; Q337-Q340 VanDerWaalsContact N-OE1 3.07Å; Q337-Q340 WeakPolarHBondContact O-CB 3.2Å; Q337-Q340 PolarHBondContact O-N 3.29Å; Q340-L342 VanDerWaalsContact C-N 3.32Å; Q340-C343 WeakPolarHBondContact O-CB 3.28Å; Q340-C343 PolarHBondContact O-N 3.39Å; Q340-L344 PolarHBondContact O-N 3.3Å |
| 341 | V | 94.1 | Very high | 90.6 | Very high | 5 Ų | 5 | 54.9 Ų | 54.9 | 3% | 0.03 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.6 | -37 | 175.7 | -174.5 | 0 | 0 | 0 | 0 | 111.1 | Y326 A329 L336 Q337 P338 G339 L344 A345 L383 | Y326-V341 HydrophobicContact CD2-CB 4.27Å; Y326-V341 HydrophobicContact CD2-CG1 3.7Å; Y326-V341 HydrophobicContact CE2-CB 4.48Å; Y326-V341 HydrophobicContact CE2-CG1 4.37Å; A329-V341 HydrophobicContact CB-CG2 4.15Å; L336-V341 HydrophobicContact CB-CG2 4.2Å; Q337-V341 PolarHBondContact O-N 3.08Å; P338-V341 PolarHBondContact O-N 3.06Å; G339-V341 VanDerWaalsContact C-N 3.31Å; G339-V341 PolarHBondContact O-N 2.91Å; V341-L344 PolarHBondContact O-N 2.89Å; V341-A345 WeakPolarHBondContact O-CB 3.47Å; V341-A345 PolarHBondContact O-N 3.24Å; V341-L383 HydrophobicContact CG1-CB 4.09Å; V341-L383 HydrophobicContact CG1-CD2 3.91Å; V341-L383 HydrophobicContact CG1-CG 4.5Å |
| 342 | L | 95.1 | Very high | 91.2 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 172.9 | -179.4 | 60.1 | 0 | 0 | 0 | 112.2 | V282 P338 G339 Q340 L344 A345 I346 Y384 A387 V388 L391 V457 | V282-L342 HydrophobicContact CG1-CD2 4.45Å; P338-L342 PolarHBondContact O-N 3.31Å; G339-L342 WeakPolarHBondContact O-CB 3.47Å; G339-L342 PolarHBondContact O-N 3.47Å; Q340-L342 VanDerWaalsContact C-N 3.32Å; L342-L344 VanDerWaalsContact C-N 3.31Å; L342-L344 PolarHBondContact O-N 3Å; L342-A345 PolarHBondContact O-N 2.96Å; L342-I346 HydrophobicContact CD1-CD1 4.18Å; L342-I346 HydrophobicContact CD1-CG1 4.39Å; L342-I346 HydrophobicContact CG-CD1 4.2Å; L342-I346 WeakPolarHBondContact O-CG1 3.32Å; L342-I346 PolarHBondContact O-N 3.28Å; L342-Y384 HydrophobicContact CD1-CD2 3.54Å; L342-Y384 HydrophobicContact CD1-CE2 3.92Å; L342-A387 HydrophobicContact CB-CB 4.02Å; L342-A387 HydrophobicContact CD1-CB 4.5Å; L342-V388 HydrophobicContact CD1-CG2 3.62Å; L342-V388 HydrophobicContact CD2-CG2 4.25Å; L342-L391 HydrophobicContact CD2-CD1 3.54Å; L342-V457 HydrophobicContact CD2-CG1 4.29Å; L342-V457 HydrophobicContact CD2-CG2 3.86Å; L342-V457 HydrophobicContact CG-CG1 4.37Å; L342-V457 HydrophobicContact CG-CG2 4.1Å |
| 343 | C | 95.3 | Very high | 92.3 | Very high | 31 Ų | 31 | 49 Ų | 49 | 21% | 0.209 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -56.2 | -46.6 | 173.6 | -81.9 | 0 | 0 | 0 | 0 | 111.7 | G339 Q340 I346 L347 V457 F461 | G339-C343 PolarHBondContact O-N 3.13Å; Q340-C343 WeakPolarHBondContact O-CB 3.28Å; Q340-C343 PolarHBondContact O-N 3.39Å; C343-I346 PolarHBondContact O-N 2.94Å; C343-L347 WeakPolarHBondContact O-CB 3.33Å; C343-L347 PolarHBondContact O-N 3.45Å; C343-V457 WeakPolarHBondContact SG-CG1 3.38Å; C343-F461 VanDerWaalsContact SG-CE2 3.56Å |
| 344 | L | 96 | Very high | 93.1 | Very high | 88 Ų | 88 | 45.9 Ų | 45.9 | 46% | 0.461 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -60.4 | -46.1 | 178.7 | 178.2 | 62.9 | 0 | 0 | 0 | 111.1 | Q340 V341 L342 I346 L347 M348 | Q340-L344 PolarHBondContact O-N 3.3Å; V341-L344 PolarHBondContact O-N 2.89Å; L342-L344 VanDerWaalsContact C-N 3.31Å; L342-L344 PolarHBondContact O-N 3Å; L344-I346 PolarHBondContact O-N 3.34Å; L344-L347 PolarHBondContact O-N 3.44Å; L344-M348 HydrophobicContact CD1-CG 4.19Å; L344-M348 HydrophobicContact CD1-SD 4.09Å; L344-M348 HydrophobicContact CD2-SD 4.47Å; L344-M348 HydrophobicContact CG-CG 4.42Å; L344-M348 HydrophobicContact CG-SD 3.84Å; L344-M348 WeakPolarHBondContact O-CB 3.35Å; L344-M348 WeakPolarHBondContact O-CG 3.12Å; L344-M348 PolarHBondContact O-N 2.95Å |
| 345 | A | 97.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58 | -47.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | V341 L342 L347 M348 A349 A380 L383 | V341-A345 WeakPolarHBondContact O-CB 3.47Å; V341-A345 PolarHBondContact O-N 3.24Å; L342-A345 PolarHBondContact O-N 2.96Å; A345-L347 VanDerWaalsContact C-N 3.34Å; A345-L347 PolarHBondContact O-N 3.37Å; A345-M348 PolarHBondContact O-N 2.97Å; A345-A349 PolarHBondContact O-N 3Å; A345-A380 WeakPolarHBondContact O-CB 3.43Å; A345-L383 HydrophobicContact CB-CB 3.83Å |
| 346 | I | 97.7 | Very high | 94.6 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.5 | -39.2 | 178.9 | -63.4 | 170.9 | 0 | 0 | 0 | 111.3 | V282 F286 L342 C343 L344 A349 F350 M450 A453 L454 V457 | V282-I346 HydrophobicContact CG1-CD1 3.8Å; F286-I346 HydrophobicContact CD2-CG1 3.99Å; F286-I346 HydrophobicContact CE2-CG1 4.35Å; L342-I346 HydrophobicContact CD1-CD1 4.18Å; L342-I346 HydrophobicContact CD1-CG1 4.39Å; L342-I346 HydrophobicContact CG-CD1 4.2Å; L342-I346 WeakPolarHBondContact O-CG1 3.32Å; L342-I346 PolarHBondContact O-N 3.28Å; C343-I346 PolarHBondContact O-N 2.94Å; L344-I346 PolarHBondContact O-N 3.34Å; I346-A349 PolarHBondContact O-N 2.94Å; I346-F350 WeakPolarHBondContact O-CB 3.41Å; I346-F350 PolarHBondContact O-N 2.9Å; I346-M450 VanDerWaalsContact CG2-O 3.28Å; I346-M450 WeakPolarHBondContact CG2-O 3.45Å; I346-A453 HydrophobicContact CD1-CB 4.33Å; I346-A453 HydrophobicContact CG2-CB 4.07Å; I346-L454 HydrophobicContact CG2-CB 3.88Å; I346-L454 HydrophobicContact CG2-CD1 4.38Å; I346-V457 HydrophobicContact CD1-CB 4.15Å; I346-V457 HydrophobicContact CD1-CG2 3.26Å |
| 347 | L | 97.3 | Very high | 94.9 | Very high | 65 Ų | 65 | 34.3 Ų | 34.3 | 34% | 0.34 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -64.1 | -41.3 | 176.6 | -174.2 | 65 | 0 | 0 | 0 | 111.7 | C343 L344 A345 F350 F351 L454 | C343-L347 WeakPolarHBondContact O-CB 3.33Å; C343-L347 PolarHBondContact O-N 3.45Å; L344-L347 PolarHBondContact O-N 3.44Å; A345-L347 VanDerWaalsContact C-N 3.34Å; A345-L347 PolarHBondContact O-N 3.37Å; L347-F350 WeakPolarHBondContact O-CB 3.45Å; L347-F350 PolarHBondContact O-N 2.99Å; L347-F351 HydrophobicContact CD1-CD2 4.09Å; L347-F351 HydrophobicContact CD1-CE2 3.57Å; L347-F351 HydrophobicContact CD1-CZ 4.35Å; L347-F351 HydrophobicContact CD2-CE2 4.18Å; L347-F351 HydrophobicContact CG-CD2 3.92Å; L347-F351 HydrophobicContact CG-CE2 3.64Å; L347-F351 WeakPolarHBondContact O-CD2 3.24Å; L347-F351 PolarHBondContact O-N 3Å; L347-L454 HydrophobicContact CD1-CD2 4.26Å |
| 348 | M | 97.8 | Very high | 95.1 | Very high | 33 Ų | 33 | 36.1 Ų | 36.1 | 16% | 0.163 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64 | -42.3 | 175 | -68.7 | 172.1 | 74.7 | 0 | 0 | 111.8 | L344 A345 F351 S352 L376 L379 A380 L383 | L344-M348 HydrophobicContact CD1-CG 4.19Å; L344-M348 HydrophobicContact CD1-SD 4.09Å; L344-M348 HydrophobicContact CD2-SD 4.47Å; L344-M348 HydrophobicContact CG-CG 4.42Å; L344-M348 HydrophobicContact CG-SD 3.84Å; L344-M348 WeakPolarHBondContact O-CB 3.35Å; L344-M348 WeakPolarHBondContact O-CG 3.12Å; L344-M348 PolarHBondContact O-N 2.95Å; A345-M348 PolarHBondContact O-N 2.97Å; M348-F351 PolarHBondContact O-N 2.6Å; M348-S352 WeakPolarHBondContact O-CB 3.41Å; M348-S352 PolarHBondContact O-N 2.85Å; M348-L376 HydrophobicContact CB-CD1 4.34Å; M348-L376 HydrophobicContact CE-CD1 3.49Å; M348-L376 VanDerWaalsContact CE-CD1 3.49Å; M348-L379 HydrophobicContact CE-CD2 3.17Å; M348-L379 HydrophobicContact SD-CD2 4.37Å; M348-A380 HydrophobicContact CB-CB 3.8Å; M348-L383 HydrophobicContact CE-CD1 4.42Å; M348-L383 HydrophobicContact SD-CD1 3.7Å |
| 349 | A | 98 | Very high | 95.3 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.5 | -42.9 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | F286 A345 I346 F351 S352 F353 L377 A380 M450 | F286-A349 HydrophobicContact CE2-CB 3.7Å; F286-A349 HydrophobicContact CZ-CB 4.29Å; A345-A349 PolarHBondContact O-N 3Å; I346-A349 PolarHBondContact O-N 2.94Å; A349-F351 PolarHBondContact O-N 3.22Å; A349-S352 WeakPolarHBondContact O-CB 3.28Å; A349-S352 PolarHBondContact O-N 3.45Å; A349-F353 WeakPolarHBondContact O-CD2 3.42Å; A349-F353 PolarHBondContact O-N 3.33Å; A349-L377 HydrophobicContact CB-CD1 3.81Å; A349-A380 HydrophobicContact CB-CB 4.3Å; A349-M450 HydrophobicContact CB-CG 4.16Å; A349-M450 HydrophobicContact CB-SD 3.78Å |
| 350 | F | 97.8 | Very high | 95.4 | Very high | 42 Ų | 42 | 36.7 Ų | 36.7 | 18% | 0.184 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -55.8 | -52 | 173.7 | 169.6 | -96.5 | 0 | 0 | 0 | 111.6 | I346 L347 S352 F353 F354 A447 M450 L451 | I346-F350 WeakPolarHBondContact O-CB 3.41Å; I346-F350 PolarHBondContact O-N 2.9Å; L347-F350 WeakPolarHBondContact O-CB 3.45Å; L347-F350 PolarHBondContact O-N 2.99Å; F350-S352 VanDerWaalsContact C-N 3.3Å; F350-S352 PolarHBondContact O-N 3.15Å; F350-F353 PolarHBondContact O-N 3.29Å; F350-F354 VanDerWaalsContact O-CB 3.29Å; F350-F354 WeakPolarHBondContact O-CB 3.32Å; F350-F354 PolarHBondContact O-N 3.27Å; F350-A447 HydrophobicContact CD2-CB 4.27Å; F350-A447 VanDerWaalsContact CD2-O 3.32Å; F350-A447 WeakPolarHBondContact CD2-O 3.37Å; F350-A447 HydrophobicContact CE2-CB 4.21Å; F350-M450 HydrophobicContact CB-CB 3.89Å; F350-M450 HydrophobicContact CD2-CB 4.41Å; F350-L451 HydrophobicContact CD2-CB 4.3Å; F350-L451 HydrophobicContact CE2-CB 4.31Å |
| 351 | F | 97.7 | Very high | 95.2 | Very high | 107 Ų | 107 | 33.8 Ų | 33.8 | 47% | 0.469 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -64.2 | -35.4 | 179.8 | -78.8 | -62.2 | 0 | 0 | 0 | 112.7 | L347 M348 A349 F354 M355 | L347-F351 HydrophobicContact CD1-CD2 4.09Å; L347-F351 HydrophobicContact CD1-CE2 3.57Å; L347-F351 HydrophobicContact CD1-CZ 4.35Å; L347-F351 HydrophobicContact CD2-CE2 4.18Å; L347-F351 HydrophobicContact CG-CD2 3.92Å; L347-F351 HydrophobicContact CG-CE2 3.64Å; L347-F351 WeakPolarHBondContact O-CD2 3.24Å; L347-F351 PolarHBondContact O-N 3Å; M348-F351 PolarHBondContact O-N 2.6Å; A349-F351 PolarHBondContact O-N 3.22Å; F351-F354 PolarHBondContact O-N 3.02Å; F351-M355 VanDerWaalsContact O-CB 3.24Å; F351-M355 WeakPolarHBondContact O-CB 3.48Å; F351-M355 PolarHBondContact O-N 3.49Å |
| 352 | S | 97.9 | Very high | 94.7 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.6 | -53.5 | 173 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | M348 A349 F350 F354 M355 L356 A373 | M348-S352 WeakPolarHBondContact O-CB 3.41Å; M348-S352 PolarHBondContact O-N 2.85Å; A349-S352 WeakPolarHBondContact O-CB 3.28Å; A349-S352 PolarHBondContact O-N 3.45Å; F350-S352 VanDerWaalsContact C-N 3.3Å; F350-S352 PolarHBondContact O-N 3.15Å; S352-F354 VanDerWaalsContact C-N 3.34Å; S352-F354 PolarHBondContact O-N 2.89Å; S352-M355 WeakPolarHBondContact O-CB 3.44Å; S352-M355 PolarHBondContact O-N 2.9Å; S352-L356 WeakPolarHBondContact O-CG 3.41Å; S352-L356 PolarHBondContact O-N 3.37Å; S352-A373 WeakPolarHBondContact CB-O 3.45Å; S352-A373 VanDerWaalsContact OG-C 3.27Å; S352-A373 PolarHBondContact OG-O 3.01Å |
| 353 | F | 96.6 | Very high | 94 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.7 | -37.7 | 178.4 | -75.5 | -65.1 | 0 | 0 | 0 | 113.1 | V289 F293 A349 F350 L356 T357 L377 F443 C446 A447 M450 | V289-F353 HydrophobicContact CB-CE2 4.47Å; V289-F353 HydrophobicContact CG1-CD2 3.83Å; V289-F353 HydrophobicContact CG1-CE1 4.04Å; V289-F353 HydrophobicContact CG1-CE2 2.99Å; V289-F353 HydrophobicContact CG1-CZ 3.11Å; F293-F353 HydrophobicContact CB-CE1 4.47Å; F293-F353 HydrophobicContact CB-CZ 4.17Å; A349-F353 WeakPolarHBondContact O-CD2 3.42Å; A349-F353 PolarHBondContact O-N 3.33Å; F350-F353 PolarHBondContact O-N 3.29Å; F353-L356 HydrophobicContact CD1-CD1 3.88Å; F353-L356 HydrophobicContact CE1-CD1 4.22Å; F353-L356 WeakPolarHBondContact O-CB 3.45Å; F353-L356 PolarHBondContact O-N 3.14Å; F353-T357 WeakPolarHBondContact O-CG2 3.32Å; F353-T357 PolarHBondContact O-N 3.35Å; F353-L377 HydrophobicContact CD2-CD1 4.33Å; F353-L377 HydrophobicContact CE1-CD2 4.2Å; F353-L377 HydrophobicContact CE2-CD1 3.47Å; F353-L377 VanDerWaalsContact CE2-CD1 3.47Å; F353-L377 HydrophobicContact CE2-CD2 3.9Å; F353-L377 HydrophobicContact CE2-CG 4.33Å; F353-L377 HydrophobicContact CZ-CD1 3.95Å; F353-L377 HydrophobicContact CZ-CD2 3.46Å; F353-L377 VanDerWaalsContact CZ-CD2 3.46Å; F353-L377 HydrophobicContact CZ-CG 4.36Å; F353-F443 AromaticContact CD1-CD1 3.67Å; F353-F443 HydrophobicContact CD1-CD1 3.67Å; F353-F443 HydrophobicContact CD1-CE1 4.33Å; F353-F443 AromaticContact CE1-CD1 3.92Å; F353-F443 HydrophobicContact CE1-CD1 3.92Å; F353-F443 HydrophobicContact CE1-CE1 4.2Å; F353-C446 HydrophobicContact CB-CB 4.25Å; F353-C446 HydrophobicContact CD1-CB 3.54Å; F353-C446 HydrophobicContact CD2-CB 4.05Å; F353-C446 HydrophobicContact CE1-CB 3.83Å; F353-C446 HydrophobicContact CE2-CB 4.34Å; F353-C446 HydrophobicContact CG-CB 3.66Å; F353-C446 HydrophobicContact CZ-CB 4.23Å; F353-A447 HydrophobicContact CB-CB 4Å; F353-M450 HydrophobicContact CD2-CG 4Å; F353-M450 HydrophobicContact CE2-CG 4.48Å |
| 354 | F | 95.3 | Very high | 93.6 | Very high | 96 Ų | 96 | 44.7 Ų | 44.7 | 42% | 0.421 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.1 | -47.9 | 174.5 | -175.8 | -107.2 | 0 | 0 | 0 | 111.1 | F350 F351 S352 L356 T357 F358 | F350-F354 VanDerWaalsContact O-CB 3.29Å; F350-F354 WeakPolarHBondContact O-CB 3.32Å; F350-F354 PolarHBondContact O-N 3.27Å; F351-F354 PolarHBondContact O-N 3.02Å; S352-F354 VanDerWaalsContact C-N 3.34Å; S352-F354 PolarHBondContact O-N 2.89Å; F354-L356 VanDerWaalsContact C-N 3.28Å; F354-L356 PolarHBondContact O-N 2.93Å; F354-T357 WeakPolarHBondContact O-CB 3.1Å; F354-T357 PolarHBondContact O-N 2.92Å; F354-T357 PolarHBondContact O-OG1 2.79Å; F354-F358 AromaticContact CD1-CE2 3.99Å; F354-F358 HydrophobicContact CD1-CE2 3.99Å; F354-F358 HydrophobicContact CD2-CE2 4.26Å; F354-F358 HydrophobicContact CE1-CD2 4.45Å; F354-F358 AromaticContact CE1-CE2 3.55Å; F354-F358 HydrophobicContact CE1-CE2 3.55Å; F354-F358 HydrophobicContact CE1-CZ 4.26Å; F354-F358 AromaticContact CE2-CE2 3.84Å; F354-F358 HydrophobicContact CE2-CE2 3.84Å; F354-F358 HydrophobicContact CE2-CZ 4.24Å; F354-F358 HydrophobicContact CG-CE2 4.34Å; F354-F358 AromaticContact CZ-CE2 3.47Å; F354-F358 HydrophobicContact CZ-CE2 3.47Å; F354-F358 VanDerWaalsContact CZ-CE2 3.47Å; F354-F358 AromaticContact CZ-CZ 3.82Å; F354-F358 HydrophobicContact CZ-CZ 3.82Å; F354-F358 VanDerWaalsContact O-CD2 3.25Å; F354-F358 WeakPolarHBondContact O-CD2 3.28Å |
| 355 | M | 95.4 | Very high | 93.1 | Very high | 56 Ų | 56 | 44 Ų | 44 | 28% | 0.276 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.3 | -37.8 | 175.2 | -175.4 | -176.8 | 148.6 | 0 | 0 | 112 | F351 S352 T357 F358 S359 D369 L372 A373 | F351-M355 VanDerWaalsContact O-CB 3.24Å; F351-M355 WeakPolarHBondContact O-CB 3.48Å; F351-M355 PolarHBondContact O-N 3.49Å; S352-M355 WeakPolarHBondContact O-CB 3.44Å; S352-M355 PolarHBondContact O-N 2.9Å; M355-T357 VanDerWaalsContact C-N 3.29Å; M355-T357 PolarHBondContact O-N 3.39Å; M355-F358 PolarHBondContact O-N 3.35Å; M355-F358 VanDerWaalsContact O-N 3.13Å; M355-S359 PolarHBondContact O-N 2.96Å; M355-D369 VanDerWaalsContact CE-C 3.48Å; M355-D369 HydrophobicContact CE-CB 3.64Å; M355-D369 WeakPolarHBondContact CE-O 3.37Å; M355-L372 HydrophobicContact CE-CB 4.28Å; M355-L372 HydrophobicContact CE-CD2 4.36Å; M355-A373 HydrophobicContact CB-CB 4.42Å; M355-A373 HydrophobicContact CE-CB 4.04Å; M355-A373 HydrophobicContact CG-CB 4.37Å; M355-A373 HydrophobicContact SD-CB 3.99Å |
| 356 | L | 94.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.6 | -38.3 | 176.7 | -75 | 163 | 0 | 0 | 0 | 112.3 | S352 F353 F354 F358 S359 T360 A373 F374 F443 | S352-L356 WeakPolarHBondContact O-CG 3.41Å; S352-L356 PolarHBondContact O-N 3.37Å; F353-L356 HydrophobicContact CD1-CD1 3.88Å; F353-L356 HydrophobicContact CE1-CD1 4.22Å; F353-L356 WeakPolarHBondContact O-CB 3.45Å; F353-L356 PolarHBondContact O-N 3.14Å; F354-L356 VanDerWaalsContact C-N 3.28Å; F354-L356 PolarHBondContact O-N 2.93Å; L356-F358 PolarHBondContact O-N 3.12Å; L356-F358 VanDerWaalsContact O-N 3.12Å; L356-S359 WeakPolarHBondContact CA-OG 3.11Å; L356-S359 PolarHBondContact O-N 3.19Å; L356-S359 PolarHBondContact O-OG 3.39Å; L356-T360 PolarHBondContact O-N 2.93Å; L356-T360 PolarHBondContact O-OG1 3.1Å; L356-A373 HydrophobicContact CD1-CB 4.3Å; L356-A373 HydrophobicContact CD2-CB 3.89Å; L356-A373 HydrophobicContact CG-CB 3.7Å; L356-F374 HydrophobicContact CD1-CD1 3.77Å; L356-F374 HydrophobicContact CD1-CE1 3.48Å; L356-F374 VanDerWaalsContact CD1-CE1 3.48Å; L356-F374 HydrophobicContact CD2-CD1 3.88Å; L356-F374 HydrophobicContact CD2-CE1 3.35Å; L356-F374 HydrophobicContact CD2-CZ 3.79Å; L356-F374 HydrophobicContact CG-CD1 4.42Å; L356-F374 HydrophobicContact CG-CE1 4.07Å; L356-F443 HydrophobicContact CB-CB 4.06Å; L356-F443 HydrophobicContact CB-CD1 4.11Å; L356-F443 HydrophobicContact CB-CD2 3.69Å; L356-F443 HydrophobicContact CB-CE1 4.46Å; L356-F443 HydrophobicContact CB-CE2 4.08Å; L356-F443 HydrophobicContact CB-CG 3.7Å; L356-F443 HydrophobicContact CB-CZ 4.44Å; L356-F443 HydrophobicContact CD1-CD1 3.96Å; L356-F443 HydrophobicContact CD1-CE1 3.82Å; L356-F443 HydrophobicContact CD1-CG 4.42Å; L356-F443 HydrophobicContact CD1-CZ 4.18Å; L356-F443 HydrophobicContact CD2-CE2 4.31Å; L356-F443 HydrophobicContact CD2-CZ 4.31Å |
| 357 | T | 92.4 | Very high | 92.7 | Very high | 17 Ų | 17 | 51.4 Ų | 51.4 | 10% | 0.104 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58.5 | -26.7 | 177.2 | 70.7 | 0 | 0 | 0 | 0 | 114.3 | F353 F354 M355 R440 F443 | F353-T357 WeakPolarHBondContact O-CG2 3.32Å; F353-T357 PolarHBondContact O-N 3.35Å; F354-T357 WeakPolarHBondContact O-CB 3.1Å; F354-T357 PolarHBondContact O-N 2.92Å; F354-T357 PolarHBondContact O-OG1 2.79Å; M355-T357 VanDerWaalsContact C-N 3.29Å; M355-T357 PolarHBondContact O-N 3.39Å; T357-R440 PolarHBondContact O-NE 2.65Å; T357-F443 HydrophobicContact CG2-CB 3.96Å |
| 358 | F | 92.1 | Very high | 92.6 | Very high | 108 Ų | 108 | 52.8 Ų | 52.8 | 47% | 0.474 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -93.7 | -36.3 | 176.6 | -61.7 | -81.6 | 0 | 0 | 0 | 112.2 | F354 M355 L356 T360 V361 | F354-F358 AromaticContact CD1-CE2 3.99Å; F354-F358 HydrophobicContact CD1-CE2 3.99Å; F354-F358 HydrophobicContact CD2-CE2 4.26Å; F354-F358 HydrophobicContact CE1-CD2 4.45Å; F354-F358 AromaticContact CE1-CE2 3.55Å; F354-F358 HydrophobicContact CE1-CE2 3.55Å; F354-F358 HydrophobicContact CE1-CZ 4.26Å; F354-F358 AromaticContact CE2-CE2 3.84Å; F354-F358 HydrophobicContact CE2-CE2 3.84Å; F354-F358 HydrophobicContact CE2-CZ 4.24Å; F354-F358 HydrophobicContact CG-CE2 4.34Å; F354-F358 AromaticContact CZ-CE2 3.47Å; F354-F358 HydrophobicContact CZ-CE2 3.47Å; F354-F358 VanDerWaalsContact CZ-CE2 3.47Å; F354-F358 AromaticContact CZ-CZ 3.82Å; F354-F358 HydrophobicContact CZ-CZ 3.82Å; F354-F358 VanDerWaalsContact O-CD2 3.25Å; F354-F358 WeakPolarHBondContact O-CD2 3.28Å; M355-F358 PolarHBondContact O-N 3.35Å; M355-F358 VanDerWaalsContact O-N 3.13Å; L356-F358 PolarHBondContact O-N 3.12Å; L356-F358 VanDerWaalsContact O-N 3.12Å; F358-T360 VanDerWaalsContact C-N 3.26Å; F358-T360 PolarHBondContact O-N 3.27Å; F358-V361 VanDerWaalsContact O-CG2 3.23Å; F358-V361 WeakPolarHBondContact O-CG2 3.46Å |
| 359 | S | 93.1 | Very high | 92.5 | Very high | 3 Ų | 3 | 54.1 Ų | 54.1 | 2% | 0.021 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -69.9 | -24.4 | -179.6 | 73.4 | 0 | 0 | 0 | 0 | 113.1 | M355 L356 R366 S370 | M355-S359 PolarHBondContact O-N 2.96Å; L356-S359 WeakPolarHBondContact CA-OG 3.11Å; L356-S359 PolarHBondContact O-N 3.19Å; L356-S359 PolarHBondContact O-OG 3.39Å; S359-R366 PolarHBondContact O-N 2.94Å; S359-S370 WeakPolarHBondContact CB-OG 3.05Å; S359-S370 PolarHBondContact OG-OG 2.97Å |
| 360 | T | 89.8 | Confident | 92.4 | Very high | 16 Ų | 16 | 54.2 Ų | 54.2 | 10% | 0.098 | 28% | 0.284 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.9 | 30.9 | -178.6 | 69.9 | 0 | 0 | 0 | 0 | 113 | V300 L356 F358 F443 | V300-T360 HydrophobicContact CG1-CG2 3.97Å; V300-T360 HydrophobicContact CG2-CG2 4.26Å; L356-T360 PolarHBondContact O-N 2.93Å; L356-T360 PolarHBondContact O-OG1 3.1Å; F358-T360 VanDerWaalsContact C-N 3.26Å; F358-T360 PolarHBondContact O-N 3.27Å; T360-F443 HydrophobicContact CG2-CD2 4.2Å; T360-F443 HydrophobicContact CG2-CE2 3.75Å |
| 361 | V | 88 | Confident | 92.4 | Very high | 43 Ų | 43 | 52.4 Ų | 52.4 | 26% | 0.261 | 28% | 0.276 | S | S | . | . | trans | -64.1 | 130.5 | 176.6 | 168.6 | 0 | 0 | 0 | 0 | 109.9 | F358 G363 Q364 | F358-V361 VanDerWaalsContact O-CG2 3.23Å; F358-V361 WeakPolarHBondContact O-CG2 3.46Å; V361-G363 PolarHBondContact O-N 3.16Å; V361-Q364 CarbonylContact O-C 3.45Å; V361-Q364 PolarHBondContact O-N 3.34Å; V361-Q364 VanDerWaalsContact O-N 3.14Å | ||
| 362 | P | 82.4 | Confident | 92.4 | Very high | 50 Ų | 50 | 52.2 Ų | 52.2 | 33% | 0.325 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.5 | 133.1 | 176.2 | -25.5 | 33.5 | 0 | 0 | 0 | 111.7 | Q364 | P362-Q364 PolarHBondContact O-N 3.49Š|
| 363 | G | 80.6 | Confident | 92.4 | Very high | 79 Ų | 79 | 52.2 Ų | 52.2 | 81% | 0.814 | 28% | 0.279 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80.2 | -12.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | V361 | V361-G363 PolarHBondContact O-N 3.16Š|
| 364 | Q | 86.4 | Confident | 92.4 | Very high | 136 Ų | 136 | 52.2 Ų | 52.2 | 64% | 0.636 | 28% | 0.279 | S | S | * | . | trans | -139.4 | 57 | 175.5 | -62 | -174 | 8.2 | 0 | 0 | 112.8 | V361 P362 | V361-Q364 CarbonylContact O-C 3.45Å; V361-Q364 PolarHBondContact O-N 3.34Å; V361-Q364 VanDerWaalsContact O-N 3.14Å; P362-Q364 PolarHBondContact O-N 3.49Å | ||
| 365 | P | 87.2 | Confident | 92.6 | Very high | 73 Ų | 73 | 48.8 Ų | 48.8 | 47% | 0.474 | 27% | 0.265 | S | S | . | . | trans | -68.1 | 136.4 | -179.4 | 29.4 | -34.9 | 0 | 0 | 0 | 111.7 | P367 | P365-P367 VanDerWaalsContact O-CD 3.31Å; P365-P367 WeakPolarHBondContact O-CD 3.28Å | ||
| 366 | R | 93.3 | Very high | 92.7 | Very high | 139 Ų | 139 | 48.8 Ų | 48.8 | 53% | 0.525 | 27% | 0.266 | S | S | . | . | trans | -114.8 | 80.9 | 176.9 | -61.3 | -175.8 | -171.5 | 162.9 | 3 | 110 | S359 H368 D369 S370 | S359-R366 PolarHBondContact O-N 2.94Å; R366-H368 PolarHBondContact O-N 3.47Å; R366-D369 HydrophobicContact CB-CB 4.02Å; R366-D369 WeakPolarHBondContact CB-OD2 3.48Å; R366-D369 WeakPolarHBondContact CD-OD2 3.44Å; R366-D369 WeakPolarHBondContact O-CB 3.4Å; R366-D369 PolarHBondContact O-N 2.9Å; R366-D369 VanDerWaalsContact O-N 3.08Å; R366-S370 PolarHBondContact O-N 3.19Å; R366-S370 PolarHBondContact O-OG 3.42Å | ||
| 367 | P | 93.2 | Very high | 92.9 | Very high | 17 Ų | 17 | 49 Ų | 49 | 11% | 0.11 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.1 | -25.1 | -170.5 | 26.9 | -37 | 0 | 0 | 0 | 114 | M1 L301 H304 P365 F371 | M1-P367 HydrophobicContact CE-CB 4.22Å; M1-P367 HydrophobicContact CG-CB 4.17Å; M1-P367 HydrophobicContact CG-CG 4.27Å; M1-P367 HydrophobicContact SD-CB 3.72Å; M1-P367 HydrophobicContact SD-CG 3.99Å; L301-P367 HydrophobicContact CD2-CB 4.41Å; H304-P367 HydrophobicContact CB-CB 4.33Å; H304-P367 HydrophobicContact CB-CG 4.41Å; H304-P367 VanDerWaalsContact CD2-CB 3.47Å; H304-P367 WeakPolarHBondContact CD2-CB 3.36Å; P365-P367 VanDerWaalsContact O-CD 3.31Å; P365-P367 WeakPolarHBondContact O-CD 3.28Å; P367-F371 WeakPolarHBondContact O-CB 3.34Å; P367-F371 PolarHBondContact O-N 2.72Å |
| 368 | H | 94.7 | Very high | 93.1 | Very high | 93 Ų | 93 | 48.8 Ų | 48.8 | 43% | 0.431 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -66.9 | -43.1 | 174 | -66.3 | -81.4 | 0 | 0 | 0 | 111.8 | T4 R366 F371 L372 | T4-H368 PolarHBondContact OG1-CE1 2.9Å; T4-H368 PolarHBondContact OG1-ND1 3.39Å; R366-H368 PolarHBondContact O-N 3.47Å; H368-F371 PolarHBondContact O-N 3.08Å; H368-L372 PolarHBondContact O-N 3.46Å |
| 369 | D | 95.7 | Very high | 93.4 | Very high | 61 Ų | 61 | 45.3 Ų | 45.3 | 33% | 0.326 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -65.8 | -47.2 | 175.3 | -63.9 | -9.9 | 0 | 0 | 0 | 109.4 | M355 R366 F371 L372 A373 | M355-D369 VanDerWaalsContact CE-C 3.48Å; M355-D369 HydrophobicContact CE-CB 3.64Å; M355-D369 WeakPolarHBondContact CE-O 3.37Å; R366-D369 HydrophobicContact CB-CB 4.02Å; R366-D369 WeakPolarHBondContact CB-OD2 3.48Å; R366-D369 WeakPolarHBondContact CD-OD2 3.44Å; R366-D369 WeakPolarHBondContact O-CB 3.4Å; R366-D369 PolarHBondContact O-N 2.9Å; R366-D369 VanDerWaalsContact O-N 3.08Å; D369-F371 VanDerWaalsContact C-N 3.28Å; D369-F371 PolarHBondContact O-N 3.14Å; D369-L372 PolarHBondContact O-N 2.84Å; D369-L372 VanDerWaalsContact O-N 3.13Å; D369-A373 PolarHBondContact O-N 3.07Å |
| 370 | S | 96.2 | Very high | 93.6 | Very high | 2 Ų | 2 | 45.1 Ų | 45.1 | 1% | 0.014 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.4 | -42 | 177.4 | -50.3 | 0 | 0 | 0 | 0 | 112.3 | S359 R366 A373 F374 | S359-S370 WeakPolarHBondContact CB-OG 3.05Å; S359-S370 PolarHBondContact OG-OG 2.97Å; R366-S370 PolarHBondContact O-N 3.19Å; R366-S370 PolarHBondContact O-OG 3.42Å; S370-A373 PolarHBondContact O-N 3.25Å; S370-F374 VanDerWaalsContact O-CD2 3.31Å; S370-F374 WeakPolarHBondContact O-CD2 3.45Å; S370-F374 WeakPolarHBondContact O-CG 3.39Å; S370-F374 PolarHBondContact O-N 3.5Å |
| 371 | F | 97.4 | Very high | 94 | Very high | 5 Ų | 5 | 44.4 Ų | 44.4 | 2% | 0.022 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.8 | -43.4 | 176.2 | 179.4 | -124.7 | 0 | 0 | 0 | 112.4 | M1 T4 A8 L301 V311 C314 P367 H368 D369 A373 F374 L375 | M1-F371 HydrophobicContact CE-CB 3.94Å; M1-F371 HydrophobicContact CE-CG 4.35Å; T4-F371 HydrophobicContact CG2-CD1 4.18Å; T4-F371 HydrophobicContact CG2-CE1 4.35Å; A8-F371 HydrophobicContact CB-CE1 3.79Å; A8-F371 HydrophobicContact CB-CZ 4.07Å; L301-F371 HydrophobicContact CD1-CD2 4.16Å; L301-F371 HydrophobicContact CD2-CB 4.33Å; V311-F371 HydrophobicContact CB-CE2 4.45Å; V311-F371 HydrophobicContact CG1-CD2 4.21Å; V311-F371 HydrophobicContact CG1-CE2 3.93Å; V311-F371 HydrophobicContact CG2-CE2 4.33Å; C314-F371 HydrophobicContact CB-CE2 4.14Å; C314-F371 HydrophobicContact CB-CZ 3.82Å; P367-F371 WeakPolarHBondContact O-CB 3.34Å; P367-F371 PolarHBondContact O-N 2.72Å; H368-F371 PolarHBondContact O-N 3.08Å; D369-F371 VanDerWaalsContact C-N 3.28Å; D369-F371 PolarHBondContact O-N 3.14Å; F371-A373 VanDerWaalsContact C-N 3.32Å; F371-A373 PolarHBondContact O-N 3.44Å; F371-F374 PolarHBondContact O-N 2.89Å; F371-L375 HydrophobicContact CD1-CD1 4.38Å; F371-L375 HydrophobicContact CE1-CD1 3.94Å; F371-L375 HydrophobicContact CE2-CD1 4.43Å; F371-L375 HydrophobicContact CE2-CD2 4.01Å; F371-L375 HydrophobicContact CE2-CG 4.18Å; F371-L375 HydrophobicContact CZ-CD1 3.97Å; F371-L375 HydrophobicContact CZ-CD2 4.08Å; F371-L375 HydrophobicContact CZ-CG 4.2Å; F371-L375 WeakPolarHBondContact O-CG 3.24Å; F371-L375 PolarHBondContact O-N 3.17Å |
| 372 | L | 97.4 | Very high | 94.4 | Very high | 102 Ų | 102 | 42.5 Ų | 42.5 | 53% | 0.534 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61 | -41.5 | 174.9 | 178.6 | 63.5 | 0 | 0 | 0 | 111.7 | M355 H368 D369 F374 L375 L376 | M355-L372 HydrophobicContact CE-CB 4.28Å; M355-L372 HydrophobicContact CE-CD2 4.36Å; H368-L372 PolarHBondContact O-N 3.46Å; D369-L372 PolarHBondContact O-N 2.84Å; D369-L372 VanDerWaalsContact O-N 3.13Å; L372-F374 VanDerWaalsContact C-N 3.33Å; L372-F374 PolarHBondContact O-N 3.42Å; L372-L375 PolarHBondContact O-N 3.29Å; L372-L376 PolarHBondContact O-N 3.02Å |
| 373 | A | 97.8 | Very high | 95 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.7 | -41.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | S352 M355 L356 D369 S370 F371 L375 L376 L377 | S352-A373 WeakPolarHBondContact CB-O 3.45Å; S352-A373 VanDerWaalsContact OG-C 3.27Å; S352-A373 PolarHBondContact OG-O 3.01Å; M355-A373 HydrophobicContact CB-CB 4.42Å; M355-A373 HydrophobicContact CE-CB 4.04Å; M355-A373 HydrophobicContact CG-CB 4.37Å; M355-A373 HydrophobicContact SD-CB 3.99Å; L356-A373 HydrophobicContact CD1-CB 4.3Å; L356-A373 HydrophobicContact CD2-CB 3.89Å; L356-A373 HydrophobicContact CG-CB 3.7Å; D369-A373 PolarHBondContact O-N 3.07Å; S370-A373 PolarHBondContact O-N 3.25Å; F371-A373 VanDerWaalsContact C-N 3.32Å; F371-A373 PolarHBondContact O-N 3.44Å; A373-L375 PolarHBondContact O-N 3.43Å; A373-L376 WeakPolarHBondContact O-CB 3.35Å; A373-L376 PolarHBondContact O-N 3.39Å; A373-L377 PolarHBondContact O-N 3.3Å |
| 374 | F | 98 | Very high | 95.8 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.2 | -38.5 | 175.7 | -59.9 | -31.1 | 0 | 0 | 0 | 113 | F293 W297 V300 L301 L315 L356 S370 F371 L372 L376 L377 E378 F443 | F293-F374 AromaticContact CD2-CD1 3.91Å; F293-F374 HydrophobicContact CD2-CD1 3.91Å; F293-F374 HydrophobicContact CD2-CE1 4.02Å; F293-F374 HydrophobicContact CE2-CB 4Å; F293-F374 AromaticContact CE2-CD1 3.35Å; F293-F374 HydrophobicContact CE2-CD1 3.35Å; F293-F374 HydrophobicContact CE2-CD2 4.41Å; F293-F374 AromaticContact CE2-CE1 3.79Å; F293-F374 HydrophobicContact CE2-CE1 3.79Å; F293-F374 AromaticContact CE2-CG 3.69Å; F293-F374 HydrophobicContact CE2-CG 3.69Å; F293-F374 HydrophobicContact CZ-CB 4.3Å; F293-F374 HydrophobicContact CZ-CD1 4.41Å; F293-F374 HydrophobicContact CZ-CG 4.42Å; W297-F374 HydrophobicContact CB-CD2 4.26Å; W297-F374 HydrophobicContact CB-CE2 4Å; W297-F374 HydrophobicContact CB-CZ 4.15Å; V300-F374 HydrophobicContact CB-CE2 4.22Å; V300-F374 HydrophobicContact CB-CZ 3.99Å; V300-F374 HydrophobicContact CG1-CE2 3.99Å; V300-F374 HydrophobicContact CG1-CZ 3.86Å; V300-F374 HydrophobicContact CG2-CZ 4.33Å; L301-F374 HydrophobicContact CD1-CD2 3.85Å; L301-F374 HydrophobicContact CD1-CE2 3.92Å; L301-F374 HydrophobicContact CD2-CE2 4.14Å; L301-F374 HydrophobicContact CG-CD2 4.26Å; L301-F374 HydrophobicContact CG-CE2 3.83Å; L315-F374 HydrophobicContact CD2-CB 3.65Å; L356-F374 HydrophobicContact CD1-CD1 3.77Å; L356-F374 HydrophobicContact CD1-CE1 3.48Å; L356-F374 VanDerWaalsContact CD1-CE1 3.48Å; L356-F374 HydrophobicContact CD2-CD1 3.88Å; L356-F374 HydrophobicContact CD2-CE1 3.35Å; L356-F374 HydrophobicContact CD2-CZ 3.79Å; L356-F374 HydrophobicContact CG-CD1 4.42Å; L356-F374 HydrophobicContact CG-CE1 4.07Å; S370-F374 VanDerWaalsContact O-CD2 3.31Å; S370-F374 WeakPolarHBondContact O-CD2 3.45Å; S370-F374 WeakPolarHBondContact O-CG 3.39Å; S370-F374 PolarHBondContact O-N 3.5Å; F371-F374 PolarHBondContact O-N 2.89Å; L372-F374 VanDerWaalsContact C-N 3.33Å; L372-F374 PolarHBondContact O-N 3.42Å; F374-L376 VanDerWaalsContact C-N 3.33Å; F374-L376 PolarHBondContact O-N 2.94Å; F374-L377 PolarHBondContact O-N 3.13Å; F374-E378 WeakPolarHBondContact O-CG 2.99Å; F374-E378 PolarHBondContact O-N 3.42Å; F374-F443 HydrophobicContact CE1-CE1 4.39Å; F374-F443 HydrophobicContact CE1-CZ 4.12Å; F374-F443 HydrophobicContact CZ-CZ 4.25Å |
| 375 | L | 98.3 | Very high | 96.2 | Very high | 24 Ų | 24 | 34.2 Ų | 34.2 | 13% | 0.126 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.1 | -39.8 | 172.6 | -63.7 | 178.7 | 0 | 0 | 0 | 112 | A8 L12 C314 L315 A318 F371 L372 A373 E378 L379 | A8-L375 HydrophobicContact CB-CD1 4.49Å; L12-L375 HydrophobicContact CD1-CD2 4.03Å; C314-L375 HydrophobicContact CB-CD2 3.69Å; L315-L375 HydrophobicContact CD2-CD2 4.26Å; A318-L375 HydrophobicContact CB-CB 4.46Å; A318-L375 HydrophobicContact CB-CD2 4.17Å; F371-L375 HydrophobicContact CD1-CD1 4.38Å; F371-L375 HydrophobicContact CE1-CD1 3.94Å; F371-L375 HydrophobicContact CE2-CD1 4.43Å; F371-L375 HydrophobicContact CE2-CD2 4.01Å; F371-L375 HydrophobicContact CE2-CG 4.18Å; F371-L375 HydrophobicContact CZ-CD1 3.97Å; F371-L375 HydrophobicContact CZ-CD2 4.08Å; F371-L375 HydrophobicContact CZ-CG 4.2Å; F371-L375 WeakPolarHBondContact O-CG 3.24Å; F371-L375 PolarHBondContact O-N 3.17Å; L372-L375 PolarHBondContact O-N 3.29Å; A373-L375 PolarHBondContact O-N 3.43Å; L375-E378 PolarHBondContact O-N 3.15Å; L375-L379 WeakPolarHBondContact O-CB 3.41Å; L375-L379 PolarHBondContact O-N 2.96Å |
| 376 | L | 98.2 | Very high | 96.4 | Very high | 56 Ų | 56 | 32.5 Ų | 32.5 | 29% | 0.293 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -63.8 | -41.4 | 175.4 | -178.9 | 64.6 | 0 | 0 | 0 | 111.7 | M348 L372 A373 F374 A380 | M348-L376 HydrophobicContact CB-CD1 4.34Å; M348-L376 HydrophobicContact CE-CD1 3.49Å; M348-L376 VanDerWaalsContact CE-CD1 3.49Å; L372-L376 PolarHBondContact O-N 3.02Å; A373-L376 WeakPolarHBondContact O-CB 3.35Å; A373-L376 PolarHBondContact O-N 3.39Å; F374-L376 VanDerWaalsContact C-N 3.33Å; F374-L376 PolarHBondContact O-N 2.94Å; L376-A380 WeakPolarHBondContact O-CB 3.43Å; L376-A380 PolarHBondContact O-N 2.71Å |
| 377 | L | 98.1 | Very high | 96.4 | Very high | 4 Ų | 4 | 25.9 Ų | 25.9 | 2% | 0.021 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.2 | -46.2 | 176.2 | 178.3 | 62.2 | 0 | 0 | 0 | 111.4 | F293 A349 F353 A373 F374 A380 C381 | F293-L377 HydrophobicContact CB-CD2 3.93Å; F293-L377 HydrophobicContact CD1-CD2 3.85Å; F293-L377 HydrophobicContact CD2-CD2 3.51Å; F293-L377 HydrophobicContact CE1-CD2 4.26Å; F293-L377 HydrophobicContact CE2-CD2 3.95Å; F293-L377 HydrophobicContact CG-CD2 3.44Å; F293-L377 VanDerWaalsContact CG-CD2 3.44Å; F293-L377 HydrophobicContact CZ-CD2 4.3Å; A349-L377 HydrophobicContact CB-CD1 3.81Å; F353-L377 HydrophobicContact CD2-CD1 4.33Å; F353-L377 HydrophobicContact CE1-CD2 4.2Å; F353-L377 HydrophobicContact CE2-CD1 3.47Å; F353-L377 VanDerWaalsContact CE2-CD1 3.47Å; F353-L377 HydrophobicContact CE2-CD2 3.9Å; F353-L377 HydrophobicContact CE2-CG 4.33Å; F353-L377 HydrophobicContact CZ-CD1 3.95Å; F353-L377 HydrophobicContact CZ-CD2 3.46Å; F353-L377 VanDerWaalsContact CZ-CD2 3.46Å; F353-L377 HydrophobicContact CZ-CG 4.36Å; A373-L377 PolarHBondContact O-N 3.3Å; F374-L377 PolarHBondContact O-N 3.13Å; L377-A380 CarbonylContact O-C 3.34Å; L377-A380 WeakPolarHBondContact O-CA 3.49Å; L377-A380 VanDerWaalsContact O-CB 3.29Å; L377-A380 WeakPolarHBondContact O-CB 3.25Å; L377-A380 PolarHBondContact O-N 2.85Å; L377-C381 PolarHBondContact O-N 3.42Å; L377-C381 PolarHBondContact O-SG 3.38Å |
| 378 | E | 97.8 | Very high | 96.4 | Very high | 14 Ų | 14 | 25.2 Ų | 25.2 | 7% | 0.065 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -68 | -38.7 | -179.8 | -74.7 | -73.2 | -178.6 | 0 | 0 | 112.3 | F293 L315 A318 S319 F374 L375 A380 C381 G382 | F293-E378 VanDerWaalsContact CE1-OE1 3.26Å; F293-E378 WeakPolarHBondContact CE1-OE1 3.42Å; L315-E378 HydrophobicContact CB-CG 3.72Å; L315-E378 HydrophobicContact CD2-CG 3.71Å; L315-E378 HydrophobicContact CG-CG 4.21Å; L315-E378 WeakPolarHBondContact O-CB 3.44Å; A318-E378 HydrophobicContact CB-CB 4.03Å; S319-E378 VanDerWaalsContact CA-O 3.25Å; S319-E378 WeakPolarHBondContact CA-O 3.37Å; F374-E378 WeakPolarHBondContact O-CG 2.99Å; F374-E378 PolarHBondContact O-N 3.42Å; L375-E378 PolarHBondContact O-N 3.15Å; E378-A380 VanDerWaalsContact C-N 3.26Å; E378-A380 PolarHBondContact O-N 2.82Å; E378-C381 WeakPolarHBondContact O-CA 3.48Å; E378-C381 WeakPolarHBondContact O-CB 3.25Å; E378-C381 PolarHBondContact O-N 3.38Å; E378-C381 VanDerWaalsContact O-N 3.08Å; E378-G382 PolarHBondContact O-N 2.93Å |
| 379 | L | 98.1 | Very high | 96.2 | Very high | 34 Ų | 34 | 24.1 Ų | 24.1 | 18% | 0.178 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.2 | -38.5 | 171.5 | -171.9 | 144.2 | 0 | 0 | 0 | 111.5 | A318 V321 L325 M348 L375 G382 L383 | A318-L379 HydrophobicContact CB-CB 4.44Å; A318-L379 WeakPolarHBondContact O-CA 3.41Å; V321-L379 HydrophobicContact CB-CD1 4.3Å; V321-L379 HydrophobicContact CG1-CD1 3.68Å; L325-L379 HydrophobicContact CD1-CD1 4.29Å; L325-L379 HydrophobicContact CD1-CD2 4.41Å; M348-L379 HydrophobicContact CE-CD2 3.17Å; M348-L379 HydrophobicContact SD-CD2 4.37Å; L375-L379 WeakPolarHBondContact O-CB 3.41Å; L375-L379 PolarHBondContact O-N 2.96Å; L379-G382 PolarHBondContact O-N 3.44Å; L379-L383 HydrophobicContact CD2-CD1 4.25Å; L379-L383 PolarHBondContact O-N 2.81Å |
| 380 | A | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -63.3 | -40.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A345 M348 A349 L376 L377 E378 G382 L383 Y384 | A345-A380 WeakPolarHBondContact O-CB 3.43Å; M348-A380 HydrophobicContact CB-CB 3.8Å; A349-A380 HydrophobicContact CB-CB 4.3Å; L376-A380 WeakPolarHBondContact O-CB 3.43Å; L376-A380 PolarHBondContact O-N 2.71Å; L377-A380 CarbonylContact O-C 3.34Å; L377-A380 WeakPolarHBondContact O-CA 3.49Å; L377-A380 VanDerWaalsContact O-CB 3.29Å; L377-A380 WeakPolarHBondContact O-CB 3.25Å; L377-A380 PolarHBondContact O-N 2.85Å; E378-A380 VanDerWaalsContact C-N 3.26Å; E378-A380 PolarHBondContact O-N 2.82Å; A380-G382 VanDerWaalsContact C-N 3.3Å; A380-G382 PolarHBondContact O-N 3.44Å; A380-L383 PolarHBondContact O-N 2.92Å; A380-L383 VanDerWaalsContact O-N 3.16Å; A380-Y384 VanDerWaalsContact O-CB 3.24Å; A380-Y384 WeakPolarHBondContact O-CB 3.44Å; A380-Y384 PolarHBondContact O-N 3.31Å |
| 381 | C | 97.1 | Very high | 95.5 | Very high | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.007 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -59.9 | -41 | 174.3 | -64.1 | 0 | 0 | 0 | 0 | 111.6 | L290 L377 E378 L383 Y384 F385 | L290-C381 HydrophobicContact CD1-CB 4.49Å; L377-C381 PolarHBondContact O-N 3.42Å; L377-C381 PolarHBondContact O-SG 3.38Å; E378-C381 WeakPolarHBondContact O-CA 3.48Å; E378-C381 WeakPolarHBondContact O-CB 3.25Å; E378-C381 PolarHBondContact O-N 3.38Å; E378-C381 VanDerWaalsContact O-N 3.08Å; C381-L383 VanDerWaalsContact C-N 3.29Å; C381-L383 PolarHBondContact O-N 3.38Å; C381-Y384 PolarHBondContact O-N 3Å; C381-F385 HydrophobicContact CB-CD2 4.37Å; C381-F385 HydrophobicContact CB-CE2 4.13Å; C381-F385 WeakPolarHBondContact O-CD2 3.46Å; C381-F385 PolarHBondContact O-N 3.19Å |
| 382 | G | 96.1 | Very high | 95.1 | Very high | 2 Ų | 2 | 24.3 Ų | 24.3 | 2% | 0.021 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61 | -33.3 | 175 | 0 | 0 | 0 | 0 | 0 | 114.3 | S319 G322 S323 E378 L379 A380 P386 | S319-G382 WeakPolarHBondContact O-CA 3.4Å; G322-G382 VanDerWaalsContact C-C 3.45Å; G322-G382 CarbonylContact C-O 3.57Å; S323-G382 VanDerWaalsContact CA-O 3.22Å; S323-G382 WeakPolarHBondContact CA-O 3.4Å; S323-G382 PolarHBondContact N-O 3.44Å; E378-G382 PolarHBondContact O-N 2.93Å; L379-G382 PolarHBondContact O-N 3.44Å; A380-G382 VanDerWaalsContact C-N 3.3Å; A380-G382 PolarHBondContact O-N 3.44Å; G382-P386 WeakPolarHBondContact O-CD 3.25Å; G382-P386 WeakPolarHBondContact O-CG 3.14Å |
| 383 | L | 96.4 | Very high | 94.6 | Very high | 9 Ų | 9 | 21.1 Ų | 21.1 | 5% | 0.047 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -77.9 | -38.3 | 172.6 | -66.5 | 170.7 | 0 | 0 | 0 | 112 | G322 L325 V341 A345 M348 L379 A380 C381 A387 | G322-L383 VanDerWaalsContact O-CD2 3.26Å; G322-L383 WeakPolarHBondContact O-CD2 3.48Å; L325-L383 HydrophobicContact CB-CD2 3.98Å; V341-L383 HydrophobicContact CG1-CB 4.09Å; V341-L383 HydrophobicContact CG1-CD2 3.91Å; V341-L383 HydrophobicContact CG1-CG 4.5Å; A345-L383 HydrophobicContact CB-CB 3.83Å; M348-L383 HydrophobicContact CE-CD1 4.42Å; M348-L383 HydrophobicContact SD-CD1 3.7Å; L379-L383 HydrophobicContact CD2-CD1 4.25Å; L379-L383 PolarHBondContact O-N 2.81Å; A380-L383 PolarHBondContact O-N 2.92Å; A380-L383 VanDerWaalsContact O-N 3.16Å; C381-L383 VanDerWaalsContact C-N 3.29Å; C381-L383 PolarHBondContact O-N 3.38Å; L383-A387 WeakPolarHBondContact O-CB 3.38Å; L383-A387 PolarHBondContact O-N 3.05Å |
| 384 | Y | 96.9 | Very high | 94 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.6 | -53 | -174.6 | 167.8 | -93.6 | 0 | 0 | 0 | 112.8 | Q283 F286 E287 L342 A380 C381 A387 V388 | Q283-Y384 WeakPolarHBondContact CA-OH 3.44Å; F286-Y384 HydrophobicContact CB-CD2 4.27Å; F286-Y384 HydrophobicContact CB-CE2 3.54Å; F286-Y384 AromaticContact CD1-CD1 3.53Å; F286-Y384 HydrophobicContact CD1-CD1 3.53Å; F286-Y384 AromaticContact CD1-CD2 3.6Å; F286-Y384 HydrophobicContact CD1-CD2 3.6Å; F286-Y384 AromaticContact CD1-CE1 3.47Å; F286-Y384 HydrophobicContact CD1-CE1 3.47Å; F286-Y384 VanDerWaalsContact CD1-CE1 3.47Å; F286-Y384 AromaticContact CD1-CE2 3.52Å; F286-Y384 HydrophobicContact CD1-CE2 3.52Å; F286-Y384 AromaticContact CD1-CG 3.6Å; F286-Y384 HydrophobicContact CD1-CG 3.6Å; F286-Y384 AromaticContact CD1-CZ 3.46Å; F286-Y384 VanDerWaalsContact CD1-CZ 3.46Å; F286-Y384 AromaticContact CD2-CD2 3.77Å; F286-Y384 HydrophobicContact CD2-CD2 3.77Å; F286-Y384 AromaticContact CD2-CE2 3.92Å; F286-Y384 HydrophobicContact CD2-CE2 3.92Å; F286-Y384 HydrophobicContact CD2-CG 4.37Å; F286-Y384 AromaticContact CE1-CD1 3.45Å; F286-Y384 HydrophobicContact CE1-CD1 3.45Å; F286-Y384 VanDerWaalsContact CE1-CD1 3.45Å; F286-Y384 AromaticContact CE1-CD2 3.77Å; F286-Y384 HydrophobicContact CE1-CD2 3.77Å; F286-Y384 AromaticContact CE1-CE1 3.91Å; F286-Y384 HydrophobicContact CE1-CE1 3.91Å; F286-Y384 HydrophobicContact CE1-CE2 4.18Å; F286-Y384 AromaticContact CE1-CG 3.39Å; F286-Y384 HydrophobicContact CE1-CG 3.39Å; F286-Y384 AromaticContact CE2-CD2 3.91Å; F286-Y384 HydrophobicContact CE2-CD2 3.91Å; F286-Y384 HydrophobicContact CE2-CG 4.17Å; F286-Y384 HydrophobicContact CG-CD1 4.36Å; F286-Y384 AromaticContact CG-CD2 3.59Å; F286-Y384 HydrophobicContact CG-CD2 3.59Å; F286-Y384 HydrophobicContact CG-CE1 4.2Å; F286-Y384 AromaticContact CG-CE2 3.36Å; F286-Y384 HydrophobicContact CG-CE2 3.36Å; F286-Y384 HydrophobicContact CG-CG 4.09Å; F286-Y384 AromaticContact CG-CZ 3.7Å; F286-Y384 HydrophobicContact CZ-CD1 4.22Å; F286-Y384 AromaticContact CZ-CD2 3.92Å; F286-Y384 HydrophobicContact CZ-CD2 3.92Å; F286-Y384 AromaticContact CZ-CG 3.69Å; F286-Y384 HydrophobicContact CZ-CG 3.69Å; E287-Y384 HydrophobicContact CG-CE1 4.01Å; L342-Y384 HydrophobicContact CD1-CD2 3.54Å; L342-Y384 HydrophobicContact CD1-CE2 3.92Å; A380-Y384 VanDerWaalsContact O-CB 3.24Å; A380-Y384 WeakPolarHBondContact O-CB 3.44Å; A380-Y384 PolarHBondContact O-N 3.31Å; C381-Y384 PolarHBondContact O-N 3Å; Y384-A387 PolarHBondContact O-N 3.08Å; Y384-A387 VanDerWaalsContact O-N 3.14Å; Y384-V388 HydrophobicContact CD2-CG2 3.82Å; Y384-V388 HydrophobicContact CE1-CG2 4.17Å; Y384-V388 HydrophobicContact CE2-CG2 3.36Å; Y384-V388 HydrophobicContact CG-CG2 4.39Å; Y384-V388 PolarHBondContact O-N 3.09Å |
| 385 | F | 93.9 | Very high | 93.4 | Very high | 83 Ų | 83 | 26.8 Ų | 26.8 | 36% | 0.364 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -60.1 | -49.4 | -171.6 | -76.7 | -65.8 | 0 | 0 | 0 | 112.6 | E287 L290 C381 A387 V388 S389 | E287-F385 HydrophobicContact CG-CE1 4.46Å; L290-F385 HydrophobicContact CD1-CE2 4.03Å; L290-F385 HydrophobicContact CD1-CZ 3.87Å; C381-F385 HydrophobicContact CB-CD2 4.37Å; C381-F385 HydrophobicContact CB-CE2 4.13Å; C381-F385 WeakPolarHBondContact O-CD2 3.46Å; C381-F385 PolarHBondContact O-N 3.19Å; F385-A387 VanDerWaalsContact C-N 3.32Å; F385-A387 PolarHBondContact O-N 3.46Å; F385-V388 PolarHBondContact O-N 3.46Å; F385-S389 WeakPolarHBondContact O-CB 3.47Å; F385-S389 PolarHBondContact O-N 3.13Å; F385-S389 PolarHBondContact O-OG 3.43Å |
| 386 | P | 92.4 | Very high | 92.9 | Very high | 36 Ų | 36 | 25.8 Ų | 25.8 | 23% | 0.234 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.9 | -38.4 | 175.6 | -23.1 | 35.1 | 0 | 0 | 0 | 113.1 | Y326 G382 S389 F390 | Y326-P386 HydrophobicContact CD1-CB 3.37Å; Y326-P386 HydrophobicContact CD1-CG 4.13Å; Y326-P386 HydrophobicContact CD2-CB 3.96Å; Y326-P386 HydrophobicContact CE1-CB 3.45Å; Y326-P386 VanDerWaalsContact CE1-CB 3.45Å; Y326-P386 HydrophobicContact CE2-CB 4.06Å; Y326-P386 HydrophobicContact CG-CB 3.65Å; Y326-P386 HydrophobicContact CG-CG 4.16Å; Y326-P386 PolarHBondContact OH-O 2.92Å; G382-P386 WeakPolarHBondContact O-CD 3.25Å; G382-P386 WeakPolarHBondContact O-CG 3.14Å; P386-S389 PolarHBondContact O-N 3.38Å; P386-F390 WeakPolarHBondContact O-CB 3.32Å; P386-F390 PolarHBondContact O-N 3.04Å |
| 387 | A | 93.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65 | -46.2 | -180 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y326 L342 L383 Y384 F385 F390 L391 | Y326-A387 HydrophobicContact CD2-CB 4.18Å; Y326-A387 HydrophobicContact CE2-CB 3.68Å; L342-A387 HydrophobicContact CB-CB 4.02Å; L342-A387 HydrophobicContact CD1-CB 4.5Å; L383-A387 WeakPolarHBondContact O-CB 3.38Å; L383-A387 PolarHBondContact O-N 3.05Å; Y384-A387 PolarHBondContact O-N 3.08Å; Y384-A387 VanDerWaalsContact O-N 3.14Å; F385-A387 VanDerWaalsContact C-N 3.32Å; F385-A387 PolarHBondContact O-N 3.46Å; A387-F390 PolarHBondContact O-N 3.48Å; A387-L391 WeakPolarHBondContact O-CG 3.49Å; A387-L391 PolarHBondContact O-N 3.36Å; A387-L391 VanDerWaalsContact O-N 3.11Å |
| 388 | V | 92.9 | Very high | 91.2 | Very high | 3 Ų | 3 | 32.7 Ų | 32.7 | 2% | 0.018 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -67 | -43 | 176.4 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | L342 Y384 F385 F390 L391 Q392 | L342-V388 HydrophobicContact CD1-CG2 3.62Å; L342-V388 HydrophobicContact CD2-CG2 4.25Å; Y384-V388 HydrophobicContact CD2-CG2 3.82Å; Y384-V388 HydrophobicContact CE1-CG2 4.17Å; Y384-V388 HydrophobicContact CE2-CG2 3.36Å; Y384-V388 HydrophobicContact CG-CG2 4.39Å; Y384-V388 PolarHBondContact O-N 3.09Å; F385-V388 PolarHBondContact O-N 3.46Å; V388-F390 VanDerWaalsContact C-N 3.29Å; V388-F390 PolarHBondContact O-N 3.31Å; V388-L391 PolarHBondContact O-N 3.05Å; V388-L391 VanDerWaalsContact O-N 3.16Å; V388-Q392 HydrophobicContact CG1-CG 4.04Å; V388-Q392 WeakPolarHBondContact O-CB 3.18Å; V388-Q392 VanDerWaalsContact O-CG 3.28Å; V388-Q392 WeakPolarHBondContact O-CG 3.31Å; V388-Q392 PolarHBondContact O-N 3.46Å |
| 389 | S | 89.4 | Confident | 90.1 | Very high | 70 Ų | 70 | 39.7 Ų | 39.7 | 49% | 0.49 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -59.5 | -39.9 | 176.9 | -64.8 | 0 | 0 | 0 | 0 | 112.3 | F385 P386 G393 | F385-S389 WeakPolarHBondContact O-CB 3.47Å; F385-S389 PolarHBondContact O-N 3.13Å; F385-S389 PolarHBondContact O-OG 3.43Å; P386-S389 PolarHBondContact O-N 3.38Å; S389-G393 PolarHBondContact O-N 2.98Å |
| 390 | F | 89.2 | Confident | 89.1 | Confident | 50 Ų | 50 | 42 Ų | 42 | 22% | 0.219 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.3 | -47.6 | 173.7 | 178.9 | -88.1 | 0 | 0 | 0 | 112 | P338 P386 A387 V388 G393 R394 L472 | P338-F390 HydrophobicContact CB-CB 4.45Å; P338-F390 HydrophobicContact CB-CD1 3.64Å; P338-F390 HydrophobicContact CB-CE1 4.16Å; P338-F390 HydrophobicContact CB-CG 4.15Å; P338-F390 HydrophobicContact CG-CD1 3.59Å; P338-F390 HydrophobicContact CG-CD2 4.47Å; P338-F390 HydrophobicContact CG-CE1 3.69Å; P338-F390 HydrophobicContact CG-CG 4.01Å; P338-F390 HydrophobicContact CG-CZ 4.18Å; P386-F390 WeakPolarHBondContact O-CB 3.32Å; P386-F390 PolarHBondContact O-N 3.04Å; A387-F390 PolarHBondContact O-N 3.48Å; V388-F390 VanDerWaalsContact C-N 3.29Å; V388-F390 PolarHBondContact O-N 3.31Å; F390-G393 VanDerWaalsContact O-CA 3.3Å; F390-G393 WeakPolarHBondContact O-CA 3.4Å; F390-G393 PolarHBondContact O-N 3.18Å; F390-G393 VanDerWaalsContact O-N 3.07Å; F390-R394 HydrophobicContact CE1-CG 4.15Å; F390-R394 HydrophobicContact CZ-CG 4.29Å; F390-R394 PolarHBondContact O-N 3.33Å; F390-L472 HydrophobicContact CE2-CD2 4.21Å; F390-L472 HydrophobicContact CZ-CD2 4.18Å |
| 391 | L | 89.1 | Confident | 88.2 | Confident | 3 Ų | 3 | 44.7 Ų | 44.7 | 2% | 0.016 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.7 | -40.1 | -179.4 | -69.7 | 170 | 0 | 0 | 0 | 112.1 | L279 L342 A387 V388 G393 R394 V395 L470 | L279-L391 HydrophobicContact CD1-CB 4.04Å; L279-L391 HydrophobicContact CD1-CD1 4.35Å; L279-L391 HydrophobicContact CD2-CB 4.22Å; L342-L391 HydrophobicContact CD2-CD1 3.54Å; A387-L391 WeakPolarHBondContact O-CG 3.49Å; A387-L391 PolarHBondContact O-N 3.36Å; A387-L391 VanDerWaalsContact O-N 3.11Å; V388-L391 PolarHBondContact O-N 3.05Å; V388-L391 VanDerWaalsContact O-N 3.16Å; L391-G393 PolarHBondContact O-N 3.22Å; L391-R394 PolarHBondContact O-N 3.44Å; L391-R394 VanDerWaalsContact O-N 3.16Å; L391-V395 WeakPolarHBondContact O-CB 3.5Å; L391-V395 VanDerWaalsContact O-CG2 3.3Å; L391-V395 WeakPolarHBondContact O-CG2 3.24Å; L391-V395 PolarHBondContact O-N 3.12Å; L391-L470 HydrophobicContact CD2-CD2 3.86Å |
| 392 | Q | 89.6 | Confident | 87.1 | Confident | 20 Ų | 20 | 48.3 Ų | 48.3 | 9% | 0.093 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58 | -40.5 | 170.5 | -73 | 172.4 | -8.3 | 0 | 0 | 110.3 | L279 V388 R394 I396 R401 L405 | L279-Q392 HydrophobicContact CD2-CB 4.48Å; L279-Q392 HydrophobicContact CD2-CG 3.94Å; V388-Q392 HydrophobicContact CG1-CG 4.04Å; V388-Q392 WeakPolarHBondContact O-CB 3.18Å; V388-Q392 VanDerWaalsContact O-CG 3.28Å; V388-Q392 WeakPolarHBondContact O-CG 3.31Å; V388-Q392 PolarHBondContact O-N 3.46Å; Q392-R394 VanDerWaalsContact C-N 3.28Å; Q392-R394 PolarHBondContact O-N 2.81Å; Q392-I396 HydrophobicContact CB-CD1 4Å; Q392-I396 HydrophobicContact CG-CD1 3.98Å; Q392-I396 WeakPolarHBondContact O-CB 3.38Å; Q392-I396 PolarHBondContact O-N 3.27Å; Q392-R401 PolarHBondContact O-NH1 3.01Å; Q392-R401 PolarHBondContact O-NH2 3.24Å; Q392-L405 HydrophobicContact CG-CD2 4.26Å |
| 393 | G | 85 | Confident | 86.1 | Confident | 34 Ų | 34 | 48.4 Ų | 48.4 | 35% | 0.351 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -47.6 | -47.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | S389 F390 L391 R401 | S389-G393 PolarHBondContact O-N 2.98Å; F390-G393 VanDerWaalsContact O-CA 3.3Å; F390-G393 WeakPolarHBondContact O-CA 3.4Å; F390-G393 PolarHBondContact O-N 3.18Å; F390-G393 VanDerWaalsContact O-N 3.07Å; L391-G393 PolarHBondContact O-N 3.22Å; G393-R401 VanDerWaalsContact CA-NH1 3.29Å; G393-R401 PolarHBondContact O-NH2 3.25Å |
| 394 | R | 86.1 | Confident | 85.4 | Confident | 102 Ų | 102 | 48 Ų | 48 | 39% | 0.385 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -91.3 | -36.5 | -173.4 | -64 | -68.2 | -175.5 | 154.4 | -3.4 | 114.6 | F390 L391 Q392 D469 L470 E473 | F390-R394 HydrophobicContact CE1-CG 4.15Å; F390-R394 HydrophobicContact CZ-CG 4.29Å; F390-R394 PolarHBondContact O-N 3.33Å; L391-R394 PolarHBondContact O-N 3.44Å; L391-R394 VanDerWaalsContact O-N 3.16Å; Q392-R394 VanDerWaalsContact C-N 3.28Å; Q392-R394 PolarHBondContact O-N 2.81Å; R394-D469 WeakPolarHBondContact CD-O 3.47Å; R394-L470 HydrophobicContact CB-CD2 4.01Å; R394-E473 IonicContact CZ-OE1 2.94Å; R394-E473 IonicContact NH1-OE1 3.07Å; R394-E473 PolarHBondContact NH1-OE1 3.17Å; R394-E473 IonicContact NH2-OE1 3.35Å; R394-E473 PolarHBondContact NH2-OE1 2.67Å |
| 395 | V | 86 | Confident | 84.6 | Confident | 17 Ų | 17 | 50.1 Ų | 50.1 | 10% | 0.103 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -83 | -32 | -174.3 | 178.2 | 0 | 0 | 0 | 0 | 112.2 | R275 V276 L279 L391 L470 | R275-V395 HydrophobicContact CB-CG1 3.87Å; V276-V395 HydrophobicContact CG2-CG1 3.81Å; L279-V395 HydrophobicContact CD2-CB 4.14Å; L279-V395 HydrophobicContact CD2-CG1 4.45Å; L279-V395 HydrophobicContact CD2-CG2 4.35Å; L391-V395 WeakPolarHBondContact O-CB 3.5Å; L391-V395 VanDerWaalsContact O-CG2 3.3Å; L391-V395 WeakPolarHBondContact O-CG2 3.24Å; L391-V395 PolarHBondContact O-N 3.12Å; V395-L470 HydrophobicContact CG2-CD2 3.67Å |
| 396 | I | 86.3 | Confident | 83.9 | Confident | 3 Ų | 3 | 48.6 Ų | 48.6 | 2% | 0.015 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -101.8 | 123.1 | -172.1 | -51.9 | 174.5 | 0 | 0 | 0 | 109.6 | Q392 E398 R401 V404 L405 F408 | Q392-I396 HydrophobicContact CB-CD1 4Å; Q392-I396 HydrophobicContact CG-CD1 3.98Å; Q392-I396 WeakPolarHBondContact O-CB 3.38Å; Q392-I396 PolarHBondContact O-N 3.27Å; I396-E398 PolarHBondContact O-N 3.22Å; I396-R401 HydrophobicContact CG2-CB 4.19Å; I396-R401 HydrophobicContact CG2-CG 4.46Å; I396-R401 PolarHBondContact O-NH2 3.46Å; I396-R401 VanDerWaalsContact O-NH2 3.12Å; I396-V404 HydrophobicContact CD1-CG1 4.03Å; I396-V404 HydrophobicContact CG2-CB 4.03Å; I396-V404 HydrophobicContact CG2-CG1 4.18Å; I396-V404 HydrophobicContact CG2-CG2 4.16Å; I396-L405 HydrophobicContact CD1-CD2 4.1Å; I396-F408 HydrophobicContact CD1-CE2 3.76Å; I396-F408 HydrophobicContact CD1-CZ 4.17Å |
| 397 | P | 82.4 | Confident | 83.4 | Confident | 52 Ų | 52 | 50.4 Ų | 50.4 | 34% | 0.338 | 27% | 0.271 | S | S | . | . | trans | -55.5 | 136.9 | 175 | -24.8 | 33.5 | 0 | 0 | 0 | 111.9 | E399 K400 R401 | P397-E399 VanDerWaalsContact C-N 3.25Å; P397-E399 PolarHBondContact O-N 2.99Å; P397-K400 PolarHBondContact O-N 2.9Å; P397-K400 VanDerWaalsContact O-N 3.14Å; P397-R401 PolarHBondContact O-N 3Å | ||
| 398 | E | 78.3 | Confident | 82.9 | Confident | 154 Ų | 154 | 50.5 Ų | 50.5 | 72% | 0.72 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -38.3 | -175.4 | -68.2 | -167.2 | 163.9 | 0 | 0 | 112.5 | I396 K400 R401 | I396-E398 PolarHBondContact O-N 3.22Å; E398-K400 VanDerWaalsContact C-N 3.27Å; E398-K400 PolarHBondContact O-N 3.35Å; E398-R401 PolarHBondContact O-N 3.16Å |
| 399 | E | 76.1 | Confident | 82.3 | Confident | 160 Ų | 160 | 54.1 Ų | 54.1 | 75% | 0.748 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -28.8 | -176.6 | -52.5 | 78.8 | -169.7 | 0 | 0 | 112.3 | P397 | P397-E399 VanDerWaalsContact C-N 3.25Å; P397-E399 PolarHBondContact O-N 2.99Å |
| 400 | K | 77.4 | Confident | 81.9 | Confident | 82 Ų | 82 | 53.8 Ų | 53.8 | 36% | 0.357 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | -6.3 | -175.1 | -60 | -179.2 | -173.1 | 170.7 | 0 | 113 | C269 P397 E398 A402 G403 V404 | C269-K400 HydrophobicContact CB-CD 3.99Å; P397-K400 PolarHBondContact O-N 2.9Å; P397-K400 VanDerWaalsContact O-N 3.14Å; E398-K400 VanDerWaalsContact C-N 3.27Å; E398-K400 PolarHBondContact O-N 3.35Å; K400-A402 PolarHBondContact O-N 2.63Å; K400-G403 PolarHBondContact O-N 3.12Å; K400-G403 VanDerWaalsContact O-N 3.15Å; K400-V404 HydrophobicContact CB-CG2 4.37Å; K400-V404 WeakPolarHBondContact O-CG2 3.29Å; K400-V404 PolarHBondContact O-N 3.49Å |
| 401 | R | 78.8 | Confident | 81.7 | Confident | 57 Ų | 57 | 53.9 Ų | 53.9 | 22% | 0.215 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -51.9 | -50.8 | -173.3 | -174.7 | -174.7 | -63 | -80.3 | -8.3 | 112.9 | Q392 G393 I396 P397 E398 G403 V404 L405 | Q392-R401 PolarHBondContact O-NH1 3.01Å; Q392-R401 PolarHBondContact O-NH2 3.24Å; G393-R401 VanDerWaalsContact CA-NH1 3.29Å; G393-R401 PolarHBondContact O-NH2 3.25Å; I396-R401 HydrophobicContact CG2-CB 4.19Å; I396-R401 HydrophobicContact CG2-CG 4.46Å; I396-R401 PolarHBondContact O-NH2 3.46Å; I396-R401 VanDerWaalsContact O-NH2 3.12Å; P397-R401 PolarHBondContact O-N 3Å; E398-R401 PolarHBondContact O-N 3.16Å; R401-G403 VanDerWaalsContact C-N 3.33Å; R401-G403 PolarHBondContact O-N 2.8Å; R401-V404 PolarHBondContact O-N 3.22Å; R401-L405 HydrophobicContact CG-CD1 3.76Å; R401-L405 HydrophobicContact CG-CG 4.2Å; R401-L405 WeakPolarHBondContact O-CB 3.48Å; R401-L405 VanDerWaalsContact O-CG 3.24Å; R401-L405 WeakPolarHBondContact O-CG 3.26Å; R401-L405 PolarHBondContact O-N 2.99Å |
| 402 | A | 72.9 | Confident | 81.4 | Confident | 77 Ų | 77 | 53.8 Ų | 53.8 | 64% | 0.636 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -59.5 | -43.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | K400 A406 | K400-A402 PolarHBondContact O-N 2.63Å; A402-A406 WeakPolarHBondContact O-CB 3.39Å; A402-A406 PolarHBondContact O-N 3.15Å; A402-A406 VanDerWaalsContact O-N 3.13Å |
| 403 | G | 74.9 | Confident | 81.1 | Confident | 5 Ų | 5 | 53 Ų | 53 | 5% | 0.052 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -68 | -43.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | K400 R401 A406 W407 | K400-G403 PolarHBondContact O-N 3.12Å; K400-G403 VanDerWaalsContact O-N 3.15Å; R401-G403 VanDerWaalsContact C-N 3.33Å; R401-G403 PolarHBondContact O-N 2.8Å; G403-A406 PolarHBondContact O-N 2.93Å; G403-W407 PolarHBondContact O-N 2.94Å |
| 404 | V | 82 | Confident | 81.1 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.9 | -46.1 | 178.1 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | C269 V276 I396 K400 R401 A406 W407 F408 | C269-V404 HydrophobicContact CB-CG2 4.02Å; V276-V404 HydrophobicContact CG1-CG1 3.65Å; I396-V404 HydrophobicContact CD1-CG1 4.03Å; I396-V404 HydrophobicContact CG2-CB 4.03Å; I396-V404 HydrophobicContact CG2-CG1 4.18Å; I396-V404 HydrophobicContact CG2-CG2 4.16Å; K400-V404 HydrophobicContact CB-CG2 4.37Å; K400-V404 WeakPolarHBondContact O-CG2 3.29Å; K400-V404 PolarHBondContact O-N 3.49Å; R401-V404 PolarHBondContact O-N 3.22Å; V404-A406 VanDerWaalsContact C-N 3.29Å; V404-A406 PolarHBondContact O-N 3.37Å; V404-W407 PolarHBondContact O-N 3.41Å; V404-W407 VanDerWaalsContact O-N 3.09Å; V404-F408 HydrophobicContact CG1-CD1 4.38Å; V404-F408 HydrophobicContact CG1-CE1 3.84Å; V404-F408 HydrophobicContact CG1-CE2 4.06Å; V404-F408 HydrophobicContact CG1-CZ 3.65Å; V404-F408 PolarHBondContact O-N 3.04Å |
| 405 | L | 80.8 | Confident | 81.1 | Confident | 44 Ų | 44 | 53.9 Ų | 53.9 | 23% | 0.23 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.9 | -33.7 | 178.8 | -67.5 | 179.8 | 0 | 0 | 0 | 112.3 | Q392 I396 R401 W407 F408 R409 | Q392-L405 HydrophobicContact CG-CD2 4.26Å; I396-L405 HydrophobicContact CD1-CD2 4.1Å; R401-L405 HydrophobicContact CG-CD1 3.76Å; R401-L405 HydrophobicContact CG-CG 4.2Å; R401-L405 WeakPolarHBondContact O-CB 3.48Å; R401-L405 VanDerWaalsContact O-CG 3.24Å; R401-L405 WeakPolarHBondContact O-CG 3.26Å; R401-L405 PolarHBondContact O-N 2.99Å; L405-W407 VanDerWaalsContact C-N 3.33Å; L405-F408 HydrophobicContact CD2-CD2 3.79Å; L405-F408 HydrophobicContact CD2-CE2 4.11Å; L405-F408 PolarHBondContact O-N 3.23Å; L405-R409 PolarHBondContact O-N 2.78Å |
| 406 | A | 78.8 | Confident | 80.9 | Confident | 52 Ų | 52 | 53 Ų | 53 | 43% | 0.43 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -62.7 | -41.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | A402 G403 V404 F408 R409 | A402-A406 WeakPolarHBondContact O-CB 3.39Å; A402-A406 PolarHBondContact O-N 3.15Å; A402-A406 VanDerWaalsContact O-N 3.13Å; G403-A406 PolarHBondContact O-N 2.93Å; V404-A406 VanDerWaalsContact C-N 3.29Å; V404-A406 PolarHBondContact O-N 3.37Å; A406-F408 VanDerWaalsContact C-N 3.34Å; A406-F408 PolarHBondContact O-N 2.86Å; A406-R409 PolarHBondContact O-N 3.36Å |
| 407 | W | 82.3 | Confident | 80.9 | Confident | 73 Ų | 73 | 53.6 Ų | 53.6 | 28% | 0.277 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -69.2 | -28.3 | 176 | -79.4 | 111.9 | 0 | 0 | 0 | 113.7 | C263 L267 L270 G403 V404 L405 R409 L410 P411 | C263-W407 PolarHBondContact O-NE1 2.92Å; L267-W407 HydrophobicContact CB-CZ2 4.16Å; L267-W407 HydrophobicContact CD1-CD2 4.27Å; L267-W407 HydrophobicContact CD1-CE3 4.44Å; L267-W407 HydrophobicContact CD2-CH2 4.35Å; L267-W407 HydrophobicContact CD2-CZ2 4.11Å; L270-W407 HydrophobicContact CD2-CB 4.03Å; G403-W407 PolarHBondContact O-N 2.94Å; V404-W407 PolarHBondContact O-N 3.41Å; V404-W407 VanDerWaalsContact O-N 3.09Å; L405-W407 VanDerWaalsContact C-N 3.33Å; W407-R409 VanDerWaalsContact C-N 3.3Å; W407-R409 PolarHBondContact O-N 3.2Å; W407-L410 HydrophobicContact CE3-CD2 4.04Å; W407-L410 HydrophobicContact CZ3-CD2 3.75Å; W407-L410 PolarHBondContact O-N 3Å; W407-P411 WeakPolarHBondContact O-CD 3.48Å |
| 408 | F | 82.9 | Confident | 81 | Confident | 3 Ų | 3 | 56.5 Ų | 56.5 | 1% | 0.013 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66.1 | -30.3 | 173.7 | -70.5 | -13.6 | 0 | 0 | 0 | 113.5 | L270 V276 G280 I396 V404 L405 A406 L410 P411 L412 | L270-F408 HydrophobicContact CD1-CD1 4.11Å; L270-F408 HydrophobicContact CD1-CE1 3.43Å; L270-F408 VanDerWaalsContact CD1-CE1 3.43Å; L270-F408 HydrophobicContact CD1-CZ 4.42Å; V276-F408 HydrophobicContact CG1-CE1 4.23Å; V276-F408 HydrophobicContact CG1-CZ 3.9Å; V276-F408 WeakPolarHBondContact O-CZ 3.44Å; G280-F408 VanDerWaalsContact CA-CZ 3.41Å; I396-F408 HydrophobicContact CD1-CE2 3.76Å; I396-F408 HydrophobicContact CD1-CZ 4.17Å; V404-F408 HydrophobicContact CG1-CD1 4.38Å; V404-F408 HydrophobicContact CG1-CE1 3.84Å; V404-F408 HydrophobicContact CG1-CE2 4.06Å; V404-F408 HydrophobicContact CG1-CZ 3.65Å; V404-F408 PolarHBondContact O-N 3.04Å; L405-F408 HydrophobicContact CD2-CD2 3.79Å; L405-F408 HydrophobicContact CD2-CE2 4.11Å; L405-F408 PolarHBondContact O-N 3.23Å; A406-F408 VanDerWaalsContact C-N 3.34Å; A406-F408 PolarHBondContact O-N 2.86Å; F408-L410 VanDerWaalsContact C-N 3.32Å; F408-L410 PolarHBondContact O-N 3.16Å; F408-P411 WeakPolarHBondContact O-CD 3.42Å; F408-P411 WeakPolarHBondContact O-CG 3.47Å; F408-L412 WeakPolarHBondContact O-CB 3.5Å |
| 409 | R | 79.1 | Confident | 81.1 | Confident | 78 Ų | 78 | 50.1 Ų | 50.1 | 29% | 0.294 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -68 | -31.6 | 179 | -67.4 | -178 | -178.9 | -176.2 | 2.2 | 112.8 | L405 A406 W407 H413 | L405-R409 PolarHBondContact O-N 2.78Å; A406-R409 PolarHBondContact O-N 3.36Å; W407-R409 VanDerWaalsContact C-N 3.3Å; W407-R409 PolarHBondContact O-N 3.2Å; R409-H413 PolarHBondContact O-CD2 2.94Å; R409-H413 PolarHBondContact O-N 3.42Å |
| 410 | L | 82.1 | Confident | 81.4 | Confident | 63 Ų | 63 | 42.5 Ų | 42.5 | 33% | 0.33 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61.7 | -59 | -177.5 | -177.6 | 66.1 | 0 | 0 | 0 | 113.4 | V92 W407 F408 L412 H413 L414 | V92-L410 HydrophobicContact CG1-CD1 3.51Å; W407-L410 HydrophobicContact CE3-CD2 4.04Å; W407-L410 HydrophobicContact CZ3-CD2 3.75Å; W407-L410 PolarHBondContact O-N 3Å; F408-L410 VanDerWaalsContact C-N 3.32Å; F408-L410 PolarHBondContact O-N 3.16Å; L410-L412 VanDerWaalsContact C-N 3.28Å; L410-L412 PolarHBondContact O-N 3.35Å; L410-H413 PolarHBondContact O-N 3.28Å; L410-L414 HydrophobicContact CD1-CD1 3.92Å; L410-L414 HydrophobicContact CD1-CG 4.2Å; L410-L414 HydrophobicContact CG-CD1 3.9Å; L410-L414 WeakPolarHBondContact O-CB 3.38Å; L410-L414 VanDerWaalsContact O-CG 3.25Å; L410-L414 WeakPolarHBondContact O-CG 3.32Å; L410-L414 PolarHBondContact O-N 3.49Å |
| 411 | P | 84.2 | Confident | 81.6 | Confident | 53 Ų | 53 | 42.7 Ų | 42.7 | 34% | 0.344 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -62.5 | -37.3 | -179.4 | 25.3 | -33.9 | 0 | 0 | 0 | 112 | A284 W407 F408 L414 L415 | A284-P411 HydrophobicContact CB-CB 4.15Å; A284-P411 HydrophobicContact CB-CG 4.04Å; W407-P411 WeakPolarHBondContact O-CD 3.48Å; F408-P411 WeakPolarHBondContact O-CD 3.42Å; F408-P411 WeakPolarHBondContact O-CG 3.47Å; P411-L414 PolarHBondContact O-N 3.13Å; P411-L415 WeakPolarHBondContact O-CB 3.39Å; P411-L415 VanDerWaalsContact O-CG 3.24Å; P411-L415 WeakPolarHBondContact O-CG 3.07Å; P411-L415 PolarHBondContact O-N 2.85Å |
| 412 | L | 83.3 | Confident | 81.4 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -55.4 | -54.2 | 175.7 | 170.1 | 162.1 | 0 | 0 | 0 | 112.7 | A284 E287 S288 Y291 F408 L410 L415 A416 | A284-L412 HydrophobicContact CB-CB 4.23Å; E287-L412 HydrophobicContact CB-CD1 3.3Å; E287-L412 HydrophobicContact CB-CG 3.91Å; E287-L412 HydrophobicContact CG-CD1 4.03Å; E287-L412 VanDerWaalsContact OE2-CD1 3.26Å; E287-L412 WeakPolarHBondContact OE2-CD1 3.42Å; S288-L412 VanDerWaalsContact CB-O 3.28Å; S288-L412 WeakPolarHBondContact CB-O 3.33Å; Y291-L412 HydrophobicContact CD2-CD2 3.74Å; Y291-L412 HydrophobicContact CD2-CG 4.5Å; Y291-L412 HydrophobicContact CE2-CD2 3.38Å; Y291-L412 HydrophobicContact CE2-CG 4.29Å; F408-L412 WeakPolarHBondContact O-CB 3.5Å; L410-L412 VanDerWaalsContact C-N 3.28Å; L410-L412 PolarHBondContact O-N 3.35Å; L412-L415 PolarHBondContact O-N 3.26Å; L412-A416 PolarHBondContact O-N 2.89Å; L412-A416 VanDerWaalsContact O-N 3.08Å |
| 413 | H | 83.2 | Confident | 81.1 | Confident | 4 Ų | 4 | 39.2 Ų | 39.2 | 2% | 0.019 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -74.4 | -32.5 | -177.5 | -73.1 | -62 | 0 | 0 | 0 | 111.5 | V92 Y291 R409 L410 A416 C417 | V92-H413 HydrophobicContact CG2-CB 3.07Å; V92-H413 WeakPolarHBondContact CG2-CD2 3.39Å; Y291-H413 AromaticContact CE2-CE1 3.81Å; Y291-H413 AromaticContact CZ-CE1 3.51Å; Y291-H413 PolarHBondContact OH-CE1 3.49Å; R409-H413 PolarHBondContact O-CD2 2.94Å; R409-H413 PolarHBondContact O-N 3.42Å; L410-H413 PolarHBondContact O-N 3.28Å; H413-A416 PolarHBondContact O-N 3.18Å; H413-C417 WeakPolarHBondContact O-CB 3.44Å; H413-C417 PolarHBondContact O-N 2.95Å; H413-C417 PolarHBondContact O-SG 3.4Å |
| 414 | L | 85.3 | Confident | 80.8 | Confident | 91 Ų | 91 | 41.8 Ų | 41.8 | 48% | 0.476 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61.9 | -46.1 | 172.9 | -73.3 | 174 | 0 | 0 | 0 | 111.3 | L410 P411 A416 C417 L418 | L410-L414 HydrophobicContact CD1-CD1 3.92Å; L410-L414 HydrophobicContact CD1-CG 4.2Å; L410-L414 HydrophobicContact CG-CD1 3.9Å; L410-L414 WeakPolarHBondContact O-CB 3.38Å; L410-L414 VanDerWaalsContact O-CG 3.25Å; L410-L414 WeakPolarHBondContact O-CG 3.32Å; L410-L414 PolarHBondContact O-N 3.49Å; P411-L414 PolarHBondContact O-N 3.13Å; L414-A416 VanDerWaalsContact C-N 3.35Å; L414-A416 PolarHBondContact O-N 3.27Å; L414-C417 PolarHBondContact O-N 3.34Å; L414-L418 WeakPolarHBondContact O-CB 3.35Å; L414-L418 VanDerWaalsContact O-CG 3.27Å; L414-L418 WeakPolarHBondContact O-CG 3.5Å; L414-L418 PolarHBondContact O-N 3.2Å |
| 415 | L | 86.1 | Confident | 79.7 | Confident | 62 Ų | 62 | 43.8 Ų | 43.8 | 33% | 0.325 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60 | -44.1 | 175.2 | -75.3 | 170.2 | 0 | 0 | 0 | 111.7 | A284 L285 P411 L412 L418 G419 | A284-L415 HydrophobicContact CB-CD1 4.37Å; L285-L415 HydrophobicContact CD2-CD1 4.37Å; P411-L415 WeakPolarHBondContact O-CB 3.39Å; P411-L415 VanDerWaalsContact O-CG 3.24Å; P411-L415 WeakPolarHBondContact O-CG 3.07Å; P411-L415 PolarHBondContact O-N 2.85Å; L412-L415 PolarHBondContact O-N 3.26Å; L415-L418 PolarHBondContact O-N 2.98Å; L415-G419 PolarHBondContact O-N 3.3Å |
| 416 | A | 82.7 | Confident | 78.7 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L88 Y291 L412 H413 L414 G419 L420 | L88-A416 HydrophobicContact CD1-CB 4.25Å; Y291-A416 HydrophobicContact CG-CB 4.43Å; L412-A416 PolarHBondContact O-N 2.89Å; L412-A416 VanDerWaalsContact O-N 3.08Å; H413-A416 PolarHBondContact O-N 3.18Å; L414-A416 VanDerWaalsContact C-N 3.35Å; L414-A416 PolarHBondContact O-N 3.27Å; A416-G419 PolarHBondContact O-N 2.93Å; A416-L420 WeakPolarHBondContact O-CG 3.32Å; A416-L420 PolarHBondContact O-N 3.28Å |
| 417 | C | 84.9 | Confident | 77.6 | Confident | 15 Ų | 15 | 46.9 Ų | 46.9 | 10% | 0.101 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 176.1 | -73.9 | 0 | 0 | 0 | 0 | 111.7 | V85 H413 L414 G419 L420 L421 | V85-C417 HydrophobicContact CG1-CB 4.33Å; H413-C417 WeakPolarHBondContact O-CB 3.44Å; H413-C417 PolarHBondContact O-N 2.95Å; H413-C417 PolarHBondContact O-SG 3.4Å; L414-C417 PolarHBondContact O-N 3.34Å; C417-G419 VanDerWaalsContact C-N 3.35Å; C417-L420 PolarHBondContact O-N 2.88Å; C417-L421 WeakPolarHBondContact O-CB 3.33Å; C417-L421 VanDerWaalsContact O-CG 3.26Å; C417-L421 WeakPolarHBondContact O-CG 3.26Å; C417-L421 PolarHBondContact O-N 3.44Å |
| 418 | L | 85.7 | Confident | 76.1 | Confident | 112 Ų | 112 | 46.7 Ų | 46.7 | 59% | 0.586 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -62 | -42.5 | 176.1 | -71.7 | 171.6 | 0 | 0 | 0 | 111.4 | L414 L415 L421 A422 | L414-L418 WeakPolarHBondContact O-CB 3.35Å; L414-L418 VanDerWaalsContact O-CG 3.27Å; L414-L418 WeakPolarHBondContact O-CG 3.5Å; L414-L418 PolarHBondContact O-N 3.2Å; L415-L418 PolarHBondContact O-N 2.98Å; L418-L421 PolarHBondContact O-N 2.97Å; L418-A422 WeakPolarHBondContact O-CB 3.27Å; L418-A422 PolarHBondContact O-N 3.34Å |
| 419 | G | 80.7 | Confident | 74.2 | Confident | 20 Ų | 20 | 49.5 Ų | 49.5 | 21% | 0.206 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L415 A416 C417 A422 L423 | L415-G419 PolarHBondContact O-N 3.3Å; A416-G419 PolarHBondContact O-N 2.93Å; C417-G419 VanDerWaalsContact C-N 3.35Å; G419-A422 PolarHBondContact O-N 3.22Å; G419-L423 PolarHBondContact O-N 3.49Å |
| 420 | L | 81.6 | Confident | 72.4 | Confident | 1 Ų | 1 | 50.9 Ų | 50.9 | 1% | 0.005 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -71.3 | -31.9 | 177 | -67.4 | 175.5 | 0 | 0 | 0 | 113.1 | V85 L88 F295 A416 C417 L423 H424 M442 | V85-L420 HydrophobicContact CG2-CB 3.57Å; V85-L420 HydrophobicContact CG2-CD1 3.96Å; V85-L420 HydrophobicContact CG2-CG 4.44Å; L88-L420 HydrophobicContact CD1-CD1 3.77Å; F295-L420 HydrophobicContact CB-CD2 3.85Å; F295-L420 HydrophobicContact CD1-CD2 3.71Å; F295-L420 HydrophobicContact CD2-CD2 4.28Å; F295-L420 HydrophobicContact CE1-CD2 4.37Å; F295-L420 HydrophobicContact CG-CD2 3.67Å; A416-L420 WeakPolarHBondContact O-CG 3.32Å; A416-L420 PolarHBondContact O-N 3.28Å; C417-L420 PolarHBondContact O-N 2.88Å; L420-L423 WeakPolarHBondContact O-CB 3.44Å; L420-L423 PolarHBondContact O-N 3.47Å; L420-H424 PolarHBondContact O-N 3.18Å; L420-M442 HydrophobicContact CD2-CE 4.25Å |
| 421 | L | 81.8 | Confident | 70.4 | Confident | 86 Ų | 86 | 52.6 Ų | 52.6 | 45% | 0.45 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -72.2 | -35.4 | 173.9 | -74.5 | 170.5 | 0 | 0 | 0 | 112 | V85 C417 L418 L423 H424 G425 | V85-L421 HydrophobicContact CG2-CG 4.43Å; C417-L421 WeakPolarHBondContact O-CB 3.33Å; C417-L421 VanDerWaalsContact O-CG 3.26Å; C417-L421 WeakPolarHBondContact O-CG 3.26Å; C417-L421 PolarHBondContact O-N 3.44Å; L418-L421 PolarHBondContact O-N 2.97Å; L421-L423 VanDerWaalsContact C-N 3.26Å; L421-L423 PolarHBondContact O-N 2.75Å; L421-H424 WeakPolarHBondContact O-CB 3.28Å; L421-H424 PolarHBondContact O-N 3.27Å; L421-H424 VanDerWaalsContact O-N 3.1Å; L421-G425 PolarHBondContact O-N 3Å |
| 422 | A | 75 | Confident | 68.1 | Low | 57 Ų | 57 | 52.6 Ų | 52.6 | 47% | 0.471 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.2 | -40.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111 | L418 G419 H424 G425 E426 | L418-A422 WeakPolarHBondContact O-CB 3.27Å; L418-A422 PolarHBondContact O-N 3.34Å; G419-A422 PolarHBondContact O-N 3.22Å; A422-H424 PolarHBondContact O-N 2.91Å; A422-G425 PolarHBondContact O-N 2.89Å; A422-G425 VanDerWaalsContact O-N 3.17Å; A422-E426 PolarHBondContact O-N 2.85Å |
| 423 | L | 66.9 | Low | 66 | Low | 3 Ų | 3 | 56.8 Ų | 56.8 | 2% | 0.016 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -59.8 | -43.5 | 172 | -178.5 | 65.6 | 0 | 0 | 0 | 112.3 | F295 G419 L420 L421 G425 E426 I427 M442 | F295-L423 HydrophobicContact CD1-CD2 4.2Å; F295-L423 HydrophobicContact CE1-CD2 3.32Å; F295-L423 HydrophobicContact CZ-CD2 3.91Å; G419-L423 PolarHBondContact O-N 3.49Å; L420-L423 WeakPolarHBondContact O-CB 3.44Å; L420-L423 PolarHBondContact O-N 3.47Å; L421-L423 VanDerWaalsContact C-N 3.26Å; L421-L423 PolarHBondContact O-N 2.75Å; L423-G425 VanDerWaalsContact C-N 3.27Å; L423-G425 PolarHBondContact O-N 2.94Å; L423-E426 PolarHBondContact O-N 3.34Å; L423-I427 HydrophobicContact CD1-CD1 3.59Å; L423-I427 HydrophobicContact CD1-CG1 4.04Å; L423-I427 HydrophobicContact CD2-CD1 4.19Å; L423-I427 HydrophobicContact CG-CD1 3.61Å; L423-I427 HydrophobicContact CG-CG1 4.35Å; L423-I427 WeakPolarHBondContact O-CB 3.42Å; L423-I427 VanDerWaalsContact O-CG1 3.25Å; L423-I427 WeakPolarHBondContact O-CG1 3.5Å; L423-I427 PolarHBondContact O-N 3.3Å; L423-M442 HydrophobicContact CB-CE 4.1Å; L423-M442 HydrophobicContact CB-SD 3.66Å; L423-M442 HydrophobicContact CD1-CG 4.24Å; L423-M442 HydrophobicContact CD1-SD 3.51Å; L423-M442 VanDerWaalsContact CD1-SD 3.51Å; L423-M442 HydrophobicContact CD2-CE 4.38Å; L423-M442 HydrophobicContact CD2-SD 3.65Å; L423-M442 HydrophobicContact CG-SD 3.75Å |
| 424 | H | 67.1 | Low | 64 | Low | 59 Ų | 59 | 64 Ų | 64 | 27% | 0.273 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.1 | -41.5 | 175.8 | -176.5 | 88.8 | 0 | 0 | 0 | 111.5 | S78 L420 L421 A422 S428 | S78-H424 PolarHBondContact O-ND1 2.96Å; L420-H424 PolarHBondContact O-N 3.18Å; L421-H424 WeakPolarHBondContact O-CB 3.28Å; L421-H424 PolarHBondContact O-N 3.27Å; L421-H424 VanDerWaalsContact O-N 3.1Å; A422-H424 PolarHBondContact O-N 2.91Å; H424-S428 WeakPolarHBondContact O-CB 3.48Å; H424-S428 PolarHBondContact O-N 3.48Å; H424-S428 PolarHBondContact O-OG 3.43Å |
| 425 | G | 59 | Low | 62.3 | Low | 42 Ų | 42 | 64.4 Ų | 64.4 | 43% | 0.433 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.4 | -44.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L421 A422 L423 S428 G429 | L421-G425 PolarHBondContact O-N 3Å; A422-G425 PolarHBondContact O-N 2.89Å; A422-G425 VanDerWaalsContact O-N 3.17Å; L423-G425 VanDerWaalsContact C-N 3.27Å; L423-G425 PolarHBondContact O-N 2.94Å; G425-S428 PolarHBondContact O-N 3.27Å; G425-G429 WeakPolarHBondContact O-CA 3.46Å; G425-G429 PolarHBondContact O-N 2.87Å |
| 426 | E | 59.9 | Low | 60.6 | Low | 92 Ų | 92 | 62.2 Ų | 62.2 | 43% | 0.43 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -68.1 | -39 | 179 | -72.1 | -174 | 174.9 | 0 | 0 | 112.6 | A422 L423 | A422-E426 PolarHBondContact O-N 2.85Å; L423-E426 PolarHBondContact O-N 3.34Å |
| 427 | I | 55.1 | Low | 59.6 | Low | 69 Ų | 69 | 63 Ų | 63 | 35% | 0.354 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -71.8 | -33 | 177.4 | -64.2 | 172.3 | 0 | 0 | 0 | 111.7 | E77 L423 | E77-I427 HydrophobicContact CB-CD1 4.44Å; L423-I427 HydrophobicContact CD1-CD1 3.59Å; L423-I427 HydrophobicContact CD1-CG1 4.04Å; L423-I427 HydrophobicContact CD2-CD1 4.19Å; L423-I427 HydrophobicContact CG-CD1 3.61Å; L423-I427 HydrophobicContact CG-CG1 4.35Å; L423-I427 WeakPolarHBondContact O-CB 3.42Å; L423-I427 VanDerWaalsContact O-CG1 3.25Å; L423-I427 WeakPolarHBondContact O-CG1 3.5Å; L423-I427 PolarHBondContact O-N 3.3Å |
| 428 | S | 52 | Low | 59.1 | Low | 70 Ų | 70 | 63.1 Ų | 63.1 | 49% | 0.49 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -92.5 | -20.6 | -174.6 | -50.2 | 0 | 0 | 0 | 0 | 113.8 | H424 G425 | H424-S428 WeakPolarHBondContact O-CB 3.48Å; H424-S428 PolarHBondContact O-N 3.48Å; H424-S428 PolarHBondContact O-OG 3.43Å; G425-S428 PolarHBondContact O-N 3.27Å |
| 429 | G | 42.4 | Very low | 58.8 | Low | 62 Ų | 62 | 59 Ų | 59 | 64% | 0.639 | 44% | 0.444 | S | S | * | . | S | Bend | trans | -91.2 | -9.3 | -168.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | G425 | G425-G429 WeakPolarHBondContact O-CA 3.46Å; G425-G429 PolarHBondContact O-N 2.87Å |
| 430 | T | 40.5 | Very low | 59 | Low | 106 Ų | 106 | 63.2 Ų | 63.2 | 65% | 0.65 | 45% | 0.454 | S | S | * | . | trans | -129.1 | 112.1 | 177.6 | 54.1 | 0 | 0 | 0 | 0 | 110.6 | G432 | T430-G432 PolarHBondContact O-N 3.44Š| ||
| 431 | G | 40.3 | Very low | 59.2 | Low | 100 Ų | 100 | 68.9 Ų | 68.9 | 100% | 1.031 | 48% | 0.48 | S | S | * | . | trans | -67.5 | 75.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 432 | G | 35.8 | Very low | 59.5 | Low | 53 Ų | 53 | 65.7 Ų | 65.7 | 55% | 0.546 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -177.3 | 72.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | T430 E434 | T430-G432 PolarHBondContact O-N 3.44Å; G432-E434 PolarHBondContact O-N 2.98Å |
| 433 | G | 39.2 | Very low | 60.3 | Low | 88 Ų | 88 | 63 Ų | 63 | 91% | 0.907 | 44% | 0.441 | S | S | * | . | 48 | 25.8 | 123.5 | 0 | 0 | 0 | 0 | 0 | 123 | |||||
| 434 | E | 42.8 | Very low | 61.4 | Low | 156 Ų | 156 | 63.9 Ų | 63.9 | 73% | 0.729 | 45% | 0.451 | S | S | * | . | trans | -124.5 | 83.4 | 165.2 | -70.6 | -165.7 | 165.9 | 0 | 0 | 111.3 | G432 G436 G437 | G432-E434 PolarHBondContact O-N 2.98Å; E434-G436 PolarHBondContact O-N 3.36Å; E434-G437 PolarHBondContact O-N 3.31Å | ||
| 435 | G | 47.9 | Very low | 62.6 | Low | 99 Ų | 99 | 62.5 Ų | 62.5 | 100% | 1.021 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | 37.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 436 | G | 52.2 | Low | 64.3 | Low | 16 Ų | 16 | 60.5 Ų | 60.5 | 17% | 0.165 | 43% | 0.432 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -145.6 | -10.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | E434 | E434-G436 PolarHBondContact O-N 3.36Š|
| 437 | G | 61.5 | Low | 66 | Low | 18 Ų | 18 | 56.5 Ų | 56.5 | 19% | 0.186 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -65.8 | -48.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E434 T439 R440 H441 | E434-G437 PolarHBondContact O-N 3.31Å; G437-T439 PolarHBondContact O-N 3.38Å; G437-R440 WeakPolarHBondContact O-CB 3.5Å; G437-R440 PolarHBondContact O-N 2.87Å; G437-R440 VanDerWaalsContact O-N 3.17Å; G437-H441 PolarHBondContact O-CD2 2.95Å; G437-H441 PolarHBondContact O-N 3.44Å |
| 438 | G | 73 | Confident | 67.9 | Low | 17 Ų | 17 | 59 Ų | 59 | 18% | 0.175 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -59.9 | -43.9 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | R440 H441 M442 | G438-R440 VanDerWaalsContact C-N 3.33Å; G438-R440 PolarHBondContact O-N 3.48Å; G438-H441 PolarHBondContact O-N 2.99Å; G438-M442 WeakPolarHBondContact O-CG 3.37Å; G438-M442 PolarHBondContact O-N 3.16Å |
| 439 | T | 80.1 | Confident | 69.9 | Low | 24 Ų | 24 | 57.6 Ų | 57.6 | 15% | 0.147 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -60.9 | -41 | 177.5 | -52.6 | 0 | 0 | 0 | 0 | 112.3 | L296 V300 G437 M442 F443 | L296-T439 HydrophobicContact CD2-CG2 4.32Å; V300-T439 HydrophobicContact CG2-CG2 3.76Å; G437-T439 PolarHBondContact O-N 3.38Å; T439-M442 PolarHBondContact O-N 2.87Å; T439-F443 HydrophobicContact CG2-CD2 4.01Å; T439-F443 HydrophobicContact CG2-CE2 3.46Å; T439-F443 VanDerWaalsContact CG2-CE2 3.46Å; T439-F443 HydrophobicContact CG2-CZ 4.1Å; T439-F443 VanDerWaalsContact O-CD2 3.27Å; T439-F443 WeakPolarHBondContact O-CD2 3.36Å; T439-F443 PolarHBondContact O-N 3.31Å; T439-F443 VanDerWaalsContact O-N 3.1Å |
| 440 | R | 84.9 | Confident | 72.5 | Confident | 109 Ų | 109 | 54.7 Ų | 54.7 | 41% | 0.411 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.8 | -44.6 | 176.5 | 179.2 | -179 | 177.8 | -161.7 | -2.8 | 111.7 | T357 G437 G438 M442 F443 G444 | T357-R440 PolarHBondContact O-NE 2.65Å; G437-R440 WeakPolarHBondContact O-CB 3.5Å; G437-R440 PolarHBondContact O-N 2.87Å; G437-R440 VanDerWaalsContact O-N 3.17Å; G438-R440 VanDerWaalsContact C-N 3.33Å; G438-R440 PolarHBondContact O-N 3.48Å; R440-M442 VanDerWaalsContact C-N 3.3Å; R440-M442 PolarHBondContact O-N 3.38Å; R440-F443 PolarHBondContact O-N 2.89Å; R440-G444 PolarHBondContact O-N 2.9Å |
| 441 | H | 85.8 | Confident | 75.1 | Confident | 121 Ų | 121 | 53.7 Ų | 53.7 | 56% | 0.56 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -61.6 | -39 | 177.1 | -72.5 | -64.3 | 0 | 0 | 0 | 111.8 | G437 G438 G444 G445 | G437-H441 PolarHBondContact O-CD2 2.95Å; G437-H441 PolarHBondContact O-N 3.44Å; G438-H441 PolarHBondContact O-N 2.99Å; H441-G444 PolarHBondContact O-N 3.11Å; H441-G445 PolarHBondContact O-N 3.45Å |
| 442 | M | 87.2 | Confident | 77.8 | Confident | 18 Ų | 18 | 51.1 Ų | 51.1 | 9% | 0.089 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 174.9 | -70.7 | -172.7 | 86.4 | 0 | 0 | 113.1 | I292 L296 L420 L423 G438 T439 R440 G444 G445 C446 | I292-M442 HydrophobicContact CG2-CE 3.53Å; L296-M442 HydrophobicContact CD1-CB 3.86Å; L296-M442 HydrophobicContact CD1-CE 4.08Å; L296-M442 HydrophobicContact CD1-SD 3.89Å; L296-M442 HydrophobicContact CD2-CE 4.44Å; L296-M442 HydrophobicContact CD2-SD 3.7Å; L296-M442 HydrophobicContact CG-CE 4.45Å; L296-M442 HydrophobicContact CG-SD 4.23Å; L420-M442 HydrophobicContact CD2-CE 4.25Å; L423-M442 HydrophobicContact CB-CE 4.1Å; L423-M442 HydrophobicContact CB-SD 3.66Å; L423-M442 HydrophobicContact CD1-CG 4.24Å; L423-M442 HydrophobicContact CD1-SD 3.51Å; L423-M442 VanDerWaalsContact CD1-SD 3.51Å; L423-M442 HydrophobicContact CD2-CE 4.38Å; L423-M442 HydrophobicContact CD2-SD 3.65Å; L423-M442 HydrophobicContact CG-SD 3.75Å; G438-M442 WeakPolarHBondContact O-CG 3.37Å; G438-M442 PolarHBondContact O-N 3.16Å; T439-M442 PolarHBondContact O-N 2.87Å; R440-M442 VanDerWaalsContact C-N 3.3Å; R440-M442 PolarHBondContact O-N 3.38Å; M442-G444 VanDerWaalsContact C-N 3.27Å; M442-G444 PolarHBondContact O-N 3.27Å; M442-G445 PolarHBondContact O-N 3.29Å; M442-C446 PolarHBondContact O-N 3.4Å; M442-C446 PolarHBondContact O-SG 2.64Å |
| 443 | F | 91.9 | Very high | 80.6 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64 | -35.4 | 175.5 | -68 | -43.6 | 0 | 0 | 0 | 112 | L296 V300 F353 L356 T357 T360 F374 T439 R440 C446 A447 | L296-F443 HydrophobicContact CB-CE1 4.02Å; L296-F443 HydrophobicContact CB-CZ 3.99Å; L296-F443 HydrophobicContact CD1-CD1 4.03Å; L296-F443 HydrophobicContact CD1-CE1 3.62Å; L296-F443 HydrophobicContact CD1-CZ 4.09Å; L296-F443 HydrophobicContact CG-CE1 4.48Å; V300-F443 HydrophobicContact CG2-CE2 3.94Å; V300-F443 HydrophobicContact CG2-CZ 3.94Å; F353-F443 AromaticContact CD1-CD1 3.67Å; F353-F443 HydrophobicContact CD1-CD1 3.67Å; F353-F443 HydrophobicContact CD1-CE1 4.33Å; F353-F443 AromaticContact CE1-CD1 3.92Å; F353-F443 HydrophobicContact CE1-CD1 3.92Å; F353-F443 HydrophobicContact CE1-CE1 4.2Å; L356-F443 HydrophobicContact CB-CB 4.06Å; L356-F443 HydrophobicContact CB-CD1 4.11Å; L356-F443 HydrophobicContact CB-CD2 3.69Å; L356-F443 HydrophobicContact CB-CE1 4.46Å; L356-F443 HydrophobicContact CB-CE2 4.08Å; L356-F443 HydrophobicContact CB-CG 3.7Å; L356-F443 HydrophobicContact CB-CZ 4.44Å; L356-F443 HydrophobicContact CD1-CD1 3.96Å; L356-F443 HydrophobicContact CD1-CE1 3.82Å; L356-F443 HydrophobicContact CD1-CG 4.42Å; L356-F443 HydrophobicContact CD1-CZ 4.18Å; L356-F443 HydrophobicContact CD2-CE2 4.31Å; L356-F443 HydrophobicContact CD2-CZ 4.31Å; T357-F443 HydrophobicContact CG2-CB 3.96Å; T360-F443 HydrophobicContact CG2-CD2 4.2Å; T360-F443 HydrophobicContact CG2-CE2 3.75Å; F374-F443 HydrophobicContact CE1-CE1 4.39Å; F374-F443 HydrophobicContact CE1-CZ 4.12Å; F374-F443 HydrophobicContact CZ-CZ 4.25Å; T439-F443 HydrophobicContact CG2-CD2 4.01Å; T439-F443 HydrophobicContact CG2-CE2 3.46Å; T439-F443 VanDerWaalsContact CG2-CE2 3.46Å; T439-F443 HydrophobicContact CG2-CZ 4.1Å; T439-F443 VanDerWaalsContact O-CD2 3.27Å; T439-F443 WeakPolarHBondContact O-CD2 3.36Å; T439-F443 PolarHBondContact O-N 3.31Å; T439-F443 VanDerWaalsContact O-N 3.1Å; R440-F443 PolarHBondContact O-N 2.89Å; F443-C446 PolarHBondContact O-N 3.3Å; F443-A447 PolarHBondContact O-N 3.17Å |
| 444 | G | 91.8 | Very high | 83.3 | Confident | 23 Ų | 23 | 45.7 Ų | 45.7 | 24% | 0.237 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61 | -46.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R440 H441 M442 C446 A447 I448 | R440-G444 PolarHBondContact O-N 2.9Å; H441-G444 PolarHBondContact O-N 3.11Å; M442-G444 VanDerWaalsContact C-N 3.27Å; M442-G444 PolarHBondContact O-N 3.27Å; G444-C446 PolarHBondContact O-N 3.4Å; G444-A447 PolarHBondContact O-N 3.03Å; G444-I448 WeakPolarHBondContact O-CG1 3.46Å; G444-I448 PolarHBondContact O-N 3.39Å |
| 445 | G | 91.2 | Very high | 85.8 | Confident | 29 Ų | 29 | 43.5 Ų | 43.5 | 30% | 0.299 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.7 | -41.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.9 | H441 M442 I448 M449 | H441-G445 PolarHBondContact O-N 3.45Å; M442-G445 PolarHBondContact O-N 3.29Å; G445-I448 PolarHBondContact O-N 3.34Å; G445-M449 WeakPolarHBondContact O-CG 3.4Å; G445-M449 PolarHBondContact O-N 3.4Å |
| 446 | C | 93.8 | Very high | 87.9 | Confident | 1 Ų | 1 | 39.5 Ų | 39.5 | 1% | 0.007 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -62.5 | -42.7 | 174.9 | -66 | 0 | 0 | 0 | 0 | 112.1 | V289 F353 M442 F443 G444 I448 M449 M450 | V289-C446 HydrophobicContact CG1-CB 3.85Å; V289-C446 HydrophobicContact CG2-CB 4.06Å; F353-C446 HydrophobicContact CB-CB 4.25Å; F353-C446 HydrophobicContact CD1-CB 3.54Å; F353-C446 HydrophobicContact CD2-CB 4.05Å; F353-C446 HydrophobicContact CE1-CB 3.83Å; F353-C446 HydrophobicContact CE2-CB 4.34Å; F353-C446 HydrophobicContact CG-CB 3.66Å; F353-C446 HydrophobicContact CZ-CB 4.23Å; M442-C446 PolarHBondContact O-N 3.4Å; M442-C446 PolarHBondContact O-SG 2.64Å; F443-C446 PolarHBondContact O-N 3.3Å; G444-C446 PolarHBondContact O-N 3.4Å; C446-I448 VanDerWaalsContact C-N 3.34Å; C446-I448 PolarHBondContact O-N 3.29Å; C446-M449 PolarHBondContact O-N 3.18Å; C446-M450 WeakPolarHBondContact O-CG 3.24Å; C446-M450 PolarHBondContact O-N 3.12Å |
| 447 | A | 95.8 | Very high | 89.8 | Confident | 7 Ų | 7 | 38.8 Ų | 38.8 | 6% | 0.058 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.7 | -41.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | F350 F353 F443 G444 M450 L451 | F350-A447 HydrophobicContact CD2-CB 4.27Å; F350-A447 VanDerWaalsContact CD2-O 3.32Å; F350-A447 WeakPolarHBondContact CD2-O 3.37Å; F350-A447 HydrophobicContact CE2-CB 4.21Å; F353-A447 HydrophobicContact CB-CB 4Å; F443-A447 PolarHBondContact O-N 3.17Å; G444-A447 PolarHBondContact O-N 3.03Å; A447-M450 PolarHBondContact O-N 3.02Å; A447-L451 PolarHBondContact O-N 3.31Å |
| 448 | I | 95.1 | Very high | 91.3 | Very high | 121 Ų | 121 | 41.5 Ų | 41.5 | 62% | 0.621 | 23% | 0.23 | S | C | * | . | H | α-helix | trans | -62.8 | -44 | 175.4 | -66.2 | 166.6 | 0 | 0 | 0 | 111.1 | G444 G445 C446 M450 L451 A452 | G444-I448 WeakPolarHBondContact O-CG1 3.46Å; G444-I448 PolarHBondContact O-N 3.39Å; G445-I448 PolarHBondContact O-N 3.34Å; C446-I448 VanDerWaalsContact C-N 3.34Å; C446-I448 PolarHBondContact O-N 3.29Å; I448-M450 VanDerWaalsContact C-N 3.31Å; I448-M450 PolarHBondContact O-N 3.47Å; I448-L451 WeakPolarHBondContact O-CB 3.41Å; I448-L451 PolarHBondContact O-N 3.45Å; I448-A452 PolarHBondContact O-N 3.37Å |
| 449 | M | 94.4 | Very high | 92.1 | Very high | 41 Ų | 41 | 42.9 Ų | 42.9 | 20% | 0.202 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.4 | -37.5 | 175.8 | -72.8 | -170.7 | -76.3 | 0 | 0 | 112.2 | L285 V289 I292 G445 C446 A452 A453 | L285-M449 HydrophobicContact CD2-CB 4.32Å; L285-M449 HydrophobicContact CD2-CG 4.34Å; V289-M449 HydrophobicContact CG2-CB 3.86Å; V289-M449 HydrophobicContact CG2-CE 3.53Å; V289-M449 HydrophobicContact CG2-SD 4.16Å; I292-M449 HydrophobicContact CD1-CE 3.91Å; G445-M449 WeakPolarHBondContact O-CG 3.4Å; G445-M449 PolarHBondContact O-N 3.4Å; C446-M449 PolarHBondContact O-N 3.18Å; M449-A452 PolarHBondContact O-N 3.1Å; M449-A453 WeakPolarHBondContact O-CB 3.49Å; M449-A453 PolarHBondContact O-N 3.05Å |
| 450 | M | 96.9 | Very high | 92.5 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.2 | -37.8 | 174.3 | -69.6 | -55.6 | 89 | 0 | 0 | 112 | L285 F286 V289 I346 A349 F350 F353 C446 A447 I448 A453 L454 | L285-M450 VanDerWaalsContact O-CE 3.32Å; L285-M450 WeakPolarHBondContact O-CE 3.37Å; F286-M450 HydrophobicContact CB-CE 4.41Å; F286-M450 HydrophobicContact CD2-CE 4.37Å; F286-M450 HydrophobicContact CD2-SD 3.71Å; F286-M450 HydrophobicContact CE2-SD 4.16Å; F286-M450 HydrophobicContact CG-SD 4.48Å; V289-M450 HydrophobicContact CB-CE 3.7Å; V289-M450 HydrophobicContact CG1-CE 4.05Å; V289-M450 HydrophobicContact CG1-SD 4.47Å; V289-M450 HydrophobicContact CG2-CE 3.52Å; I346-M450 VanDerWaalsContact CG2-O 3.28Å; I346-M450 WeakPolarHBondContact CG2-O 3.45Å; A349-M450 HydrophobicContact CB-CG 4.16Å; A349-M450 HydrophobicContact CB-SD 3.78Å; F350-M450 HydrophobicContact CB-CB 3.89Å; F350-M450 HydrophobicContact CD2-CB 4.41Å; F353-M450 HydrophobicContact CD2-CG 4Å; F353-M450 HydrophobicContact CE2-CG 4.48Å; C446-M450 WeakPolarHBondContact O-CG 3.24Å; C446-M450 PolarHBondContact O-N 3.12Å; A447-M450 PolarHBondContact O-N 3.02Å; I448-M450 VanDerWaalsContact C-N 3.31Å; I448-M450 PolarHBondContact O-N 3.47Å; M450-A453 WeakPolarHBondContact O-CB 3.43Å; M450-A453 PolarHBondContact O-N 3.27Å; M450-L454 WeakPolarHBondContact O-CB 3.27Å; M450-L454 PolarHBondContact O-N 3.01Å |
| 451 | L | 96 | Very high | 92.5 | Very high | 85 Ų | 85 | 39.3 Ų | 39.3 | 45% | 0.445 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.1 | -41.8 | 174.2 | -173 | 64.8 | 0 | 0 | 0 | 111.5 | F350 A447 I448 A453 L454 M455 | F350-L451 HydrophobicContact CD2-CB 4.3Å; F350-L451 HydrophobicContact CE2-CB 4.31Å; A447-L451 PolarHBondContact O-N 3.31Å; I448-L451 WeakPolarHBondContact O-CB 3.41Å; I448-L451 PolarHBondContact O-N 3.45Å; L451-A453 VanDerWaalsContact C-N 3.32Å; L451-A453 PolarHBondContact O-N 3.17Å; L451-L454 HydrophobicContact CD1-CD2 4.46Å; L451-L454 WeakPolarHBondContact O-CB 3.34Å; L451-L454 PolarHBondContact O-N 3.37Å; L451-M455 WeakPolarHBondContact O-CG 3.44Å; L451-M455 PolarHBondContact O-N 2.88Å |
| 452 | A | 95.8 | Very high | 92.5 | Very high | 47 Ų | 47 | 38 Ų | 38 | 39% | 0.388 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.4 | -40.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L285 I448 M449 L454 M455 A456 | L285-A452 HydrophobicContact CD1-CB 4.01Å; I448-A452 PolarHBondContact O-N 3.37Å; M449-A452 PolarHBondContact O-N 3.1Å; A452-L454 VanDerWaalsContact C-N 3.33Å; A452-L454 PolarHBondContact O-N 3.2Å; A452-M455 PolarHBondContact O-N 3.43Å; A452-A456 WeakPolarHBondContact O-CB 3.26Å; A452-A456 PolarHBondContact O-N 3.25Å |
| 453 | A | 95.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.9 | -40.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L285 I346 M449 M450 L451 A456 V457 | L285-A453 HydrophobicContact CB-CB 3.84Å; L285-A453 HydrophobicContact CD1-CB 4.06Å; I346-A453 HydrophobicContact CD1-CB 4.33Å; I346-A453 HydrophobicContact CG2-CB 4.07Å; M449-A453 WeakPolarHBondContact O-CB 3.49Å; M449-A453 PolarHBondContact O-N 3.05Å; M450-A453 WeakPolarHBondContact O-CB 3.43Å; M450-A453 PolarHBondContact O-N 3.27Å; L451-A453 VanDerWaalsContact C-N 3.32Å; L451-A453 PolarHBondContact O-N 3.17Å; A453-A456 PolarHBondContact O-N 3.4Å; A453-V457 WeakPolarHBondContact O-CG2 3.48Å; A453-V457 PolarHBondContact O-N 2.96Å |
| 454 | L | 95.1 | Very high | 91.3 | Very high | 27 Ų | 27 | 41.9 Ų | 41.9 | 14% | 0.141 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.3 | -45.2 | 176.7 | -174.2 | 63.2 | 0 | 0 | 0 | 111.1 | I346 L347 M450 L451 A452 A456 V457 I458 | I346-L454 HydrophobicContact CG2-CB 3.88Å; I346-L454 HydrophobicContact CG2-CD1 4.38Å; L347-L454 HydrophobicContact CD1-CD2 4.26Å; M450-L454 WeakPolarHBondContact O-CB 3.27Å; M450-L454 PolarHBondContact O-N 3.01Å; L451-L454 HydrophobicContact CD1-CD2 4.46Å; L451-L454 WeakPolarHBondContact O-CB 3.34Å; L451-L454 PolarHBondContact O-N 3.37Å; A452-L454 VanDerWaalsContact C-N 3.33Å; A452-L454 PolarHBondContact O-N 3.2Å; L454-A456 VanDerWaalsContact C-N 3.32Å; L454-A456 PolarHBondContact O-N 2.85Å; L454-V457 PolarHBondContact O-N 3.47Å; L454-I458 HydrophobicContact CD1-CD1 4.39Å; L454-I458 HydrophobicContact CG-CD1 4Å; L454-I458 VanDerWaalsContact O-CG1 3.26Å; L454-I458 WeakPolarHBondContact O-CG1 3.23Å; L454-I458 PolarHBondContact O-N 3.17Å |
| 455 | M | 94.8 | Very high | 90.3 | Very high | 109 Ų | 109 | 50 Ų | 50 | 54% | 0.537 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.5 | -39.1 | 175.9 | -66.8 | -57 | -64.9 | 0 | 0 | 112.2 | L451 A452 I458 S459 | L451-M455 WeakPolarHBondContact O-CG 3.44Å; L451-M455 PolarHBondContact O-N 2.88Å; A452-M455 PolarHBondContact O-N 3.43Å; M455-I458 PolarHBondContact O-N 3.23Å; M455-S459 WeakPolarHBondContact O-CB 3.48Å; M455-S459 PolarHBondContact O-N 3.4Å; M455-S459 PolarHBondContact O-OG 3.46Å |
| 456 | A | 93.3 | Very high | 88.9 | Confident | 16 Ų | 16 | 56 Ų | 56 | 13% | 0.132 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.3 | -41 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | L278 V282 A452 A453 L454 S459 L460 | L278-A456 HydrophobicContact CD2-CB 4.33Å; V282-A456 HydrophobicContact CG2-CB 3.6Å; A452-A456 WeakPolarHBondContact O-CB 3.26Å; A452-A456 PolarHBondContact O-N 3.25Å; A453-A456 PolarHBondContact O-N 3.4Å; L454-A456 VanDerWaalsContact C-N 3.32Å; L454-A456 PolarHBondContact O-N 2.85Å; A456-S459 WeakPolarHBondContact O-CB 3.49Å; A456-S459 PolarHBondContact O-N 3.4Å; A456-L460 PolarHBondContact O-N 3.41Å |
| 457 | V | 92.6 | Very high | 87.6 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.9 | -44.4 | 174.3 | 169.9 | 0 | 0 | 0 | 0 | 111.8 | V282 L342 C343 I346 A453 L454 S459 L460 F461 | V282-V457 HydrophobicContact CB-CG2 3.97Å; V282-V457 HydrophobicContact CG1-CG2 3.4Å; V282-V457 HydrophobicContact CG2-CB 4.28Å; V282-V457 HydrophobicContact CG2-CG2 3.3Å; L342-V457 HydrophobicContact CD2-CG1 4.29Å; L342-V457 HydrophobicContact CD2-CG2 3.86Å; L342-V457 HydrophobicContact CG-CG1 4.37Å; L342-V457 HydrophobicContact CG-CG2 4.1Å; C343-V457 WeakPolarHBondContact SG-CG1 3.38Å; I346-V457 HydrophobicContact CD1-CB 4.15Å; I346-V457 HydrophobicContact CD1-CG2 3.26Å; A453-V457 WeakPolarHBondContact O-CG2 3.48Å; A453-V457 PolarHBondContact O-N 2.96Å; L454-V457 PolarHBondContact O-N 3.47Å; V457-S459 VanDerWaalsContact C-N 3.26Å; V457-S459 PolarHBondContact O-N 2.94Å; V457-L460 WeakPolarHBondContact O-CB 3.38Å; V457-L460 PolarHBondContact O-N 3.28Å; V457-L460 VanDerWaalsContact O-N 3.15Å; V457-F461 HydrophobicContact CG1-CD2 3.72Å; V457-F461 HydrophobicContact CG1-CE2 3.09Å; V457-F461 HydrophobicContact CG1-CZ 3.68Å; V457-F461 VanDerWaalsContact O-CD2 3.32Å; V457-F461 WeakPolarHBondContact O-CD2 3.45Å; V457-F461 PolarHBondContact O-N 2.86Å |
| 458 | I | 91.3 | Very high | 85.9 | Confident | 75 Ų | 75 | 63.5 Ų | 63.5 | 39% | 0.385 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 176.3 | -68.4 | 165.6 | 0 | 0 | 0 | 109.7 | L454 M455 L460 F461 T462 | L454-I458 HydrophobicContact CD1-CD1 4.39Å; L454-I458 HydrophobicContact CG-CD1 4Å; L454-I458 VanDerWaalsContact O-CG1 3.26Å; L454-I458 WeakPolarHBondContact O-CG1 3.23Å; L454-I458 PolarHBondContact O-N 3.17Å; M455-I458 PolarHBondContact O-N 3.23Å; I458-L460 VanDerWaalsContact C-N 3.32Å; I458-L460 PolarHBondContact O-N 3.45Å; I458-F461 PolarHBondContact O-N 2.99Å; I458-T462 HydrophobicContact CG2-CG2 4.44Å; I458-T462 WeakPolarHBondContact O-CG2 3.4Å; I458-T462 PolarHBondContact O-N 3.46Å; I458-T462 PolarHBondContact O-OG1 3.1Å |
| 459 | S | 90.5 | Very high | 84.2 | Confident | 47 Ų | 47 | 62.9 Ų | 62.9 | 33% | 0.329 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.8 | -36.6 | 176.6 | -58.5 | 0 | 0 | 0 | 0 | 112.7 | M455 A456 V457 T462 L463 | M455-S459 WeakPolarHBondContact O-CB 3.48Å; M455-S459 PolarHBondContact O-N 3.4Å; M455-S459 PolarHBondContact O-OG 3.46Å; A456-S459 WeakPolarHBondContact O-CB 3.49Å; A456-S459 PolarHBondContact O-N 3.4Å; V457-S459 VanDerWaalsContact C-N 3.26Å; V457-S459 PolarHBondContact O-N 2.94Å; S459-T462 WeakPolarHBondContact CA-OG1 3.25Å; S459-T462 PolarHBondContact O-OG1 3.04Å; S459-L463 WeakPolarHBondContact O-CB 3.41Å; S459-L463 WeakPolarHBondContact O-CD1 3.25Å; S459-L463 WeakPolarHBondContact O-CG 3.34Å; S459-L463 PolarHBondContact O-N 3.32Å; S459-L463 VanDerWaalsContact O-N 3.14Å |
| 460 | L | 88.6 | Confident | 82.6 | Confident | 4 Ų | 4 | 62.1 Ų | 62.1 | 2% | 0.021 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.1 | -45.1 | 174 | -179 | 63.3 | 0 | 0 | 0 | 110.6 | R275 L278 L279 A456 V457 I458 L463 S464 | R275-L460 HydrophobicContact CB-CD1 3.85Å; R275-L460 HydrophobicContact CG-CD1 4.25Å; L278-L460 HydrophobicContact CB-CB 4.2Å; L278-L460 HydrophobicContact CB-CD1 4.09Å; L278-L460 HydrophobicContact CD1-CB 4.35Å; L279-L460 HydrophobicContact CB-CD2 4.27Å; L279-L460 HydrophobicContact CD1-CD2 4.28Å; A456-L460 PolarHBondContact O-N 3.41Å; V457-L460 WeakPolarHBondContact O-CB 3.38Å; V457-L460 PolarHBondContact O-N 3.28Å; V457-L460 VanDerWaalsContact O-N 3.15Å; I458-L460 VanDerWaalsContact C-N 3.32Å; I458-L460 PolarHBondContact O-N 3.45Å; L460-L463 PolarHBondContact O-N 2.88Å; L460-S464 VanDerWaalsContact O-CB 3.32Å; L460-S464 WeakPolarHBondContact O-CB 3.42Å; L460-S464 PolarHBondContact O-N 3.3Å; L460-S464 PolarHBondContact O-OG 3.14Å |
| 461 | F | 84.4 | Confident | 80.9 | Confident | 54 Ų | 54 | 66.8 Ų | 66.8 | 24% | 0.237 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -72.7 | -31.9 | -179.7 | -63.2 | -39.8 | 0 | 0 | 0 | 114.3 | G339 C343 V457 I458 L463 S464 R465 | G339-F461 VanDerWaalsContact C-CZ 3.42Å; G339-F461 WeakPolarHBondContact O-CE2 3.46Å; G339-F461 VanDerWaalsContact O-CZ 3.28Å; G339-F461 WeakPolarHBondContact O-CZ 3.19Å; C343-F461 VanDerWaalsContact SG-CE2 3.56Å; V457-F461 HydrophobicContact CG1-CD2 3.72Å; V457-F461 HydrophobicContact CG1-CE2 3.09Å; V457-F461 HydrophobicContact CG1-CZ 3.68Å; V457-F461 VanDerWaalsContact O-CD2 3.32Å; V457-F461 WeakPolarHBondContact O-CD2 3.45Å; V457-F461 PolarHBondContact O-N 2.86Å; I458-F461 PolarHBondContact O-N 2.99Å; F461-L463 VanDerWaalsContact C-N 3.33Å; F461-S464 WeakPolarHBondContact CA-OG 3.35Å; F461-S464 PolarHBondContact O-N 3.27Å; F461-R465 PolarHBondContact O-N 3.37Å |
| 462 | T | 85.1 | Confident | 79.1 | Confident | 93 Ų | 93 | 65.2 Ų | 65.2 | 57% | 0.571 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -66.4 | -39.3 | 172.8 | 54.8 | 0 | 0 | 0 | 0 | 111 | I458 S459 S464 | I458-T462 HydrophobicContact CG2-CG2 4.44Å; I458-T462 WeakPolarHBondContact O-CG2 3.4Å; I458-T462 PolarHBondContact O-N 3.46Å; I458-T462 PolarHBondContact O-OG1 3.1Å; S459-T462 WeakPolarHBondContact CA-OG1 3.25Å; S459-T462 PolarHBondContact O-OG1 3.04Å; T462-S464 VanDerWaalsContact C-N 3.32Å |
| 463 | L | 81.2 | Confident | 77 | Confident | 89 Ų | 89 | 70.7 Ų | 70.7 | 47% | 0.466 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -70.5 | -26.7 | 174.9 | -74.2 | 167.3 | 0 | 0 | 0 | 113.6 | L278 S459 L460 F461 | L278-L463 HydrophobicContact CD1-CD1 3.42Å; L278-L463 VanDerWaalsContact CD1-CD1 3.42Å; S459-L463 WeakPolarHBondContact O-CB 3.41Å; S459-L463 WeakPolarHBondContact O-CD1 3.25Å; S459-L463 WeakPolarHBondContact O-CG 3.34Å; S459-L463 PolarHBondContact O-N 3.32Å; S459-L463 VanDerWaalsContact O-N 3.14Å; L460-L463 PolarHBondContact O-N 2.88Å; F461-L463 VanDerWaalsContact C-N 3.33Å |
| 464 | S | 73.3 | Confident | 74.5 | Confident | 11 Ų | 11 | 73.1 Ų | 73.1 | 8% | 0.077 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -101.8 | 7.2 | -177.5 | 79.6 | 0 | 0 | 0 | 0 | 114.4 | L460 F461 T462 N466 D467 | L460-S464 VanDerWaalsContact O-CB 3.32Å; L460-S464 WeakPolarHBondContact O-CB 3.42Å; L460-S464 PolarHBondContact O-N 3.3Å; L460-S464 PolarHBondContact O-OG 3.14Å; F461-S464 WeakPolarHBondContact CA-OG 3.35Å; F461-S464 PolarHBondContact O-N 3.27Å; T462-S464 VanDerWaalsContact C-N 3.32Å; S464-N466 PolarHBondContact O-N 3.41Å; S464-N466 VanDerWaalsContact O-N 3.1Å; S464-D467 WeakPolarHBondContact O-CB 3.49Å; S464-D467 PolarHBondContact O-N 2.74Å |
| 465 | R | 70.3 | Confident | 71.8 | Confident | 193 Ų | 193 | 76 Ų | 76 | 73% | 0.728 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | -31.3 | -173 | -171.5 | 174.2 | 178.7 | 176.3 | -0.6 | 113.8 | F461 R471 | F461-R465 PolarHBondContact O-N 3.37Å; R465-R471 PolarHBondContact O-NH2 3.01Å |
| 466 | N | 62.5 | Low | 69.3 | Low | 155 Ų | 155 | 82.7 Ų | 82.7 | 83% | 0.829 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.2 | 2.5 | -179.6 | -64.8 | -9.2 | 0 | 0 | 0 | 113.5 | S464 | S464-N466 PolarHBondContact O-N 3.41Å; S464-N466 VanDerWaalsContact O-N 3.1Å |
| 467 | D | 66.3 | Low | 66.6 | Low | 31 Ų | 31 | 85.1 Ų | 85.1 | 17% | 0.166 | 45% | 0.446 | C | S | . | . | trans | -90.7 | 114.9 | -177.6 | -149.6 | -41.8 | 0 | 0 | 0 | 110.9 | R275 S464 D469 L470 | R275-D467 IonicContact CZ-OD2 2.83Å; R275-D467 IonicContact NH1-OD2 2.65Å; R275-D467 PolarHBondContact NH1-OD2 3.05Å; R275-D467 IonicContact NH2-OD2 2.61Å; R275-D467 PolarHBondContact NH2-OD2 3.05Å; S464-D467 WeakPolarHBondContact O-CB 3.49Å; S464-D467 PolarHBondContact O-N 2.74Å; D467-D469 VanDerWaalsContact C-N 3.28Å; D467-D469 PolarHBondContact OD1-N 2.99Å; D467-L470 HydrophobicContact CB-CD1 4.11Å | ||
| 468 | I | 60.3 | Low | 63.9 | Low | 135 Ų | 135 | 95 Ų | 95 | 69% | 0.692 | 49% | 0.492 | S | S | * | . | G | 310 helix | trans | -72.5 | -28.9 | -177.1 | -59.5 | 172.7 | 0 | 0 | 0 | 110 | L470 R471 | I468-L470 PolarHBondContact O-N 3.25Å; I468-R471 PolarHBondContact O-N 3.45Å; I468-R471 VanDerWaalsContact O-N 3.17Å |
| 469 | D | 60.6 | Low | 61.5 | Low | 108 Ų | 108 | 95 Ų | 95 | 58% | 0.578 | 51% | 0.511 | S | S | * | . | G | 310 helix | trans | -71 | -14 | -174.4 | -66.5 | -20.6 | 0 | 0 | 0 | 113.6 | R394 D467 | R394-D469 WeakPolarHBondContact CD-O 3.47Å; D467-D469 VanDerWaalsContact C-N 3.28Å; D467-D469 PolarHBondContact OD1-N 2.99Å |
| 470 | L | 59.1 | Low | 58.9 | Low | 24 Ų | 24 | 102.1 Ų | 102.1 | 13% | 0.126 | 54% | 0.539 | C | S | . | . | G | 310 helix | trans | -94.1 | -5.4 | 178.4 | -74.7 | 166.3 | 0 | 0 | 0 | 113.7 | L391 R394 V395 D467 I468 | L391-L470 HydrophobicContact CD2-CD2 3.86Å; R394-L470 HydrophobicContact CB-CD2 4.01Å; V395-L470 HydrophobicContact CG2-CD2 3.67Å; D467-L470 HydrophobicContact CB-CD1 4.11Å; I468-L470 PolarHBondContact O-N 3.25Å |
| 471 | R | 61.4 | Low | 56.5 | Low | 100 Ų | 100 | 110.9 Ų | 110.9 | 38% | 0.377 | 58% | 0.582 | S | S | . | * | S | Bend | trans | -89.1 | 150 | 174.3 | -61.3 | -173.1 | -177.6 | -178.9 | 4.7 | 109.9 | R465 I468 E473 | R465-R471 PolarHBondContact O-NH2 3.01Å; I468-R471 PolarHBondContact O-N 3.45Å; I468-R471 VanDerWaalsContact O-N 3.17Å; R471-E473 PolarHBondContact O-N 2.92Å |
| 472 | L | 59.1 | Low | 54.1 | Low | 51 Ų | 51 | 121.3 Ų | 121.3 | 27% | 0.267 | 63% | 0.632 | S | S | . | * | trans | -60.2 | 130.8 | 167.1 | -77.5 | 162 | 0 | 0 | 0 | 108.6 | L336 P338 F390 G474 | L336-L472 WeakPolarHBondContact O-CD1 3.15Å; P338-L472 HydrophobicContact CG-CD1 4.32Å; P338-L472 HydrophobicContact CG-CD2 4.38Å; P338-L472 HydrophobicContact CG-CG 4.21Å; F390-L472 HydrophobicContact CE2-CD2 4.21Å; F390-L472 HydrophobicContact CZ-CD2 4.18Å; L472-G474 PolarHBondContact O-N 2.86Å | ||
| 473 | E | 51.1 | Low | 52.5 | Low | 162 Ų | 162 | 122.8 Ų | 122.8 | 76% | 0.757 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | 81.6 | 175.7 | -76.1 | 166.3 | -148.4 | 0 | 0 | 109.8 | R394 R471 | R394-E473 IonicContact CZ-OE1 2.94Å; R394-E473 IonicContact NH1-OE1 3.07Å; R394-E473 PolarHBondContact NH1-OE1 3.17Å; R394-E473 IonicContact NH2-OE1 3.35Å; R394-E473 PolarHBondContact NH2-OE1 2.67Å; R471-E473 PolarHBondContact O-N 2.92Å |
| 474 | G | 44.2 | Very low | 51 | Low | 51 Ų | 51 | 124.5 Ų | 124.5 | 53% | 0.526 | 64% | 0.644 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -174.7 | 1.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L472 R476 | L472-G474 PolarHBondContact O-N 2.86Å; G474-R476 PolarHBondContact O-N 2.81Å |
| 475 | C | 37.8 | Very low | 49.8 | Very low | 88 Ų | 88 | 130.8 Ų | 130.8 | 60% | 0.595 | 68% | 0.675 | S | S | * | * | trans | -79.7 | 15.6 | 177.6 | -153.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 476 | R | 41.4 | Very low | 48.6 | Very low | 249 Ų | 249 | 127.2 Ų | 127.2 | 94% | 0.94 | 67% | 0.672 | S | S | * | * | trans | -120 | 111.3 | 179 | -134.9 | -178.4 | 178.7 | -167.5 | -2.2 | 110.3 | G474 | G474-R476 PolarHBondContact O-N 2.81Š| ||
| 477 | G | 37.4 | Very low | 47.7 | Very low | 68 Ų | 68 | 125.4 Ų | 125.4 | 70% | 0.701 | 66% | 0.662 | S | S | * | * | S | Bend | trans | 127.3 | 104.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 107 | ||
| 478 | E | 36.9 | Very low | 46.5 | Very low | 206 Ų | 206 | 131.7 Ų | 131.7 | 96% | 0.963 | 70% | 0.695 | S | S | * | * | S | Bend | cis | -145.5 | 141.1 | 28.3 | -65.8 | 160.5 | 147.7 | 0 | 0 | 107.5 | ||
| 479 | G | 40.3 | Very low | 45.5 | Very low | 76 Ų | 76 | 131.5 Ų | 131.5 | 78% | 0.784 | 70% | 0.695 | S | S | * | * | S | Bend | trans | 148 | 8.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||
| 480 | E | 36.2 | Very low | 44.3 | Very low | 196 Ų | 196 | 133.3 Ų | 133.3 | 92% | 0.916 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -142.2 | 64.3 | 167.4 | -72.5 | -172.9 | 169.1 | 0 | 0 | 110.2 | ||
| 481 | M | 38.6 | Very low | 43.1 | Very low | 189 Ų | 189 | 142.4 Ų | 142.4 | 93% | 0.931 | 75% | 0.753 | S | S | * | * | trans | -149.3 | 84.4 | 149.4 | -91.8 | -165.4 | -129.3 | 0 | 0 | 105.8 | ||||
| 482 | E | 32.9 | Very low | 41.5 | Very low | 273 Ų | 273 | 146.3 Ų | 146.3 | 100% | 1.276 | 79% | 0.787 | S | S | * | * | trans | -159.3 | 0 | 146.3 | -106.3 | 177.4 | -170.8 | 0 | 0 | 109 |
Retrieved 482 of 482 residues in 1446.6 ms
(Link to these results)