| 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 | 36 | Very low | 41.2 | Very low | 242 Ų | 242 | 124.5 Ų | 124.5 | 100% | 1.192 | 77% | 0.765 | S | S | * | * | 0 | 145.4 | 0 | -82.6 | 172.2 | 104.1 | 0 | 0 | 107 | |||||
| 2 | E | 26.3 | Very low | 44.3 | Very low | 205 Ų | 205 | 115.3 Ų | 115.3 | 96% | 0.958 | 71% | 0.706 | S | S | * | * | trans | 79.3 | 87.3 | -161.2 | -56.2 | -177.7 | 134.5 | 0 | 0 | 111.3 | ||||
| 3 | G | 27.8 | Very low | 47.1 | Very low | 71 Ų | 71 | 108.2 Ų | 108.2 | 73% | 0.732 | 67% | 0.67 | S | S | * | * | cis | 96.4 | 53.6 | 43.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q5 | G3-Q5 VanDerWaalsContact C-N 3.31Å; G3-Q5 PolarHBondContact O-N 3.32Å | ||
| 4 | A | 30.3 | Very low | 49.9 | Very low | 105 Ų | 105 | 108.5 Ų | 108.5 | 87% | 0.868 | 67% | 0.674 | S | S | * | * | trans | -65.3 | 95.6 | 168.7 | 0 | 0 | 0 | 0 | 0 | 107.8 | A6 | A4-A6 VanDerWaalsContact C-N 3.28Å; A4-A6 PolarHBondContact O-N 3.37Å | ||
| 5 | Q | 28.7 | Very low | 52.5 | Low | 191 Ų | 191 | 113.8 Ų | 113.8 | 89% | 0.893 | 68% | 0.677 | S | S | * | * | trans | -63.2 | 94.4 | 167.8 | -81.7 | 170.4 | -42.1 | 0 | 0 | 107.4 | G3 A7 | G3-Q5 VanDerWaalsContact C-N 3.31Å; G3-Q5 PolarHBondContact O-N 3.32Å; Q5-A7 PolarHBondContact O-N 3.27Å; Q5-A7 VanDerWaalsContact O-N 3.15Å | ||
| 6 | A | 33.7 | Very low | 54.8 | Low | 89 Ų | 89 | 107.1 Ų | 107.1 | 74% | 0.736 | 64% | 0.637 | S | S | * | * | trans | -49.7 | 119.6 | 148 | 0 | 0 | 0 | 0 | 0 | 105.6 | A4 A8 | A4-A6 VanDerWaalsContact C-N 3.28Å; A4-A6 PolarHBondContact O-N 3.37Å; A6-A8 PolarHBondContact O-N 3.09Å | ||
| 7 | A | 37.9 | Very low | 56.7 | Low | 96 Ų | 96 | 106.9 Ų | 106.9 | 79% | 0.793 | 62% | 0.623 | S | S | * | * | trans | -46.9 | 114.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | Q5 R9 | Q5-A7 PolarHBondContact O-N 3.27Å; Q5-A7 VanDerWaalsContact O-N 3.15Å; A7-R9 PolarHBondContact O-N 3.3Å | ||
| 8 | A | 43.7 | Very low | 58.6 | Low | 98 Ų | 98 | 102.8 Ų | 102.8 | 81% | 0.81 | 61% | 0.608 | S | S | * | * | trans | -59 | 115.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 107 | A6 A10 | A6-A8 PolarHBondContact O-N 3.09Å; A8-A10 PolarHBondContact O-N 3.36Å | ||
| 9 | R | 55 | Low | 60.3 | Low | 139 Ų | 139 | 100.3 Ų | 100.3 | 53% | 0.525 | 59% | 0.593 | S | S | . | * | trans | -57 | 118.6 | 178 | -153.8 | 175.5 | -171.3 | 144.3 | 2 | 106.3 | A7 T11 | A7-R9 PolarHBondContact O-N 3.3Å; R9-T11 PolarHBondContact O-N 3.44Å; R9-T11 VanDerWaalsContact O-N 3.09Å | ||
| 10 | A | 61.1 | Low | 61.8 | Low | 42 Ų | 42 | 96.2 Ų | 96.2 | 35% | 0.347 | 57% | 0.568 | S | S | . | * | trans | -55.1 | 120.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | A8 | A8-A10 PolarHBondContact O-N 3.36Š| ||
| 11 | T | 72.2 | Confident | 63.2 | Low | 91 Ų | 91 | 93.7 Ų | 93.7 | 56% | 0.558 | 56% | 0.557 | S | S | * | * | trans | -113.8 | 157.3 | -178.8 | 45 | 0 | 0 | 0 | 0 | 109.7 | R9 G13 V159 | R9-T11 PolarHBondContact O-N 3.44Å; R9-T11 VanDerWaalsContact O-N 3.09Å; T11-G13 PolarHBondContact O-N 2.76Å; T11-V159 WeakPolarHBondContact CA-O 3.26Å | ||
| 12 | F | 78.5 | Confident | 65.9 | Low | 15 Ų | 15 | 86.3 Ų | 86.3 | 7% | 0.066 | 53% | 0.526 | C | S | . | . | trans | -54.7 | 129.9 | -179.9 | -89.9 | 20.6 | 0 | 0 | 0 | 113.3 | D16 Y17 V159 T160 L330 P340 L344 | F12-D16 HydrophobicContact CB-CB 4.02Å; F12-D16 HydrophobicContact CD1-CB 4.16Å; F12-D16 HydrophobicContact CD2-CB 3.52Å; F12-D16 HydrophobicContact CE1-CB 4.47Å; F12-D16 HydrophobicContact CE2-CB 3.89Å; F12-D16 HydrophobicContact CG-CB 3.66Å; F12-D16 HydrophobicContact CZ-CB 4.37Å; F12-Y17 HydrophobicContact CB-CD2 4.32Å; F12-Y17 HydrophobicContact CB-CE2 3.71Å; F12-V159 HydrophobicContact CD1-CB 3.56Å; F12-V159 HydrophobicContact CD1-CG1 4.48Å; F12-V159 HydrophobicContact CD1-CG2 3.82Å; F12-V159 HydrophobicContact CD2-CG2 3.98Å; F12-V159 HydrophobicContact CE1-CB 3.26Å; F12-V159 HydrophobicContact CE1-CG1 3.76Å; F12-V159 HydrophobicContact CE1-CG2 3.5Å; F12-V159 VanDerWaalsContact CE1-CG2 3.5Å; F12-V159 HydrophobicContact CE2-CB 4.39Å; F12-V159 HydrophobicContact CE2-CG2 3.67Å; F12-V159 HydrophobicContact CG-CB 4.26Å; F12-V159 HydrophobicContact CG-CG2 4.06Å; F12-V159 HydrophobicContact CZ-CB 3.71Å; F12-V159 HydrophobicContact CZ-CG1 4.11Å; F12-V159 HydrophobicContact CZ-CG2 3.4Å; F12-V159 VanDerWaalsContact CZ-CG2 3.4Å; F12-V159 PolarHBondContact N-O 3.09Å; F12-T160 HydrophobicContact CD2-CG2 4.47Å; F12-L330 HydrophobicContact CE1-CD2 4.43Å; F12-P340 HydrophobicContact CD1-CB 4.05Å; F12-P340 HydrophobicContact CE1-CB 3.33Å; F12-P340 VanDerWaalsContact CZ-C 3.44Å; F12-P340 HydrophobicContact CZ-CB 3.91Å; F12-P340 VanDerWaalsContact CZ-O 3.28Å; F12-P340 WeakPolarHBondContact CZ-O 3.44Å; F12-L344 HydrophobicContact CD2-CD2 4.4Å; F12-L344 HydrophobicContact CE2-CB 3.89Å; F12-L344 HydrophobicContact CE2-CD2 3.58Å; F12-L344 HydrophobicContact CE2-CG 4.29Å; F12-L344 HydrophobicContact CZ-CB 3.94Å; F12-L344 HydrophobicContact CZ-CD2 4.36Å | ||
| 13 | G | 81 | Confident | 69 | Low | 22 Ų | 22 | 76.9 Ų | 76.9 | 23% | 0.227 | 48% | 0.482 | C | S | . | . | trans | -83 | 168.9 | 170 | 0 | 0 | 0 | 0 | 0 | 112.1 | T11 W15 D16 Y17 | T11-G13 PolarHBondContact O-N 2.76Å; G13-W15 PolarHBondContact O-N 2.88Å; G13-W15 VanDerWaalsContact O-N 3.15Å; G13-D16 PolarHBondContact N-OD2 3.46Å; G13-D16 WeakPolarHBondContact O-CB 3.4Å; G13-D16 PolarHBondContact O-N 2.89Å; G13-Y17 VanDerWaalsContact O-CD2 3.3Å; G13-Y17 WeakPolarHBondContact O-CD2 3.41Å; G13-Y17 PolarHBondContact O-N 3.01Å | ||
| 14 | P | 85.8 | Confident | 71.9 | Confident | 113 Ų | 113 | 74.9 Ų | 74.9 | 73% | 0.734 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -55.4 | -33.4 | 178 | -26.5 | 34.9 | 0 | 0 | 0 | 114.1 | Y17 G18 | P14-Y17 PolarHBondContact O-N 3.06Å; P14-G18 PolarHBondContact O-N 3.41Å |
| 15 | W | 89.1 | Confident | 74.7 | Confident | 188 Ų | 188 | 75.9 Ų | 75.9 | 71% | 0.712 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -66.3 | -34.8 | 177.5 | -65.3 | 108.9 | 0 | 0 | 0 | 112.8 | G13 G18 V19 P337 | G13-W15 PolarHBondContact O-N 2.88Å; G13-W15 VanDerWaalsContact O-N 3.15Å; W15-G18 PolarHBondContact O-N 3.03Å; W15-V19 WeakPolarHBondContact O-CG2 3.09Å; W15-V19 PolarHBondContact O-N 3.06Å; W15-P337 HydrophobicContact CB-CB 4.2Å; W15-P337 HydrophobicContact CG-CB 4.45Å |
| 16 | D | 88.9 | Confident | 77.7 | Confident | 7 Ų | 7 | 69.5 Ų | 69.5 | 4% | 0.037 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -66.1 | -44.2 | 177.3 | -61.2 | -54.9 | 0 | 0 | 0 | 111.1 | F12 G13 G18 V19 F20 G338 P340 G341 | F12-D16 HydrophobicContact CB-CB 4.02Å; F12-D16 HydrophobicContact CD1-CB 4.16Å; F12-D16 HydrophobicContact CD2-CB 3.52Å; F12-D16 HydrophobicContact CE1-CB 4.47Å; F12-D16 HydrophobicContact CE2-CB 3.89Å; F12-D16 HydrophobicContact CG-CB 3.66Å; F12-D16 HydrophobicContact CZ-CB 4.37Å; G13-D16 PolarHBondContact N-OD2 3.46Å; G13-D16 WeakPolarHBondContact O-CB 3.4Å; G13-D16 PolarHBondContact O-N 2.89Å; D16-G18 VanDerWaalsContact C-N 3.3Å; D16-G18 PolarHBondContact O-N 2.82Å; D16-V19 PolarHBondContact O-N 3.37Å; D16-F20 WeakPolarHBondContact O-CB 3.21Å; D16-F20 PolarHBondContact O-N 3.4Å; D16-F20 VanDerWaalsContact O-N 3.07Å; D16-G338 VanDerWaalsContact OD1-C 3.31Å; D16-G338 WeakPolarHBondContact OD1-CA 3.3Å; D16-G338 PolarHBondContact OD1-N 3.2Å; D16-P340 VanDerWaalsContact OD1-CD 3.28Å; D16-P340 WeakPolarHBondContact OD1-CD 3.44Å; D16-G341 WeakPolarHBondContact O-CA 3.49Å; D16-G341 PolarHBondContact OD1-N 3.15Å |
| 17 | Y | 88 | Confident | 80.2 | Confident | 103 Ų | 103 | 65.3 Ų | 65.3 | 40% | 0.404 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.4 | -38.7 | 172.3 | -68 | -73 | 0 | 0 | 0 | 111.9 | F12 G13 P14 F20 A21 T160 | F12-Y17 HydrophobicContact CB-CD2 4.32Å; F12-Y17 HydrophobicContact CB-CE2 3.71Å; G13-Y17 VanDerWaalsContact O-CD2 3.3Å; G13-Y17 WeakPolarHBondContact O-CD2 3.41Å; G13-Y17 PolarHBondContact O-N 3.01Å; P14-Y17 PolarHBondContact O-N 3.06Å; Y17-F20 PolarHBondContact O-N 3.02Å; Y17-A21 VanDerWaalsContact O-CB 3.23Å; Y17-A21 WeakPolarHBondContact O-CB 3.32Å; Y17-A21 PolarHBondContact O-N 3.23Å; Y17-T160 HydrophobicContact CE1-CG2 4.08Å; Y17-T160 VanDerWaalsContact OH-CG2 3.25Å; Y17-T160 WeakPolarHBondContact OH-CG2 3.45Å |
| 18 | G | 90.5 | Very high | 82.4 | Confident | 34 Ų | 34 | 63.3 Ų | 63.3 | 35% | 0.351 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.3 | -50.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | P14 W15 D16 F20 A21 V22 | P14-G18 PolarHBondContact O-N 3.41Å; W15-G18 PolarHBondContact O-N 3.03Å; D16-G18 VanDerWaalsContact C-N 3.3Å; D16-G18 PolarHBondContact O-N 2.82Å; G18-F20 VanDerWaalsContact C-N 3.33Å; G18-F20 PolarHBondContact O-N 2.96Å; G18-A21 PolarHBondContact O-N 3.18Å; G18-V22 VanDerWaalsContact O-CG2 3.28Å; G18-V22 WeakPolarHBondContact O-CG2 3.24Å; G18-V22 PolarHBondContact O-N 3.45Å |
| 19 | V | 92 | Very high | 84.3 | Confident | 54 Ų | 54 | 60.5 Ų | 60.5 | 33% | 0.327 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 177.7 | 172.7 | 0 | 0 | 0 | 0 | 111 | W15 D16 V22 M23 L342 | W15-V19 WeakPolarHBondContact O-CG2 3.09Å; W15-V19 PolarHBondContact O-N 3.06Å; D16-V19 PolarHBondContact O-N 3.37Å; V19-V22 PolarHBondContact O-N 3.29Å; V19-M23 PolarHBondContact O-N 3.39Å; V19-M23 VanDerWaalsContact O-N 3.11Å; V19-L342 HydrophobicContact CG1-CB 4.2Å |
| 20 | F | 89.9 | Confident | 85.8 | Confident | 19 Ų | 19 | 56.2 Ų | 56.2 | 8% | 0.083 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.9 | -45.7 | 177.6 | 177.9 | -121.5 | 0 | 0 | 0 | 112.5 | D16 Y17 G18 V22 M23 L24 L344 A345 Y348 | D16-F20 WeakPolarHBondContact O-CB 3.21Å; D16-F20 PolarHBondContact O-N 3.4Å; D16-F20 VanDerWaalsContact O-N 3.07Å; Y17-F20 PolarHBondContact O-N 3.02Å; G18-F20 VanDerWaalsContact C-N 3.33Å; G18-F20 PolarHBondContact O-N 2.96Å; F20-V22 VanDerWaalsContact C-N 3.34Å; F20-V22 PolarHBondContact O-N 2.99Å; F20-M23 HydrophobicContact CD2-CE 4.27Å; F20-M23 HydrophobicContact CE2-CE 4.06Å; F20-M23 PolarHBondContact O-N 3.18Å; F20-L24 HydrophobicContact CD1-CD1 4.33Å; F20-L24 HydrophobicContact CE1-CD1 3.76Å; F20-L24 HydrophobicContact CE2-CD1 4.23Å; F20-L24 HydrophobicContact CE2-CD2 4.41Å; F20-L24 HydrophobicContact CE2-CG 4.22Å; F20-L24 HydrophobicContact CZ-CD1 3.7Å; F20-L24 HydrophobicContact CZ-CD2 4.41Å; F20-L24 HydrophobicContact CZ-CG 4.18Å; F20-L24 PolarHBondContact O-N 3.25Å; F20-L24 VanDerWaalsContact O-N 3.14Å; F20-L344 HydrophobicContact CB-CD2 4.32Å; F20-L344 HydrophobicContact CD1-CD2 3.85Å; F20-L344 HydrophobicContact CD2-CB 4.47Å; F20-L344 HydrophobicContact CD2-CD2 3.95Å; F20-L344 HydrophobicContact CD2-CG 3.98Å; F20-L344 HydrophobicContact CE1-CD2 4.1Å; F20-L344 HydrophobicContact CE2-CD2 4.21Å; F20-L344 HydrophobicContact CE2-CG 4.11Å; F20-L344 HydrophobicContact CG-CD2 3.77Å; F20-L344 HydrophobicContact CG-CG 4.31Å; F20-L344 HydrophobicContact CZ-CD2 4.27Å; F20-A345 HydrophobicContact CD2-CB 4.31Å; F20-Y348 AromaticContact CE2-CD1 3.95Å; F20-Y348 HydrophobicContact CE2-CD1 3.95Å; F20-Y348 AromaticContact CE2-CD2 3.77Å; F20-Y348 HydrophobicContact CE2-CD2 3.77Å; F20-Y348 HydrophobicContact CE2-CE1 4.48Å; F20-Y348 HydrophobicContact CE2-CE2 4.35Å; F20-Y348 AromaticContact CE2-CG 3.53Å; F20-Y348 HydrophobicContact CE2-CG 3.53Å; F20-Y348 AromaticContact CZ-CD1 3.72Å; F20-Y348 HydrophobicContact CZ-CD1 3.72Å; F20-Y348 AromaticContact CZ-CD2 3.93Å; F20-Y348 HydrophobicContact CZ-CD2 3.93Å; F20-Y348 AromaticContact CZ-CE1 3.84Å; F20-Y348 HydrophobicContact CZ-CE1 3.84Å; F20-Y348 HydrophobicContact CZ-CE2 4.07Å; F20-Y348 AromaticContact CZ-CG 3.74Å; F20-Y348 HydrophobicContact CZ-CG 3.74Å |
| 21 | A | 90.2 | Very high | 86.7 | Confident | 43 Ų | 43 | 54.6 Ų | 54.6 | 36% | 0.355 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.5 | -40.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y17 G18 M23 L24 L25 | Y17-A21 VanDerWaalsContact O-CB 3.23Å; Y17-A21 WeakPolarHBondContact O-CB 3.32Å; Y17-A21 PolarHBondContact O-N 3.23Å; G18-A21 PolarHBondContact O-N 3.18Å; A21-M23 VanDerWaalsContact C-N 3.33Å; A21-M23 PolarHBondContact O-N 3.43Å; A21-L24 PolarHBondContact O-N 3.26Å; A21-L25 WeakPolarHBondContact O-CB 2.83Å; A21-L25 VanDerWaalsContact O-CG 3.29Å; A21-L25 WeakPolarHBondContact O-CG 3.27Å; A21-L25 PolarHBondContact O-N 3.35Å |
| 22 | V | 92.6 | Very high | 87.1 | Confident | 87 Ų | 87 | 53.9 Ų | 53.9 | 53% | 0.527 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.6 | -43.8 | 175 | 168.8 | 0 | 0 | 0 | 0 | 110.9 | G18 V19 F20 L24 L25 V26 | G18-V22 VanDerWaalsContact O-CG2 3.28Å; G18-V22 WeakPolarHBondContact O-CG2 3.24Å; G18-V22 PolarHBondContact O-N 3.45Å; V19-V22 PolarHBondContact O-N 3.29Å; F20-V22 VanDerWaalsContact C-N 3.34Å; F20-V22 PolarHBondContact O-N 2.99Å; V22-L24 PolarHBondContact O-N 3.37Å; V22-L25 PolarHBondContact O-N 3.08Å; V22-V26 HydrophobicContact CG1-CG2 4.25Å; V22-V26 WeakPolarHBondContact O-CB 3.45Å; V22-V26 VanDerWaalsContact O-CG2 3.29Å; V22-V26 WeakPolarHBondContact O-CG2 3.45Å; V22-V26 PolarHBondContact O-N 3.45Å |
| 23 | M | 92.1 | Very high | 87 | Confident | 7 Ų | 7 | 55 Ų | 55 | 3% | 0.034 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.2 | -45.5 | 176.1 | -178.6 | -80.2 | -80.7 | 0 | 0 | 112 | V19 F20 A21 V26 S27 F193 V197 A345 S349 | V19-M23 PolarHBondContact O-N 3.39Å; V19-M23 VanDerWaalsContact O-N 3.11Å; F20-M23 HydrophobicContact CD2-CE 4.27Å; F20-M23 HydrophobicContact CE2-CE 4.06Å; F20-M23 PolarHBondContact O-N 3.18Å; A21-M23 VanDerWaalsContact C-N 3.33Å; A21-M23 PolarHBondContact O-N 3.43Å; M23-V26 PolarHBondContact O-N 3.16Å; M23-S27 WeakPolarHBondContact O-CB 3.17Å; M23-S27 PolarHBondContact O-N 3.14Å; M23-S27 PolarHBondContact O-OG 3.26Å; M23-S27 PolarHBondContact SD-OG 3.38Å; M23-F193 HydrophobicContact CG-CE1 4.14Å; M23-V197 HydrophobicContact CG-CG1 4.26Å; M23-V197 HydrophobicContact CG-CG2 4.39Å; M23-A345 HydrophobicContact CB-CB 3.92Å; M23-A345 HydrophobicContact CE-CB 3.92Å; M23-A345 VanDerWaalsContact CE-O 3.27Å; M23-A345 WeakPolarHBondContact CE-O 3.43Å; M23-A345 HydrophobicContact CG-CB 4Å; M23-S349 WeakPolarHBondContact CE-OG 3.29Å |
| 24 | L | 88.7 | Confident | 86.8 | Confident | 29 Ų | 29 | 55.8 Ų | 55.8 | 15% | 0.152 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 179 | -69 | 178.1 | 0 | 0 | 0 | 112.1 | F20 A21 V22 S27 T28 I174 L352 | F20-L24 HydrophobicContact CD1-CD1 4.33Å; F20-L24 HydrophobicContact CE1-CD1 3.76Å; F20-L24 HydrophobicContact CE2-CD1 4.23Å; F20-L24 HydrophobicContact CE2-CD2 4.41Å; F20-L24 HydrophobicContact CE2-CG 4.22Å; F20-L24 HydrophobicContact CZ-CD1 3.7Å; F20-L24 HydrophobicContact CZ-CD2 4.41Å; F20-L24 HydrophobicContact CZ-CG 4.18Å; F20-L24 PolarHBondContact O-N 3.25Å; F20-L24 VanDerWaalsContact O-N 3.14Å; A21-L24 PolarHBondContact O-N 3.26Å; V22-L24 PolarHBondContact O-N 3.37Å; L24-S27 PolarHBondContact O-N 3.03Å; L24-T28 VanDerWaalsContact O-CB 3.27Å; L24-T28 WeakPolarHBondContact O-CB 3.27Å; L24-T28 PolarHBondContact O-N 3.49Å; L24-T28 PolarHBondContact O-OG1 2.83Å; L24-I174 HydrophobicContact CD1-CD1 4.42Å; L24-I174 HydrophobicContact CD1-CG2 4.34Å; L24-I174 HydrophobicContact CD2-CG2 3.89Å; L24-L352 HydrophobicContact CD2-CD1 3.74Å |
| 25 | L | 89.5 | Confident | 85.9 | Confident | 126 Ų | 126 | 51.6 Ų | 51.6 | 66% | 0.66 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -65.7 | -43.6 | 178.1 | -72 | 172.9 | 0 | 0 | 0 | 111.7 | A21 V22 T28 G29 | A21-L25 WeakPolarHBondContact O-CB 2.83Å; A21-L25 VanDerWaalsContact O-CG 3.29Å; A21-L25 WeakPolarHBondContact O-CG 3.27Å; A21-L25 PolarHBondContact O-N 3.35Å; V22-L25 PolarHBondContact O-N 3.08Å; L25-T28 PolarHBondContact O-N 2.68Å; L25-G29 WeakPolarHBondContact O-CA 3.45Å; L25-G29 PolarHBondContact O-N 2.9Å |
| 26 | V | 90.4 | Very high | 84.9 | Confident | 58 Ų | 58 | 48.7 Ų | 48.7 | 35% | 0.352 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.7 | -46 | 176.3 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | V22 M23 T28 G29 I30 F193 | V22-V26 HydrophobicContact CG1-CG2 4.25Å; V22-V26 WeakPolarHBondContact O-CB 3.45Å; V22-V26 VanDerWaalsContact O-CG2 3.29Å; V22-V26 WeakPolarHBondContact O-CG2 3.45Å; V22-V26 PolarHBondContact O-N 3.45Å; M23-V26 PolarHBondContact O-N 3.16Å; V26-T28 PolarHBondContact O-N 3.48Å; V26-G29 PolarHBondContact O-N 3.2Å; V26-I30 HydrophobicContact CG1-CD1 3.78Å; V26-I30 HydrophobicContact CG1-CG1 4.38Å; V26-I30 VanDerWaalsContact O-CG1 3.27Å; V26-I30 WeakPolarHBondContact O-CG1 3.06Å; V26-I30 PolarHBondContact O-N 3.28Å; V26-F193 HydrophobicContact CB-CE1 4.07Å; V26-F193 HydrophobicContact CB-CZ 3.94Å; V26-F193 HydrophobicContact CG1-CD1 4.18Å; V26-F193 HydrophobicContact CG1-CD2 4.21Å; V26-F193 HydrophobicContact CG1-CE1 3.71Å; V26-F193 HydrophobicContact CG1-CE2 3.75Å; V26-F193 HydrophobicContact CG1-CG 4.42Å; V26-F193 HydrophobicContact CG1-CZ 3.48Å; V26-F193 VanDerWaalsContact CG1-CZ 3.48Å |
| 27 | S | 86.7 | Confident | 83.3 | Confident | 1 Ų | 1 | 52.5 Ų | 52.5 | 1% | 0.007 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -61 | -46.1 | 177.9 | -59.7 | 0 | 0 | 0 | 0 | 111.6 | M23 L24 I30 G31 T190 | M23-S27 WeakPolarHBondContact O-CB 3.17Å; M23-S27 PolarHBondContact O-N 3.14Å; M23-S27 PolarHBondContact O-OG 3.26Å; M23-S27 PolarHBondContact SD-OG 3.38Å; L24-S27 PolarHBondContact O-N 3.03Å; S27-I30 PolarHBondContact O-N 3.4Å; S27-G31 PolarHBondContact O-N 3.15Å; S27-T190 WeakPolarHBondContact O-CG2 3.21Å |
| 28 | T | 83.7 | Confident | 81.6 | Confident | 53 Ų | 53 | 56.9 Ų | 56.9 | 33% | 0.325 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.5 | -39.7 | 177.8 | -54.6 | 0 | 0 | 0 | 0 | 111.3 | L24 L25 V26 G31 L32 | L24-T28 VanDerWaalsContact O-CB 3.27Å; L24-T28 WeakPolarHBondContact O-CB 3.27Å; L24-T28 PolarHBondContact O-N 3.49Å; L24-T28 PolarHBondContact O-OG1 2.83Å; L25-T28 PolarHBondContact O-N 2.68Å; V26-T28 PolarHBondContact O-N 3.48Å; T28-G31 PolarHBondContact O-N 3.47Å; T28-L32 HydrophobicContact CG2-CD1 3.96Å; T28-L32 HydrophobicContact CG2-CG 4.35Å; T28-L32 WeakPolarHBondContact O-CB 3.42Å; T28-L32 WeakPolarHBondContact O-CG 3.46Å; T28-L32 PolarHBondContact O-N 2.95Å |
| 29 | G | 85.3 | Confident | 79.6 | Confident | 40 Ų | 40 | 57.3 Ų | 57.3 | 41% | 0.412 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63.6 | -43.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L25 V26 G33 | L25-G29 WeakPolarHBondContact O-CA 3.45Å; L25-G29 PolarHBondContact O-N 2.9Å; V26-G29 PolarHBondContact O-N 3.2Å; G29-G33 WeakPolarHBondContact O-CA 3.44Å; G29-G33 PolarHBondContact O-N 3.14Å |
| 30 | I | 85.5 | Confident | 77.8 | Confident | 49 Ų | 49 | 56.7 Ų | 56.7 | 25% | 0.251 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.5 | -46.3 | 172.4 | -67.8 | 165.4 | 0 | 0 | 0 | 109.8 | V26 S27 G33 V34 W189 T190 F193 | V26-I30 HydrophobicContact CG1-CD1 3.78Å; V26-I30 HydrophobicContact CG1-CG1 4.38Å; V26-I30 VanDerWaalsContact O-CG1 3.27Å; V26-I30 WeakPolarHBondContact O-CG1 3.06Å; V26-I30 PolarHBondContact O-N 3.28Å; S27-I30 PolarHBondContact O-N 3.4Å; I30-G33 PolarHBondContact O-N 3.25Å; I30-V34 HydrophobicContact CG2-CG2 4.36Å; I30-V34 WeakPolarHBondContact O-CB 3.46Å; I30-V34 VanDerWaalsContact O-CG2 3.32Å; I30-V34 WeakPolarHBondContact O-CG2 3.33Å; I30-V34 PolarHBondContact O-N 3.07Å; I30-W189 HydrophobicContact CG2-CB 3.94Å; I30-T190 HydrophobicContact CB-CG2 4Å; I30-T190 HydrophobicContact CG2-CG2 3.8Å; I30-F193 HydrophobicContact CD1-CB 3.8Å; I30-F193 HydrophobicContact CD1-CD1 4.24Å; I30-F193 HydrophobicContact CD1-CD2 4.36Å; I30-F193 HydrophobicContact CD1-CG 3.87Å |
| 31 | G | 80.1 | Confident | 76.1 | Confident | 8 Ų | 8 | 58.8 Ų | 58.8 | 8% | 0.082 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60.3 | -47.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S27 T28 G35 A186 | S27-G31 PolarHBondContact O-N 3.15Å; T28-G31 PolarHBondContact O-N 3.47Å; G31-G35 PolarHBondContact O-N 3.39Å; G31-A186 WeakPolarHBondContact O-CB 3.23Å |
| 32 | L | 80.5 | Confident | 74.5 | Confident | 76 Ų | 76 | 66.6 Ų | 66.6 | 40% | 0.398 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.9 | -46.2 | 176.5 | -74.6 | 172.2 | 0 | 0 | 0 | 111.9 | T28 G35 L36 V181 | T28-L32 HydrophobicContact CG2-CD1 3.96Å; T28-L32 HydrophobicContact CG2-CG 4.35Å; T28-L32 WeakPolarHBondContact O-CB 3.42Å; T28-L32 WeakPolarHBondContact O-CG 3.46Å; T28-L32 PolarHBondContact O-N 2.95Å; L32-G35 PolarHBondContact O-N 3.26Å; L32-L36 HydrophobicContact CB-CD1 4.46Å; L32-L36 VanDerWaalsContact O-CB 3.27Å; L32-L36 WeakPolarHBondContact O-CB 3.17Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.45Å; L32-V181 HydrophobicContact CD2-CG1 3.32Å; L32-V181 HydrophobicContact CG-CG1 3.97Å |
| 33 | G | 77.4 | Confident | 73 | Confident | 37 Ų | 37 | 64.1 Ų | 64.1 | 38% | 0.381 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.5 | -48.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | G29 I30 G35 L36 A37 | G29-G33 WeakPolarHBondContact O-CA 3.44Å; G29-G33 PolarHBondContact O-N 3.14Å; I30-G33 PolarHBondContact O-N 3.25Å; G33-G35 VanDerWaalsContact C-N 3.35Å; G33-L36 PolarHBondContact O-N 3.47Å; G33-A37 WeakPolarHBondContact O-CB 3.47Å; G33-A37 PolarHBondContact O-N 3.11Å |
| 34 | V | 75.3 | Confident | 71.5 | Confident | 40 Ų | 40 | 64.5 Ų | 64.5 | 24% | 0.242 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -68.5 | -35.4 | 176.2 | 175.3 | 0 | 0 | 0 | 0 | 111.5 | I30 K185 W189 | I30-V34 HydrophobicContact CG2-CG2 4.36Å; I30-V34 WeakPolarHBondContact O-CB 3.46Å; I30-V34 VanDerWaalsContact O-CG2 3.32Å; I30-V34 WeakPolarHBondContact O-CG2 3.33Å; I30-V34 PolarHBondContact O-N 3.07Å; V34-K185 HydrophobicContact CG1-CB 4.28Å; V34-W189 HydrophobicContact CG2-CB 4.25Å; V34-W189 HydrophobicContact CG2-CG 4.3Å |
| 35 | G | 66.9 | Low | 70.3 | Confident | 24 Ų | 24 | 69.1 Ų | 69.1 | 25% | 0.247 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -66.9 | -34.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114 | G31 L32 G33 | G31-G35 PolarHBondContact O-N 3.39Å; L32-G35 PolarHBondContact O-N 3.26Å; G33-G35 VanDerWaalsContact C-N 3.35Å |
| 36 | L | 68 | Low | 69.1 | Low | 128 Ų | 128 | 65.7 Ų | 65.7 | 67% | 0.67 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -93.6 | -39.3 | -176.2 | -67 | 168.7 | 0 | 0 | 0 | 113.2 | L32 G33 R38 | L32-L36 HydrophobicContact CB-CD1 4.46Å; L32-L36 VanDerWaalsContact O-CB 3.27Å; L32-L36 WeakPolarHBondContact O-CB 3.17Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.45Å; G33-L36 PolarHBondContact O-N 3.47Å; L36-R38 PolarHBondContact O-N 3.23Å; L36-R38 VanDerWaalsContact O-N 3.09Å |
| 37 | A | 55.5 | Low | 67.9 | Low | 87 Ų | 87 | 63.3 Ų | 63.3 | 72% | 0.719 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -2.8 | -168.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | G33 | G33-A37 WeakPolarHBondContact O-CB 3.47Å; G33-A37 PolarHBondContact O-N 3.11Å |
| 38 | R | 52.5 | Low | 66.7 | Low | 195 Ų | 195 | 63.4 Ų | 63.4 | 74% | 0.736 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122.6 | 33.3 | -177.5 | -73.1 | -172.3 | 166.6 | 178.9 | -3.6 | 114.9 | L36 | L36-R38 PolarHBondContact O-N 3.23Å; L36-R38 VanDerWaalsContact O-N 3.09Å |
| 39 | G | 49.8 | Very low | 65.7 | Low | 43 Ų | 43 | 61.6 Ų | 61.6 | 44% | 0.443 | 36% | 0.355 | S | S | . | . | S | Bend | trans | 90.3 | 9.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | R42 | G39-R42 PolarHBondContact O-NE 3.31Š|
| 40 | G | 53.5 | Low | 64.6 | Low | 41 Ų | 41 | 59.7 Ų | 59.7 | 42% | 0.423 | 34% | 0.336 | S | S | . | . | trans | 75.4 | 156 | -179 | 0 | 0 | 0 | 0 | 0 | 113.5 | R42 | G40-R42 VanDerWaalsContact C-N 3.32Å; G40-R42 PolarHBondContact O-N 3.45Å | ||
| 41 | Q | 54.1 | Low | 63.5 | Low | 62 Ų | 62 | 58.4 Ų | 58.4 | 29% | 0.29 | 33% | 0.334 | S | S | . | . | trans | -68.8 | 85.8 | 174 | -64.9 | 163.8 | -5.8 | 0 | 0 | 109.4 | F47 | Q41-F47 HydrophobicContact CG-CD2 4.15Å; Q41-F47 VanDerWaalsContact OE1-CD2 3.26Å | ||
| 42 | R | 55.8 | Low | 63 | Low | 208 Ų | 208 | 61.6 Ų | 61.6 | 79% | 0.785 | 34% | 0.344 | S | S | * | . | trans | -81.3 | -22.9 | -175.3 | -68.5 | -178.2 | -179.9 | -171 | -5.2 | 113.2 | G39 G40 | G39-R42 PolarHBondContact O-NE 3.31Å; G40-R42 VanDerWaalsContact C-N 3.32Å; G40-R42 PolarHBondContact O-N 3.45Å | ||
| 43 | S | 62.8 | Low | 62.8 | Low | 35 Ų | 35 | 65.2 Ų | 65.2 | 25% | 0.245 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -134.5 | 156.8 | -177.5 | 77.6 | 0 | 0 | 0 | 0 | 112.5 | E45 D46 F47 | S43-E45 VanDerWaalsContact C-N 3.27Å; S43-E45 PolarHBondContact O-N 2.73Å; S43-D46 PolarHBondContact O-N 2.74Å; S43-D46 WeakPolarHBondContact OG-CB 3.3Å; S43-D46 VanDerWaalsContact OG-CG 3.26Å; S43-D46 PolarHBondContact OG-N 2.83Å; S43-D46 PolarHBondContact OG-OD2 3.14Å; S43-F47 PolarHBondContact O-N 2.96Å |
| 44 | A | 59.6 | Low | 62.9 | Low | 14 Ų | 14 | 64.2 Ų | 64.2 | 12% | 0.116 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -67.9 | -29.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F47 F48 L383 | A44-F47 PolarHBondContact O-N 3.2Å; A44-F48 HydrophobicContact CB-CD2 4.27Å; A44-F48 HydrophobicContact CB-CE2 4.3Å; A44-F48 WeakPolarHBondContact O-CB 3.48Å; A44-F48 WeakPolarHBondContact O-CD2 3.35Å; A44-F48 PolarHBondContact O-N 3.25Å; A44-L383 HydrophobicContact CB-CD2 3.57Å; A44-L383 HydrophobicContact CB-CG 4.33Å |
| 45 | E | 63.3 | Low | 63.5 | Low | 126 Ų | 126 | 64.6 Ų | 64.6 | 59% | 0.589 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -65.6 | -40.3 | 174.2 | -171.8 | 173.2 | -179.3 | 0 | 0 | 111.4 | S43 F47 T49 | S43-E45 VanDerWaalsContact C-N 3.27Å; S43-E45 PolarHBondContact O-N 2.73Å; E45-F47 VanDerWaalsContact C-N 3.32Å; E45-F47 PolarHBondContact O-N 3.5Å; E45-T49 HydrophobicContact CG-CG2 4.5Å; E45-T49 WeakPolarHBondContact CG-OG1 3.28Å; E45-T49 WeakPolarHBondContact O-CA 3.42Å; E45-T49 WeakPolarHBondContact O-CB 3.44Å; E45-T49 PolarHBondContact O-N 2.65Å; E45-T49 PolarHBondContact O-OG1 2.88Å |
| 46 | D | 65.4 | Low | 64.6 | Low | 55 Ų | 55 | 63.8 Ų | 63.8 | 29% | 0.294 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.8 | -37.3 | 172.9 | -75.2 | -53.1 | 0 | 0 | 0 | 112.6 | S43 G50 | S43-D46 PolarHBondContact O-N 2.74Å; S43-D46 WeakPolarHBondContact OG-CB 3.3Å; S43-D46 VanDerWaalsContact OG-CG 3.26Å; S43-D46 PolarHBondContact OG-N 2.83Å; S43-D46 PolarHBondContact OG-OD2 3.14Å; D46-G50 WeakPolarHBondContact O-CA 3.16Å; D46-G50 PolarHBondContact O-N 3.39Å |
| 47 | F | 64.3 | Low | 65.8 | Low | 8 Ų | 8 | 61.6 Ų | 61.6 | 4% | 0.035 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -67.2 | -46.6 | 179.3 | -170.9 | -97.6 | 0 | 0 | 0 | 111.8 | Q41 S43 A44 E45 M184 N360 | Q41-F47 HydrophobicContact CG-CD2 4.15Å; Q41-F47 VanDerWaalsContact OE1-CD2 3.26Å; S43-F47 PolarHBondContact O-N 2.96Å; A44-F47 PolarHBondContact O-N 3.2Å; E45-F47 VanDerWaalsContact C-N 3.32Å; E45-F47 PolarHBondContact O-N 3.5Å; F47-M184 WeakPolarHBondContact O-CB 3.06Å; F47-M184 PolarHBondContact O-N 3.18Å; F47-N360 VanDerWaalsContact CE1-OD1 3.31Å; F47-N360 WeakPolarHBondContact CE1-OD1 3.46Å |
| 48 | F | 62.4 | Low | 67.5 | Low | 2 Ų | 2 | 58.2 Ų | 58.2 | 1% | 0.009 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -92.9 | -30.6 | -173 | -67.1 | -54.4 | 0 | 0 | 0 | 114.8 | A44 M184 Q267 A364 S387 | A44-F48 HydrophobicContact CB-CD2 4.27Å; A44-F48 HydrophobicContact CB-CE2 4.3Å; A44-F48 WeakPolarHBondContact O-CB 3.48Å; A44-F48 WeakPolarHBondContact O-CD2 3.35Å; A44-F48 PolarHBondContact O-N 3.25Å; F48-M184 WeakPolarHBondContact O-CE 3.36Å; F48-Q267 PolarHBondContact O-NE2 3.14Å; F48-A364 HydrophobicContact CD1-CB 3.45Å; F48-A364 VanDerWaalsContact CD1-CB 3.45Å; F48-A364 HydrophobicContact CE1-CB 3.45Å; F48-A364 VanDerWaalsContact CE1-CB 3.45Å; F48-A364 HydrophobicContact CG-CB 4.14Å; F48-A364 HydrophobicContact CZ-CB 4.14Å; F48-S387 WeakPolarHBondContact CZ-OG 3.31Å |
| 49 | T | 61.4 | Low | 69.4 | Low | 15 Ų | 15 | 49 Ų | 49 | 9% | 0.092 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -116.1 | -2 | -174.7 | 72.5 | 0 | 0 | 0 | 0 | 113.1 | E45 G51 R52 A271 | E45-T49 HydrophobicContact CG-CG2 4.5Å; E45-T49 WeakPolarHBondContact CG-OG1 3.28Å; E45-T49 WeakPolarHBondContact O-CA 3.42Å; E45-T49 WeakPolarHBondContact O-CB 3.44Å; E45-T49 PolarHBondContact O-N 2.65Å; E45-T49 PolarHBondContact O-OG1 2.88Å; T49-G51 PolarHBondContact O-N 2.92Å; T49-G51 VanDerWaalsContact O-N 3.08Å; T49-G51 PolarHBondContact OG1-N 3.43Å; T49-R52 PolarHBondContact O-N 3.11Å; T49-R52 VanDerWaalsContact O-N 3.14Å; T49-A271 WeakPolarHBondContact O-CB 3.15Å |
| 50 | G | 61.9 | Low | 71.4 | Confident | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 25% | 0.25 | C | C | . | . | G | 310 helix | trans | 57.5 | 23.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | D46 R52 K185 | D46-G50 WeakPolarHBondContact O-CA 3.16Å; D46-G50 PolarHBondContact O-N 3.39Å; G50-R52 PolarHBondContact O-N 3.03Å; G50-K185 WeakPolarHBondContact O-CE 3.41Å; G50-K185 PolarHBondContact O-NZ 3.39Å |
| 51 | G | 63.8 | Low | 73.3 | Confident | 22 Ų | 22 | 46.9 Ų | 46.9 | 23% | 0.227 | 24% | 0.24 | C | C | . | . | G | 310 helix | trans | 64.7 | 19 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | T49 Q53 | T49-G51 PolarHBondContact O-N 2.92Å; T49-G51 VanDerWaalsContact O-N 3.08Å; T49-G51 PolarHBondContact OG1-N 3.43Å; G51-Q53 WeakPolarHBondContact O-CG 3.34Å; G51-Q53 PolarHBondContact O-N 3.02Å; G51-Q53 VanDerWaalsContact O-N 3.16Å |
| 52 | R | 68.8 | Low | 75.1 | Confident | 75 Ų | 75 | 43.9 Ų | 43.9 | 28% | 0.283 | 23% | 0.226 | S | C | . | . | G | 310 helix | trans | 55.1 | 31.6 | 178 | -52.5 | -178.9 | 84.6 | 165.4 | 0.3 | 115.2 | T49 G50 Y110 V270 A271 R273 | T49-R52 PolarHBondContact O-N 3.11Å; T49-R52 VanDerWaalsContact O-N 3.14Å; G50-R52 PolarHBondContact O-N 3.03Å; R52-Y110 PolarHBondContact NH2-O 3.39Å; R52-V270 PolarHBondContact NE-O 3.37Å; R52-A271 CarbonylContact C-O 3.35Å; R52-A271 WeakPolarHBondContact CA-O 3.3Å; R52-R273 VanDerWaalsContact O-CA 3.24Å; R52-R273 WeakPolarHBondContact O-CA 3.29Å; R52-R273 PolarHBondContact O-N 3.36Å |
| 53 | Q | 76 | Confident | 76.9 | Confident | 152 Ų | 152 | 34 Ų | 34 | 71% | 0.71 | 19% | 0.188 | S | C | * | . | trans | -113.3 | 12.1 | -177.5 | -74.4 | 175.1 | 11.4 | 0 | 0 | 113.2 | G51 A271 | G51-Q53 WeakPolarHBondContact O-CG 3.34Å; G51-Q53 PolarHBondContact O-N 3.02Å; G51-Q53 VanDerWaalsContact O-N 3.16Å; Q53-A271 PolarHBondContact N-O 3.27Å | ||
| 54 | L | 80.1 | Confident | 78.2 | Confident | 16 Ų | 16 | 32.3 Ų | 32.3 | 8% | 0.084 | 18% | 0.177 | C | C | . | . | B | Isolated β-bridge | trans | -74.6 | 145.5 | -175 | -62.6 | 179.3 | 0 | 0 | 0 | 112.1 | V59 K185 V188 A271 | L54-V59 HydrophobicContact CB-CG2 3.49Å; L54-V59 VanDerWaalsContact CB-CG2 3.49Å; L54-V59 HydrophobicContact CD1-CG2 3.89Å; L54-V59 HydrophobicContact CG-CG2 4.32Å; L54-K185 HydrophobicContact CD2-CG 4.2Å; L54-V188 HydrophobicContact CD1-CG2 4.12Å; L54-A271 HydrophobicContact CD1-CB 3.92Å; L54-A271 PolarHBondContact N-O 2.96Å |
| 55 | A | 87.2 | Confident | 79.7 | Confident | 48 Ų | 48 | 31.7 Ų | 31.7 | 40% | 0.397 | 17% | 0.171 | S | C | . | . | trans | -81.6 | 151.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | V57 P58 V59 | A55-V57 PolarHBondContact O-N 3.49Å; A55-P58 HydrophobicContact CB-CG 4.3Å; A55-P58 WeakPolarHBondContact O-CD 3.49Å; A55-V59 VanDerWaalsContact O-CG2 3.28Å; A55-V59 WeakPolarHBondContact O-CG2 3.24Å; A55-V59 PolarHBondContact O-N 3Å | ||
| 56 | A | 90.6 | Very high | 80.7 | Confident | 8 Ų | 8 | 25.8 Ų | 25.8 | 7% | 0.066 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.8 | -38.3 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | G60 R277 L280 A281 | A56-G60 PolarHBondContact O-N 3.2Å; A56-R277 HydrophobicContact CB-CB 4.24Å; A56-R277 VanDerWaalsContact CB-O 3.3Å; A56-R277 WeakPolarHBondContact CB-O 3.48Å; A56-L280 HydrophobicContact CB-CB 4.04Å; A56-L280 HydrophobicContact CB-CD2 3.81Å; A56-L280 HydrophobicContact CB-CG 3.92Å; A56-A281 HydrophobicContact CB-CB 4.31Å; A56-A281 WeakPolarHBondContact O-CA 3.26Å; A56-A281 WeakPolarHBondContact O-CB 3.39Å |
| 57 | V | 93.3 | Very high | 81.1 | Confident | 81 Ų | 81 | 23.4 Ų | 23.4 | 49% | 0.491 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -68.6 | -52.5 | -176.1 | 174.5 | 0 | 0 | 0 | 0 | 112.3 | A55 V59 G60 L61 V284 | A55-V57 PolarHBondContact O-N 3.49Å; V57-V59 VanDerWaalsContact C-N 3.29Å; V57-V59 PolarHBondContact O-N 3.19Å; V57-G60 PolarHBondContact O-N 3.24Å; V57-L61 HydrophobicContact CG1-CD1 4.09Å; V57-L61 HydrophobicContact CG1-CG 4.47Å; V57-L61 WeakPolarHBondContact O-CG 3.37Å; V57-L61 PolarHBondContact O-N 3.36Å; V57-V284 HydrophobicContact CG2-CG2 4.27Å |
| 58 | P | 91.2 | Very high | 81.7 | Confident | 17 Ų | 17 | 23 Ų | 23 | 11% | 0.11 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58 | -41 | 175.1 | -26 | 34.6 | 0 | 0 | 0 | 112.8 | A55 S62 V188 W189 V192 | A55-P58 HydrophobicContact CB-CG 4.3Å; A55-P58 WeakPolarHBondContact O-CD 3.49Å; P58-S62 WeakPolarHBondContact O-CB 3.34Å; P58-S62 PolarHBondContact O-N 3.12Å; P58-V188 HydrophobicContact CB-CG1 3.68Å; P58-W189 HydrophobicContact CG-CH2 4.3Å; P58-W189 HydrophobicContact CG-CZ2 4.32Å; P58-V192 HydrophobicContact CB-CG2 4.02Å |
| 59 | V | 91.6 | Very high | 82.8 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64 | -45.3 | 176.7 | 175.1 | 0 | 0 | 0 | 0 | 110.7 | L54 A55 V57 S62 L63 R268 A281 | L54-V59 HydrophobicContact CB-CG2 3.49Å; L54-V59 VanDerWaalsContact CB-CG2 3.49Å; L54-V59 HydrophobicContact CD1-CG2 3.89Å; L54-V59 HydrophobicContact CG-CG2 4.32Å; A55-V59 VanDerWaalsContact O-CG2 3.28Å; A55-V59 WeakPolarHBondContact O-CG2 3.24Å; A55-V59 PolarHBondContact O-N 3Å; V57-V59 VanDerWaalsContact C-N 3.29Å; V57-V59 PolarHBondContact O-N 3.19Å; V59-S62 WeakPolarHBondContact O-CB 3.46Å; V59-S62 PolarHBondContact O-N 3.16Å; V59-L63 HydrophobicContact CG1-CD1 4.17Å; V59-L63 HydrophobicContact CG1-CG 4.28Å; V59-L63 VanDerWaalsContact O-CG 3.23Å; V59-L63 WeakPolarHBondContact O-CG 3.14Å; V59-L63 PolarHBondContact O-N 3.39Å; V59-R268 HydrophobicContact CG1-CB 4.36Å; V59-R268 WeakPolarHBondContact CG1-O 3.17Å; V59-A281 HydrophobicContact CB-CB 4.09Å; V59-A281 HydrophobicContact CG1-CB 3.87Å |
| 60 | G | 93.5 | Very high | 83.9 | Confident | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.3 | -43.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | A56 V57 S62 L63 A64 A281 N285 | A56-G60 PolarHBondContact O-N 3.2Å; V57-G60 PolarHBondContact O-N 3.24Å; G60-S62 VanDerWaalsContact C-N 3.32Å; G60-L63 PolarHBondContact O-N 3.31Å; G60-A64 PolarHBondContact O-N 3.17Å; G60-A281 WeakPolarHBondContact CA-O 3.46Å; G60-N285 VanDerWaalsContact O-CA 3.29Å; G60-N285 WeakPolarHBondContact O-CA 3.4Å; G60-N285 WeakPolarHBondContact O-CB 3.3Å |
| 61 | L | 93 | Very high | 85.2 | Confident | 40 Ų | 40 | 22.4 Ų | 22.4 | 21% | 0.209 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.6 | -37.9 | 174.4 | -68.8 | 176 | 0 | 0 | 0 | 111.7 | V57 A64 A65 V192 V195 V284 | V57-L61 HydrophobicContact CG1-CD1 4.09Å; V57-L61 HydrophobicContact CG1-CG 4.47Å; V57-L61 WeakPolarHBondContact O-CG 3.37Å; V57-L61 PolarHBondContact O-N 3.36Å; L61-A64 PolarHBondContact O-N 3.13Å; L61-A65 WeakPolarHBondContact O-CB 3.32Å; L61-A65 PolarHBondContact O-N 3.08Å; L61-V192 HydrophobicContact CB-CG2 4.03Å; L61-V192 HydrophobicContact CD1-CG1 4.04Å; L61-V192 HydrophobicContact CD1-CG2 4.14Å; L61-V195 HydrophobicContact CD2-CG1 4.31Å; L61-V284 HydrophobicContact CD2-CG1 4.44Å; L61-V284 HydrophobicContact CG-CG1 4.31Å |
| 62 | S | 91.9 | Very high | 86.5 | Confident | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -63.8 | -46.3 | 174.9 | 175.3 | 0 | 0 | 0 | 0 | 112 | P58 V59 G60 A64 A65 S66 D191 R268 | P58-S62 WeakPolarHBondContact O-CB 3.34Å; P58-S62 PolarHBondContact O-N 3.12Å; V59-S62 WeakPolarHBondContact O-CB 3.46Å; V59-S62 PolarHBondContact O-N 3.16Å; G60-S62 VanDerWaalsContact C-N 3.32Å; S62-A64 VanDerWaalsContact C-N 3.26Å; S62-A64 PolarHBondContact O-N 3.19Å; S62-A65 PolarHBondContact O-N 3.4Å; S62-S66 PolarHBondContact O-N 3.45Å; S62-S66 PolarHBondContact O-OG 3.48Å; S62-S66 VanDerWaalsContact O-OG 3.13Å; S62-D191 WeakPolarHBondContact CB-OD2 3.47Å; S62-D191 PolarHBondContact OG-OD2 3.21Å; S62-R268 PolarHBondContact O-NH1 2.97Å; S62-R268 PolarHBondContact OG-NH1 3.5Å; S62-R268 PolarHBondContact OG-NH2 2.91Å |
| 63 | L | 92.1 | Very high | 87.5 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -53.4 | -44.6 | 171.9 | -69.7 | 171.3 | 0 | 0 | 0 | 111 | V59 G60 Y259 Q265 R268 Y269 A281 L282 N285 | V59-L63 HydrophobicContact CG1-CD1 4.17Å; V59-L63 HydrophobicContact CG1-CG 4.28Å; V59-L63 VanDerWaalsContact O-CG 3.23Å; V59-L63 WeakPolarHBondContact O-CG 3.14Å; V59-L63 PolarHBondContact O-N 3.39Å; G60-L63 PolarHBondContact O-N 3.31Å; L63-Y259 HydrophobicContact CB-CE1 4.35Å; L63-Q265 HydrophobicContact CD2-CB 4.15Å; L63-R268 HydrophobicContact CD2-CB 3.78Å; L63-Y269 HydrophobicContact CD2-CD1 4.42Å; L63-A281 HydrophobicContact CD1-CB 4.4Å; L63-L282 HydrophobicContact CD1-CD2 4.16Å; L63-N285 VanDerWaalsContact C-OD1 3.22Å; L63-N285 HydrophobicContact CB-CB 3.87Å; L63-N285 HydrophobicContact CD1-CB 4.22Å |
| 64 | A | 91.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 10.9 Ų | 10.9 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -66.2 | -47.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | G60 L61 S62 S66 F67 M68 N285 L289 | G60-A64 PolarHBondContact O-N 3.17Å; L61-A64 PolarHBondContact O-N 3.13Å; S62-A64 VanDerWaalsContact C-N 3.26Å; S62-A64 PolarHBondContact O-N 3.19Å; A64-S66 VanDerWaalsContact C-N 3.27Å; A64-S66 PolarHBondContact O-N 3.47Å; A64-F67 PolarHBondContact O-N 3.26Å; A64-M68 WeakPolarHBondContact O-CB 3.47Å; A64-M68 VanDerWaalsContact O-CG 3.26Å; A64-M68 WeakPolarHBondContact O-CG 3.39Å; A64-M68 PolarHBondContact O-N 3.47Å; A64-N285 WeakPolarHBondContact CA-OD1 3.44Å; A64-N285 WeakPolarHBondContact CB-OD1 3.03Å; A64-N285 PolarHBondContact N-OD1 2.89Å; A64-L289 HydrophobicContact CB-CD2 4.31Å; A64-L289 HydrophobicContact CB-CG 4.32Å |
| 65 | A | 89.3 | Confident | 88.7 | Confident | 0 Ų | 0 | 10.2 Ų | 10.2 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -55.7 | -41.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L61 S62 F67 M68 D191 V195 S353 | L61-A65 WeakPolarHBondContact O-CB 3.32Å; L61-A65 PolarHBondContact O-N 3.08Å; S62-A65 PolarHBondContact O-N 3.4Å; A65-F67 VanDerWaalsContact C-N 3.29Å; A65-F67 PolarHBondContact O-N 3.06Å; A65-M68 CarbonylContact O-C 3.48Å; A65-M68 PolarHBondContact O-N 3.47Å; A65-D191 HydrophobicContact CB-CB 3.78Å; A65-V195 HydrophobicContact CB-CG2 3.57Å; A65-S353 VanDerWaalsContact C-OG 3.32Å; A65-S353 VanDerWaalsContact CB-OG 3.23Å; A65-S353 WeakPolarHBondContact CB-OG 3.38Å |
| 66 | S | 84.2 | Confident | 89 | Confident | 2 Ų | 2 | 7.9 Ų | 7.9 | 1% | 0.014 | 5% | 0.047 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | -7 | -170.9 | -60.2 | 0 | 0 | 0 | 0 | 115.5 | S62 A64 D191 R268 S353 T354 T357 | S62-S66 PolarHBondContact O-N 3.45Å; S62-S66 PolarHBondContact O-OG 3.48Å; S62-S66 VanDerWaalsContact O-OG 3.13Å; A64-S66 VanDerWaalsContact C-N 3.27Å; A64-S66 PolarHBondContact O-N 3.47Å; S66-D191 PolarHBondContact OG-OD2 3.22Å; S66-R268 PolarHBondContact OG-NH1 3.32Å; S66-R268 PolarHBondContact OG-NH2 3.46Å; S66-S353 WeakPolarHBondContact CA-OG 3.45Å; S66-S353 PolarHBondContact N-OG 3.07Å; S66-S353 PolarHBondContact OG-O 3.33Å; S66-S353 PolarHBondContact OG-OG 2.93Å; S66-T354 WeakPolarHBondContact O-CB 3.43Å; S66-T354 WeakPolarHBondContact O-CG2 3.37Å; S66-T354 PolarHBondContact O-OG1 3.18Å; S66-T354 VanDerWaalsContact O-OG1 3.05Å; S66-T357 PolarHBondContact OG-OG1 3.44Å |
| 67 | F | 75.8 | Confident | 89.2 | Confident | 5 Ų | 5 | 7.5 Ų | 7.5 | 2% | 0.022 | 4% | 0.044 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -111.3 | -17.8 | 165.2 | -81.3 | -57.4 | 0 | 0 | 0 | 113 | A64 A65 S69 Q72 Y144 W255 M258 Y259 Q265 M420 | A64-F67 PolarHBondContact O-N 3.26Å; A65-F67 VanDerWaalsContact C-N 3.29Å; A65-F67 PolarHBondContact O-N 3.06Å; F67-S69 PolarHBondContact O-N 3.43Å; F67-Q72 PolarHBondContact O-NE2 3.23Å; F67-Y144 HydrophobicContact CD1-CE1 4.31Å; F67-Y144 HydrophobicContact CE1-CE1 4.2Å; F67-W255 HydrophobicContact CB-CH2 4.1Å; F67-W255 HydrophobicContact CB-CZ3 3.82Å; F67-W255 HydrophobicContact CD1-CZ3 4.35Å; F67-W255 HydrophobicContact CD2-CZ3 4.12Å; F67-W255 AromaticContact CG-CZ3 3.88Å; F67-W255 HydrophobicContact CG-CZ3 3.88Å; F67-M258 HydrophobicContact CE1-CB 4.33Å; F67-M258 HydrophobicContact CE1-CG 4.2Å; F67-M258 HydrophobicContact CE1-SD 3.73Å; F67-M258 HydrophobicContact CE2-CB 3.78Å; F67-M258 HydrophobicContact CE2-CG 4.5Å; F67-M258 HydrophobicContact CZ-CB 3.59Å; F67-M258 HydrophobicContact CZ-CG 3.89Å; F67-M258 HydrophobicContact CZ-SD 3.56Å; F67-M258 VanDerWaalsContact CZ-SD 3.56Å; F67-Y259 HydrophobicContact CD2-CE1 4.31Å; F67-Y259 AromaticContact CD2-CE2 3.88Å; F67-Y259 HydrophobicContact CD2-CE2 3.88Å; F67-Y259 AromaticContact CD2-CZ 3.66Å; F67-Y259 HydrophobicContact CE2-CE2 4.13Å; F67-Q265 HydrophobicContact CD2-CG 4.11Å; F67-Q265 HydrophobicContact CE2-CG 3.27Å; F67-Q265 HydrophobicContact CZ-CG 3.94Å; F67-M420 HydrophobicContact CD1-CE 4.08Å; F67-M420 HydrophobicContact CE1-CE 3.68Å; F67-M420 HydrophobicContact CZ-CE 4.48Å |
| 68 | M | 76.9 | Confident | 89.1 | Confident | 0 Ų | 0 | 3.8 Ų | 3.8 | 0% | 0 | 2% | 0.022 | C | C | . | . | S | Bend | trans | -78.2 | 75.3 | 166.2 | -63.9 | -53.4 | -63.8 | 0 | 0 | 110.1 | A64 A65 Q72 M198 L289 I292 V293 G350 | A64-M68 WeakPolarHBondContact O-CB 3.47Å; A64-M68 VanDerWaalsContact O-CG 3.26Å; A64-M68 WeakPolarHBondContact O-CG 3.39Å; A64-M68 PolarHBondContact O-N 3.47Å; A65-M68 CarbonylContact O-C 3.48Å; A65-M68 PolarHBondContact O-N 3.47Å; M68-Q72 HydrophobicContact CE-CB 3.8Å; M68-Q72 HydrophobicContact CE-CG 4.38Å; M68-Q72 HydrophobicContact SD-CB 4.47Å; M68-Q72 HydrophobicContact SD-CG 4.46Å; M68-Q72 PolarHBondContact SD-NE2 3.32Å; M68-Q72 PolarHBondContact SD-OE1 2.81Å; M68-Q72 VanDerWaalsContact SD-OE1 3.35Å; M68-M198 HydrophobicContact CB-CE 3.67Å; M68-M198 VanDerWaalsContact O-CE 3.29Å; M68-M198 WeakPolarHBondContact O-CE 3.31Å; M68-L289 HydrophobicContact CG-CD2 3.58Å; M68-L289 HydrophobicContact SD-CD2 3.59Å; M68-L289 VanDerWaalsContact SD-CD2 3.59Å; M68-I292 HydrophobicContact CB-CD1 4.22Å; M68-I292 HydrophobicContact CE-CB 3.68Å; M68-I292 HydrophobicContact CE-CG2 3.17Å; M68-I292 HydrophobicContact CG-CB 4.31Å; M68-I292 HydrophobicContact CG-CD1 3.71Å; M68-I292 HydrophobicContact CG-CG2 4.27Å; M68-I292 HydrophobicContact SD-CB 4.44Å; M68-I292 HydrophobicContact SD-CG2 4.38Å; M68-V293 HydrophobicContact CE-CG2 4Å; M68-V293 HydrophobicContact SD-CG2 4.13Å; M68-G350 WeakPolarHBondContact O-CA 3.23Å |
| 69 | S | 84.8 | Confident | 89.2 | Confident | 1 Ų | 1 | 3.8 Ų | 3.8 | 1% | 0.007 | 2% | 0.02 | C | C | . | . | trans | -85.2 | 173.4 | 175.3 | 66.6 | 0 | 0 | 0 | 0 | 112.4 | F67 V71 Q72 V73 T354 | F67-S69 PolarHBondContact O-N 3.43Å; S69-V71 PolarHBondContact O-N 2.73Å; S69-V71 VanDerWaalsContact OG-CB 3.28Å; S69-V71 WeakPolarHBondContact OG-CB 3.5Å; S69-V71 PolarHBondContact OG-N 2.94Å; S69-Q72 PolarHBondContact O-N 3.44Å; S69-V73 PolarHBondContact O-N 3.05Å; S69-T354 WeakPolarHBondContact CB-OG1 3.26Å | ||
| 70 | A | 85.2 | Confident | 89.3 | Confident | 0 Ų | 0 | 3.8 Ų | 3.8 | 0% | 0 | 2% | 0.02 | C | C | . | . | H | α-helix | trans | -54.1 | -25.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113 | Q72 V73 L74 A151 P152 A347 T351 | A70-Q72 VanDerWaalsContact C-N 3.27Å; A70-Q72 PolarHBondContact O-N 2.89Å; A70-V73 PolarHBondContact O-N 3.08Å; A70-V73 VanDerWaalsContact O-N 3.16Å; A70-L74 WeakPolarHBondContact O-CG 3.48Å; A70-L74 PolarHBondContact O-N 2.94Å; A70-A151 HydrophobicContact CB-CB 3.69Å; A70-P152 HydrophobicContact CB-CB 4.16Å; A70-P152 HydrophobicContact CB-CG 4.26Å; A70-A347 HydrophobicContact CB-CB 4.06Å; A70-A347 WeakPolarHBondContact CB-O 3.36Å; A70-T351 WeakPolarHBondContact CB-OG1 3.48Å |
| 71 | V | 88.3 | Confident | 89.2 | Confident | 4 Ų | 4 | 4.1 Ų | 4.1 | 2% | 0.024 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -57.5 | -42.1 | 173.1 | 176.5 | 0 | 0 | 0 | 0 | 111 | S69 G75 I147 V148 A151 V412 L413 S416 | S69-V71 PolarHBondContact O-N 2.73Å; S69-V71 VanDerWaalsContact OG-CB 3.28Å; S69-V71 WeakPolarHBondContact OG-CB 3.5Å; S69-V71 PolarHBondContact OG-N 2.94Å; V71-G75 VanDerWaalsContact O-CA 3.32Å; V71-G75 WeakPolarHBondContact O-CA 3.4Å; V71-G75 PolarHBondContact O-N 2.82Å; V71-I147 HydrophobicContact CG2-CG2 4.33Å; V71-V148 HydrophobicContact CG2-CB 4.41Å; V71-V148 HydrophobicContact CG2-CG2 3.84Å; V71-A151 HydrophobicContact CG2-CB 4.03Å; V71-V412 HydrophobicContact CB-CG2 4.34Å; V71-V412 HydrophobicContact CG1-CB 4.28Å; V71-V412 HydrophobicContact CG1-CG2 4Å; V71-V412 WeakPolarHBondContact CG1-O 3.18Å; V71-V412 HydrophobicContact CG2-CB 4.38Å; V71-V412 HydrophobicContact CG2-CG2 4.39Å; V71-L413 VanDerWaalsContact CG1-CA 3.41Å; V71-L413 HydrophobicContact CG1-CB 3.99Å; V71-S416 WeakPolarHBondContact CG1-OG 3.16Å |
| 72 | Q | 90.1 | Very high | 89 | Confident | 7 Ų | 7 | 4.4 Ų | 4.4 | 3% | 0.033 | 2% | 0.021 | C | C | . | . | H | α-helix | trans | -76.7 | -33 | 176.5 | -65.4 | -157 | 62.1 | 0 | 0 | 111.8 | F67 M68 S69 A70 L74 V76 P77 | F67-Q72 PolarHBondContact O-NE2 3.23Å; M68-Q72 HydrophobicContact CE-CB 3.8Å; M68-Q72 HydrophobicContact CE-CG 4.38Å; M68-Q72 HydrophobicContact SD-CB 4.47Å; M68-Q72 HydrophobicContact SD-CG 4.46Å; M68-Q72 PolarHBondContact SD-NE2 3.32Å; M68-Q72 PolarHBondContact SD-OE1 2.81Å; M68-Q72 VanDerWaalsContact SD-OE1 3.35Å; S69-Q72 PolarHBondContact O-N 3.44Å; A70-Q72 VanDerWaalsContact C-N 3.27Å; A70-Q72 PolarHBondContact O-N 2.89Å; Q72-L74 VanDerWaalsContact C-N 3.27Å; Q72-L74 PolarHBondContact O-N 2.97Å; Q72-V76 HydrophobicContact CB-CG2 4.02Å; Q72-V76 HydrophobicContact CG-CG2 4.42Å; Q72-V76 WeakPolarHBondContact O-CB 3.31Å; Q72-V76 WeakPolarHBondContact O-CG2 3.39Å; Q72-V76 PolarHBondContact O-N 2.59Å; Q72-P77 WeakPolarHBondContact O-CD 3.41Å |
| 73 | V | 90.3 | Very high | 88.9 | Confident | 0 Ų | 0 | 4.8 Ų | 4.8 | 0% | 0 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -61.7 | -35.7 | 176.4 | 179.4 | 0 | 0 | 0 | 0 | 112.3 | S69 A70 P77 M198 F202 F343 A347 | S69-V73 PolarHBondContact O-N 3.05Å; A70-V73 PolarHBondContact O-N 3.08Å; A70-V73 VanDerWaalsContact O-N 3.16Å; V73-P77 WeakPolarHBondContact O-CD 3.38Å; V73-P77 VanDerWaalsContact O-CG 3.3Å; V73-P77 WeakPolarHBondContact O-CG 3.4Å; V73-M198 HydrophobicContact CG2-CE 4Å; V73-F202 HydrophobicContact CB-CZ 4.12Å; V73-F202 HydrophobicContact CG1-CE1 4.22Å; V73-F202 HydrophobicContact CG1-CZ 3.98Å; V73-F202 HydrophobicContact CG2-CE2 4.3Å; V73-F202 HydrophobicContact CG2-CZ 3.91Å; V73-F343 HydrophobicContact CG1-CE2 3.78Å; V73-F343 HydrophobicContact CG1-CZ 4.36Å; V73-A347 HydrophobicContact CG1-CB 4.35Å |
| 74 | L | 90.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 4.8 Ų | 4.8 | 0% | 0 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -89.4 | -47.3 | 175.5 | -63.1 | -178.6 | 0 | 0 | 0 | 112.6 | A70 Q72 A78 A151 L154 I155 D322 M325 P326 F343 | A70-L74 WeakPolarHBondContact O-CG 3.48Å; A70-L74 PolarHBondContact O-N 2.94Å; Q72-L74 VanDerWaalsContact C-N 3.27Å; Q72-L74 PolarHBondContact O-N 2.97Å; L74-A78 WeakPolarHBondContact O-CB 3.46Å; L74-A78 PolarHBondContact O-N 3.15Å; L74-A151 HydrophobicContact CD1-CB 4.15Å; L74-L154 HydrophobicContact CD1-CD2 4.49Å; L74-I155 HydrophobicContact CD1-CD1 3.98Å; L74-I155 HydrophobicContact CD1-CG1 3.8Å; L74-I155 HydrophobicContact CD2-CD1 3.68Å; L74-I155 HydrophobicContact CD2-CG1 3.79Å; L74-I155 HydrophobicContact CG-CD1 3.93Å; L74-I155 HydrophobicContact CG-CG1 4.17Å; L74-D322 HydrophobicContact CB-CB 4.5Å; L74-D322 HydrophobicContact CD1-CB 4.45Å; L74-M325 HydrophobicContact CD2-CB 4.06Å; L74-P326 HydrophobicContact CD2-CG 3.81Å; L74-F343 HydrophobicContact CD2-CZ 4.07Å |
| 75 | G | 91.5 | Very high | 88.9 | Confident | 1 Ų | 1 | 5.9 Ų | 5.9 | 1% | 0.01 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -73.5 | -44.2 | -169.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | V71 A78 E79 | V71-G75 VanDerWaalsContact O-CA 3.32Å; V71-G75 WeakPolarHBondContact O-CA 3.4Å; V71-G75 PolarHBondContact O-N 2.82Å; G75-A78 PolarHBondContact O-N 2.9Å; G75-E79 WeakPolarHBondContact O-CB 3.49Å; G75-E79 WeakPolarHBondContact O-CG 3.33Å; G75-E79 PolarHBondContact O-N 2.89Å |
| 76 | V | 93.6 | Very high | 89 | Confident | 0 Ų | 0 | 7 Ų | 7 | 0% | 0 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -63.2 | -45.9 | -176.3 | 178.1 | 0 | 0 | 0 | 0 | 111.6 | Q72 A78 E79 A80 F87 V293 A296 A297 L413 | Q72-V76 HydrophobicContact CB-CG2 4.02Å; Q72-V76 HydrophobicContact CG-CG2 4.42Å; Q72-V76 WeakPolarHBondContact O-CB 3.31Å; Q72-V76 WeakPolarHBondContact O-CG2 3.39Å; Q72-V76 PolarHBondContact O-N 2.59Å; V76-A78 PolarHBondContact O-N 2.81Å; V76-E79 PolarHBondContact O-N 2.84Å; V76-A80 VanDerWaalsContact O-CB 3.29Å; V76-A80 WeakPolarHBondContact O-CB 3.41Å; V76-A80 PolarHBondContact O-N 2.97Å; V76-F87 HydrophobicContact CB-CE1 4.34Å; V76-F87 HydrophobicContact CG1-CD1 3.82Å; V76-F87 HydrophobicContact CG1-CE1 3.89Å; V76-F87 HydrophobicContact CG2-CD1 4.37Å; V76-F87 HydrophobicContact CG2-CE1 3.61Å; V76-F87 HydrophobicContact CG2-CZ 3.79Å; V76-V293 HydrophobicContact CG1-CG1 4.46Å; V76-A296 HydrophobicContact CB-CB 3.96Å; V76-A296 HydrophobicContact CG1-CB 3.81Å; V76-A297 HydrophobicContact CG1-CB 4.3Å; V76-L413 HydrophobicContact CG2-CD1 3.9Å |
| 77 | P | 94.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 7 Ų | 7 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -61.1 | -42 | 173.4 | -23.1 | 34.3 | 0 | 0 | 0 | 112.9 | Q72 V73 A80 A81 F202 A296 G300 M303 M325 | Q72-P77 WeakPolarHBondContact O-CD 3.41Å; V73-P77 WeakPolarHBondContact O-CD 3.38Å; V73-P77 VanDerWaalsContact O-CG 3.3Å; V73-P77 WeakPolarHBondContact O-CG 3.4Å; P77-A80 PolarHBondContact O-N 2.69Å; P77-A81 WeakPolarHBondContact O-CB 3.46Å; P77-A81 PolarHBondContact O-N 3.23Å; P77-F202 HydrophobicContact CG-CE1 4.39Å; P77-A296 HydrophobicContact CG-CB 4.17Å; P77-A296 WeakPolarHBondContact CG-O 3.38Å; P77-G300 WeakPolarHBondContact O-CA 3.35Å; P77-M303 HydrophobicContact CB-CE 4.2Å; P77-M303 VanDerWaalsContact O-CE 3.27Å; P77-M303 WeakPolarHBondContact O-CE 3.49Å; P77-M325 HydrophobicContact CB-SD 3.75Å; P77-M325 HydrophobicContact CG-CG 4.49Å; P77-M325 HydrophobicContact CG-SD 3.9Å |
| 78 | A | 92.3 | Very high | 90.1 | Very high | 3 Ų | 3 | 8.6 Ų | 8.6 | 3% | 0.025 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -62.8 | -43.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L74 G75 V76 A81 R82 P321 Y324 | L74-A78 WeakPolarHBondContact O-CB 3.46Å; L74-A78 PolarHBondContact O-N 3.15Å; G75-A78 PolarHBondContact O-N 2.9Å; V76-A78 PolarHBondContact O-N 2.81Å; A78-A81 PolarHBondContact O-N 3.27Å; A78-R82 WeakPolarHBondContact O-CB 3.48Å; A78-R82 WeakPolarHBondContact O-CG 3.41Å; A78-R82 PolarHBondContact O-N 3.23Å; A78-P321 HydrophobicContact CB-CB 4.34Å; A78-P321 WeakPolarHBondContact CB-O 3.46Å; A78-Y324 HydrophobicContact CB-CD2 4.37Å |
| 79 | E | 91.8 | Very high | 90.9 | Very high | 16 Ų | 16 | 11.7 Ų | 11.7 | 8% | 0.075 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -67.6 | -40.7 | 176.9 | -65.6 | -75.5 | -179.9 | 0 | 0 | 110.9 | G75 V76 A81 R82 Y83 F87 R241 Y242 L413 | G75-E79 WeakPolarHBondContact O-CB 3.49Å; G75-E79 WeakPolarHBondContact O-CG 3.33Å; G75-E79 PolarHBondContact O-N 2.89Å; V76-E79 PolarHBondContact O-N 2.84Å; E79-A81 VanDerWaalsContact C-N 3.35Å; E79-A81 PolarHBondContact O-N 3.48Å; E79-R82 PolarHBondContact O-N 3.49Å; E79-Y83 WeakPolarHBondContact O-CB 3.26Å; E79-Y83 WeakPolarHBondContact O-CD2 3.27Å; E79-Y83 PolarHBondContact O-N 2.92Å; E79-Y83 WeakPolarHBondContact OE2-CD2 3.3Å; E79-Y83 WeakPolarHBondContact OE2-CE2 3.48Å; E79-F87 HydrophobicContact CB-CD2 4.3Å; E79-R241 IonicContact OE1-CZ 3.08Å; E79-R241 IonicContact OE1-NE 2.64Å; E79-R241 IonicContact OE1-NH2 3.86Å; E79-R241 PolarHBondContact OE1-NH2 2.98Å; E79-R241 IonicContact OE2-NE 3.64Å; E79-R241 IonicContact OE2-NH2 3.32Å; E79-Y242 HydrophobicContact CB-CE2 4.27Å; E79-Y242 PolarHBondContact OE1-OH 3.35Å; E79-Y242 WeakPolarHBondContact OE2-CE2 3.45Å; E79-Y242 VanDerWaalsContact OE2-CZ 3.23Å; E79-Y242 PolarHBondContact OE2-OH 3.42Å; E79-L413 HydrophobicContact CG-CD1 4.41Å; E79-L413 HydrophobicContact CG-CD2 4.16Å |
| 80 | A | 93.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -65.4 | -36.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V76 P77 G84 A297 | V76-A80 VanDerWaalsContact O-CB 3.29Å; V76-A80 WeakPolarHBondContact O-CB 3.41Å; V76-A80 PolarHBondContact O-N 2.97Å; P77-A80 PolarHBondContact O-N 2.69Å; A80-G84 WeakPolarHBondContact CA-O 3.38Å; A80-G84 CarbonylContact O-C 3.18Å; A80-G84 WeakPolarHBondContact O-CA 3.48Å; A80-G84 PolarHBondContact O-N 2.92Å; A80-A297 HydrophobicContact CB-CB 4.19Å |
| 81 | A | 91.9 | Very high | 91.7 | Very high | 8 Ų | 8 | 12 Ų | 12 | 7% | 0.066 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -67.1 | -38.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | P77 A78 E79 R228 G300 M303 F304 | P77-A81 WeakPolarHBondContact O-CB 3.46Å; P77-A81 PolarHBondContact O-N 3.23Å; A78-A81 PolarHBondContact O-N 3.27Å; E79-A81 VanDerWaalsContact C-N 3.35Å; E79-A81 PolarHBondContact O-N 3.48Å; A81-R228 VanDerWaalsContact O-CZ 3.25Å; A81-R228 PolarHBondContact O-NH1 2.89Å; A81-G300 WeakPolarHBondContact CB-O 3.39Å; A81-M303 HydrophobicContact CB-CE 3.4Å; A81-F304 HydrophobicContact CB-CB 4.18Å |
| 82 | R | 89.6 | Confident | 91.9 | Very high | 46 Ų | 46 | 13.7 Ų | 13.7 | 17% | 0.174 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -87 | -30.5 | -175.8 | -69.6 | -177.5 | 76 | -166.6 | 5.9 | 115.2 | A78 E79 R228 P321 Y324 L476 | A78-R82 WeakPolarHBondContact O-CB 3.48Å; A78-R82 WeakPolarHBondContact O-CG 3.41Å; A78-R82 PolarHBondContact O-N 3.23Å; E79-R82 PolarHBondContact O-N 3.49Å; R82-R228 PolarHBondContact O-NH1 2.92Å; R82-P321 VanDerWaalsContact NH1-CG 3.33Å; R82-Y324 HydrophobicContact CG-CE2 4.45Å; R82-L476 PolarHBondContact O-N 2.96Å |
| 83 | Y | 89.6 | Confident | 92.1 | Very high | 7 Ų | 7 | 13.3 Ų | 13.3 | 3% | 0.027 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -125.5 | -3.6 | -174.6 | -55.9 | -87 | 0 | 0 | 0 | 114.1 | E79 R241 Y242 M473 G474 V475 | E79-Y83 WeakPolarHBondContact O-CB 3.26Å; E79-Y83 WeakPolarHBondContact O-CD2 3.27Å; E79-Y83 PolarHBondContact O-N 2.92Å; E79-Y83 WeakPolarHBondContact OE2-CD2 3.3Å; E79-Y83 WeakPolarHBondContact OE2-CE2 3.48Å; Y83-R241 VanDerWaalsContact CZ-CD 3.47Å; Y83-R241 WeakPolarHBondContact OH-CD 3.49Å; Y83-Y242 HydrophobicContact CD1-CD2 4.12Å; Y83-Y242 HydrophobicContact CD1-CE2 4.4Å; Y83-Y242 AromaticContact CD2-CD2 3.99Å; Y83-Y242 HydrophobicContact CD2-CD2 3.99Å; Y83-Y242 AromaticContact CD2-CE2 3.53Å; Y83-Y242 HydrophobicContact CD2-CE2 3.53Å; Y83-Y242 HydrophobicContact CE2-CE2 4.13Å; Y83-Y242 AromaticContact CG-CD2 3.62Å; Y83-Y242 HydrophobicContact CG-CD2 3.62Å; Y83-Y242 AromaticContact CG-CE2 3.69Å; Y83-Y242 HydrophobicContact CG-CE2 3.69Å; Y83-M473 HydrophobicContact CE1-CB 4.39Å; Y83-M473 VanDerWaalsContact CE1-O 3.3Å; Y83-M473 WeakPolarHBondContact CE1-O 3.36Å; Y83-G474 WeakPolarHBondContact CD1-O 3.26Å; Y83-V475 HydrophobicContact CE1-CB 4.21Å; Y83-V475 HydrophobicContact CE1-CG2 3.57Å |
| 84 | G | 91.1 | Very high | 92.2 | Very high | 1 Ų | 1 | 13.3 Ų | 13.3 | 1% | 0.01 | 7% | 0.068 | C | C | . | . | trans | 83.7 | -169.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114 | A80 K86 R228 | A80-G84 WeakPolarHBondContact CA-O 3.38Å; A80-G84 CarbonylContact O-C 3.18Å; A80-G84 WeakPolarHBondContact O-CA 3.48Å; A80-G84 PolarHBondContact O-N 2.92Å; G84-K86 PolarHBondContact O-N 3.43Å; G84-K86 VanDerWaalsContact O-N 3.1Å; G84-R228 CarbonylContact C-O 3.5Å; G84-R228 WeakPolarHBondContact CA-O 3.37Å | ||
| 85 | L | 93 | Very high | 92.4 | Very high | 22 Ų | 22 | 17 Ų | 17 | 12% | 0.115 | 9% | 0.087 | C | C | . | . | G | 310 helix | trans | -73.1 | 2.4 | -175.2 | -69.1 | -178.4 | 0 | 0 | 0 | 114.7 | F87 L88 R228 I229 L231 A297 I301 | L85-F87 PolarHBondContact O-N 2.76Å; L85-L88 HydrophobicContact CB-CD1 4.23Å; L85-L88 HydrophobicContact CD2-CD1 4.2Å; L85-L88 HydrophobicContact CD2-CG 4.48Å; L85-L88 WeakPolarHBondContact O-CB 3.5Å; L85-L88 WeakPolarHBondContact O-CG 3.14Å; L85-L88 PolarHBondContact O-N 3.28Å; L85-R228 PolarHBondContact N-O 3.36Å; L85-I229 HydrophobicContact CD1-CG1 4.29Å; L85-I229 HydrophobicContact CD1-CG2 4.37Å; L85-L231 VanDerWaalsContact C-CD2 3.47Å; L85-L231 HydrophobicContact CB-CD2 3.83Å; L85-L231 WeakPolarHBondContact O-CD2 3.29Å; L85-A297 HydrophobicContact CD2-CB 3.94Å; L85-I301 HydrophobicContact CD1-CG1 4.32Å; L85-I301 HydrophobicContact CD2-CD1 3.9Å; L85-I301 HydrophobicContact CD2-CG1 3.48Å; L85-I301 VanDerWaalsContact CD2-CG1 3.48Å; L85-I301 HydrophobicContact CG-CD1 3.84Å; L85-I301 HydrophobicContact CG-CG1 3.81Å |
| 86 | K | 91.2 | Very high | 92.6 | Very high | 25 Ų | 25 | 20.5 Ų | 20.5 | 11% | 0.109 | 11% | 0.106 | C | C | . | . | G | 310 helix | trans | -51.8 | -31 | 176 | -65.3 | -177.7 | -172.5 | 179.2 | 0 | 112.3 | G84 L88 W89 N230 D233 F247 | G84-K86 PolarHBondContact O-N 3.43Å; G84-K86 VanDerWaalsContact O-N 3.1Å; K86-L88 PolarHBondContact O-N 3.37Å; K86-L88 VanDerWaalsContact O-N 3.11Å; K86-W89 WeakPolarHBondContact O-CB 3.35Å; K86-W89 PolarHBondContact O-N 3.46Å; K86-W89 VanDerWaalsContact O-N 3.1Å; K86-N230 WeakPolarHBondContact CG-O 3.41Å; K86-D233 HydrophobicContact CD-CB 4.17Å; K86-D233 WeakPolarHBondContact CE-OD2 3.26Å; K86-D233 IonicContact NZ-OD2 3.93Å; K86-D233 PolarHBondContact NZ-OD2 2.67Å; K86-F247 HydrophobicContact CB-CE2 4.41Å; K86-F247 WeakPolarHBondContact O-CD2 3Å; K86-F247 VanDerWaalsContact O-CE2 3.23Å; K86-F247 WeakPolarHBondContact O-CE2 3.31Å |
| 87 | F | 90.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 11% | 0.106 | C | C | . | . | G | 310 helix | trans | -55.9 | -25.3 | 176.3 | -163.7 | -84.1 | 0 | 0 | 0 | 114 | V76 E79 L85 W89 M90 F247 V293 L413 | V76-F87 HydrophobicContact CB-CE1 4.34Å; V76-F87 HydrophobicContact CG1-CD1 3.82Å; V76-F87 HydrophobicContact CG1-CE1 3.89Å; V76-F87 HydrophobicContact CG2-CD1 4.37Å; V76-F87 HydrophobicContact CG2-CE1 3.61Å; V76-F87 HydrophobicContact CG2-CZ 3.79Å; E79-F87 HydrophobicContact CB-CD2 4.3Å; L85-F87 PolarHBondContact O-N 2.76Å; F87-W89 PolarHBondContact O-N 3.25Å; F87-W89 VanDerWaalsContact O-N 3.16Å; F87-M90 HydrophobicContact CD1-CB 4.31Å; F87-M90 HydrophobicContact CE1-CB 4.12Å; F87-M90 HydrophobicContact CE1-CG 4.35Å; F87-M90 HydrophobicContact CZ-CE 4.42Å; F87-M90 HydrophobicContact CZ-CG 4.5Å; F87-M90 WeakPolarHBondContact O-CB 3.47Å; F87-M90 PolarHBondContact O-N 3.44Å; F87-F247 VanDerWaalsContact CA-CZ 3.46Å; F87-F247 HydrophobicContact CB-CZ 4.13Å; F87-F247 AromaticContact CD2-CE1 3.83Å; F87-F247 HydrophobicContact CD2-CE1 3.83Å; F87-F247 AromaticContact CD2-CZ 3.72Å; F87-F247 HydrophobicContact CD2-CZ 3.72Å; F87-F247 HydrophobicContact CE2-CE1 4.11Å; F87-F247 HydrophobicContact CE2-CZ 4.42Å; F87-F247 HydrophobicContact CG-CE1 4.3Å; F87-F247 HydrophobicContact CG-CZ 4.12Å; F87-V293 HydrophobicContact CD1-CG1 4.06Å; F87-V293 HydrophobicContact CE1-CG1 4.05Å; F87-L413 HydrophobicContact CE2-CD1 4.33Å; F87-L413 HydrophobicContact CE2-CD2 4.33Å; F87-L413 HydrophobicContact CZ-CD1 4.26Å |
| 88 | L | 93.2 | Very high | 92.6 | Very high | 40 Ų | 40 | 20.9 Ų | 20.9 | 21% | 0.209 | 11% | 0.108 | C | C | . | . | G | 310 helix | trans | -62.5 | -21.7 | 177.6 | -65.5 | -176.7 | 0 | 0 | 0 | 113.5 | L85 K86 M90 C91 V293 V294 A297 | L85-L88 HydrophobicContact CB-CD1 4.23Å; L85-L88 HydrophobicContact CD2-CD1 4.2Å; L85-L88 HydrophobicContact CD2-CG 4.48Å; L85-L88 WeakPolarHBondContact O-CB 3.5Å; L85-L88 WeakPolarHBondContact O-CG 3.14Å; L85-L88 PolarHBondContact O-N 3.28Å; K86-L88 PolarHBondContact O-N 3.37Å; K86-L88 VanDerWaalsContact O-N 3.11Å; L88-M90 PolarHBondContact O-N 2.91Å; L88-C91 VanDerWaalsContact O-CB 3.3Å; L88-C91 WeakPolarHBondContact O-CB 3.35Å; L88-C91 PolarHBondContact O-N 3.18Å; L88-V293 HydrophobicContact CD2-CG1 4.34Å; L88-V294 HydrophobicContact CD2-CB 4.44Å; L88-V294 HydrophobicContact CD2-CG2 3.88Å; L88-A297 HydrophobicContact CD2-CB 3.69Å; L88-A297 HydrophobicContact CG-CB 4.34Å |
| 89 | W | 93.7 | Very high | 92.8 | Very high | 64 Ų | 64 | 25.6 Ų | 25.6 | 24% | 0.242 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.5 | -20.3 | 170.9 | -75.2 | 120.1 | 0 | 0 | 0 | 112.8 | K86 F87 C91 A92 G93 L231 F234 F244 F247 | K86-W89 WeakPolarHBondContact O-CB 3.35Å; K86-W89 PolarHBondContact O-N 3.46Å; K86-W89 VanDerWaalsContact O-N 3.1Å; F87-W89 PolarHBondContact O-N 3.25Å; F87-W89 VanDerWaalsContact O-N 3.16Å; W89-C91 PolarHBondContact O-N 3.17Å; W89-A92 HydrophobicContact CE3-CB 4.01Å; W89-A92 HydrophobicContact CZ3-CB 4.46Å; W89-A92 WeakPolarHBondContact O-CB 3.1Å; W89-A92 PolarHBondContact O-N 3.2Å; W89-G93 PolarHBondContact O-N 2.75Å; W89-L231 PolarHBondContact NE1-O 2.99Å; W89-F234 HydrophobicContact CZ2-CZ 4.42Å; W89-F244 AromaticContact CD2-CD2 3.66Å; W89-F244 HydrophobicContact CD2-CD2 3.66Å; W89-F244 HydrophobicContact CD2-CE2 4.23Å; W89-F244 AromaticContact CE2-CD2 3.72Å; W89-F244 AromaticContact CE3-CD2 3.69Å; W89-F244 HydrophobicContact CE3-CD2 3.69Å; W89-F244 AromaticContact CE3-CE2 3.76Å; W89-F244 HydrophobicContact CE3-CE2 3.76Å; W89-F244 HydrophobicContact CG-CD2 4.32Å; W89-F244 AromaticContact CH2-CD2 3.87Å; W89-F244 HydrophobicContact CH2-CD2 3.87Å; W89-F244 AromaticContact CH2-CE2 3.82Å; W89-F244 HydrophobicContact CH2-CE2 3.82Å; W89-F244 AromaticContact CZ2-CD2 3.83Å; W89-F244 HydrophobicContact CZ2-CD2 3.83Å; W89-F244 HydrophobicContact CZ2-CE2 4.27Å; W89-F244 AromaticContact CZ3-CD2 3.81Å; W89-F244 HydrophobicContact CZ3-CD2 3.81Å; W89-F244 AromaticContact CZ3-CE2 3.55Å; W89-F244 HydrophobicContact CZ3-CE2 3.55Å; W89-F247 HydrophobicContact CB-CB 3.62Å; W89-F247 HydrophobicContact CB-CD2 3.82Å; W89-F247 HydrophobicContact CB-CG 3.97Å |
| 90 | M | 91.6 | Very high | 92.9 | Very high | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.005 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -55.5 | -36.3 | 170.4 | -172.3 | 61.5 | 88.8 | 0 | 0 | 111.8 | F87 L88 A92 G93 Q94 F247 W255 F417 L524 | F87-M90 HydrophobicContact CD1-CB 4.31Å; F87-M90 HydrophobicContact CE1-CB 4.12Å; F87-M90 HydrophobicContact CE1-CG 4.35Å; F87-M90 HydrophobicContact CZ-CE 4.42Å; F87-M90 HydrophobicContact CZ-CG 4.5Å; F87-M90 WeakPolarHBondContact O-CB 3.47Å; F87-M90 PolarHBondContact O-N 3.44Å; L88-M90 PolarHBondContact O-N 2.91Å; M90-A92 VanDerWaalsContact C-N 3.29Å; M90-A92 PolarHBondContact O-N 3.3Å; M90-G93 PolarHBondContact O-N 2.86Å; M90-Q94 HydrophobicContact CG-CG 4.35Å; M90-Q94 WeakPolarHBondContact O-CG 3.07Å; M90-Q94 PolarHBondContact O-N 3.23Å; M90-F247 HydrophobicContact CB-CD1 3.78Å; M90-F247 HydrophobicContact CB-CE1 4.12Å; M90-F247 HydrophobicContact CE-CD1 3.61Å; M90-F247 HydrophobicContact CE-CE1 3.71Å; M90-F247 HydrophobicContact CG-CD1 4.45Å; M90-F247 HydrophobicContact SD-CD1 3.99Å; M90-W255 PolarHBondContact SD-NE1 3.13Å; M90-F417 HydrophobicContact CE-CE2 4.4Å; M90-F417 HydrophobicContact CE-CZ 4.24Å; M90-L524 HydrophobicContact CE-CD1 4.02Å; M90-L524 HydrophobicContact CE-CD2 3.71Å |
| 91 | C | 93.6 | Very high | 93 | Very high | 8 Ų | 8 | 27.5 Ų | 27.5 | 5% | 0.054 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.2 | -37 | 177.2 | -64.7 | 0 | 0 | 0 | 0 | 112 | L88 W89 Q94 L95 Q286 F290 | L88-C91 VanDerWaalsContact O-CB 3.3Å; L88-C91 WeakPolarHBondContact O-CB 3.35Å; L88-C91 PolarHBondContact O-N 3.18Å; W89-C91 PolarHBondContact O-N 3.17Å; C91-Q94 PolarHBondContact O-N 2.87Å; C91-L95 WeakPolarHBondContact O-CB 3.25Å; C91-L95 PolarHBondContact O-N 3.46Å; C91-Q286 PolarHBondContact O-NE2 2.96Å; C91-F290 HydrophobicContact CB-CD2 3.91Å |
| 92 | A | 93.8 | Very high | 93.1 | Very high | 38 Ų | 38 | 27.9 Ų | 27.9 | 31% | 0.314 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -67.7 | -41.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | W89 M90 L95 L96 V248 | W89-A92 HydrophobicContact CE3-CB 4.01Å; W89-A92 HydrophobicContact CZ3-CB 4.46Å; W89-A92 WeakPolarHBondContact O-CB 3.1Å; W89-A92 PolarHBondContact O-N 3.2Å; M90-A92 VanDerWaalsContact C-N 3.29Å; M90-A92 PolarHBondContact O-N 3.3Å; A92-L95 PolarHBondContact O-N 3.02Å; A92-L96 PolarHBondContact O-N 2.82Å; A92-V248 HydrophobicContact CB-CG2 4.38Å |
| 93 | G | 93.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.9 | -42.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | W89 M90 L95 L96 N97 T252 | W89-G93 PolarHBondContact O-N 2.75Å; M90-G93 PolarHBondContact O-N 2.86Å; G93-L95 PolarHBondContact O-N 2.93Å; G93-L96 PolarHBondContact O-N 2.89Å; G93-N97 WeakPolarHBondContact O-CB 3.32Å; G93-N97 PolarHBondContact O-N 3.38Å; G93-T252 VanDerWaalsContact CA-OG1 3.28Å; G93-T252 WeakPolarHBondContact CA-OG1 3.44Å; G93-T252 PolarHBondContact O-OG1 3.33Å |
| 94 | Q | 93.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.3 | -39 | 175.2 | -73.2 | 170.9 | -25 | 0 | 0 | 112.7 | M90 C91 N97 S98 W255 Q286 | M90-Q94 HydrophobicContact CG-CG 4.35Å; M90-Q94 WeakPolarHBondContact O-CG 3.07Å; M90-Q94 PolarHBondContact O-N 3.23Å; C91-Q94 PolarHBondContact O-N 2.87Å; Q94-N97 PolarHBondContact O-N 3.3Å; Q94-N97 PolarHBondContact O-ND2 2.9Å; Q94-S98 WeakPolarHBondContact O-CB 3.15Å; Q94-S98 PolarHBondContact O-N 2.57Å; Q94-S98 PolarHBondContact O-OG 3.23Å; Q94-W255 HydrophobicContact CG-CD2 3.86Å; Q94-W255 HydrophobicContact CG-CG 3.78Å; Q94-W255 HydrophobicContact CG-CZ2 4.33Å; Q94-W255 VanDerWaalsContact NE2-CE2 3.27Å; Q94-Q286 VanDerWaalsContact C-OE1 3.3Å; Q94-Q286 PolarHBondContact O-OE1 3.4Å |
| 95 | L | 94.6 | Very high | 93.5 | Very high | 76 Ų | 76 | 29.8 Ų | 29.8 | 40% | 0.398 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.8 | -49.3 | 175.4 | 175.9 | 62.9 | 0 | 0 | 0 | 110.5 | C91 A92 G93 N97 S98 L99 Q286 | C91-L95 WeakPolarHBondContact O-CB 3.25Å; C91-L95 PolarHBondContact O-N 3.46Å; A92-L95 PolarHBondContact O-N 3.02Å; G93-L95 PolarHBondContact O-N 2.93Å; L95-N97 VanDerWaalsContact C-N 3.34Å; L95-N97 PolarHBondContact O-N 3.34Å; L95-S98 PolarHBondContact O-N 3.18Å; L95-S98 VanDerWaalsContact O-N 3.1Å; L95-L99 HydrophobicContact CD1-CG 4.46Å; L95-L99 HydrophobicContact CG-CD1 4.41Å; L95-L99 WeakPolarHBondContact O-CG 3.46Å; L95-L99 PolarHBondContact O-N 3.25Å; L95-Q286 HydrophobicContact CB-CG 4.27Å; L95-Q286 HydrophobicContact CD1-CG 3.86Å |
| 96 | L | 95.7 | Very high | 93.5 | Very high | 76 Ų | 76 | 28.7 Ų | 28.7 | 40% | 0.398 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -60.5 | -44.8 | 178.7 | -176.2 | 59.1 | 0 | 0 | 0 | 111.4 | A92 G93 S98 L99 L100 T252 | A92-L96 PolarHBondContact O-N 2.82Å; G93-L96 PolarHBondContact O-N 2.89Å; L96-S98 VanDerWaalsContact C-N 3.33Å; L96-S98 PolarHBondContact O-N 3.04Å; L96-L99 PolarHBondContact O-N 3.43Å; L96-L100 HydrophobicContact CD1-CG 4.5Å; L96-L100 HydrophobicContact CG-CD1 4.2Å; L96-L100 VanDerWaalsContact O-CG 3.3Å; L96-L100 WeakPolarHBondContact O-CG 3.29Å; L96-L100 PolarHBondContact O-N 2.9Å; L96-T252 HydrophobicContact CB-CG2 4.18Å; L96-T252 HydrophobicContact CD2-CG2 3.93Å; L96-T252 HydrophobicContact CG-CG2 3.89Å |
| 97 | N | 94.2 | Very high | 93.5 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -53.5 | -48.6 | 171.2 | 143 | 66.8 | 0 | 0 | 0 | 111.9 | G93 Q94 L95 L99 L100 T101 T252 W255 L256 Y259 | G93-N97 WeakPolarHBondContact O-CB 3.32Å; G93-N97 PolarHBondContact O-N 3.38Å; Q94-N97 PolarHBondContact O-N 3.3Å; Q94-N97 PolarHBondContact O-ND2 2.9Å; L95-N97 VanDerWaalsContact C-N 3.34Å; L95-N97 PolarHBondContact O-N 3.34Å; N97-L99 VanDerWaalsContact C-N 3.29Å; N97-L99 PolarHBondContact O-N 3.04Å; N97-L100 PolarHBondContact O-N 3.38Å; N97-T101 WeakPolarHBondContact O-CB 3.41Å; N97-T101 PolarHBondContact O-N 3.04Å; N97-T101 PolarHBondContact O-OG1 3.31Å; N97-T101 VanDerWaalsContact O-OG1 3.07Å; N97-T101 PolarHBondContact OD1-OG1 3.05Å; N97-T252 HydrophobicContact CB-CG2 4.39Å; N97-W255 HydrophobicContact CB-CB 3.81Å; N97-W255 VanDerWaalsContact CG-C 3.49Å; N97-W255 VanDerWaalsContact OD1-C 3.26Å; N97-W255 PolarHBondContact OD1-O 3.03Å; N97-W255 VanDerWaalsContact OD1-O 3.08Å; N97-L256 HydrophobicContact CB-CB 4.45Å; N97-L256 WeakPolarHBondContact OD1-CA 3.38Å; N97-L256 PolarHBondContact OD1-N 3.07Å; N97-Y259 WeakPolarHBondContact ND2-CD2 3.49Å |
| 98 | S | 93.6 | Very high | 93.6 | Very high | 7 Ų | 7 | 28 Ų | 28 | 5% | 0.049 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.6 | -38.5 | -174.6 | -63.6 | 0 | 0 | 0 | 0 | 111 | Q94 L95 L96 A102 | Q94-S98 WeakPolarHBondContact O-CB 3.15Å; Q94-S98 PolarHBondContact O-N 2.57Å; Q94-S98 PolarHBondContact O-OG 3.23Å; L95-S98 PolarHBondContact O-N 3.18Å; L95-S98 VanDerWaalsContact O-N 3.1Å; L96-S98 VanDerWaalsContact C-N 3.33Å; L96-S98 PolarHBondContact O-N 3.04Å; S98-A102 VanDerWaalsContact O-CB 3.26Å; S98-A102 WeakPolarHBondContact O-CB 3.41Å; S98-A102 PolarHBondContact O-N 2.82Å |
| 99 | L | 95.3 | Very high | 93.5 | Very high | 102 Ų | 102 | 26.2 Ų | 26.2 | 53% | 0.534 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -64.2 | -46.4 | 173.1 | -65.1 | 175.7 | 0 | 0 | 0 | 111.7 | L95 L96 N97 T101 A102 A103 | L95-L99 HydrophobicContact CD1-CG 4.46Å; L95-L99 HydrophobicContact CG-CD1 4.41Å; L95-L99 WeakPolarHBondContact O-CG 3.46Å; L95-L99 PolarHBondContact O-N 3.25Å; L96-L99 PolarHBondContact O-N 3.43Å; N97-L99 VanDerWaalsContact C-N 3.29Å; N97-L99 PolarHBondContact O-N 3.04Å; L99-T101 PolarHBondContact O-N 3.15Å; L99-A102 PolarHBondContact O-N 3.31Å; L99-A103 VanDerWaalsContact O-CB 3.28Å; L99-A103 WeakPolarHBondContact O-CB 3.48Å; L99-A103 PolarHBondContact O-N 3.36Å |
| 100 | L | 95.6 | Very high | 93.2 | Very high | 56 Ų | 56 | 24.8 Ų | 24.8 | 29% | 0.293 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -63.2 | -40.9 | 177 | -70.1 | 173.9 | 0 | 0 | 0 | 111.9 | L96 N97 A103 L104 T252 L256 | L96-L100 HydrophobicContact CD1-CG 4.5Å; L96-L100 HydrophobicContact CG-CD1 4.2Å; L96-L100 VanDerWaalsContact O-CG 3.3Å; L96-L100 WeakPolarHBondContact O-CG 3.29Å; L96-L100 PolarHBondContact O-N 2.9Å; N97-L100 PolarHBondContact O-N 3.38Å; L100-A103 PolarHBondContact O-N 3.35Å; L100-L104 HydrophobicContact CD2-CD1 4.07Å; L100-L104 VanDerWaalsContact O-CB 3.29Å; L100-L104 WeakPolarHBondContact O-CB 3.37Å; L100-L104 PolarHBondContact O-N 3.27Å; L100-T252 HydrophobicContact CD1-CG2 4Å; L100-L256 HydrophobicContact CB-CD1 3.83Å; L100-L256 HydrophobicContact CB-CD2 4.46Å; L100-L256 HydrophobicContact CD1-CD2 4.12Å |
| 101 | T | 95.4 | Very high | 93 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 16% | 0.16 | C | C | . | . | I | π-helix | trans | -61.9 | -49.7 | 174.8 | -64.9 | 0 | 0 | 0 | 0 | 110.6 | N97 L99 A103 F105 L106 L256 Y259 G260 Y269 L282 | N97-T101 WeakPolarHBondContact O-CB 3.41Å; N97-T101 PolarHBondContact O-N 3.04Å; N97-T101 PolarHBondContact O-OG1 3.31Å; N97-T101 VanDerWaalsContact O-OG1 3.07Å; N97-T101 PolarHBondContact OD1-OG1 3.05Å; L99-T101 PolarHBondContact O-N 3.15Å; T101-A103 VanDerWaalsContact C-N 3.28Å; T101-A103 PolarHBondContact O-N 2.9Å; T101-F105 PolarHBondContact O-N 3.15Å; T101-L106 VanDerWaalsContact O-CB 3.3Å; T101-L106 WeakPolarHBondContact O-CB 3.47Å; T101-L106 PolarHBondContact O-N 3.49Å; T101-L256 WeakPolarHBondContact OG1-CD1 3.36Å; T101-Y259 WeakPolarHBondContact CG2-O 3.23Å; T101-G260 PolarHBondContact OG1-N 3.2Å; T101-Y269 HydrophobicContact CG2-CE1 4.35Å; T101-L282 HydrophobicContact CG2-CD1 3.79Å; T101-L282 HydrophobicContact CG2-CD2 4.4Å |
| 102 | A | 94.1 | Very high | 92.6 | Very high | 17 Ų | 17 | 31 Ų | 31 | 14% | 0.14 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -62.8 | -33.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | S98 L99 K279 L282 | S98-A102 VanDerWaalsContact O-CB 3.26Å; S98-A102 WeakPolarHBondContact O-CB 3.41Å; S98-A102 PolarHBondContact O-N 2.82Å; L99-A102 PolarHBondContact O-N 3.31Å; A102-K279 HydrophobicContact CB-CG 4.18Å; A102-K279 WeakPolarHBondContact O-CE 3.32Å; A102-L282 HydrophobicContact CB-CD1 3.9Å |
| 103 | A | 92.4 | Very high | 91.9 | Very high | 49 Ų | 49 | 30.9 Ų | 30.9 | 41% | 0.405 | 17% | 0.172 | S | C | . | . | I | π-helix | trans | -84.3 | -48.3 | -179 | 0 | 0 | 0 | 0 | 0 | 113.1 | L99 L100 T101 W559 | L99-A103 VanDerWaalsContact O-CB 3.28Å; L99-A103 WeakPolarHBondContact O-CB 3.48Å; L99-A103 PolarHBondContact O-N 3.36Å; L100-A103 PolarHBondContact O-N 3.35Å; T101-A103 VanDerWaalsContact C-N 3.28Å; T101-A103 PolarHBondContact O-N 2.9Å; A103-W559 PolarHBondContact O-NE1 3.07Å |
| 104 | L | 92.5 | Very high | 91.3 | Very high | 39 Ų | 39 | 32 Ų | 32 | 20% | 0.204 | 18% | 0.178 | C | C | . | . | I | π-helix | trans | -98.5 | -48.1 | -167 | -57.6 | 177.4 | 0 | 0 | 0 | 113.5 | L100 W559 | L100-L104 HydrophobicContact CD2-CD1 4.07Å; L100-L104 VanDerWaalsContact O-CB 3.29Å; L100-L104 WeakPolarHBondContact O-CB 3.37Å; L100-L104 PolarHBondContact O-N 3.27Å; L104-W559 HydrophobicContact CD2-CD2 4.05Å; L104-W559 HydrophobicContact CD2-CE3 4.34Å; L104-W559 HydrophobicContact CD2-CH2 4.25Å; L104-W559 HydrophobicContact CD2-CZ2 3.95Å; L104-W559 HydrophobicContact CD2-CZ3 4.41Å |
| 105 | F | 93.4 | Very high | 90.4 | Very high | 5 Ų | 5 | 34 Ų | 34 | 2% | 0.022 | 19% | 0.19 | C | C | . | . | I | π-helix | trans | -94.2 | -46 | -168.6 | -66.6 | -91.1 | 0 | 0 | 0 | 112.5 | T101 V108 F109 L256 G260 V261 L428 F431 M435 | T101-F105 PolarHBondContact O-N 3.15Å; F105-V108 PolarHBondContact O-N 3.25Å; F105-F109 HydrophobicContact CB-CD2 4.49Å; F105-F109 HydrophobicContact CB-CE2 4.27Å; F105-F109 HydrophobicContact CD1-CE2 4.49Å; F105-F109 VanDerWaalsContact O-CD2 3.29Å; F105-F109 WeakPolarHBondContact O-CD2 3.21Å; F105-F109 PolarHBondContact O-N 3.42Å; F105-L256 HydrophobicContact CD2-CD1 4.08Å; F105-L256 HydrophobicContact CE2-CD1 3.84Å; F105-L256 HydrophobicContact CE2-CD2 4.17Å; F105-L256 HydrophobicContact CE2-CG 4.12Å; F105-G260 WeakPolarHBondContact CB-O 3.2Å; F105-V261 HydrophobicContact CD1-CG1 3.73Å; F105-V261 HydrophobicContact CE1-CG1 3.63Å; F105-L428 HydrophobicContact CE1-CD1 4.03Å; F105-L428 HydrophobicContact CE2-CD1 4.41Å; F105-L428 HydrophobicContact CZ-CD1 3.64Å; F105-F431 HydrophobicContact CE1-CB 4.24Å; F105-M435 HydrophobicContact CD1-CE 4.09Å; F105-M435 HydrophobicContact CD1-SD 3.59Å; F105-M435 VanDerWaalsContact CD1-SD 3.59Å; F105-M435 HydrophobicContact CE1-SD 3.93Å; F105-M435 HydrophobicContact CG-SD 4.39Å |
| 106 | L | 92.7 | Very high | 90.1 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -56.1 | -46.7 | -175.4 | 179.9 | 159.7 | 0 | 0 | 0 | 113.2 | T101 V108 F109 Y110 Y269 E275 A278 K279 L282 | T101-L106 VanDerWaalsContact O-CB 3.3Å; T101-L106 WeakPolarHBondContact O-CB 3.47Å; T101-L106 PolarHBondContact O-N 3.49Å; L106-V108 VanDerWaalsContact C-N 3.26Å; L106-V108 PolarHBondContact O-N 2.9Å; L106-F109 PolarHBondContact O-N 3.4Å; L106-Y110 VanDerWaalsContact O-CB 3.24Å; L106-Y110 WeakPolarHBondContact O-CB 3.23Å; L106-Y110 PolarHBondContact O-N 3.23Å; L106-Y269 HydrophobicContact CB-CE2 4.11Å; L106-Y269 HydrophobicContact CD1-CD2 3.87Å; L106-Y269 HydrophobicContact CD1-CE2 4.18Å; L106-Y269 HydrophobicContact CD1-CG 4.35Å; L106-Y269 HydrophobicContact CG-CD2 3.94Å; L106-Y269 HydrophobicContact CG-CE2 3.91Å; L106-E275 HydrophobicContact CD2-CG 3.63Å; L106-A278 HydrophobicContact CD1-CB 3.84Å; L106-A278 HydrophobicContact CD2-CB 4.27Å; L106-A278 HydrophobicContact CG-CB 4.39Å; L106-K279 HydrophobicContact CD1-CG 4.12Å; L106-K279 HydrophobicContact CD2-CG 4.1Å; L106-L282 HydrophobicContact CD1-CD1 3.51Å; L106-L282 HydrophobicContact CD1-CG 4.35Å |
| 107 | P | 90.9 | Very high | 89.9 | Confident | 9 Ų | 9 | 27 Ų | 27 | 6% | 0.058 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.7 | -33.9 | -178 | -23.5 | 35.6 | 0 | 0 | 0 | 113 | R111 | P107-R111 WeakPolarHBondContact O-CB 3.4Å; P107-R111 VanDerWaalsContact O-CG 3.27Å; P107-R111 WeakPolarHBondContact O-CG 3.49Å; P107-R111 PolarHBondContact O-N 3.35Å |
| 108 | V | 91.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.9 | -54.3 | 178.8 | -176.9 | 0 | 0 | 0 | 0 | 109.8 | F105 L106 Y110 L112 Y120 M435 W559 L562 | F105-V108 PolarHBondContact O-N 3.25Å; L106-V108 VanDerWaalsContact C-N 3.26Å; L106-V108 PolarHBondContact O-N 2.9Å; V108-Y110 PolarHBondContact O-N 3.41Å; V108-L112 HydrophobicContact CG1-CD1 3.74Å; V108-L112 WeakPolarHBondContact O-CB 3.36Å; V108-L112 VanDerWaalsContact O-CG 3.26Å; V108-L112 WeakPolarHBondContact O-CG 3.37Å; V108-L112 PolarHBondContact O-N 3.36Å; V108-L112 VanDerWaalsContact O-N 3.13Å; V108-Y120 HydrophobicContact CG1-CD2 4.03Å; V108-Y120 HydrophobicContact CG1-CE2 3.79Å; V108-M435 HydrophobicContact CB-CE 4.03Å; V108-M435 HydrophobicContact CB-SD 4.41Å; V108-M435 HydrophobicContact CG1-CE 3.87Å; V108-M435 HydrophobicContact CG2-CE 4.4Å; V108-M435 HydrophobicContact CG2-CG 4.5Å; V108-M435 HydrophobicContact CG2-SD 4.14Å; V108-W559 HydrophobicContact CG2-CB 4.38Å; V108-L562 HydrophobicContact CB-CD1 4.13Å; V108-L562 HydrophobicContact CG1-CD1 4.39Å; V108-L562 HydrophobicContact CG2-CD1 3.84Å |
| 109 | F | 91.3 | Very high | 89.7 | Confident | 3 Ų | 3 | 29.4 Ų | 29.4 | 1% | 0.013 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66.3 | -40.9 | -179.1 | -66.3 | -59.7 | 0 | 0 | 0 | 112.8 | F105 L106 R111 G113 T117 Y120 G260 V266 V270 F431 M435 | F105-F109 HydrophobicContact CB-CD2 4.49Å; F105-F109 HydrophobicContact CB-CE2 4.27Å; F105-F109 HydrophobicContact CD1-CE2 4.49Å; F105-F109 VanDerWaalsContact O-CD2 3.29Å; F105-F109 WeakPolarHBondContact O-CD2 3.21Å; F105-F109 PolarHBondContact O-N 3.42Å; L106-F109 PolarHBondContact O-N 3.4Å; F109-R111 PolarHBondContact O-N 2.94Å; F109-G113 PolarHBondContact O-N 3.43Å; F109-T117 HydrophobicContact CD1-CG2 4.07Å; F109-T117 HydrophobicContact CE1-CG2 3.78Å; F109-T117 HydrophobicContact CE2-CG2 4.47Å; F109-T117 HydrophobicContact CZ-CG2 4Å; F109-Y120 HydrophobicContact CE1-CG 4.48Å; F109-G260 VanDerWaalsContact CE2-O 3.25Å; F109-G260 WeakPolarHBondContact CE2-O 3.28Å; F109-V266 HydrophobicContact CB-CG1 3.83Å; F109-V266 HydrophobicContact CD1-CG1 4.36Å; F109-V266 HydrophobicContact CD2-CG1 3.81Å; F109-V266 HydrophobicContact CD2-CG2 4.37Å; F109-V266 HydrophobicContact CE2-CG1 4.47Å; F109-V266 HydrophobicContact CE2-CG2 4.37Å; F109-V266 HydrophobicContact CG-CG1 3.74Å; F109-V270 HydrophobicContact CB-CG1 4.15Å; F109-F431 AromaticContact CE1-CE1 3.99Å; F109-F431 HydrophobicContact CE1-CE1 3.99Å; F109-F431 AromaticContact CZ-CD1 3.93Å; F109-F431 HydrophobicContact CZ-CD1 3.93Å; F109-F431 AromaticContact CZ-CE1 3.68Å; F109-F431 HydrophobicContact CZ-CE1 3.68Å; F109-F431 HydrophobicContact CZ-CZ 4.47Å; F109-M435 HydrophobicContact CD2-CE 4.42Å; F109-M435 HydrophobicContact CE1-CE 4.05Å; F109-M435 HydrophobicContact CE2-CE 3.68Å; F109-M435 HydrophobicContact CZ-CE 3.48Å; F109-M435 VanDerWaalsContact CZ-CE 3.48Å |
| 110 | Y | 88.1 | Confident | 89.6 | Confident | 35 Ų | 35 | 24.5 Ų | 24.5 | 14% | 0.137 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.9 | -44.3 | -176.8 | -166.3 | -81.5 | 0 | 0 | 0 | 111.9 | R52 L106 V108 G113 V270 C272 R273 T274 E275 A278 | R52-Y110 PolarHBondContact NH2-O 3.39Å; L106-Y110 VanDerWaalsContact O-CB 3.24Å; L106-Y110 WeakPolarHBondContact O-CB 3.23Å; L106-Y110 PolarHBondContact O-N 3.23Å; V108-Y110 PolarHBondContact O-N 3.41Å; Y110-G113 PolarHBondContact O-N 3.28Å; Y110-V270 HydrophobicContact CD2-CB 4.37Å; Y110-V270 HydrophobicContact CD2-CG1 4.41Å; Y110-C272 PolarHBondContact OH-O 2.97Å; Y110-R273 PolarHBondContact OH-O 3.27Å; Y110-T274 VanDerWaalsContact CZ-C 3.5Å; Y110-T274 VanDerWaalsContact OH-C 3.3Å; Y110-T274 WeakPolarHBondContact OH-CA 3.34Å; Y110-T274 PolarHBondContact OH-N 2.94Å; Y110-E275 HydrophobicContact CD1-CB 4.02Å; Y110-E275 HydrophobicContact CD1-CG 4.37Å; Y110-E275 HydrophobicContact CE1-CB 4.19Å; Y110-E275 HydrophobicContact CG-CB 4.34Å; Y110-E275 HydrophobicContact CG-CG 4.34Å; Y110-A278 HydrophobicContact CD2-CB 4.21Å; Y110-A278 HydrophobicContact CE2-CB 4.28Å |
| 111 | R | 87.4 | Confident | 89.6 | Confident | 92 Ų | 92 | 21.9 Ų | 21.9 | 35% | 0.347 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -80 | -33.7 | -175.7 | -66.7 | 179.2 | -175.8 | -167.1 | 5.5 | 113.8 | P107 F109 G113 E275 L562 T566 | P107-R111 WeakPolarHBondContact O-CB 3.4Å; P107-R111 VanDerWaalsContact O-CG 3.27Å; P107-R111 WeakPolarHBondContact O-CG 3.49Å; P107-R111 PolarHBondContact O-N 3.35Å; F109-R111 PolarHBondContact O-N 2.94Å; R111-G113 PolarHBondContact O-N 3.43Å; R111-E275 IonicContact CZ-OE2 3.53Å; R111-E275 IonicContact NE-OE2 3.87Å; R111-E275 PolarHBondContact NE-OE2 2.92Å; R111-E275 IonicContact NH2-OE2 3.14Å; R111-E275 PolarHBondContact NH2-OE2 3.21Å; R111-E275 VanDerWaalsContact NH2-OE2 3.14Å; R111-L562 PolarHBondContact NH1-O 3.02Å; R111-T566 VanDerWaalsContact CZ-OG1 3.24Å; R111-T566 PolarHBondContact NH1-OG1 3.37Å; R111-T566 PolarHBondContact NH2-OG1 2.78Å |
| 112 | L | 85.4 | Confident | 89.6 | Confident | 48 Ų | 48 | 24.7 Ų | 24.7 | 25% | 0.251 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -70.3 | -18.7 | 172.8 | -67.5 | 173.6 | 0 | 0 | 0 | 112.1 | V108 L114 Y120 L557 | V108-L112 HydrophobicContact CG1-CD1 3.74Å; V108-L112 WeakPolarHBondContact O-CB 3.36Å; V108-L112 VanDerWaalsContact O-CG 3.26Å; V108-L112 WeakPolarHBondContact O-CG 3.37Å; V108-L112 PolarHBondContact O-N 3.36Å; V108-L112 VanDerWaalsContact O-N 3.13Å; L112-L114 HydrophobicContact CB-CD1 3.99Å; L112-L114 HydrophobicContact CB-CD2 4.2Å; L112-L114 HydrophobicContact CB-CG 3.68Å; L112-L114 HydrophobicContact CD1-CD1 4.04Å; L112-L114 PolarHBondContact O-N 2.94Å; L112-Y120 HydrophobicContact CD1-CD2 3.73Å; L112-Y120 HydrophobicContact CD1-CE2 4.28Å; L112-L557 HydrophobicContact CD1-CD2 4.45Å |
| 113 | G | 79.9 | Confident | 89.4 | Confident | 35 Ų | 35 | 28.3 Ų | 28.3 | 36% | 0.361 | 15% | 0.154 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 63.4 | 28.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | F109 Y110 R111 | F109-G113 PolarHBondContact O-N 3.43Å; Y110-G113 PolarHBondContact O-N 3.28Å; R111-G113 PolarHBondContact O-N 3.43Å |
| 114 | L | 79.6 | Confident | 89.5 | Confident | 24 Ų | 24 | 26.4 Ų | 26.4 | 13% | 0.126 | 14% | 0.137 | C | C | . | . | trans | -77.1 | 137.7 | -176 | -53.4 | 175.7 | 0 | 0 | 0 | 110.6 | L112 Q119 L123 | L112-L114 HydrophobicContact CB-CD1 3.99Å; L112-L114 HydrophobicContact CB-CD2 4.2Å; L112-L114 HydrophobicContact CB-CG 3.68Å; L112-L114 HydrophobicContact CD1-CD1 4.04Å; L112-L114 PolarHBondContact O-N 2.94Å; L114-Q119 HydrophobicContact CD1-CB 4.39Å; L114-Q119 HydrophobicContact CD2-CB 4.47Å; L114-Q119 HydrophobicContact CD2-CG 4.12Å; L114-L123 HydrophobicContact CD1-CD1 4.37Å; L114-L123 HydrophobicContact CD2-CD1 4Å | ||
| 115 | T | 75.5 | Confident | 89.6 | Confident | 41 Ų | 41 | 25.9 Ų | 25.9 | 25% | 0.252 | 13% | 0.132 | S | C | . | . | S | Bend | trans | -77.9 | -38.4 | 173.4 | -49.1 | 0 | 0 | 0 | 0 | 111.4 | Q263 E368 | T115-Q263 PolarHBondContact O-NE2 2.88Å; T115-E368 HydrophobicContact CG2-CG 3.86Å |
| 116 | S | 87.3 | Confident | 89.7 | Confident | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 14% | 0.142 | C | C | . | . | S | Bend | trans | -107.4 | 130 | 175.5 | 171.3 | 0 | 0 | 0 | 0 | 110 | Y118 Q119 D369 | S116-Y118 PolarHBondContact O-N 2.78Å; S116-Y118 PolarHBondContact OG-N 2.87Å; S116-Q119 VanDerWaalsContact O-CB 3.28Å; S116-Q119 WeakPolarHBondContact O-CB 3.45Å; S116-Q119 PolarHBondContact O-N 3.04Å; S116-D369 VanDerWaalsContact CB-OD1 3.23Å; S116-D369 WeakPolarHBondContact CB-OD1 2.99Å; S116-D369 PolarHBondContact OG-OD1 3.24Å; S116-D369 PolarHBondContact OG-OD2 3.2Å |
| 117 | T | 91.1 | Very high | 89.7 | Confident | 4 Ų | 4 | 32.4 Ų | 32.4 | 3% | 0.025 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.8 | -29.7 | 173.5 | 57.7 | 0 | 0 | 0 | 0 | 111.8 | F109 Q119 Y120 V261 Q263 V266 F431 | F109-T117 HydrophobicContact CD1-CG2 4.07Å; F109-T117 HydrophobicContact CE1-CG2 3.78Å; F109-T117 HydrophobicContact CE2-CG2 4.47Å; F109-T117 HydrophobicContact CZ-CG2 4Å; T117-Q119 VanDerWaalsContact C-N 3.25Å; T117-Q119 PolarHBondContact O-N 3.31Å; T117-Y120 WeakPolarHBondContact O-CB 3.44Å; T117-Y120 PolarHBondContact O-N 3.46Å; T117-Y120 VanDerWaalsContact O-N 3.15Å; T117-V261 PolarHBondContact OG1-O 2.98Å; T117-Q263 PolarHBondContact OG1-OE1 2.65Å; T117-V266 HydrophobicContact CG2-CB 3.51Å; T117-V266 HydrophobicContact CG2-CG1 3.45Å; T117-V266 VanDerWaalsContact CG2-CG1 3.45Å; T117-V266 HydrophobicContact CG2-CG2 3.68Å; T117-F431 WeakPolarHBondContact O-CE1 3.29Å; T117-F431 WeakPolarHBondContact O-CZ 3.27Å |
| 118 | Y | 93.3 | Very high | 90 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -72.7 | -19.3 | 179.7 | -51.9 | -66.9 | 0 | 0 | 0 | 113 | S116 Y120 L121 E122 R130 Y137 Q263 V365 L427 F431 | S116-Y118 PolarHBondContact O-N 2.78Å; S116-Y118 PolarHBondContact OG-N 2.87Å; Y118-Y120 PolarHBondContact O-N 2.86Å; Y118-L121 HydrophobicContact CD1-CD1 4.08Å; Y118-L121 WeakPolarHBondContact O-CB 2.99Å; Y118-L121 PolarHBondContact O-N 3.02Å; Y118-E122 PolarHBondContact O-N 3.14Å; Y118-R130 WeakPolarHBondContact O-CB 3.46Å; Y118-R130 WeakPolarHBondContact O-CG 3.27Å; Y118-Y137 AromaticContact CE2-CD1 3.84Å; Y118-Y137 HydrophobicContact CE2-CD1 3.84Å; Y118-Y137 HydrophobicContact CE2-CD2 4.44Å; Y118-Y137 AromaticContact CE2-CG 3.75Å; Y118-Y137 HydrophobicContact CE2-CG 3.75Å; Y118-Y137 AromaticContact CZ-CG 3.61Å; Y118-Y137 WeakPolarHBondContact OH-CB 3.13Å; Y118-Y137 WeakPolarHBondContact OH-CD2 3.44Å; Y118-Q263 HydrophobicContact CE2-CB 4.32Å; Y118-V365 HydrophobicContact CD2-CG1 3.92Å; Y118-V365 HydrophobicContact CD2-CG2 4.33Å; Y118-V365 HydrophobicContact CE2-CG1 4.11Å; Y118-V365 HydrophobicContact CE2-CG2 4.13Å; Y118-L427 HydrophobicContact CE1-CD1 4Å; Y118-L427 HydrophobicContact CE1-CD2 3.73Å; Y118-L427 HydrophobicContact CE1-CG 4.36Å; Y118-F431 HydrophobicContact CD1-CE2 4.24Å; Y118-F431 HydrophobicContact CD1-CZ 4.07Å; Y118-F431 HydrophobicContact CE1-CE2 4.02Å; Y118-F431 HydrophobicContact CE1-CZ 4.18Å |
| 119 | Q | 91.1 | Very high | 90.2 | Very high | 58 Ų | 58 | 34.2 Ų | 34.2 | 27% | 0.271 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -59.8 | -32.7 | 170.2 | -170.3 | 178.6 | -0.7 | 0 | 0 | 111.3 | L114 S116 T117 L121 E122 L123 | L114-Q119 HydrophobicContact CD1-CB 4.39Å; L114-Q119 HydrophobicContact CD2-CB 4.47Å; L114-Q119 HydrophobicContact CD2-CG 4.12Å; S116-Q119 VanDerWaalsContact O-CB 3.28Å; S116-Q119 WeakPolarHBondContact O-CB 3.45Å; S116-Q119 PolarHBondContact O-N 3.04Å; T117-Q119 VanDerWaalsContact C-N 3.25Å; T117-Q119 PolarHBondContact O-N 3.31Å; Q119-L121 VanDerWaalsContact C-N 3.29Å; Q119-L121 PolarHBondContact O-N 3.26Å; Q119-E122 PolarHBondContact O-N 2.94Å; Q119-L123 WeakPolarHBondContact O-CG 3.21Å; Q119-L123 PolarHBondContact O-N 3.28Å |
| 120 | Y | 94.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -58.1 | -41.9 | 172.9 | 170.7 | -96.4 | 0 | 0 | 0 | 111.7 | V108 F109 L112 T117 Y118 E122 L123 R124 F431 G434 M435 L557 | V108-Y120 HydrophobicContact CG1-CD2 4.03Å; V108-Y120 HydrophobicContact CG1-CE2 3.79Å; F109-Y120 HydrophobicContact CE1-CG 4.48Å; L112-Y120 HydrophobicContact CD1-CD2 3.73Å; L112-Y120 HydrophobicContact CD1-CE2 4.28Å; T117-Y120 WeakPolarHBondContact O-CB 3.44Å; T117-Y120 PolarHBondContact O-N 3.46Å; T117-Y120 VanDerWaalsContact O-N 3.15Å; Y118-Y120 PolarHBondContact O-N 2.86Å; Y120-E122 VanDerWaalsContact C-N 3.29Å; Y120-E122 PolarHBondContact O-N 2.81Å; Y120-L123 PolarHBondContact O-N 3.37Å; Y120-R124 HydrophobicContact CE1-CB 4.32Å; Y120-R124 VanDerWaalsContact O-CB 3.32Å; Y120-R124 WeakPolarHBondContact O-CB 3.35Å; Y120-R124 PolarHBondContact O-N 3.37Å; Y120-F431 AromaticContact CD1-CD1 3.58Å; Y120-F431 HydrophobicContact CD1-CD1 3.58Å; Y120-F431 AromaticContact CD1-CE1 3.66Å; Y120-F431 HydrophobicContact CD1-CE1 3.66Å; Y120-F431 HydrophobicContact CE1-CD1 4.02Å; Y120-F431 HydrophobicContact CG-CE1 4.35Å; Y120-G434 PolarHBondContact OH-O 3.22Å; Y120-G434 VanDerWaalsContact OH-O 3.12Å; Y120-M435 HydrophobicContact CD1-CE 4.2Å; Y120-M435 HydrophobicContact CE1-CE 4.03Å; Y120-M435 HydrophobicContact CE1-CG 3.77Å; Y120-M435 HydrophobicContact CE2-CE 4.45Å; Y120-M435 HydrophobicContact CE2-CG 4.27Å; Y120-M435 VanDerWaalsContact CZ-CG 3.47Å; Y120-M435 WeakPolarHBondContact OH-CA 3.32Å; Y120-M435 WeakPolarHBondContact OH-CG 3.44Å; Y120-M435 PolarHBondContact OH-N 2.8Å; Y120-M435 VanDerWaalsContact OH-N 3.09Å; Y120-L557 HydrophobicContact CD2-CD2 4.31Å; Y120-L557 HydrophobicContact CE2-CD2 4.15Å; Y120-L557 WeakPolarHBondContact CE2-O 3.33Å; Y120-L557 PolarHBondContact OH-O 3.15Å |
| 121 | L | 94.9 | Very high | 90.7 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.2 | -31.8 | 179.8 | -62 | 177.6 | 0 | 0 | 0 | 112.2 | Y118 Q119 F125 S126 V129 L427 F431 | Y118-L121 HydrophobicContact CD1-CD1 4.08Å; Y118-L121 WeakPolarHBondContact O-CB 2.99Å; Y118-L121 PolarHBondContact O-N 3.02Å; Q119-L121 VanDerWaalsContact C-N 3.29Å; Q119-L121 PolarHBondContact O-N 3.26Å; L121-F125 HydrophobicContact CD2-CD2 4.43Å; L121-F125 HydrophobicContact CD2-CE2 4.44Å; L121-F125 WeakPolarHBondContact O-CA 3.31Å; L121-F125 WeakPolarHBondContact O-CB 3.19Å; L121-F125 PolarHBondContact O-N 3.38Å; L121-S126 PolarHBondContact O-N 3.48Å; L121-V129 HydrophobicContact CB-CB 4.43Å; L121-V129 HydrophobicContact CB-CG1 3.95Å; L121-V129 HydrophobicContact CD1-CG1 4.18Å; L121-V129 HydrophobicContact CD2-CG1 4.45Å; L121-V129 HydrophobicContact CG-CG1 4.42Å; L121-L427 HydrophobicContact CD1-CD1 4.39Å; L121-F431 HydrophobicContact CD1-CE1 4.42Å; L121-F431 HydrophobicContact CD1-CE2 3.92Å; L121-F431 HydrophobicContact CD1-CZ 3.87Å; L121-F431 HydrophobicContact CD2-CD1 3.9Å; L121-F431 HydrophobicContact CD2-CD2 4.4Å; L121-F431 HydrophobicContact CD2-CE1 3.93Å; L121-F431 HydrophobicContact CD2-CE2 4.41Å; L121-F431 HydrophobicContact CD2-CG 4.16Å; L121-F431 HydrophobicContact CD2-CZ 4.19Å; L121-F431 HydrophobicContact CG-CD1 4.37Å; L121-F431 HydrophobicContact CG-CE1 3.88Å; L121-F431 HydrophobicContact CG-CE2 4.26Å; L121-F431 HydrophobicContact CG-CZ 3.82Å |
| 122 | E | 94.3 | Very high | 91.1 | Very high | 60 Ų | 60 | 34.5 Ų | 34.5 | 28% | 0.28 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -69.8 | -45.7 | 172.8 | 179.2 | 166.9 | -152.6 | 0 | 0 | 111.8 | Y118 Q119 Y120 R124 F125 R127 R130 | Y118-E122 PolarHBondContact O-N 3.14Å; Q119-E122 PolarHBondContact O-N 2.94Å; Y120-E122 VanDerWaalsContact C-N 3.29Å; Y120-E122 PolarHBondContact O-N 2.81Å; E122-R124 PolarHBondContact O-N 3.32Å; E122-F125 PolarHBondContact O-N 2.89Å; E122-R127 HydrophobicContact CG-CB 4.49Å; E122-R127 WeakPolarHBondContact OE1-CB 3.39Å; E122-R130 HydrophobicContact CB-CB 3.83Å; E122-R130 HydrophobicContact CB-CG 4.41Å; E122-R130 WeakPolarHBondContact OE2-CD 3.5Å; E122-R130 IonicContact OE2-CZ 3Å; E122-R130 IonicContact OE2-NE 3.2Å; E122-R130 IonicContact OE2-NH1 2.82Å; E122-R130 PolarHBondContact OE2-NH1 2.96Å |
| 123 | L | 91.7 | Very high | 91.6 | Very high | 92 Ų | 92 | 32.2 Ų | 32.2 | 48% | 0.482 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -62.1 | -34.6 | 177.5 | -64.8 | 174 | 0 | 0 | 0 | 112 | L114 Q119 Y120 L557 | L114-L123 HydrophobicContact CD1-CD1 4.37Å; L114-L123 HydrophobicContact CD2-CD1 4Å; Q119-L123 WeakPolarHBondContact O-CG 3.21Å; Q119-L123 PolarHBondContact O-N 3.28Å; Y120-L123 PolarHBondContact O-N 3.37Å; L123-L557 HydrophobicContact CB-CD2 3.82Å |
| 124 | R | 94.1 | Very high | 92.3 | Very high | 10 Ų | 10 | 30.7 Ų | 30.7 | 4% | 0.038 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -84.9 | -33.2 | -178.6 | 178.8 | 58 | -173.7 | 84.2 | -0.2 | 113.8 | Y120 E122 G434 L437 P438 C440 | Y120-R124 HydrophobicContact CE1-CB 4.32Å; Y120-R124 VanDerWaalsContact O-CB 3.32Å; Y120-R124 WeakPolarHBondContact O-CB 3.35Å; Y120-R124 PolarHBondContact O-N 3.37Å; E122-R124 PolarHBondContact O-N 3.32Å; R124-G434 PolarHBondContact NE-O 3.31Å; R124-L437 PolarHBondContact NH2-O 3.49Å; R124-P438 PolarHBondContact NH2-O 3.4Å; R124-C440 PolarHBondContact NH1-O 3.24Å; R124-C440 VanDerWaalsContact NH1-O 3.09Å; R124-C440 PolarHBondContact NH2-O 2.92Å |
| 125 | F | 94.3 | Very high | 93.1 | Very high | 27 Ų | 27 | 34.9 Ų | 34.9 | 12% | 0.118 | 18% | 0.184 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -130.4 | -82.3 | -172 | -60 | -68.9 | 0 | 0 | 0 | 111.8 | L121 E122 V129 G434 C440 T442 V445 | L121-F125 HydrophobicContact CD2-CD2 4.43Å; L121-F125 HydrophobicContact CD2-CE2 4.44Å; L121-F125 WeakPolarHBondContact O-CA 3.31Å; L121-F125 WeakPolarHBondContact O-CB 3.19Å; L121-F125 PolarHBondContact O-N 3.38Å; E122-F125 PolarHBondContact O-N 2.89Å; F125-V129 HydrophobicContact CB-CB 4.16Å; F125-V129 HydrophobicContact CB-CG2 3.72Å; F125-V129 HydrophobicContact CD2-CG1 4.23Å; F125-V129 HydrophobicContact CG-CG2 4.43Å; F125-G434 VanDerWaalsContact CZ-CA 3.45Å; F125-C440 HydrophobicContact CE1-CB 4.11Å; F125-C440 WeakPolarHBondContact CE1-O 3.46Å; F125-C440 HydrophobicContact CZ-CB 4.37Å; F125-T442 VanDerWaalsContact C-OG1 3.29Å; F125-T442 WeakPolarHBondContact CB-OG1 3.21Å; F125-T442 PolarHBondContact O-OG1 2.81Å; F125-V445 HydrophobicContact CD1-CG2 4.09Å; F125-V445 HydrophobicContact CD2-CG2 4.37Å; F125-V445 HydrophobicContact CE1-CG2 3.53Å; F125-V445 HydrophobicContact CE2-CG1 4.37Å; F125-V445 HydrophobicContact CE2-CG2 3.84Å; F125-V445 HydrophobicContact CG-CG2 4.48Å; F125-V445 HydrophobicContact CZ-CB 4.47Å; F125-V445 HydrophobicContact CZ-CG2 3.4Å |
| 126 | S | 94.9 | Very high | 94 | Very high | 32 Ų | 32 | 34 Ų | 34 | 22% | 0.224 | 18% | 0.177 | C | C | . | . | trans | -167.7 | 166.7 | -179 | 67.2 | 0 | 0 | 0 | 0 | 111.8 | L121 A128 V129 R130 T442 | L121-S126 PolarHBondContact O-N 3.48Å; S126-A128 PolarHBondContact O-N 3.48Å; S126-V129 PolarHBondContact O-N 3.24Å; S126-V129 VanDerWaalsContact O-N 3.11Å; S126-R130 PolarHBondContact O-N 2.91Å; S126-T442 WeakPolarHBondContact OG-CG2 3.41Å | ||
| 127 | R | 93.9 | Very high | 94.4 | Very high | 111 Ų | 111 | 34.3 Ų | 34.3 | 42% | 0.419 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -57.1 | -32.2 | 174.6 | -168.3 | 172.6 | -177.3 | 177.9 | 4.8 | 113.4 | E122 R130 L131 | E122-R127 HydrophobicContact CG-CB 4.49Å; E122-R127 WeakPolarHBondContact OE1-CB 3.39Å; R127-R130 PolarHBondContact O-N 2.79Å; R127-L131 HydrophobicContact CG-CD1 4.44Å; R127-L131 WeakPolarHBondContact O-CG 3.31Å; R127-L131 PolarHBondContact O-N 3.48Å |
| 128 | A | 95.8 | Very high | 94.6 | Very high | 46 Ų | 46 | 35 Ų | 35 | 38% | 0.38 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -62.8 | -43.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | S126 R130 L131 C132 L446 | S126-A128 PolarHBondContact O-N 3.48Å; A128-R130 PolarHBondContact O-N 3.49Å; A128-L131 PolarHBondContact O-N 3Å; A128-C132 PolarHBondContact O-N 2.96Å; A128-C132 PolarHBondContact O-SG 3.49Å; A128-C132 VanDerWaalsContact O-SG 3.38Å; A128-L446 HydrophobicContact CB-CD1 4.31Å |
| 129 | V | 96.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.7 | -39.7 | 178.6 | -172.2 | 0 | 0 | 0 | 0 | 111.1 | L121 F125 S126 C132 G133 T442 V445 L446 L449 | L121-V129 HydrophobicContact CB-CB 4.43Å; L121-V129 HydrophobicContact CB-CG1 3.95Å; L121-V129 HydrophobicContact CD1-CG1 4.18Å; L121-V129 HydrophobicContact CD2-CG1 4.45Å; L121-V129 HydrophobicContact CG-CG1 4.42Å; F125-V129 HydrophobicContact CB-CB 4.16Å; F125-V129 HydrophobicContact CB-CG2 3.72Å; F125-V129 HydrophobicContact CD2-CG1 4.23Å; F125-V129 HydrophobicContact CG-CG2 4.43Å; S126-V129 PolarHBondContact O-N 3.24Å; S126-V129 VanDerWaalsContact O-N 3.11Å; V129-C132 PolarHBondContact O-N 2.66Å; V129-G133 PolarHBondContact O-N 2.64Å; V129-T442 HydrophobicContact CG2-CG2 4.03Å; V129-V445 HydrophobicContact CG1-CG1 3.88Å; V129-L446 HydrophobicContact CB-CD2 4.47Å; V129-L446 HydrophobicContact CG2-CD2 3.89Å; V129-L446 HydrophobicContact CG2-CG 3.96Å; V129-L449 HydrophobicContact CG1-CD1 4.46Å |
| 130 | R | 95.2 | Very high | 94.8 | Very high | 21 Ų | 21 | 35.2 Ų | 35.2 | 8% | 0.079 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -56.8 | -54.3 | 172.2 | 173.8 | 176.6 | -173.4 | -170.8 | 3.7 | 111.1 | Y118 E122 S126 R127 A128 C132 G133 T134 E368 D369 | Y118-R130 WeakPolarHBondContact O-CB 3.46Å; Y118-R130 WeakPolarHBondContact O-CG 3.27Å; E122-R130 HydrophobicContact CB-CB 3.83Å; E122-R130 HydrophobicContact CB-CG 4.41Å; E122-R130 WeakPolarHBondContact OE2-CD 3.5Å; E122-R130 IonicContact OE2-CZ 3Å; E122-R130 IonicContact OE2-NE 3.2Å; E122-R130 IonicContact OE2-NH1 2.82Å; E122-R130 PolarHBondContact OE2-NH1 2.96Å; S126-R130 PolarHBondContact O-N 2.91Å; R127-R130 PolarHBondContact O-N 2.79Å; A128-R130 PolarHBondContact O-N 3.49Å; R130-C132 VanDerWaalsContact C-N 3.35Å; R130-C132 PolarHBondContact O-N 2.87Å; R130-G133 PolarHBondContact O-N 3.41Å; R130-T134 WeakPolarHBondContact O-CB 3.48Å; R130-T134 PolarHBondContact O-N 2.96Å; R130-T134 PolarHBondContact O-OG1 3.22Å; R130-E368 PolarHBondContact NH2-O 3.03Å; R130-D369 IonicContact CZ-OD1 3.96Å; R130-D369 IonicContact NE-OD1 2.59Å; R130-D369 PolarHBondContact NE-OD1 2.8Å; R130-D369 IonicContact NH2-OD1 3.9Å; R130-D369 PolarHBondContact NH2-OD1 3.16Å |
| 131 | L | 95.3 | Very high | 94.8 | Very high | 58 Ų | 58 | 35.5 Ų | 35.5 | 30% | 0.304 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -61.4 | -40.2 | -178 | -68.7 | 176.1 | 0 | 0 | 0 | 112.9 | R127 A128 L135 L370 | R127-L131 HydrophobicContact CG-CD1 4.44Å; R127-L131 WeakPolarHBondContact O-CG 3.31Å; R127-L131 PolarHBondContact O-N 3.48Å; A128-L131 PolarHBondContact O-N 3Å; L131-L135 WeakPolarHBondContact O-CB 3.3Å; L131-L135 PolarHBondContact O-N 2.8Å; L131-L370 HydrophobicContact CD2-CD2 3.46Å; L131-L370 VanDerWaalsContact CD2-CD2 3.46Å |
| 132 | C | 96 | Very high | 94.8 | Very high | 58 Ų | 58 | 37.8 Ų | 37.8 | 39% | 0.392 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -61.8 | -47.9 | 174.2 | -71.9 | 0 | 0 | 0 | 0 | 111.6 | A128 V129 R130 L135 Q136 L446 | A128-C132 PolarHBondContact O-N 2.96Å; A128-C132 PolarHBondContact O-SG 3.49Å; A128-C132 VanDerWaalsContact O-SG 3.38Å; V129-C132 PolarHBondContact O-N 2.66Å; R130-C132 VanDerWaalsContact C-N 3.35Å; R130-C132 PolarHBondContact O-N 2.87Å; C132-L135 PolarHBondContact O-N 3.4Å; C132-Q136 VanDerWaalsContact O-CB 3.29Å; C132-Q136 WeakPolarHBondContact O-CB 3.39Å; C132-Q136 PolarHBondContact O-N 3.15Å; C132-L446 HydrophobicContact CB-CD2 4.37Å |
| 133 | G | 95.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.8 | -43.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V129 R130 Q136 Y137 | V129-G133 PolarHBondContact O-N 2.64Å; R130-G133 PolarHBondContact O-N 3.41Å; G133-Q136 PolarHBondContact O-N 3.01Å; G133-Y137 WeakPolarHBondContact O-CB 3.49Å; G133-Y137 PolarHBondContact O-N 3.43Å |
| 134 | T | 95.4 | Very high | 94.8 | Very high | 2 Ų | 2 | 33.9 Ų | 33.9 | 1% | 0.012 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.1 | -50.2 | 174.3 | -58.2 | 0 | 0 | 0 | 0 | 111.4 | R130 Q136 Y137 L138 V365 D369 | R130-T134 WeakPolarHBondContact O-CB 3.48Å; R130-T134 PolarHBondContact O-N 2.96Å; R130-T134 PolarHBondContact O-OG1 3.22Å; T134-Q136 PolarHBondContact O-N 3.43Å; T134-Y137 WeakPolarHBondContact O-CB 3.31Å; T134-Y137 PolarHBondContact O-N 3.34Å; T134-L138 HydrophobicContact CG2-CD1 4.1Å; T134-L138 HydrophobicContact CG2-CG 4.43Å; T134-L138 VanDerWaalsContact O-CG 3.29Å; T134-L138 WeakPolarHBondContact O-CG 3.44Å; T134-L138 PolarHBondContact O-N 3.35Å; T134-V365 HydrophobicContact CG2-CG1 3.42Å; T134-V365 VanDerWaalsContact CG2-CG1 3.42Å; T134-D369 HydrophobicContact CG2-CB 4.06Å; T134-D369 PolarHBondContact OG1-OD2 3.23Å |
| 135 | L | 95.5 | Very high | 94.8 | Very high | 113 Ų | 113 | 33.4 Ų | 33.4 | 59% | 0.592 | 18% | 0.179 | S | C | * | . | H | α-helix | trans | -62.3 | -45.6 | -179.9 | 179.1 | 62.9 | 0 | 0 | 0 | 111.5 | L131 C132 Y137 L138 V139 | L131-L135 WeakPolarHBondContact O-CB 3.3Å; L131-L135 PolarHBondContact O-N 2.8Å; C132-L135 PolarHBondContact O-N 3.4Å; L135-Y137 VanDerWaalsContact C-N 3.29Å; L135-Y137 PolarHBondContact O-N 2.83Å; L135-L138 PolarHBondContact O-N 3.02Å; L135-V139 HydrophobicContact CD1-CG2 4.31Å; L135-V139 WeakPolarHBondContact O-CG2 3.48Å; L135-V139 PolarHBondContact O-N 3.15Å |
| 136 | Q | 94.6 | Very high | 94.7 | Very high | 22 Ų | 22 | 32.1 Ų | 32.1 | 10% | 0.103 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.8 | -41.6 | 178.4 | -172.2 | 164.6 | -2.7 | 0 | 0 | 111.5 | C132 G133 T134 A140 I423 | C132-Q136 VanDerWaalsContact O-CB 3.29Å; C132-Q136 WeakPolarHBondContact O-CB 3.39Å; C132-Q136 PolarHBondContact O-N 3.15Å; G133-Q136 PolarHBondContact O-N 3.01Å; T134-Q136 PolarHBondContact O-N 3.43Å; Q136-A140 VanDerWaalsContact O-CB 3.3Å; Q136-A140 WeakPolarHBondContact O-CB 3.28Å; Q136-A140 PolarHBondContact O-N 3.28Å; Q136-I423 HydrophobicContact CG-CG2 3.4Å; Q136-I423 VanDerWaalsContact CG-CG2 3.4Å; Q136-I423 PolarHBondContact NE2-O 3.27Å; Q136-I423 WeakPolarHBondContact O-CG2 3.37Å |
| 137 | Y | 95 | Very high | 94.6 | Very high | 6 Ų | 6 | 30.8 Ų | 30.8 | 2% | 0.024 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.1 | -47.2 | 173.9 | 168.1 | -103 | 0 | 0 | 0 | 113.6 | Y118 G133 T134 L135 V139 A140 T141 N262 Q263 A361 M362 V365 | Y118-Y137 AromaticContact CE2-CD1 3.84Å; Y118-Y137 HydrophobicContact CE2-CD1 3.84Å; Y118-Y137 HydrophobicContact CE2-CD2 4.44Å; Y118-Y137 AromaticContact CE2-CG 3.75Å; Y118-Y137 HydrophobicContact CE2-CG 3.75Å; Y118-Y137 AromaticContact CZ-CG 3.61Å; Y118-Y137 WeakPolarHBondContact OH-CB 3.13Å; Y118-Y137 WeakPolarHBondContact OH-CD2 3.44Å; G133-Y137 WeakPolarHBondContact O-CB 3.49Å; G133-Y137 PolarHBondContact O-N 3.43Å; T134-Y137 WeakPolarHBondContact O-CB 3.31Å; T134-Y137 PolarHBondContact O-N 3.34Å; L135-Y137 VanDerWaalsContact C-N 3.29Å; L135-Y137 PolarHBondContact O-N 2.83Å; Y137-V139 VanDerWaalsContact C-N 3.3Å; Y137-V139 PolarHBondContact O-N 3.17Å; Y137-A140 PolarHBondContact O-N 2.95Å; Y137-T141 VanDerWaalsContact CD2-OG1 3.31Å; Y137-T141 WeakPolarHBondContact CD2-OG1 3.47Å; Y137-T141 HydrophobicContact CE2-CG2 4.46Å; Y137-T141 WeakPolarHBondContact CE2-OG1 3.45Å; Y137-T141 WeakPolarHBondContact O-CB 3.38Å; Y137-T141 PolarHBondContact O-N 3.49Å; Y137-T141 PolarHBondContact O-OG1 3.49Å; Y137-N262 WeakPolarHBondContact CE2-OD1 3.23Å; Y137-Q263 HydrophobicContact CE1-CB 4.07Å; Y137-Q263 HydrophobicContact CE2-CB 3.91Å; Y137-A361 WeakPolarHBondContact OH-CB 3.21Å; Y137-M362 HydrophobicContact CE1-CG 4.13Å; Y137-V365 HydrophobicContact CD1-CB 4.43Å; Y137-V365 HydrophobicContact CD1-CG1 4.2Å; Y137-V365 HydrophobicContact CD1-CG2 4.19Å; Y137-V365 HydrophobicContact CE1-CB 4.24Å; Y137-V365 HydrophobicContact CE1-CG2 3.85Å |
| 138 | L | 95.8 | Very high | 94.5 | Very high | 18 Ų | 18 | 25.5 Ų | 25.5 | 9% | 0.094 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.3 | -44.5 | 179.1 | -70.5 | 175.8 | 0 | 0 | 0 | 110.5 | T134 L135 M142 M362 Y394 | T134-L138 HydrophobicContact CG2-CD1 4.1Å; T134-L138 HydrophobicContact CG2-CG 4.43Å; T134-L138 VanDerWaalsContact O-CG 3.29Å; T134-L138 WeakPolarHBondContact O-CG 3.44Å; T134-L138 PolarHBondContact O-N 3.35Å; L135-L138 PolarHBondContact O-N 3.02Å; L138-M142 WeakPolarHBondContact O-CB 3.47Å; L138-M142 PolarHBondContact O-N 3.39Å; L138-M362 HydrophobicContact CD2-CB 3.69Å; L138-M362 HydrophobicContact CD2-CG 3.76Å; L138-M362 HydrophobicContact CD2-SD 4.41Å; L138-Y394 HydrophobicContact CD2-CE1 4.29Å |
| 139 | V | 94.9 | Very high | 94.3 | Very high | 56 Ų | 56 | 23.4 Ų | 23.4 | 34% | 0.339 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -65.6 | -49.8 | 177.4 | 175 | 0 | 0 | 0 | 0 | 111.3 | L135 Y137 T141 M142 L143 I423 | L135-V139 HydrophobicContact CD1-CG2 4.31Å; L135-V139 WeakPolarHBondContact O-CG2 3.48Å; L135-V139 PolarHBondContact O-N 3.15Å; Y137-V139 VanDerWaalsContact C-N 3.3Å; Y137-V139 PolarHBondContact O-N 3.17Å; V139-T141 VanDerWaalsContact C-N 3.33Å; V139-T141 PolarHBondContact O-N 3.34Å; V139-M142 PolarHBondContact O-N 2.82Å; V139-L143 HydrophobicContact CG1-CD1 3.9Å; V139-L143 HydrophobicContact CG1-CG 4.39Å; V139-L143 WeakPolarHBondContact O-CB 3.4Å; V139-L143 VanDerWaalsContact O-CG 3.3Å; V139-L143 WeakPolarHBondContact O-CG 3.39Å; V139-L143 PolarHBondContact O-N 3.01Å; V139-I423 HydrophobicContact CG1-CD1 4.27Å |
| 140 | A | 93.6 | Very high | 94.1 | Very high | 7 Ų | 7 | 24.6 Ų | 24.6 | 6% | 0.058 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -56.6 | -47.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q136 Y137 L143 Y144 I423 | Q136-A140 VanDerWaalsContact O-CB 3.3Å; Q136-A140 WeakPolarHBondContact O-CB 3.28Å; Q136-A140 PolarHBondContact O-N 3.28Å; Y137-A140 PolarHBondContact O-N 2.95Å; A140-L143 PolarHBondContact O-N 3.19Å; A140-Y144 WeakPolarHBondContact O-CB 3.37Å; A140-Y144 PolarHBondContact O-N 2.95Å; A140-I423 HydrophobicContact CB-CB 3.86Å; A140-I423 HydrophobicContact CB-CD1 4.42Å; A140-I423 HydrophobicContact CB-CG2 3.64Å |
| 141 | T | 93.8 | Very high | 93.9 | Very high | 6 Ų | 6 | 23.6 Ų | 23.6 | 4% | 0.037 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -71.2 | -38.6 | -174.8 | -56 | 0 | 0 | 0 | 0 | 111.2 | Y137 V139 T145 M362 | Y137-T141 VanDerWaalsContact CD2-OG1 3.31Å; Y137-T141 WeakPolarHBondContact CD2-OG1 3.47Å; Y137-T141 HydrophobicContact CE2-CG2 4.46Å; Y137-T141 WeakPolarHBondContact CE2-OG1 3.45Å; Y137-T141 WeakPolarHBondContact O-CB 3.38Å; Y137-T141 PolarHBondContact O-N 3.49Å; Y137-T141 PolarHBondContact O-OG1 3.49Å; V139-T141 VanDerWaalsContact C-N 3.33Å; V139-T141 PolarHBondContact O-N 3.34Å; T141-T145 WeakPolarHBondContact O-CB 3.47Å; T141-T145 PolarHBondContact O-N 3.24Å; T141-T145 PolarHBondContact O-OG1 3.43Å; T141-M362 HydrophobicContact CG2-CE 4.21Å; T141-M362 HydrophobicContact CG2-CG 3.83Å; T141-M362 HydrophobicContact CG2-SD 3.9Å |
| 142 | M | 94.6 | Very high | 93.6 | Very high | 49 Ų | 49 | 20.9 Ų | 20.9 | 24% | 0.241 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 173.5 | -177.7 | 178.3 | 69.6 | 0 | 0 | 111.5 | L138 V139 T145 G146 M362 A397 V401 | L138-M142 WeakPolarHBondContact O-CB 3.47Å; L138-M142 PolarHBondContact O-N 3.39Å; V139-M142 PolarHBondContact O-N 2.82Å; M142-T145 PolarHBondContact O-N 3.12Å; M142-G146 PolarHBondContact O-N 3.45Å; M142-M362 HydrophobicContact CB-SD 4.14Å; M142-A397 HydrophobicContact CG-CB 4.41Å; M142-A397 HydrophobicContact SD-CB 3.71Å; M142-V401 HydrophobicContact CG-CG2 4.22Å |
| 143 | L | 94.1 | Very high | 93.3 | Very high | 54 Ų | 54 | 18.1 Ų | 18.1 | 28% | 0.283 | 9% | 0.094 | S | C | . | . | H | α-helix | trans | -62.9 | -49.3 | 178.5 | -71.5 | 175.5 | 0 | 0 | 0 | 112 | V139 A140 T145 G146 I147 V401 V419 I423 | V139-L143 HydrophobicContact CG1-CD1 3.9Å; V139-L143 HydrophobicContact CG1-CG 4.39Å; V139-L143 WeakPolarHBondContact O-CB 3.4Å; V139-L143 VanDerWaalsContact O-CG 3.3Å; V139-L143 WeakPolarHBondContact O-CG 3.39Å; V139-L143 PolarHBondContact O-N 3.01Å; A140-L143 PolarHBondContact O-N 3.19Å; L143-T145 PolarHBondContact O-N 3.37Å; L143-G146 PolarHBondContact O-N 3.16Å; L143-I147 PolarHBondContact O-N 2.91Å; L143-V401 HydrophobicContact CD2-CG1 4.02Å; L143-V401 HydrophobicContact CD2-CG2 4.26Å; L143-V419 HydrophobicContact CB-CG1 3.52Å; L143-V419 HydrophobicContact CB-CG2 4.43Å; L143-V419 HydrophobicContact CD1-CG1 4.33Å; L143-I423 HydrophobicContact CD1-CD1 3.73Å |
| 144 | Y | 93.1 | Very high | 93 | Very high | 15 Ų | 15 | 18.4 Ų | 18.4 | 6% | 0.059 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -59.4 | -47.8 | 176.6 | 170.4 | -113.6 | 0 | 0 | 0 | 112 | F67 A140 G146 I147 V148 T354 M420 | F67-Y144 HydrophobicContact CD1-CE1 4.31Å; F67-Y144 HydrophobicContact CE1-CE1 4.2Å; A140-Y144 WeakPolarHBondContact O-CB 3.37Å; A140-Y144 PolarHBondContact O-N 2.95Å; Y144-G146 VanDerWaalsContact C-N 3.28Å; Y144-G146 PolarHBondContact O-N 3.11Å; Y144-I147 PolarHBondContact O-N 3.12Å; Y144-V148 HydrophobicContact CD1-CG2 4.44Å; Y144-V148 HydrophobicContact CD2-CG2 4.1Å; Y144-V148 HydrophobicContact CE1-CG2 4.03Å; Y144-V148 HydrophobicContact CE2-CG2 3.64Å; Y144-V148 HydrophobicContact CG-CG2 4.48Å; Y144-V148 WeakPolarHBondContact O-CG2 3.36Å; Y144-V148 PolarHBondContact O-N 3.45Å; Y144-T354 HydrophobicContact CE1-CG2 3.55Å; Y144-M420 HydrophobicContact CD2-CG 3.8Å; Y144-M420 HydrophobicContact CD2-SD 3.41Å; Y144-M420 WeakPolarHBondContact CD2-SD 3.22Å; Y144-M420 HydrophobicContact CE2-CE 4.28Å; Y144-M420 HydrophobicContact CE2-CG 4.34Å; Y144-M420 HydrophobicContact CE2-SD 3.35Å; Y144-M420 WeakPolarHBondContact CE2-SD 3.29Å; Y144-M420 HydrophobicContact CG-CG 4.12Å; Y144-M420 HydrophobicContact CG-SD 4.15Å |
| 145 | T | 92.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.1 | -33.8 | -177.9 | -55.4 | 0 | 0 | 0 | 0 | 111.8 | T141 M142 L143 V148 I149 A355 S358 C398 | T141-T145 WeakPolarHBondContact O-CB 3.47Å; T141-T145 PolarHBondContact O-N 3.24Å; T141-T145 PolarHBondContact O-OG1 3.43Å; M142-T145 PolarHBondContact O-N 3.12Å; L143-T145 PolarHBondContact O-N 3.37Å; T145-V148 WeakPolarHBondContact O-CB 3.29Å; T145-V148 PolarHBondContact O-N 3.23Å; T145-I149 HydrophobicContact CG2-CD1 4.17Å; T145-I149 WeakPolarHBondContact O-CG1 3.47Å; T145-I149 PolarHBondContact O-N 2.77Å; T145-A355 HydrophobicContact CG2-CB 4.01Å; T145-S358 WeakPolarHBondContact OG1-CB 3.32Å; T145-S358 PolarHBondContact OG1-OG 3.41Å; T145-C398 HydrophobicContact CG2-CB 4.13Å |
| 146 | G | 93.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -61.3 | -47.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | M142 L143 Y144 V148 I149 Y150 C398 A402 | M142-G146 PolarHBondContact O-N 3.45Å; L143-G146 PolarHBondContact O-N 3.16Å; Y144-G146 VanDerWaalsContact C-N 3.28Å; Y144-G146 PolarHBondContact O-N 3.11Å; G146-V148 PolarHBondContact O-N 3.18Å; G146-I149 PolarHBondContact O-N 3Å; G146-I149 VanDerWaalsContact O-N 3.15Å; G146-Y150 PolarHBondContact O-N 3.45Å; G146-C398 VanDerWaalsContact CA-O 3.3Å; G146-C398 WeakPolarHBondContact CA-O 3.33Å; G146-A402 VanDerWaalsContact O-CA 3.31Å; G146-A402 WeakPolarHBondContact O-CA 3.39Å; G146-A402 WeakPolarHBondContact O-CB 3.41Å |
| 147 | I | 92.5 | Very high | 92.1 | Very high | 5 Ų | 5 | 13.9 Ų | 13.9 | 3% | 0.026 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | 175.8 | -59.7 | 167.6 | 0 | 0 | 0 | 110.6 | V71 L143 Y144 I149 Y150 A151 S405 L408 V412 S416 V419 | V71-I147 HydrophobicContact CG2-CG2 4.33Å; L143-I147 PolarHBondContact O-N 2.91Å; Y144-I147 PolarHBondContact O-N 3.12Å; I147-I149 PolarHBondContact O-N 3.48Å; I147-Y150 PolarHBondContact O-N 3.07Å; I147-A151 PolarHBondContact O-N 2.87Å; I147-S405 WeakPolarHBondContact CG1-OG 3.36Å; I147-L408 HydrophobicContact CD1-CD1 4.39Å; I147-L408 HydrophobicContact CG1-CD1 4.28Å; I147-V412 HydrophobicContact CG2-CB 4.07Å; I147-V412 HydrophobicContact CG2-CG1 4.44Å; I147-S416 WeakPolarHBondContact CG2-OG 3.3Å; I147-V419 HydrophobicContact CD1-CG2 3.87Å |
| 148 | V | 92.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -65.4 | -34.4 | 177 | 167.9 | 0 | 0 | 0 | 0 | 113.2 | V71 Y144 T145 G146 P152 T351 T354 | V71-V148 HydrophobicContact CG2-CB 4.41Å; V71-V148 HydrophobicContact CG2-CG2 3.84Å; Y144-V148 HydrophobicContact CD1-CG2 4.44Å; Y144-V148 HydrophobicContact CD2-CG2 4.1Å; Y144-V148 HydrophobicContact CE1-CG2 4.03Å; Y144-V148 HydrophobicContact CE2-CG2 3.64Å; Y144-V148 HydrophobicContact CG-CG2 4.48Å; Y144-V148 WeakPolarHBondContact O-CG2 3.36Å; Y144-V148 PolarHBondContact O-N 3.45Å; T145-V148 WeakPolarHBondContact O-CB 3.29Å; T145-V148 PolarHBondContact O-N 3.23Å; G146-V148 PolarHBondContact O-N 3.18Å; V148-P152 WeakPolarHBondContact O-CD 3.47Å; V148-T351 HydrophobicContact CG1-CG2 3.91Å; V148-T351 WeakPolarHBondContact O-CG2 3.36Å; V148-T351 PolarHBondContact O-OG1 3.27Å; V148-T354 HydrophobicContact CB-CG2 4.37Å; V148-T354 HydrophobicContact CG1-CG2 3.8Å; V148-T354 HydrophobicContact CG2-CG2 4.07Å |
| 149 | I | 92.2 | Very high | 90.9 | Very high | 1 Ų | 1 | 13.5 Ų | 13.5 | 1% | 0.005 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -74.4 | -30.8 | 174.5 | -69.5 | 169.9 | 0 | 0 | 0 | 111.5 | T145 G146 I147 P152 T171 T351 A355 C398 L399 A402 | T145-I149 HydrophobicContact CG2-CD1 4.17Å; T145-I149 WeakPolarHBondContact O-CG1 3.47Å; T145-I149 PolarHBondContact O-N 2.77Å; G146-I149 PolarHBondContact O-N 3Å; G146-I149 VanDerWaalsContact O-N 3.15Å; I147-I149 PolarHBondContact O-N 3.48Å; I149-P152 VanDerWaalsContact O-CD 3.31Å; I149-P152 WeakPolarHBondContact O-CD 3.43Å; I149-T171 HydrophobicContact CG2-CG2 4.02Å; I149-T351 HydrophobicContact CG1-CG2 4.33Å; I149-A355 HydrophobicContact CG1-CB 4.43Å; I149-C398 HydrophobicContact CD1-CB 3.81Å; I149-L399 HydrophobicContact CG2-CD1 4.42Å; I149-A402 HydrophobicContact CB-CB 3.97Å; I149-A402 HydrophobicContact CG2-CB 3.83Å |
| 150 | Y | 91.6 | Very high | 90.4 | Very high | 26 Ų | 26 | 11.7 Ų | 11.7 | 10% | 0.102 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -66.9 | -40.9 | 177.1 | 172.3 | -111.4 | 0 | 0 | 0 | 112.9 | G146 I147 A153 L154 I164 L168 S406 V412 | G146-Y150 PolarHBondContact O-N 3.45Å; I147-Y150 PolarHBondContact O-N 3.07Å; Y150-A153 WeakPolarHBondContact O-CB 3.18Å; Y150-A153 PolarHBondContact O-N 3.4Å; Y150-A153 VanDerWaalsContact O-N 3.11Å; Y150-L154 PolarHBondContact O-N 2.98Å; Y150-I164 HydrophobicContact CE2-CD1 4.09Å; Y150-I164 HydrophobicContact CE2-CG1 4.35Å; Y150-L168 HydrophobicContact CD2-CD2 4.18Å; Y150-S406 VanDerWaalsContact CE2-CA 3.49Å; Y150-V412 HydrophobicContact CD1-CG1 3.58Å; Y150-V412 HydrophobicContact CE1-CG1 3.76Å |
| 151 | A | 90.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -53.7 | -51.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | A70 V71 L74 I147 A153 L154 I155 V412 | A70-A151 HydrophobicContact CB-CB 3.69Å; V71-A151 HydrophobicContact CG2-CB 4.03Å; L74-A151 HydrophobicContact CD1-CB 4.15Å; I147-A151 PolarHBondContact O-N 2.87Å; A151-A153 VanDerWaalsContact C-N 3.33Å; A151-A153 PolarHBondContact O-N 3.09Å; A151-L154 WeakPolarHBondContact O-CB 3.14Å; A151-L154 PolarHBondContact O-N 3.46Å; A151-I155 WeakPolarHBondContact O-CG1 3.34Å; A151-I155 PolarHBondContact O-N 3.16Å; A151-V412 HydrophobicContact CB-CG2 4.33Å |
| 152 | P | 89.4 | Confident | 89.3 | Confident | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -74.4 | -22.7 | 177.5 | 32.4 | -37.2 | 0 | 0 | 0 | 113.2 | A70 V148 I149 L154 I155 L156 T171 Y348 T351 | A70-P152 HydrophobicContact CB-CB 4.16Å; A70-P152 HydrophobicContact CB-CG 4.26Å; V148-P152 WeakPolarHBondContact O-CD 3.47Å; I149-P152 VanDerWaalsContact O-CD 3.31Å; I149-P152 WeakPolarHBondContact O-CD 3.43Å; P152-L154 VanDerWaalsContact C-N 3.33Å; P152-I155 PolarHBondContact O-N 3.06Å; P152-L156 WeakPolarHBondContact O-CB 3.45Å; P152-L156 PolarHBondContact O-N 2.85Å; P152-T171 HydrophobicContact CG-CG2 3.81Å; P152-Y348 HydrophobicContact CB-CD2 3.71Å; P152-Y348 HydrophobicContact CB-CE2 3.64Å; P152-Y348 HydrophobicContact CB-CG 4.27Å; P152-T351 WeakPolarHBondContact CD-OG1 3.43Å; P152-T351 HydrophobicContact CG-CG2 3.76Å; P152-T351 WeakPolarHBondContact CG-OG1 3.28Å |
| 153 | A | 90.9 | Very high | 89 | Confident | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -66.2 | -38.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111 | Y150 A151 L156 N157 S167 L168 T171 | Y150-A153 WeakPolarHBondContact O-CB 3.18Å; Y150-A153 PolarHBondContact O-N 3.4Å; Y150-A153 VanDerWaalsContact O-N 3.11Å; A151-A153 VanDerWaalsContact C-N 3.33Å; A151-A153 PolarHBondContact O-N 3.09Å; A153-L156 PolarHBondContact O-N 3Å; A153-N157 WeakPolarHBondContact O-CB 3.4Å; A153-N157 PolarHBondContact O-N 3.33Å; A153-S167 VanDerWaalsContact O-CB 3.31Å; A153-S167 WeakPolarHBondContact O-CB 3.39Å; A153-L168 HydrophobicContact CB-CB 4.47Å; A153-L168 HydrophobicContact CB-CD2 3.72Å; A153-L168 HydrophobicContact CB-CG 3.91Å; A153-T171 WeakPolarHBondContact CA-OG1 3.27Å; A153-T171 WeakPolarHBondContact CB-OG1 3.48Å |
| 154 | L | 88.6 | Confident | 88.5 | Confident | 6 Ų | 6 | 18.7 Ų | 18.7 | 3% | 0.031 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -61.3 | -43.5 | 171.7 | -178.6 | 68 | 0 | 0 | 0 | 111.2 | L74 Y150 A151 P152 N157 Q158 D322 Q323 | L74-L154 HydrophobicContact CD1-CD2 4.49Å; Y150-L154 PolarHBondContact O-N 2.98Å; A151-L154 WeakPolarHBondContact O-CB 3.14Å; A151-L154 PolarHBondContact O-N 3.46Å; P152-L154 VanDerWaalsContact C-N 3.33Å; L154-N157 PolarHBondContact O-N 2.92Å; L154-Q158 WeakPolarHBondContact O-CG 3.08Å; L154-Q158 PolarHBondContact O-N 3.16Å; L154-D322 HydrophobicContact CD2-CB 3.77Å; L154-Q323 HydrophobicContact CD1-CG 4.42Å; L154-Q323 HydrophobicContact CD2-CG 4.35Å |
| 155 | I | 88.8 | Confident | 88.3 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.2 | -49.8 | 176.1 | -58.9 | 173 | 0 | 0 | 0 | 110.1 | L74 A151 P152 N157 Q158 V159 P326 F343 L344 A347 | L74-I155 HydrophobicContact CD1-CD1 3.98Å; L74-I155 HydrophobicContact CD1-CG1 3.8Å; L74-I155 HydrophobicContact CD2-CD1 3.68Å; L74-I155 HydrophobicContact CD2-CG1 3.79Å; L74-I155 HydrophobicContact CG-CD1 3.93Å; L74-I155 HydrophobicContact CG-CG1 4.17Å; A151-I155 WeakPolarHBondContact O-CG1 3.34Å; A151-I155 PolarHBondContact O-N 3.16Å; P152-I155 PolarHBondContact O-N 3.06Å; I155-N157 VanDerWaalsContact C-N 3.3Å; I155-N157 PolarHBondContact O-N 3.12Å; I155-Q158 PolarHBondContact O-N 3.36Å; I155-Q158 VanDerWaalsContact O-N 3.09Å; I155-V159 HydrophobicContact CG2-CG1 4.11Å; I155-V159 WeakPolarHBondContact O-CG1 3.21Å; I155-V159 VanDerWaalsContact O-CG2 3.26Å; I155-V159 WeakPolarHBondContact O-CG2 3.21Å; I155-V159 PolarHBondContact O-N 3.26Å; I155-P326 HydrophobicContact CG1-CG 4.06Å; I155-P326 HydrophobicContact CG2-CG 4.47Å; I155-F343 HydrophobicContact CD1-CE1 4.23Å; I155-F343 HydrophobicContact CD1-CZ 4.3Å; I155-F343 HydrophobicContact CG2-CD1 4.19Å; I155-F343 HydrophobicContact CG2-CE1 3.79Å; I155-L344 HydrophobicContact CB-CD1 4.21Å; I155-L344 HydrophobicContact CG2-CD1 3.66Å; I155-A347 HydrophobicContact CD1-CB 3.16Å |
| 156 | L | 88.9 | Confident | 88.1 | Confident | 10 Ų | 10 | 26.8 Ų | 26.8 | 5% | 0.052 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -57.4 | -44.9 | 180 | -172.1 | 69.1 | 0 | 0 | 0 | 110.9 | P152 A153 Q158 V159 T160 L344 Y348 | P152-L156 WeakPolarHBondContact O-CB 3.45Å; P152-L156 PolarHBondContact O-N 2.85Å; A153-L156 PolarHBondContact O-N 3Å; L156-Q158 PolarHBondContact O-N 2.89Å; L156-V159 PolarHBondContact O-N 3.06Å; L156-T160 HydrophobicContact CD1-CG2 3.59Å; L156-T160 HydrophobicContact CG-CG2 4.19Å; L156-T160 WeakPolarHBondContact O-CB 3.47Å; L156-T160 WeakPolarHBondContact O-CG2 3.44Å; L156-T160 PolarHBondContact O-N 3.42Å; L156-T160 PolarHBondContact O-OG1 3.09Å; L156-L344 HydrophobicContact CB-CD1 4.44Å; L156-L344 HydrophobicContact CD1-CD1 4.34Å; L156-L344 HydrophobicContact CD1-CD2 3.84Å; L156-Y348 WeakPolarHBondContact CD2-OH 3.1Å |
| 157 | N | 88.7 | Confident | 87.9 | Confident | 33 Ų | 33 | 26.8 Ų | 26.8 | 18% | 0.176 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -56.7 | -48 | 173.8 | 162.3 | -101.2 | 0 | 0 | 0 | 112.1 | A153 L154 I155 V159 G161 L162 I164 S167 | A153-N157 WeakPolarHBondContact O-CB 3.4Å; A153-N157 PolarHBondContact O-N 3.33Å; L154-N157 PolarHBondContact O-N 2.92Å; I155-N157 VanDerWaalsContact C-N 3.3Å; I155-N157 PolarHBondContact O-N 3.12Å; N157-V159 PolarHBondContact O-N 2.98Å; N157-G161 VanDerWaalsContact O-CA 3.31Å; N157-G161 WeakPolarHBondContact O-CA 3.29Å; N157-G161 PolarHBondContact O-N 2.82Å; N157-L162 PolarHBondContact ND2-O 3.3Å; N157-I164 HydrophobicContact CB-CD1 3.93Å; N157-S167 PolarHBondContact N-OG 3.28Å |
| 158 | Q | 83.2 | Confident | 87.8 | Confident | 16 Ų | 16 | 26.8 Ų | 26.8 | 8% | 0.075 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65.8 | -37.5 | -177.9 | -72 | -58.1 | -55.7 | 0 | 0 | 113.3 | L154 I155 L156 Q323 P326 | L154-Q158 WeakPolarHBondContact O-CG 3.08Å; L154-Q158 PolarHBondContact O-N 3.16Å; I155-Q158 PolarHBondContact O-N 3.36Å; I155-Q158 VanDerWaalsContact O-N 3.09Å; L156-Q158 PolarHBondContact O-N 2.89Å; Q158-Q323 HydrophobicContact CG-CG 4.21Å; Q158-P326 HydrophobicContact CB-CB 4.06Å |
| 159 | V | 82.3 | Confident | 87.6 | Confident | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -92.5 | -24.6 | -172 | -56.9 | 0 | 0 | 0 | 0 | 114.3 | T11 F12 I155 L156 N157 P326 L330 | T11-V159 WeakPolarHBondContact CA-O 3.26Å; F12-V159 HydrophobicContact CD1-CB 3.56Å; F12-V159 HydrophobicContact CD1-CG1 4.48Å; F12-V159 HydrophobicContact CD1-CG2 3.82Å; F12-V159 HydrophobicContact CD2-CG2 3.98Å; F12-V159 HydrophobicContact CE1-CB 3.26Å; F12-V159 HydrophobicContact CE1-CG1 3.76Å; F12-V159 HydrophobicContact CE1-CG2 3.5Å; F12-V159 VanDerWaalsContact CE1-CG2 3.5Å; F12-V159 HydrophobicContact CE2-CB 4.39Å; F12-V159 HydrophobicContact CE2-CG2 3.67Å; F12-V159 HydrophobicContact CG-CB 4.26Å; F12-V159 HydrophobicContact CG-CG2 4.06Å; F12-V159 HydrophobicContact CZ-CB 3.71Å; F12-V159 HydrophobicContact CZ-CG1 4.11Å; F12-V159 HydrophobicContact CZ-CG2 3.4Å; F12-V159 VanDerWaalsContact CZ-CG2 3.4Å; F12-V159 PolarHBondContact N-O 3.09Å; I155-V159 HydrophobicContact CG2-CG1 4.11Å; I155-V159 WeakPolarHBondContact O-CG1 3.21Å; I155-V159 VanDerWaalsContact O-CG2 3.26Å; I155-V159 WeakPolarHBondContact O-CG2 3.21Å; I155-V159 PolarHBondContact O-N 3.26Å; L156-V159 PolarHBondContact O-N 3.06Å; N157-V159 PolarHBondContact O-N 2.98Å; V159-P326 HydrophobicContact CG1-CB 4.46Å; V159-L330 HydrophobicContact CG1-CD1 4.44Å; V159-L330 HydrophobicContact CG1-CD2 4.39Å |
| 160 | T | 83.2 | Confident | 87.5 | Confident | 18 Ų | 18 | 34.1 Ų | 34.1 | 11% | 0.11 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -101.1 | -19.1 | 177.8 | 65.4 | 0 | 0 | 0 | 0 | 112.9 | F12 Y17 L156 L162 | F12-T160 HydrophobicContact CD2-CG2 4.47Å; Y17-T160 HydrophobicContact CE1-CG2 4.08Å; Y17-T160 VanDerWaalsContact OH-CG2 3.25Å; Y17-T160 WeakPolarHBondContact OH-CG2 3.45Å; L156-T160 HydrophobicContact CD1-CG2 3.59Å; L156-T160 HydrophobicContact CG-CG2 4.19Å; L156-T160 WeakPolarHBondContact O-CB 3.47Å; L156-T160 WeakPolarHBondContact O-CG2 3.44Å; L156-T160 PolarHBondContact O-N 3.42Å; L156-T160 PolarHBondContact O-OG1 3.09Å; T160-L162 PolarHBondContact O-N 3.09Å; T160-L162 WeakPolarHBondContact OG1-CB 3.31Å; T160-L162 WeakPolarHBondContact OG1-CD1 3.45Å; T160-L162 WeakPolarHBondContact OG1-CG 3.44Å; T160-L162 PolarHBondContact OG1-N 3.09Å |
| 161 | G | 80.5 | Confident | 87.3 | Confident | 57 Ų | 57 | 32.9 Ų | 32.9 | 59% | 0.588 | 19% | 0.188 | S | C | * | . | trans | 72.2 | 6.1 | -170.7 | 0 | 0 | 0 | 0 | 0 | 114 | N157 | N157-G161 VanDerWaalsContact O-CA 3.31Å; N157-G161 WeakPolarHBondContact O-CA 3.29Å; N157-G161 PolarHBondContact O-N 2.82Å | ||
| 162 | L | 83.8 | Confident | 87.1 | Confident | 81 Ų | 81 | 33 Ų | 33 | 42% | 0.424 | 19% | 0.188 | S | C | . | . | trans | -63.2 | 149.7 | 174.6 | -71.3 | 174.4 | 0 | 0 | 0 | 110.9 | N157 T160 | N157-L162 PolarHBondContact ND2-O 3.3Å; T160-L162 PolarHBondContact O-N 3.09Å; T160-L162 WeakPolarHBondContact OG1-CB 3.31Å; T160-L162 WeakPolarHBondContact OG1-CD1 3.45Å; T160-L162 WeakPolarHBondContact OG1-CG 3.44Å; T160-L162 PolarHBondContact OG1-N 3.09Å | ||
| 163 | D | 88.9 | Confident | 86.9 | Confident | 92 Ų | 92 | 36.7 Ų | 36.7 | 49% | 0.492 | 21% | 0.211 | S | C | . | . | trans | -55 | 146.8 | 170.2 | 179.2 | 66.3 | 0 | 0 | 0 | 111.8 | W165 A166 S167 | D163-W165 VanDerWaalsContact C-N 3.26Å; D163-W165 PolarHBondContact O-N 3.38Å; D163-W165 WeakPolarHBondContact OD2-CA 3.23Å; D163-W165 WeakPolarHBondContact OD2-CB 3.41Å; D163-W165 VanDerWaalsContact OD2-CD1 3.23Å; D163-W165 PolarHBondContact OD2-N 3.13Å; D163-A166 HydrophobicContact CB-CB 4.43Å; D163-A166 PolarHBondContact O-N 2.87Å; D163-S167 PolarHBondContact O-N 3.41Å; D163-S167 PolarHBondContact O-OG 2.88Å | ||
| 164 | I | 84.3 | Confident | 86.6 | Confident | 32 Ų | 32 | 38.5 Ų | 38.5 | 16% | 0.164 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.3 | -32.9 | -176.6 | -172.5 | 59.4 | 0 | 0 | 0 | 111.8 | Y150 N157 S167 L168 | Y150-I164 HydrophobicContact CE2-CD1 4.09Å; Y150-I164 HydrophobicContact CE2-CG1 4.35Å; N157-I164 HydrophobicContact CB-CD1 3.93Å; I164-S167 PolarHBondContact O-N 2.91Å; I164-L168 HydrophobicContact CG1-CD1 4.27Å; I164-L168 WeakPolarHBondContact O-CB 3.18Å; I164-L168 WeakPolarHBondContact O-CG 3.38Å; I164-L168 PolarHBondContact O-N 3.25Å |
| 165 | W | 88.3 | Confident | 86.3 | Confident | 141 Ų | 141 | 38.3 Ų | 38.3 | 53% | 0.534 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -70.3 | -40.2 | 177.4 | -61.6 | 99.3 | 0 | 0 | 0 | 111.7 | D163 S167 L168 L169 A403 | D163-W165 VanDerWaalsContact C-N 3.26Å; D163-W165 PolarHBondContact O-N 3.38Å; D163-W165 WeakPolarHBondContact OD2-CA 3.23Å; D163-W165 WeakPolarHBondContact OD2-CB 3.41Å; D163-W165 VanDerWaalsContact OD2-CD1 3.23Å; D163-W165 PolarHBondContact OD2-N 3.13Å; W165-S167 VanDerWaalsContact C-N 3.32Å; W165-L168 HydrophobicContact CE3-CD1 4.48Å; W165-L168 PolarHBondContact O-N 3.27Å; W165-L169 WeakPolarHBondContact O-CB 3.49Å; W165-L169 WeakPolarHBondContact O-CG 3.12Å; W165-L169 PolarHBondContact O-N 2.73Å; W165-A403 HydrophobicContact CH2-CB 4.09Å; W165-A403 HydrophobicContact CZ3-CB 3.56Å |
| 166 | A | 88.7 | Confident | 85.8 | Confident | 45 Ų | 45 | 39.3 Ų | 39.3 | 37% | 0.372 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -62.8 | -42.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | D163 S170 | D163-A166 HydrophobicContact CB-CB 4.43Å; D163-A166 PolarHBondContact O-N 2.87Å; A166-S170 VanDerWaalsContact O-CB 3.31Å; A166-S170 WeakPolarHBondContact O-CB 3.48Å; A166-S170 PolarHBondContact O-N 2.68Å |
| 167 | S | 89.6 | Confident | 85.1 | Confident | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -42 | 176.8 | -58.8 | 0 | 0 | 0 | 0 | 111.9 | A153 N157 D163 I164 W165 T171 | A153-S167 VanDerWaalsContact O-CB 3.31Å; A153-S167 WeakPolarHBondContact O-CB 3.39Å; N157-S167 PolarHBondContact N-OG 3.28Å; D163-S167 PolarHBondContact O-N 3.41Å; D163-S167 PolarHBondContact O-OG 2.88Å; I164-S167 PolarHBondContact O-N 2.91Å; W165-S167 VanDerWaalsContact C-N 3.32Å; S167-T171 WeakPolarHBondContact O-CB 3.15Å; S167-T171 PolarHBondContact O-N 3.06Å; S167-T171 PolarHBondContact O-OG1 3.24Å |
| 168 | L | 89.1 | Confident | 84.4 | Confident | 4 Ų | 4 | 43.6 Ų | 43.6 | 2% | 0.021 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.4 | -50.1 | 175.8 | -85.8 | 168.8 | 0 | 0 | 0 | 112.2 | Y150 A153 I164 W165 S170 T171 G172 L399 A402 A403 | Y150-L168 HydrophobicContact CD2-CD2 4.18Å; A153-L168 HydrophobicContact CB-CB 4.47Å; A153-L168 HydrophobicContact CB-CD2 3.72Å; A153-L168 HydrophobicContact CB-CG 3.91Å; I164-L168 HydrophobicContact CG1-CD1 4.27Å; I164-L168 WeakPolarHBondContact O-CB 3.18Å; I164-L168 WeakPolarHBondContact O-CG 3.38Å; I164-L168 PolarHBondContact O-N 3.25Å; W165-L168 HydrophobicContact CE3-CD1 4.48Å; W165-L168 PolarHBondContact O-N 3.27Å; L168-S170 VanDerWaalsContact C-N 3.35Å; L168-S170 PolarHBondContact O-N 3.33Å; L168-T171 PolarHBondContact O-N 3.13Å; L168-G172 PolarHBondContact O-N 3.06Å; L168-L399 WeakPolarHBondContact O-CD1 3.33Å; L168-A402 HydrophobicContact CD2-CB 3.77Å; L168-A403 HydrophobicContact CD1-CB 4.44Å |
| 169 | L | 89.6 | Confident | 83.8 | Confident | 107 Ų | 107 | 43.3 Ų | 43.3 | 56% | 0.56 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -60.1 | -45.6 | 178.6 | -75.6 | 170.7 | 0 | 0 | 0 | 111.3 | W165 G172 V173 L399 | W165-L169 WeakPolarHBondContact O-CB 3.49Å; W165-L169 WeakPolarHBondContact O-CG 3.12Å; W165-L169 PolarHBondContact O-N 2.73Å; L169-G172 PolarHBondContact O-N 3.23Å; L169-V173 VanDerWaalsContact O-CG2 3.3Å; L169-V173 WeakPolarHBondContact O-CG2 3.41Å; L169-V173 PolarHBondContact O-N 3.21Å; L169-L399 HydrophobicContact CD2-CD2 4.34Å |
| 170 | S | 88.9 | Confident | 83.1 | Confident | 49 Ų | 49 | 44.6 Ų | 44.6 | 34% | 0.343 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -58.9 | -50.9 | 176.1 | -178 | 0 | 0 | 0 | 0 | 111.6 | A166 L168 G172 V173 I174 | A166-S170 VanDerWaalsContact O-CB 3.31Å; A166-S170 WeakPolarHBondContact O-CB 3.48Å; A166-S170 PolarHBondContact O-N 2.68Å; L168-S170 VanDerWaalsContact C-N 3.35Å; L168-S170 PolarHBondContact O-N 3.33Å; S170-G172 VanDerWaalsContact C-N 3.32Å; S170-G172 PolarHBondContact O-N 3.32Å; S170-V173 PolarHBondContact O-N 3.31Å; S170-I174 VanDerWaalsContact O-CG1 3.29Å; S170-I174 WeakPolarHBondContact O-CG1 3.44Å; S170-I174 PolarHBondContact O-N 3.47Å |
| 171 | T | 87.9 | Confident | 82.2 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.2 | -45.1 | 177.8 | -53.8 | 0 | 0 | 0 | 0 | 111.5 | I149 P152 A153 S167 L168 I174 C175 Y348 | I149-T171 HydrophobicContact CG2-CG2 4.02Å; P152-T171 HydrophobicContact CG-CG2 3.81Å; A153-T171 WeakPolarHBondContact CA-OG1 3.27Å; A153-T171 WeakPolarHBondContact CB-OG1 3.48Å; S167-T171 WeakPolarHBondContact O-CB 3.15Å; S167-T171 PolarHBondContact O-N 3.06Å; S167-T171 PolarHBondContact O-OG1 3.24Å; L168-T171 PolarHBondContact O-N 3.13Å; T171-I174 PolarHBondContact O-N 3.21Å; T171-C175 WeakPolarHBondContact O-CB 3.44Å; T171-C175 PolarHBondContact O-N 3.16Å; T171-C175 PolarHBondContact O-SG 3.09Å; T171-Y348 HydrophobicContact CG2-CE1 3.98Å; T171-Y348 PolarHBondContact OG1-OH 3.33Å |
| 172 | G | 84.9 | Confident | 81.3 | Confident | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.01 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.6 | -42.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L168 L169 S170 T176 | L168-G172 PolarHBondContact O-N 3.06Å; L169-G172 PolarHBondContact O-N 3.23Å; S170-G172 VanDerWaalsContact C-N 3.32Å; S170-G172 PolarHBondContact O-N 3.32Å; G172-T176 WeakPolarHBondContact O-CB 3.14Å; G172-T176 PolarHBondContact O-N 2.58Å; G172-T176 PolarHBondContact O-OG1 3.29Å |
| 173 | V | 85.1 | Confident | 80.7 | Confident | 79 Ų | 79 | 41.1 Ų | 41.1 | 48% | 0.479 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.2 | -48.6 | 175 | 169.6 | 0 | 0 | 0 | 0 | 110.4 | L169 S170 C175 T176 L177 | L169-V173 VanDerWaalsContact O-CG2 3.3Å; L169-V173 WeakPolarHBondContact O-CG2 3.41Å; L169-V173 PolarHBondContact O-N 3.21Å; S170-V173 PolarHBondContact O-N 3.31Å; V173-C175 PolarHBondContact O-N 2.93Å; V173-T176 PolarHBondContact O-N 3.32Å; V173-L177 HydrophobicContact CG1-CD1 3.59Å; V173-L177 HydrophobicContact CG1-CG 4.16Å; V173-L177 VanDerWaalsContact O-CB 3.31Å; V173-L177 WeakPolarHBondContact O-CB 3.38Å; V173-L177 VanDerWaalsContact O-CG 3.28Å; V173-L177 WeakPolarHBondContact O-CG 3.3Å; V173-L177 PolarHBondContact O-N 2.85Å |
| 174 | I | 85.5 | Confident | 80 | Confident | 38 Ų | 38 | 37.1 Ų | 37.1 | 20% | 0.195 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.5 | -48.8 | 178.5 | -65.3 | 166.6 | 0 | 0 | 0 | 110.2 | L24 S170 T171 Y178 Y348 L352 | L24-I174 HydrophobicContact CD1-CD1 4.42Å; L24-I174 HydrophobicContact CD1-CG2 4.34Å; L24-I174 HydrophobicContact CD2-CG2 3.89Å; S170-I174 VanDerWaalsContact O-CG1 3.29Å; S170-I174 WeakPolarHBondContact O-CG1 3.44Å; S170-I174 PolarHBondContact O-N 3.47Å; T171-I174 PolarHBondContact O-N 3.21Å; I174-Y178 WeakPolarHBondContact O-CB 3.34Å; I174-Y178 PolarHBondContact O-N 3.4Å; I174-Y348 HydrophobicContact CD1-CE1 4.09Å; I174-L352 HydrophobicContact CG2-CD2 4.18Å |
| 175 | C | 82 | Confident | 79.6 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.007 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.5 | -43.1 | -179.8 | -66.5 | 0 | 0 | 0 | 0 | 112.6 | T171 V173 T179 L352 A355 | T171-C175 WeakPolarHBondContact O-CB 3.44Å; T171-C175 PolarHBondContact O-N 3.16Å; T171-C175 PolarHBondContact O-SG 3.09Å; V173-C175 PolarHBondContact O-N 2.93Å; C175-T179 VanDerWaalsContact O-CB 3.31Å; C175-T179 WeakPolarHBondContact O-CB 3.08Å; C175-T179 PolarHBondContact O-N 2.65Å; C175-T179 PolarHBondContact O-OG1 3.47Å; C175-L352 HydrophobicContact CB-CD2 4.29Å; C175-A355 HydrophobicContact CB-CB 4.47Å |
| 176 | T | 78.1 | Confident | 79.2 | Confident | 21 Ų | 21 | 31.4 Ų | 31.4 | 13% | 0.129 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -68.3 | -49.3 | -178.1 | -58.6 | 0 | 0 | 0 | 0 | 110.9 | G172 V173 Y178 T179 T180 L392 | G172-T176 WeakPolarHBondContact O-CB 3.14Å; G172-T176 PolarHBondContact O-N 2.58Å; G172-T176 PolarHBondContact O-OG1 3.29Å; V173-T176 PolarHBondContact O-N 3.32Å; T176-Y178 PolarHBondContact O-N 3.19Å; T176-T179 PolarHBondContact O-N 2.66Å; T176-T180 HydrophobicContact CG2-CG2 4.36Å; T176-T180 WeakPolarHBondContact O-CG2 3.26Å; T176-T180 PolarHBondContact O-N 3.19Å; T176-T180 PolarHBondContact O-OG1 2.73Å; T176-L392 HydrophobicContact CG2-CD2 3.67Å |
| 177 | L | 75.3 | Confident | 78.8 | Confident | 107 Ų | 107 | 29.8 Ų | 29.8 | 56% | 0.56 | 17% | 0.168 | S | C | * | . | H | α-helix | trans | -59.6 | -47.9 | 178.2 | -71.1 | 177 | 0 | 0 | 0 | 110.8 | V173 T179 T180 V181 | V173-L177 HydrophobicContact CG1-CD1 3.59Å; V173-L177 HydrophobicContact CG1-CG 4.16Å; V173-L177 VanDerWaalsContact O-CB 3.31Å; V173-L177 WeakPolarHBondContact O-CB 3.38Å; V173-L177 VanDerWaalsContact O-CG 3.28Å; V173-L177 WeakPolarHBondContact O-CG 3.3Å; V173-L177 PolarHBondContact O-N 2.85Å; L177-T179 VanDerWaalsContact C-N 3.29Å; L177-T179 PolarHBondContact O-N 2.97Å; L177-T180 PolarHBondContact O-N 3.13Å; L177-T180 PolarHBondContact O-OG1 2.97Å; L177-V181 WeakPolarHBondContact O-CG2 3.07Å |
| 178 | Y | 73.8 | Confident | 78.7 | Confident | 27 Ų | 27 | 29.8 Ų | 29.8 | 11% | 0.106 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -57 | -43 | 177.7 | 177.9 | -99.1 | 0 | 0 | 0 | 112.3 | I174 T176 T190 Q194 L352 | I174-Y178 WeakPolarHBondContact O-CB 3.34Å; I174-Y178 PolarHBondContact O-N 3.4Å; T176-Y178 PolarHBondContact O-N 3.19Å; Y178-T190 WeakPolarHBondContact OH-CB 3.32Å; Y178-T190 PolarHBondContact OH-OG1 3.47Å; Y178-Q194 PolarHBondContact OH-NE2 3.3Å; Y178-L352 HydrophobicContact CD1-CB 4.11Å; Y178-L352 HydrophobicContact CD1-CD2 3.84Å; Y178-L352 HydrophobicContact CD1-CG 4.47Å; Y178-L352 HydrophobicContact CE1-CB 3.95Å; Y178-L352 HydrophobicContact CG-CD2 3.96Å |
| 179 | T | 70.6 | Confident | 78.5 | Confident | 9 Ų | 9 | 35.2 Ų | 35.2 | 6% | 0.055 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -70.1 | -37.4 | -178.5 | -57.4 | 0 | 0 | 0 | 0 | 112.8 | C175 T176 L177 V181 G182 S356 I359 | C175-T179 VanDerWaalsContact O-CB 3.31Å; C175-T179 WeakPolarHBondContact O-CB 3.08Å; C175-T179 PolarHBondContact O-N 2.65Å; C175-T179 PolarHBondContact O-OG1 3.47Å; T176-T179 PolarHBondContact O-N 2.66Å; L177-T179 VanDerWaalsContact C-N 3.29Å; L177-T179 PolarHBondContact O-N 2.97Å; T179-V181 PolarHBondContact O-N 3.42Å; T179-G182 PolarHBondContact O-N 2.95Å; T179-S356 WeakPolarHBondContact OG1-CA 3.3Å; T179-S356 WeakPolarHBondContact OG1-CB 3.42Å; T179-I359 HydrophobicContact CG2-CB 3.82Å; T179-I359 HydrophobicContact CG2-CD1 4.28Å; T179-I359 HydrophobicContact CG2-CG2 3.65Å |
| 180 | T | 68 | Low | 78.4 | Confident | 28 Ų | 28 | 30.3 Ų | 30.3 | 17% | 0.172 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67 | -20.7 | -177.2 | 58.6 | 0 | 0 | 0 | 0 | 114.2 | T176 L177 L392 | T176-T180 HydrophobicContact CG2-CG2 4.36Å; T176-T180 WeakPolarHBondContact O-CG2 3.26Å; T176-T180 PolarHBondContact O-N 3.19Å; T176-T180 PolarHBondContact O-OG1 2.73Å; L177-T180 PolarHBondContact O-N 3.13Å; L177-T180 PolarHBondContact O-OG1 2.97Å; T180-L392 HydrophobicContact CG2-CD2 3.5Å; T180-L392 VanDerWaalsContact CG2-CD2 3.5Å; T180-L392 HydrophobicContact CG2-CG 3.91Å |
| 181 | V | 62.9 | Low | 78.5 | Confident | 69 Ų | 69 | 28 Ų | 28 | 42% | 0.418 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -90.5 | -21.6 | -175.3 | 176.1 | 0 | 0 | 0 | 0 | 112.1 | L32 L177 T179 | L32-V181 HydrophobicContact CD2-CG1 3.32Å; L32-V181 HydrophobicContact CG-CG1 3.97Å; L177-V181 WeakPolarHBondContact O-CG2 3.07Å; T179-V181 PolarHBondContact O-N 3.42Å |
| 182 | G | 62.6 | Low | 78.7 | Confident | 10 Ų | 10 | 29.4 Ų | 29.4 | 10% | 0.103 | 16% | 0.156 | C | C | . | . | trans | -100.1 | 134.4 | -171.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | T179 | T179-G182 PolarHBondContact O-N 2.95Š| ||
| 183 | G | 70.3 | Confident | 79 | Confident | 3 Ų | 3 | 32.1 Ų | 32.1 | 3% | 0.031 | 17% | 0.167 | C | C | . | . | trans | -94.3 | 172.2 | 159.7 | 0 | 0 | 0 | 0 | 0 | 111 | K185 A186 V187 | G183-K185 VanDerWaalsContact C-N 3.28Å; G183-K185 PolarHBondContact O-N 3.02Å; G183-K185 VanDerWaalsContact O-N 3.07Å; G183-A186 WeakPolarHBondContact O-CA 3.35Å; G183-A186 WeakPolarHBondContact O-CB 3.5Å; G183-A186 PolarHBondContact O-N 3.26Å; G183-V187 PolarHBondContact O-N 2.84Å; G183-V187 VanDerWaalsContact O-N 3.08Å | ||
| 184 | M | 74.9 | Confident | 79.3 | Confident | 8 Ų | 8 | 28.3 Ų | 28.3 | 4% | 0.039 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -51.2 | -40.6 | -173 | 176.6 | 166.8 | -76.8 | 0 | 0 | 114.3 | F47 F48 A186 V187 V188 Q267 R268 A271 | F47-M184 WeakPolarHBondContact O-CB 3.06Å; F47-M184 PolarHBondContact O-N 3.18Å; F48-M184 WeakPolarHBondContact O-CE 3.36Å; M184-A186 PolarHBondContact O-N 2.92Å; M184-V187 PolarHBondContact O-N 3.38Å; M184-V188 HydrophobicContact CG-CG2 4.46Å; M184-V188 VanDerWaalsContact O-CG2 3.3Å; M184-V188 WeakPolarHBondContact O-CG2 3.45Å; M184-V188 PolarHBondContact O-N 3.31Å; M184-Q267 HydrophobicContact CE-CB 4.05Å; M184-Q267 HydrophobicContact CE-CG 3.58Å; M184-R268 HydrophobicContact CE-CG 4.13Å; M184-A271 HydrophobicContact SD-CB 4.02Å |
| 185 | K | 76.1 | Confident | 79.6 | Confident | 50 Ų | 50 | 26.8 Ų | 26.8 | 22% | 0.217 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -61.9 | -41.4 | 176.6 | -70.4 | 178.8 | 179.1 | 162.7 | 0 | 112.9 | V34 G50 L54 G183 W189 | V34-K185 HydrophobicContact CG1-CB 4.28Å; G50-K185 WeakPolarHBondContact O-CE 3.41Å; G50-K185 PolarHBondContact O-NZ 3.39Å; L54-K185 HydrophobicContact CD2-CG 4.2Å; G183-K185 VanDerWaalsContact C-N 3.28Å; G183-K185 PolarHBondContact O-N 3.02Å; G183-K185 VanDerWaalsContact O-N 3.07Å; K185-W189 PolarHBondContact O-N 3.49Å |
| 186 | A | 79.8 | Confident | 80.2 | Confident | 3 Ų | 3 | 31.2 Ų | 31.2 | 3% | 0.025 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66.5 | -47 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110 | G31 G183 M184 V188 W189 T190 | G31-A186 WeakPolarHBondContact O-CB 3.23Å; G183-A186 WeakPolarHBondContact O-CA 3.35Å; G183-A186 WeakPolarHBondContact O-CB 3.5Å; G183-A186 PolarHBondContact O-N 3.26Å; M184-A186 PolarHBondContact O-N 2.92Å; A186-V188 VanDerWaalsContact C-N 3.32Å; A186-V188 PolarHBondContact O-N 2.96Å; A186-W189 PolarHBondContact O-N 3.11Å; A186-T190 WeakPolarHBondContact O-CG2 3.42Å; A186-T190 PolarHBondContact O-N 2.97Å; A186-T190 PolarHBondContact O-OG1 2.85Å; A186-T190 VanDerWaalsContact O-OG1 3.14Å |
| 187 | V | 80.1 | Confident | 80.9 | Confident | 11 Ų | 11 | 30.9 Ų | 30.9 | 7% | 0.067 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -57 | -44.2 | 178.1 | 177.9 | 0 | 0 | 0 | 0 | 111.4 | G183 M184 W189 T190 D191 | G183-V187 PolarHBondContact O-N 2.84Å; G183-V187 VanDerWaalsContact O-N 3.08Å; M184-V187 PolarHBondContact O-N 3.38Å; V187-W189 VanDerWaalsContact C-N 3.35Å; V187-W189 PolarHBondContact O-N 3.38Å; V187-T190 WeakPolarHBondContact CA-OG1 3.28Å; V187-T190 PolarHBondContact O-N 3.23Å; V187-T190 PolarHBondContact O-OG1 3.49Å; V187-D191 WeakPolarHBondContact O-CB 3.33Å; V187-D191 PolarHBondContact O-N 2.92Å |
| 188 | V | 86.1 | Confident | 81.7 | Confident | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.006 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62.8 | -39.6 | -179.7 | 169.8 | 0 | 0 | 0 | 0 | 112.5 | L54 P58 M184 A186 V192 | L54-V188 HydrophobicContact CD1-CG2 4.12Å; P58-V188 HydrophobicContact CB-CG1 3.68Å; M184-V188 HydrophobicContact CG-CG2 4.46Å; M184-V188 VanDerWaalsContact O-CG2 3.3Å; M184-V188 WeakPolarHBondContact O-CG2 3.45Å; M184-V188 PolarHBondContact O-N 3.31Å; A186-V188 VanDerWaalsContact C-N 3.32Å; A186-V188 PolarHBondContact O-N 2.96Å; V188-V192 WeakPolarHBondContact O-CG2 3.46Å; V188-V192 PolarHBondContact O-N 3.45Å |
| 189 | W | 86.2 | Confident | 82.6 | Confident | 118 Ų | 118 | 25.7 Ų | 25.7 | 45% | 0.447 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -77.3 | -34.7 | -179.2 | -83 | 105.3 | 0 | 0 | 0 | 113.3 | I30 V34 P58 K185 A186 V187 D191 V192 F193 | I30-W189 HydrophobicContact CG2-CB 3.94Å; V34-W189 HydrophobicContact CG2-CB 4.25Å; V34-W189 HydrophobicContact CG2-CG 4.3Å; P58-W189 HydrophobicContact CG-CH2 4.3Å; P58-W189 HydrophobicContact CG-CZ2 4.32Å; K185-W189 PolarHBondContact O-N 3.49Å; A186-W189 PolarHBondContact O-N 3.11Å; V187-W189 VanDerWaalsContact C-N 3.35Å; V187-W189 PolarHBondContact O-N 3.38Å; W189-D191 VanDerWaalsContact C-N 3.32Å; W189-V192 PolarHBondContact O-N 3.11Å; W189-F193 PolarHBondContact O-N 3.49Å |
| 190 | T | 88.2 | Confident | 83.7 | Confident | 3 Ų | 3 | 27.2 Ų | 27.2 | 2% | 0.018 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -67.7 | -37.2 | 173.3 | 53.6 | 0 | 0 | 0 | 0 | 111.2 | S27 I30 Y178 A186 V187 V192 F193 Q194 | S27-T190 WeakPolarHBondContact O-CG2 3.21Å; I30-T190 HydrophobicContact CB-CG2 4Å; I30-T190 HydrophobicContact CG2-CG2 3.8Å; Y178-T190 WeakPolarHBondContact OH-CB 3.32Å; Y178-T190 PolarHBondContact OH-OG1 3.47Å; A186-T190 WeakPolarHBondContact O-CG2 3.42Å; A186-T190 PolarHBondContact O-N 2.97Å; A186-T190 PolarHBondContact O-OG1 2.85Å; A186-T190 VanDerWaalsContact O-OG1 3.14Å; V187-T190 WeakPolarHBondContact CA-OG1 3.28Å; V187-T190 PolarHBondContact O-N 3.23Å; V187-T190 PolarHBondContact O-OG1 3.49Å; T190-V192 VanDerWaalsContact C-N 3.32Å; T190-V192 PolarHBondContact O-N 3.27Å; T190-F193 PolarHBondContact O-N 3.49Å; T190-Q194 WeakPolarHBondContact O-CB 3.28Å; T190-Q194 VanDerWaalsContact O-CG 3.27Å; T190-Q194 WeakPolarHBondContact O-CG 3.29Å; T190-Q194 PolarHBondContact O-N 2.74Å |
| 191 | D | 90.4 | Very high | 85 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.5 | -40.4 | 174 | -72.1 | -12.4 | 0 | 0 | 0 | 112.5 | S62 A65 S66 V187 W189 F193 Q194 V195 R268 S353 | S62-D191 WeakPolarHBondContact CB-OD2 3.47Å; S62-D191 PolarHBondContact OG-OD2 3.21Å; A65-D191 HydrophobicContact CB-CB 3.78Å; S66-D191 PolarHBondContact OG-OD2 3.22Å; V187-D191 WeakPolarHBondContact O-CB 3.33Å; V187-D191 PolarHBondContact O-N 2.92Å; W189-D191 VanDerWaalsContact C-N 3.32Å; D191-F193 VanDerWaalsContact C-N 3.32Å; D191-F193 PolarHBondContact O-N 3.33Å; D191-Q194 WeakPolarHBondContact O-CB 3.46Å; D191-Q194 PolarHBondContact O-N 3.06Å; D191-Q194 VanDerWaalsContact O-N 3.16Å; D191-V195 WeakPolarHBondContact O-CG2 3.11Å; D191-V195 PolarHBondContact O-N 3.45Å; D191-R268 IonicContact OD2-CZ 2.65Å; D191-R268 IonicContact OD2-NH1 3.5Å; D191-R268 IonicContact OD2-NH2 2.94Å; D191-R268 PolarHBondContact OD2-NH2 3.23Å; D191-S353 WeakPolarHBondContact OD1-CA 3.31Å; D191-S353 WeakPolarHBondContact OD1-CB 3.43Å; D191-S353 PolarHBondContact OD1-OG 3.11Å; D191-S353 PolarHBondContact OD2-OG 2.92Å |
| 192 | V | 91.4 | Very high | 86.5 | Confident | 30 Ų | 30 | 22.8 Ų | 22.8 | 18% | 0.182 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -58.8 | -45.8 | 177.2 | 170.1 | 0 | 0 | 0 | 0 | 111 | P58 L61 V188 W189 T190 Q194 | P58-V192 HydrophobicContact CB-CG2 4.02Å; L61-V192 HydrophobicContact CB-CG2 4.03Å; L61-V192 HydrophobicContact CD1-CG1 4.04Å; L61-V192 HydrophobicContact CD1-CG2 4.14Å; V188-V192 WeakPolarHBondContact O-CG2 3.46Å; V188-V192 PolarHBondContact O-N 3.45Å; W189-V192 PolarHBondContact O-N 3.11Å; T190-V192 VanDerWaalsContact C-N 3.32Å; T190-V192 PolarHBondContact O-N 3.27Å; V192-Q194 VanDerWaalsContact C-N 3.35Å |
| 193 | F | 91.7 | Very high | 88.1 | Confident | 58 Ų | 58 | 29 Ų | 29 | 25% | 0.254 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -63.1 | -43.5 | 175.2 | 170.7 | -107.4 | 0 | 0 | 0 | 111.3 | M23 V26 I30 W189 T190 D191 V195 V196 V197 | M23-F193 HydrophobicContact CG-CE1 4.14Å; V26-F193 HydrophobicContact CB-CE1 4.07Å; V26-F193 HydrophobicContact CB-CZ 3.94Å; V26-F193 HydrophobicContact CG1-CD1 4.18Å; V26-F193 HydrophobicContact CG1-CD2 4.21Å; V26-F193 HydrophobicContact CG1-CE1 3.71Å; V26-F193 HydrophobicContact CG1-CE2 3.75Å; V26-F193 HydrophobicContact CG1-CG 4.42Å; V26-F193 HydrophobicContact CG1-CZ 3.48Å; V26-F193 VanDerWaalsContact CG1-CZ 3.48Å; I30-F193 HydrophobicContact CD1-CB 3.8Å; I30-F193 HydrophobicContact CD1-CD1 4.24Å; I30-F193 HydrophobicContact CD1-CD2 4.36Å; I30-F193 HydrophobicContact CD1-CG 3.87Å; W189-F193 PolarHBondContact O-N 3.49Å; T190-F193 PolarHBondContact O-N 3.49Å; D191-F193 VanDerWaalsContact C-N 3.32Å; D191-F193 PolarHBondContact O-N 3.33Å; F193-V195 PolarHBondContact O-N 3.05Å; F193-V196 WeakPolarHBondContact O-CB 3.31Å; F193-V196 PolarHBondContact O-N 2.87Å; F193-V196 VanDerWaalsContact O-N 3.13Å; F193-V197 HydrophobicContact CD1-CG2 4.27Å; F193-V197 HydrophobicContact CD2-CG2 4.43Å; F193-V197 HydrophobicContact CE1-CG2 3.78Å; F193-V197 HydrophobicContact CE2-CG2 3.95Å; F193-V197 HydrophobicContact CZ-CG2 3.6Å; F193-V197 PolarHBondContact O-N 3.38Å; F193-V197 VanDerWaalsContact O-N 3.09Å |
| 194 | Q | 91.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.7 | -39 | -179.5 | -77.4 | 175.4 | -14.3 | 0 | 0 | 113 | Y178 T190 D191 V192 V196 V197 M198 S349 | Y178-Q194 PolarHBondContact OH-NE2 3.3Å; T190-Q194 WeakPolarHBondContact O-CB 3.28Å; T190-Q194 VanDerWaalsContact O-CG 3.27Å; T190-Q194 WeakPolarHBondContact O-CG 3.29Å; T190-Q194 PolarHBondContact O-N 2.74Å; D191-Q194 WeakPolarHBondContact O-CB 3.46Å; D191-Q194 PolarHBondContact O-N 3.06Å; D191-Q194 VanDerWaalsContact O-N 3.16Å; V192-Q194 VanDerWaalsContact C-N 3.35Å; Q194-V196 VanDerWaalsContact C-N 3.29Å; Q194-V196 PolarHBondContact O-N 3.41Å; Q194-V197 PolarHBondContact O-N 3.02Å; Q194-M198 WeakPolarHBondContact O-CB 3.47Å; Q194-M198 WeakPolarHBondContact O-CG 3.16Å; Q194-M198 PolarHBondContact O-N 3.36Å; Q194-S349 PolarHBondContact OE1-O 2.97Å |
| 195 | V | 91.9 | Very high | 90.2 | Very high | 5 Ų | 5 | 31.1 Ų | 31.1 | 3% | 0.03 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60 | -40.3 | 174.3 | 169.8 | 0 | 0 | 0 | 0 | 111.8 | L61 A65 D191 F193 M198 L199 I292 | L61-V195 HydrophobicContact CD2-CG1 4.31Å; A65-V195 HydrophobicContact CB-CG2 3.57Å; D191-V195 WeakPolarHBondContact O-CG2 3.11Å; D191-V195 PolarHBondContact O-N 3.45Å; F193-V195 PolarHBondContact O-N 3.05Å; V195-M198 PolarHBondContact O-N 2.94Å; V195-L199 HydrophobicContact CG1-CD1 4.13Å; V195-L199 PolarHBondContact O-N 2.9Å; V195-I292 HydrophobicContact CG1-CD1 4.28Å |
| 196 | V | 93.6 | Very high | 91.1 | Very high | 95 Ų | 95 | 30.9 Ų | 30.9 | 58% | 0.576 | 15% | 0.154 | S | C | * | . | H | α-helix | trans | -65.3 | -45.2 | 177.8 | 177 | 0 | 0 | 0 | 0 | 110.5 | F193 Q194 M198 L199 S200 | F193-V196 WeakPolarHBondContact O-CB 3.31Å; F193-V196 PolarHBondContact O-N 2.87Å; F193-V196 VanDerWaalsContact O-N 3.13Å; Q194-V196 VanDerWaalsContact C-N 3.29Å; Q194-V196 PolarHBondContact O-N 3.41Å; V196-M198 VanDerWaalsContact C-N 3.3Å; V196-M198 PolarHBondContact O-N 2.96Å; V196-L199 PolarHBondContact O-N 3.34Å; V196-S200 WeakPolarHBondContact O-CB 3.2Å; V196-S200 PolarHBondContact O-N 2.9Å; V196-S200 PolarHBondContact O-OG 3.18Å |
| 197 | V | 93.3 | Very high | 91.8 | Very high | 13 Ų | 13 | 33.3 Ų | 33.3 | 8% | 0.079 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59 | -44.2 | 175.4 | 176.9 | 0 | 0 | 0 | 0 | 110.6 | M23 F193 Q194 S200 G201 L342 A345 | M23-V197 HydrophobicContact CG-CG1 4.26Å; M23-V197 HydrophobicContact CG-CG2 4.39Å; F193-V197 HydrophobicContact CD1-CG2 4.27Å; F193-V197 HydrophobicContact CD2-CG2 4.43Å; F193-V197 HydrophobicContact CE1-CG2 3.78Å; F193-V197 HydrophobicContact CE2-CG2 3.95Å; F193-V197 HydrophobicContact CZ-CG2 3.6Å; F193-V197 PolarHBondContact O-N 3.38Å; F193-V197 VanDerWaalsContact O-N 3.09Å; Q194-V197 PolarHBondContact O-N 3.02Å; V197-S200 PolarHBondContact O-N 3.44Å; V197-S200 PolarHBondContact O-OG 2.75Å; V197-G201 PolarHBondContact O-N 3Å; V197-L342 HydrophobicContact CG1-CD1 4.35Å; V197-A345 HydrophobicContact CG1-CB 4.11Å |
| 198 | M | 91.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.6 | -50.7 | 179.1 | -72 | 178.4 | 66.6 | 0 | 0 | 112.9 | M68 V73 Q194 V195 V196 S200 G201 F202 I292 C346 | M68-M198 HydrophobicContact CB-CE 3.67Å; M68-M198 VanDerWaalsContact O-CE 3.29Å; M68-M198 WeakPolarHBondContact O-CE 3.31Å; V73-M198 HydrophobicContact CG2-CE 4Å; Q194-M198 WeakPolarHBondContact O-CB 3.47Å; Q194-M198 WeakPolarHBondContact O-CG 3.16Å; Q194-M198 PolarHBondContact O-N 3.36Å; V195-M198 PolarHBondContact O-N 2.94Å; V196-M198 VanDerWaalsContact C-N 3.3Å; V196-M198 PolarHBondContact O-N 2.96Å; M198-S200 VanDerWaalsContact C-N 3.31Å; M198-S200 PolarHBondContact O-N 3.23Å; M198-G201 PolarHBondContact O-N 3.28Å; M198-F202 VanDerWaalsContact O-CD2 3.29Å; M198-F202 WeakPolarHBondContact O-CD2 3.41Å; M198-F202 PolarHBondContact O-N 3.23Å; M198-I292 HydrophobicContact CE-CG2 4.3Å; M198-C346 VanDerWaalsContact CA-SG 3.56Å; M198-C346 WeakPolarHBondContact CG-O 3.28Å; M198-C346 PolarHBondContact O-SG 3.45Å |
| 199 | L | 93.4 | Very high | 92.9 | Very high | 26 Ų | 26 | 36 Ų | 36 | 14% | 0.136 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.3 | -41.4 | 178 | -74.5 | 171.7 | 0 | 0 | 0 | 111.5 | V195 V196 G201 F202 W203 L291 I292 | V195-L199 HydrophobicContact CG1-CD1 4.13Å; V195-L199 PolarHBondContact O-N 2.9Å; V196-L199 PolarHBondContact O-N 3.34Å; L199-G201 VanDerWaalsContact C-N 3.32Å; L199-G201 PolarHBondContact O-N 2.68Å; L199-F202 PolarHBondContact O-N 3.32Å; L199-W203 PolarHBondContact O-N 3.45Å; L199-L291 HydrophobicContact CD2-CB 4.2Å; L199-I292 HydrophobicContact CD2-CB 4.34Å; L199-I292 HydrophobicContact CD2-CG1 3.61Å; L199-I292 HydrophobicContact CG-CG1 4.03Å |
| 200 | S | 94.8 | Very high | 93.3 | Very high | 41 Ų | 41 | 31.5 Ų | 31.5 | 29% | 0.287 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -60.4 | -41.4 | 177.6 | 74.6 | 0 | 0 | 0 | 0 | 112.2 | V196 V197 M198 W203 V204 | V196-S200 WeakPolarHBondContact O-CB 3.2Å; V196-S200 PolarHBondContact O-N 2.9Å; V196-S200 PolarHBondContact O-OG 3.18Å; V197-S200 PolarHBondContact O-N 3.44Å; V197-S200 PolarHBondContact O-OG 2.75Å; M198-S200 VanDerWaalsContact C-N 3.31Å; M198-S200 PolarHBondContact O-N 3.23Å; S200-W203 PolarHBondContact O-N 3.14Å; S200-V204 WeakPolarHBondContact O-CB 3.3Å; S200-V204 VanDerWaalsContact O-CG2 3.28Å; S200-V204 WeakPolarHBondContact O-CG2 3.15Å; S200-V204 PolarHBondContact O-N 3.24Å |
| 201 | G | 93.8 | Very high | 93.6 | Very high | 2 Ų | 2 | 36.2 Ų | 36.2 | 2% | 0.021 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.8 | -47.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V197 M198 L199 I205 | V197-G201 PolarHBondContact O-N 3Å; M198-G201 PolarHBondContact O-N 3.28Å; L199-G201 VanDerWaalsContact C-N 3.32Å; L199-G201 PolarHBondContact O-N 2.68Å; G201-I205 WeakPolarHBondContact O-CD1 3.41Å; G201-I205 VanDerWaalsContact O-CG1 3.23Å; G201-I205 WeakPolarHBondContact O-CG1 3.48Å; G201-I205 PolarHBondContact O-N 3.02Å |
| 202 | F | 94.7 | Very high | 93.7 | Very high | 1 Ų | 1 | 39.7 Ų | 39.7 | 0% | 0.004 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63 | -44.2 | 177.1 | -73.5 | -61.7 | 0 | 0 | 0 | 112.7 | V73 P77 M198 L199 V204 I205 L206 I292 A296 C299 | V73-F202 HydrophobicContact CB-CZ 4.12Å; V73-F202 HydrophobicContact CG1-CE1 4.22Å; V73-F202 HydrophobicContact CG1-CZ 3.98Å; V73-F202 HydrophobicContact CG2-CE2 4.3Å; V73-F202 HydrophobicContact CG2-CZ 3.91Å; P77-F202 HydrophobicContact CG-CE1 4.39Å; M198-F202 VanDerWaalsContact O-CD2 3.29Å; M198-F202 WeakPolarHBondContact O-CD2 3.41Å; M198-F202 PolarHBondContact O-N 3.23Å; L199-F202 PolarHBondContact O-N 3.32Å; F202-V204 PolarHBondContact O-N 2.9Å; F202-I205 PolarHBondContact O-N 2.95Å; F202-L206 VanDerWaalsContact O-CB 3.31Å; F202-L206 WeakPolarHBondContact O-CB 3.35Å; F202-L206 PolarHBondContact O-N 2.72Å; F202-I292 HydrophobicContact CD2-CG2 4.15Å; F202-I292 HydrophobicContact CE2-CG2 3.6Å; F202-A296 HydrophobicContact CD1-CB 4.24Å; F202-A296 HydrophobicContact CE1-CB 3.62Å; F202-A296 HydrophobicContact CE2-CB 4.34Å; F202-A296 HydrophobicContact CZ-CB 3.65Å; F202-C299 PolarHBondContact O-SG 3.2Å; F202-C299 VanDerWaalsContact O-SG 3.41Å |
| 203 | W | 95.8 | Very high | 93.8 | Very high | 140 Ų | 140 | 39.9 Ų | 39.9 | 53% | 0.53 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -67.1 | -37 | -176.9 | -70 | 0 | 0 | 0 | 0 | 112.7 | L199 S200 L206 A207 S295 | L199-W203 PolarHBondContact O-N 3.45Å; S200-W203 PolarHBondContact O-N 3.14Å; W203-L206 PolarHBondContact O-N 2.9Å; W203-A207 VanDerWaalsContact O-CB 3.26Å; W203-A207 WeakPolarHBondContact O-CB 3.46Å; W203-A207 PolarHBondContact O-N 3.42Å; W203-S295 PolarHBondContact NE1-OG 2.87Å |
| 204 | V | 95.6 | Very high | 93.8 | Very high | 52 Ų | 52 | 40.1 Ų | 40.1 | 32% | 0.315 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64.1 | -44 | 174.6 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | S200 F202 A207 R208 F333 V339 L342 | S200-V204 WeakPolarHBondContact O-CB 3.3Å; S200-V204 VanDerWaalsContact O-CG2 3.28Å; S200-V204 WeakPolarHBondContact O-CG2 3.15Å; S200-V204 PolarHBondContact O-N 3.24Å; F202-V204 PolarHBondContact O-N 2.9Å; V204-A207 PolarHBondContact O-N 3.43Å; V204-R208 PolarHBondContact O-N 3.36Å; V204-F333 HydrophobicContact CG1-CE1 4Å; V204-F333 HydrophobicContact CG1-CZ 3.68Å; V204-V339 HydrophobicContact CG1-CG1 3.46Å; V204-V339 VanDerWaalsContact CG1-CG1 3.46Å; V204-L342 HydrophobicContact CG2-CD2 4.12Å |
| 205 | I | 94.3 | Very high | 93.9 | Very high | 4 Ų | 4 | 41 Ų | 41 | 2% | 0.021 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.6 | -45.2 | 176.8 | -64.6 | 158.9 | 0 | 0 | 0 | 110.9 | G201 F202 A207 R208 G209 M325 L328 V329 I332 F333 F343 | G201-I205 WeakPolarHBondContact O-CD1 3.41Å; G201-I205 VanDerWaalsContact O-CG1 3.23Å; G201-I205 WeakPolarHBondContact O-CG1 3.48Å; G201-I205 PolarHBondContact O-N 3.02Å; F202-I205 PolarHBondContact O-N 2.95Å; I205-A207 PolarHBondContact O-N 2.87Å; I205-R208 PolarHBondContact O-N 3.1Å; I205-G209 PolarHBondContact O-N 3.21Å; I205-M325 HydrophobicContact CB-CE 4.24Å; I205-M325 HydrophobicContact CD1-CE 3.44Å; I205-M325 VanDerWaalsContact CD1-CE 3.44Å; I205-M325 HydrophobicContact CG1-CE 4.26Å; I205-M325 HydrophobicContact CG2-CE 3.58Å; I205-L328 HydrophobicContact CG2-CD2 4.36Å; I205-V329 HydrophobicContact CD1-CG2 3.76Å; I205-V329 HydrophobicContact CG1-CG2 4.1Å; I205-I332 HydrophobicContact CG2-CD1 3.93Å; I205-F333 HydrophobicContact CG1-CE2 3.9Å; I205-F343 HydrophobicContact CD1-CB 4.35Å; I205-F343 HydrophobicContact CD1-CD2 3.54Å; I205-F343 HydrophobicContact CD1-CE2 4.23Å; I205-F343 HydrophobicContact CD1-CG 4.26Å |
| 206 | L | 95.3 | Very high | 94 | Very high | 46 Ų | 46 | 45.3 Ų | 45.3 | 24% | 0.241 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.4 | -45.1 | 177.7 | -173.5 | 65.8 | 0 | 0 | 0 | 111.4 | F202 W203 T210 C298 V302 | F202-L206 VanDerWaalsContact O-CB 3.31Å; F202-L206 WeakPolarHBondContact O-CB 3.35Å; F202-L206 PolarHBondContact O-N 2.72Å; W203-L206 PolarHBondContact O-N 2.9Å; L206-T210 HydrophobicContact CD1-CG2 4.23Å; L206-T210 VanDerWaalsContact O-CB 3.31Å; L206-T210 WeakPolarHBondContact O-CB 3.32Å; L206-T210 WeakPolarHBondContact O-CG2 3.39Å; L206-T210 PolarHBondContact O-N 3.08Å; L206-T210 PolarHBondContact O-OG1 3.4Å; L206-C298 HydrophobicContact CD1-CB 3.72Å; L206-C298 HydrophobicContact CD2-CB 4.18Å; L206-V302 HydrophobicContact CD1-CG2 3.81Å |
| 207 | A | 95.1 | Very high | 94 | Very high | 53 Ų | 53 | 50.2 Ų | 50.2 | 44% | 0.438 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.5 | -50.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W203 V204 I205 T210 V211 | W203-A207 VanDerWaalsContact O-CB 3.26Å; W203-A207 WeakPolarHBondContact O-CB 3.46Å; W203-A207 PolarHBondContact O-N 3.42Å; V204-A207 PolarHBondContact O-N 3.43Å; I205-A207 PolarHBondContact O-N 2.87Å; A207-T210 PolarHBondContact O-OG1 3.4Å; A207-V211 VanDerWaalsContact O-CG2 3.29Å; A207-V211 WeakPolarHBondContact O-CG2 3.45Å; A207-V211 PolarHBondContact O-N 3.03Å; A207-V211 VanDerWaalsContact O-N 3.15Å |
| 208 | R | 94.8 | Very high | 94 | Very high | 68 Ų | 68 | 52.6 Ų | 52.6 | 26% | 0.257 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.5 | -49.9 | 179.7 | 179.1 | 61.8 | 172.1 | 170.1 | -1.6 | 111.6 | V204 I205 T210 V211 L212 I332 F333 | V204-R208 PolarHBondContact O-N 3.36Å; I205-R208 PolarHBondContact O-N 3.1Å; R208-T210 PolarHBondContact O-N 3.34Å; R208-V211 PolarHBondContact O-N 2.96Å; R208-L212 HydrophobicContact CG-CD1 4.14Å; R208-L212 WeakPolarHBondContact O-CG 3.13Å; R208-L212 PolarHBondContact O-N 2.95Å; R208-I332 HydrophobicContact CB-CD1 4.48Å; R208-I332 HydrophobicContact CG-CB 4.24Å; R208-I332 HydrophobicContact CG-CD1 4.35Å; R208-I332 HydrophobicContact CG-CG1 4.22Å; R208-I332 PolarHBondContact NE-O 3.45Å; R208-F333 HydrophobicContact CB-CD1 4.5Å; R208-F333 HydrophobicContact CB-CE1 3.5Å; R208-F333 VanDerWaalsContact CB-CE1 3.5Å; R208-F333 HydrophobicContact CB-CE2 4.38Å; R208-F333 HydrophobicContact CB-CZ 3.41Å; R208-F333 VanDerWaalsContact CB-CZ 3.41Å; R208-F333 HydrophobicContact CG-CD1 4.05Å; R208-F333 HydrophobicContact CG-CE1 3.51Å; R208-F333 HydrophobicContact CG-CZ 3.76Å |
| 209 | G | 93.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.4 | -35.7 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | I205 L212 M213 | I205-G209 PolarHBondContact O-N 3.21Å; G209-L212 PolarHBondContact O-N 2.96Å; G209-M213 WeakPolarHBondContact O-CG 3.15Å; G209-M213 PolarHBondContact O-N 3.42Å; G209-M213 VanDerWaalsContact O-N 3.15Å |
| 210 | T | 94.5 | Very high | 94.1 | Very high | 25 Ų | 25 | 55.3 Ų | 55.3 | 15% | 0.153 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.5 | -37.9 | 173.4 | 52 | 0 | 0 | 0 | 0 | 112.7 | L206 A207 R208 M213 G215 V219 V302 | L206-T210 HydrophobicContact CD1-CG2 4.23Å; L206-T210 VanDerWaalsContact O-CB 3.31Å; L206-T210 WeakPolarHBondContact O-CB 3.32Å; L206-T210 WeakPolarHBondContact O-CG2 3.39Å; L206-T210 PolarHBondContact O-N 3.08Å; L206-T210 PolarHBondContact O-OG1 3.4Å; A207-T210 PolarHBondContact O-OG1 3.4Å; R208-T210 PolarHBondContact O-N 3.34Å; T210-M213 PolarHBondContact O-N 3.05Å; T210-G215 VanDerWaalsContact O-CA 3.26Å; T210-G215 WeakPolarHBondContact O-CA 3.34Å; T210-G215 PolarHBondContact O-N 2.91Å; T210-V219 HydrophobicContact CG2-CG2 4.33Å; T210-V302 HydrophobicContact CG2-CG2 3.73Å |
| 211 | V | 94.9 | Very high | 94 | Very high | 102 Ų | 102 | 55.1 Ų | 55.1 | 62% | 0.618 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -64.5 | -45.6 | 175.8 | 169.9 | 0 | 0 | 0 | 0 | 111.3 | A207 R208 M213 G214 | A207-V211 VanDerWaalsContact O-CG2 3.29Å; A207-V211 WeakPolarHBondContact O-CG2 3.45Å; A207-V211 PolarHBondContact O-N 3.03Å; A207-V211 VanDerWaalsContact O-N 3.15Å; R208-V211 PolarHBondContact O-N 2.96Å; V211-M213 PolarHBondContact O-N 3.45Å; V211-G214 PolarHBondContact O-N 3.42Å; V211-G214 VanDerWaalsContact O-N 3.13Å |
| 212 | L | 92.9 | Very high | 93.9 | Very high | 73 Ų | 73 | 56 Ų | 56 | 38% | 0.382 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.2 | -34.1 | 178.5 | -70.2 | 175.5 | 0 | 0 | 0 | 112.5 | R208 G209 G214 I332 | R208-L212 HydrophobicContact CG-CD1 4.14Å; R208-L212 WeakPolarHBondContact O-CG 3.13Å; R208-L212 PolarHBondContact O-N 2.95Å; G209-L212 PolarHBondContact O-N 2.96Å; L212-G214 PolarHBondContact O-N 3.48Å; L212-I332 HydrophobicContact CD1-CB 3.65Å; L212-I332 HydrophobicContact CD1-CG2 3.82Å |
| 213 | M | 92.3 | Very high | 93.8 | Very high | 34 Ų | 34 | 56 Ų | 56 | 17% | 0.167 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 17.8 | 178.5 | -61.2 | -44.9 | -62.2 | 0 | 0 | 113.9 | G209 T210 V211 N218 V219 V305 F306 | G209-M213 WeakPolarHBondContact O-CG 3.15Å; G209-M213 PolarHBondContact O-N 3.42Å; G209-M213 VanDerWaalsContact O-N 3.15Å; T210-M213 PolarHBondContact O-N 3.05Å; V211-M213 PolarHBondContact O-N 3.45Å; M213-N218 PolarHBondContact O-ND2 3.49Å; M213-V219 HydrophobicContact CB-CG2 3.6Å; M213-V219 HydrophobicContact CG-CG2 4.36Å; M213-V305 HydrophobicContact CB-CG1 4.23Å; M213-V305 HydrophobicContact CE-CG1 3.64Å; M213-V305 HydrophobicContact CG-CG1 4.02Å; M213-F306 HydrophobicContact SD-CB 4.2Å; M213-F306 HydrophobicContact SD-CD2 3.72Å; M213-F306 HydrophobicContact SD-CG 4.39Å |
| 214 | G | 91.8 | Very high | 93.6 | Very high | 62 Ų | 62 | 57.1 Ų | 57.1 | 64% | 0.639 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.4 | 23.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | V211 L212 | V211-G214 PolarHBondContact O-N 3.42Å; V211-G214 VanDerWaalsContact O-N 3.13Å; L212-G214 PolarHBondContact O-N 3.48Å |
| 215 | G | 93.8 | Very high | 93.4 | Very high | 18 Ų | 18 | 60.4 Ų | 60.4 | 19% | 0.186 | 33% | 0.328 | C | S | . | . | trans | 99.8 | 167.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | T210 W217 N218 V219 | T210-G215 VanDerWaalsContact O-CA 3.26Å; T210-G215 WeakPolarHBondContact O-CA 3.34Å; T210-G215 PolarHBondContact O-N 2.91Å; G215-W217 VanDerWaalsContact C-N 3.3Å; G215-W217 PolarHBondContact O-N 3.08Å; G215-N218 PolarHBondContact O-N 3.18Å; G215-V219 PolarHBondContact O-N 2.93Å | ||
| 216 | P | 93.5 | Very high | 93.2 | Very high | 96 Ų | 96 | 64.1 Ų | 64.1 | 62% | 0.623 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -63.9 | -32.8 | -172.8 | 24.5 | -34.3 | 0 | 0 | 0 | 113.2 | V219 L220 | P216-V219 PolarHBondContact O-N 3.28Å; P216-L220 WeakPolarHBondContact O-CB 3.49Å; P216-L220 PolarHBondContact O-N 2.94Å |
| 217 | W | 93.3 | Very high | 92.9 | Very high | 198 Ų | 198 | 65.2 Ų | 65.2 | 75% | 0.75 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -66 | -39.8 | 178.7 | -171.4 | -107.2 | 0 | 0 | 0 | 112.2 | G215 L220 S221 | G215-W217 VanDerWaalsContact C-N 3.3Å; G215-W217 PolarHBondContact O-N 3.08Å; W217-L220 PolarHBondContact O-N 2.73Å; W217-S221 WeakPolarHBondContact O-CB 3.41Å; W217-S221 PolarHBondContact O-N 2.88Å; W217-S221 PolarHBondContact O-OG 3.34Å |
| 218 | N | 93.8 | Very high | 92.6 | Very high | 64 Ų | 64 | 62.8 Ų | 62.8 | 34% | 0.342 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -69.8 | -40.9 | 178.4 | -168 | 42.9 | 0 | 0 | 0 | 111.7 | M213 G215 L220 S221 L222 | M213-N218 PolarHBondContact O-ND2 3.49Å; G215-N218 PolarHBondContact O-N 3.18Å; N218-L220 VanDerWaalsContact C-N 3.31Å; N218-L220 PolarHBondContact O-N 3.44Å; N218-S221 WeakPolarHBondContact CA-OG 3.44Å; N218-S221 PolarHBondContact O-N 3.18Å; N218-S221 PolarHBondContact O-OG 3.36Å; N218-L222 WeakPolarHBondContact O-CB 3.42Å; N218-L222 WeakPolarHBondContact O-CD1 3.26Å; N218-L222 VanDerWaalsContact O-CG 3.24Å; N218-L222 WeakPolarHBondContact O-CG 3.3Å; N218-L222 PolarHBondContact O-N 3.08Å |
| 219 | V | 94.3 | Very high | 92.4 | Very high | 9 Ų | 9 | 61.5 Ų | 61.5 | 6% | 0.055 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -58.8 | -46.1 | 173.5 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | T210 M213 G215 P216 A223 I301 V302 V305 | T210-V219 HydrophobicContact CG2-CG2 4.33Å; M213-V219 HydrophobicContact CB-CG2 3.6Å; M213-V219 HydrophobicContact CG-CG2 4.36Å; G215-V219 PolarHBondContact O-N 2.93Å; P216-V219 PolarHBondContact O-N 3.28Å; V219-A223 WeakPolarHBondContact O-CB 3.34Å; V219-A223 PolarHBondContact O-N 2.9Å; V219-I301 HydrophobicContact CG1-CG2 4.05Å; V219-V302 HydrophobicContact CG1-CG2 4.02Å; V219-V305 HydrophobicContact CG1-CG2 4.14Å; V219-V305 HydrophobicContact CG2-CG1 4.5Å |
| 220 | L | 93.4 | Very high | 92 | Very high | 73 Ų | 73 | 64.8 Ų | 64.8 | 38% | 0.382 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67 | -41 | -178.7 | -165.3 | 74.6 | 0 | 0 | 0 | 112.5 | P216 W217 N218 R224 I229 | P216-L220 WeakPolarHBondContact O-CB 3.49Å; P216-L220 PolarHBondContact O-N 2.94Å; W217-L220 PolarHBondContact O-N 2.73Å; N218-L220 VanDerWaalsContact C-N 3.31Å; N218-L220 PolarHBondContact O-N 3.44Å; L220-R224 WeakPolarHBondContact O-CB 3.37Å; L220-R224 PolarHBondContact O-N 3.38Å; L220-I229 HydrophobicContact CD1-CD1 3.4Å; L220-I229 HydrophobicContact CG-CD1 3.89Å; L220-I229 WeakPolarHBondContact O-CD1 3.41Å |
| 221 | S | 93.2 | Very high | 91.6 | Very high | 38 Ų | 38 | 66.5 Ų | 66.5 | 27% | 0.266 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -65.9 | -44.3 | 178.6 | 67.1 | 0 | 0 | 0 | 0 | 111.4 | W217 N218 R224 N225 | W217-S221 WeakPolarHBondContact O-CB 3.41Å; W217-S221 PolarHBondContact O-N 2.88Å; W217-S221 PolarHBondContact O-OG 3.34Å; N218-S221 WeakPolarHBondContact CA-OG 3.44Å; N218-S221 PolarHBondContact O-N 3.18Å; N218-S221 PolarHBondContact O-OG 3.36Å; S221-R224 PolarHBondContact O-N 3.46Å; S221-N225 PolarHBondContact O-N 3.46Å; S221-N225 PolarHBondContact O-OD1 3Å |
| 222 | L | 92.1 | Very high | 91.1 | Very high | 20 Ų | 20 | 68 Ų | 68 | 11% | 0.105 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64.5 | -43.1 | 177.2 | -71.2 | 170 | 0 | 0 | 0 | 112.1 | N218 R224 N225 H226 V305 | N218-L222 WeakPolarHBondContact O-CB 3.42Å; N218-L222 WeakPolarHBondContact O-CD1 3.26Å; N218-L222 VanDerWaalsContact O-CG 3.24Å; N218-L222 WeakPolarHBondContact O-CG 3.3Å; N218-L222 PolarHBondContact O-N 3.08Å; L222-R224 VanDerWaalsContact C-N 3.33Å; L222-R224 PolarHBondContact O-N 3.3Å; L222-N225 PolarHBondContact O-N 3.01Å; L222-H226 PolarHBondContact O-N 3.47Å; L222-H226 PolarHBondContact O-ND1 2.94Å; L222-V305 HydrophobicContact CB-CG1 4.24Å; L222-V305 HydrophobicContact CB-CG2 4.02Å; L222-V305 HydrophobicContact CD1-CG1 3.63Å |
| 223 | A | 92.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -64.9 | -36.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | V219 S227 R228 I229 I301 V305 | V219-A223 WeakPolarHBondContact O-CB 3.34Å; V219-A223 PolarHBondContact O-N 2.9Å; A223-S227 PolarHBondContact O-N 3.31Å; A223-R228 HydrophobicContact CB-CB 4.26Å; A223-R228 WeakPolarHBondContact O-CB 3.36Å; A223-R228 PolarHBondContact O-N 2.97Å; A223-I229 HydrophobicContact CB-CD1 3.85Å; A223-I229 HydrophobicContact CB-CG1 3.9Å; A223-I301 HydrophobicContact CB-CG2 3.44Å; A223-I301 VanDerWaalsContact CB-CG2 3.44Å; A223-V305 HydrophobicContact CB-CG2 4.37Å |
| 224 | R | 91.5 | Very high | 90.6 | Very high | 164 Ų | 164 | 68.8 Ų | 68.8 | 62% | 0.619 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -64.6 | -45.1 | 173.7 | -172.9 | 178.1 | -73.4 | 178 | -3 | 111.6 | L220 S221 L222 H226 S227 I229 | L220-R224 WeakPolarHBondContact O-CB 3.37Å; L220-R224 PolarHBondContact O-N 3.38Å; S221-R224 PolarHBondContact O-N 3.46Å; L222-R224 VanDerWaalsContact C-N 3.33Å; L222-R224 PolarHBondContact O-N 3.3Å; R224-H226 PolarHBondContact O-N 3.36Å; R224-S227 PolarHBondContact O-N 3.1Å; R224-S227 VanDerWaalsContact O-N 3.13Å; R224-I229 HydrophobicContact CB-CD1 4.11Å |
| 225 | N | 91.1 | Very high | 90.4 | Very high | 122 Ų | 122 | 69.6 Ų | 69.6 | 65% | 0.652 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -63.7 | -27.6 | -178.1 | -69.5 | -8.1 | 0 | 0 | 0 | 113.1 | S221 L222 | S221-N225 PolarHBondContact O-N 3.46Å; S221-N225 PolarHBondContact O-OD1 3Å; L222-N225 PolarHBondContact O-N 3.01Å |
| 226 | H | 89.2 | Confident | 90.1 | Very high | 82 Ų | 82 | 73.3 Ų | 73.3 | 38% | 0.38 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.6 | 20.1 | 178 | -63.5 | 84.3 | 0 | 0 | 0 | 113.4 | L222 R224 R228 F304 | L222-H226 PolarHBondContact O-N 3.47Å; L222-H226 PolarHBondContact O-ND1 2.94Å; R224-H226 PolarHBondContact O-N 3.36Å; H226-R228 HydrophobicContact CB-CG 4.19Å; H226-R228 PolarHBondContact O-N 3.28Å; H226-R228 VanDerWaalsContact O-N 3.08Å; H226-F304 HydrophobicContact CB-CE1 3.7Å; H226-F304 HydrophobicContact CB-CZ 3.49Å; H226-F304 VanDerWaalsContact CB-CZ 3.49Å; H226-F304 AromaticContact CD2-CZ 4Å; H226-F304 AromaticContact CG-CE1 3.94Å; H226-F304 AromaticContact CG-CZ 3.64Å |
| 227 | S | 88.8 | Confident | 89.8 | Confident | 69 Ų | 69 | 70.7 Ų | 70.7 | 48% | 0.483 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.9 | 19.4 | 177.3 | -57.4 | 0 | 0 | 0 | 0 | 115.2 | A223 R224 I229 N230 | A223-S227 PolarHBondContact O-N 3.31Å; R224-S227 PolarHBondContact O-N 3.1Å; R224-S227 VanDerWaalsContact O-N 3.13Å; S227-I229 VanDerWaalsContact C-N 3.32Å; S227-I229 PolarHBondContact O-N 3.48Å; S227-N230 PolarHBondContact O-N 3.14Å |
| 228 | R | 90.1 | Very high | 89.5 | Confident | 1 Ų | 1 | 64 Ų | 64 | 0% | 0.004 | 34% | 0.336 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79 | -14.5 | -179.3 | -57.2 | -72.7 | 172.5 | -176.8 | -9.7 | 113.2 | A81 R82 G84 L85 A223 H226 I301 F304 L476 P477 | A81-R228 VanDerWaalsContact O-CZ 3.25Å; A81-R228 PolarHBondContact O-NH1 2.89Å; R82-R228 PolarHBondContact O-NH1 2.92Å; G84-R228 CarbonylContact C-O 3.5Å; G84-R228 WeakPolarHBondContact CA-O 3.37Å; L85-R228 PolarHBondContact N-O 3.36Å; A223-R228 HydrophobicContact CB-CB 4.26Å; A223-R228 WeakPolarHBondContact O-CB 3.36Å; A223-R228 PolarHBondContact O-N 2.97Å; H226-R228 HydrophobicContact CB-CG 4.19Å; H226-R228 PolarHBondContact O-N 3.28Å; H226-R228 VanDerWaalsContact O-N 3.08Å; R228-I301 HydrophobicContact CB-CD1 3.93Å; R228-F304 HydrophobicContact CG-CD1 3.69Å; R228-F304 HydrophobicContact CG-CD2 4.41Å; R228-F304 HydrophobicContact CG-CE1 3.63Å; R228-F304 HydrophobicContact CG-CE2 4.36Å; R228-F304 HydrophobicContact CG-CG 4.09Å; R228-F304 HydrophobicContact CG-CZ 3.99Å; R228-L476 VanDerWaalsContact NH2-C 3.27Å; R228-L476 VanDerWaalsContact NH2-CB 3.28Å; R228-L476 PolarHBondContact NH2-O 3.42Å; R228-P477 PolarHBondContact NH2-O 3.11Å |
| 229 | I | 89.8 | Confident | 89.2 | Confident | 41 Ų | 41 | 65.2 Ų | 65.2 | 21% | 0.21 | 34% | 0.336 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.8 | 10.6 | 177.1 | -54 | 178.8 | 0 | 0 | 0 | 111.5 | L85 L220 A223 R224 S227 L231 | L85-I229 HydrophobicContact CD1-CG1 4.29Å; L85-I229 HydrophobicContact CD1-CG2 4.37Å; L220-I229 HydrophobicContact CD1-CD1 3.4Å; L220-I229 HydrophobicContact CG-CD1 3.89Å; L220-I229 WeakPolarHBondContact O-CD1 3.41Å; A223-I229 HydrophobicContact CB-CD1 3.85Å; A223-I229 HydrophobicContact CB-CG1 3.9Å; R224-I229 HydrophobicContact CB-CD1 4.11Å; S227-I229 VanDerWaalsContact C-N 3.32Å; S227-I229 PolarHBondContact O-N 3.48Å; I229-L231 PolarHBondContact O-N 2.98Å |
| 230 | N | 86.1 | Confident | 88.8 | Confident | 70 Ų | 70 | 65.6 Ų | 65.6 | 37% | 0.374 | 34% | 0.339 | S | S | . | . | trans | -74.9 | 98.4 | -180 | -174 | 15.9 | 0 | 0 | 0 | 111.8 | K86 S227 M232 | K86-N230 WeakPolarHBondContact CG-O 3.41Å; S227-N230 PolarHBondContact O-N 3.14Å; N230-M232 PolarHBondContact OD1-N 3.37Å; N230-M232 VanDerWaalsContact OD1-N 3.09Å | ||
| 231 | L | 86 | Confident | 88.5 | Confident | 60 Ų | 60 | 62.8 Ų | 62.8 | 31% | 0.314 | 32% | 0.323 | S | S | . | . | trans | -87.5 | -15.1 | 172.9 | -64.3 | 176.7 | 0 | 0 | 0 | 113.1 | L85 W89 I229 D233 | L85-L231 VanDerWaalsContact C-CD2 3.47Å; L85-L231 HydrophobicContact CB-CD2 3.83Å; L85-L231 WeakPolarHBondContact O-CD2 3.29Å; W89-L231 PolarHBondContact NE1-O 2.99Å; I229-L231 PolarHBondContact O-N 2.98Å; L231-D233 VanDerWaalsContact C-N 3.29Å; L231-D233 PolarHBondContact O-N 3.12Å; L231-D233 VanDerWaalsContact O-N 3.13Å | ||
| 232 | M | 84.4 | Confident | 88.4 | Confident | 134 Ų | 134 | 61.3 Ų | 61.3 | 66% | 0.66 | 31% | 0.312 | S | S | * | . | trans | -92.9 | 56.3 | -169.5 | -60 | -63.2 | -77.5 | 0 | 0 | 111.2 | N230 F234 | N230-M232 PolarHBondContact OD1-N 3.37Å; N230-M232 VanDerWaalsContact OD1-N 3.09Å; M232-F234 HydrophobicContact CB-CE2 4.28Å; M232-F234 HydrophobicContact CE-CE2 3.68Å; M232-F234 HydrophobicContact CE-CZ 4.37Å; M232-F234 HydrophobicContact SD-CE2 3.78Å; M232-F234 HydrophobicContact SD-CZ 4.3Å | ||
| 233 | D | 84.3 | Confident | 88.3 | Confident | 34 Ų | 34 | 60.3 Ų | 60.3 | 18% | 0.182 | 31% | 0.307 | C | S | . | . | trans | -110.6 | 96.1 | 174.5 | -168.1 | -13.7 | 0 | 0 | 0 | 110.2 | K86 L231 D235 F244 | K86-D233 HydrophobicContact CD-CB 4.17Å; K86-D233 WeakPolarHBondContact CE-OD2 3.26Å; K86-D233 IonicContact NZ-OD2 3.93Å; K86-D233 PolarHBondContact NZ-OD2 2.67Å; L231-D233 VanDerWaalsContact C-N 3.29Å; L231-D233 PolarHBondContact O-N 3.12Å; L231-D233 VanDerWaalsContact O-N 3.13Å; D233-D235 WeakPolarHBondContact OD1-CB 3.49Å; D233-D235 PolarHBondContact OD1-N 3.48Å; D233-F244 WeakPolarHBondContact O-CB 3.1Å; D233-F244 PolarHBondContact O-N 3.03Å | ||
| 234 | F | 89.4 | Confident | 88.4 | Confident | 90 Ų | 90 | 62.3 Ų | 62.3 | 40% | 0.395 | 32% | 0.315 | S | S | . | . | trans | -104.2 | 20.2 | -177.3 | -66.7 | -84.4 | 0 | 0 | 0 | 112.8 | W89 M232 P236 F244 W245 | W89-F234 HydrophobicContact CZ2-CZ 4.42Å; M232-F234 HydrophobicContact CB-CE2 4.28Å; M232-F234 HydrophobicContact CE-CE2 3.68Å; M232-F234 HydrophobicContact CE-CZ 4.37Å; M232-F234 HydrophobicContact SD-CE2 3.78Å; M232-F234 HydrophobicContact SD-CZ 4.3Å; F234-P236 WeakPolarHBondContact O-CD 3.43Å; F234-F244 HydrophobicContact CD1-CB 3.59Å; F234-F244 AromaticContact CD1-CD1 3.69Å; F234-F244 HydrophobicContact CD1-CD1 3.69Å; F234-F244 HydrophobicContact CD1-CD2 4.18Å; F234-F244 HydrophobicContact CD1-CE1 4.42Å; F234-F244 AromaticContact CD1-CG 3.55Å; F234-F244 HydrophobicContact CD1-CG 3.55Å; F234-F244 HydrophobicContact CE1-CB 3.78Å; F234-F244 AromaticContact CE1-CD1 3.78Å; F234-F244 HydrophobicContact CE1-CD1 3.78Å; F234-F244 AromaticContact CE1-CD2 3.54Å; F234-F244 HydrophobicContact CE1-CD2 3.54Å; F234-F244 HydrophobicContact CE1-CE1 4.23Å; F234-F244 HydrophobicContact CE1-CE2 4.01Å; F234-F244 AromaticContact CE1-CG 3.41Å; F234-F244 HydrophobicContact CE1-CG 3.41Å; F234-F244 VanDerWaalsContact CE1-CG 3.41Å; F234-F244 HydrophobicContact CE1-CZ 4.34Å; F234-F244 HydrophobicContact CG-CB 4.35Å; F234-F244 HydrophobicContact CZ-CD2 4.32Å; F234-F244 HydrophobicContact CZ-CG 4.46Å; F234-W245 PolarHBondContact O-NE1 3.29Å | ||
| 235 | D | 88.3 | Confident | 88.5 | Confident | 78 Ų | 78 | 59.5 Ų | 59.5 | 42% | 0.417 | 31% | 0.305 | S | S | . | . | trans | -59.8 | 119.6 | 175.9 | -171.3 | -11 | 0 | 0 | 0 | 110.3 | D233 D237 T243 | D233-D235 WeakPolarHBondContact OD1-CB 3.49Å; D233-D235 PolarHBondContact OD1-N 3.48Å; D235-D237 PolarHBondContact O-N 3.11Å; D235-D237 WeakPolarHBondContact OD1-CB 3.12Å; D235-D237 PolarHBondContact OD1-N 3.32Å; D235-T243 HydrophobicContact CB-CG2 4.2Å; D235-T243 WeakPolarHBondContact O-CB 3.19Å; D235-T243 WeakPolarHBondContact O-CG2 3.43Å; D235-T243 PolarHBondContact O-OG1 3.42Å | ||
| 236 | P | 87.1 | Confident | 88.5 | Confident | 96 Ų | 96 | 53.7 Ų | 53.7 | 62% | 0.623 | 27% | 0.274 | S | S | * | . | trans | -75.4 | -2.3 | 179.7 | 32.9 | -37 | 0 | 0 | 0 | 113.7 | F234 P238 | F234-P236 WeakPolarHBondContact O-CD 3.43Å; P236-P238 VanDerWaalsContact O-CD 3.26Å; P236-P238 WeakPolarHBondContact O-CD 3.17Å; P236-P238 VanDerWaalsContact O-N 3.15Å | ||
| 237 | D | 87.9 | Confident | 88.7 | Confident | 41 Ų | 41 | 49.8 Ų | 49.8 | 22% | 0.219 | 26% | 0.256 | C | S | . | . | trans | -59.9 | 114.2 | 178.2 | -169.9 | -15 | 0 | 0 | 0 | 111.5 | D235 R239 S240 | D235-D237 PolarHBondContact O-N 3.11Å; D235-D237 WeakPolarHBondContact OD1-CB 3.12Å; D235-D237 PolarHBondContact OD1-N 3.32Å; D237-R239 PolarHBondContact O-N 3.4Å; D237-R239 VanDerWaalsContact O-N 3.16Å; D237-R239 VanDerWaalsContact OD1-CB 3.26Å; D237-R239 WeakPolarHBondContact OD1-CB 3.21Å; D237-R239 VanDerWaalsContact OD1-CG 3.3Å; D237-R239 WeakPolarHBondContact OD1-CG 3.48Å; D237-R239 IonicContact OD1-CZ 3.77Å; D237-R239 PolarHBondContact OD1-N 2.92Å; D237-R239 IonicContact OD1-NE 2.74Å; D237-R239 PolarHBondContact OD1-NE 3.44Å; D237-R239 IonicContact OD1-NH2 3.53Å; D237-R239 IonicContact OD2-CZ 3.97Å; D237-R239 VanDerWaalsContact OD2-CZ 3.29Å; D237-R239 IonicContact OD2-NE 3.03Å; D237-R239 PolarHBondContact OD2-NE 2.84Å; D237-R239 IonicContact OD2-NH2 3.6Å; D237-R239 PolarHBondContact OD2-NH2 3.1Å; D237-S240 PolarHBondContact O-N 3.35Å | ||
| 238 | P | 86.4 | Confident | 88.9 | Confident | 57 Ų | 57 | 47.8 Ų | 47.8 | 37% | 0.37 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -9.6 | -178 | 30.9 | -37.2 | 0 | 0 | 0 | 113.6 | P236 S522 Y525 | P236-P238 VanDerWaalsContact O-CD 3.26Å; P236-P238 WeakPolarHBondContact O-CD 3.17Å; P236-P238 VanDerWaalsContact O-N 3.15Å; P238-S522 PolarHBondContact O-N 2.66Å; P238-Y525 HydrophobicContact CB-CD2 4.18Å; P238-Y525 HydrophobicContact CB-CE2 3.95Å |
| 239 | R | 87.4 | Confident | 89.1 | Confident | 90 Ų | 90 | 50.8 Ų | 50.8 | 34% | 0.34 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | -25.2 | 176.1 | -57 | 175.8 | -63.4 | 167.7 | 2.5 | 112.3 | D237 R241 I472 D516 A520 | D237-R239 PolarHBondContact O-N 3.4Å; D237-R239 VanDerWaalsContact O-N 3.16Å; D237-R239 VanDerWaalsContact OD1-CB 3.26Å; D237-R239 WeakPolarHBondContact OD1-CB 3.21Å; D237-R239 VanDerWaalsContact OD1-CG 3.3Å; D237-R239 WeakPolarHBondContact OD1-CG 3.48Å; D237-R239 IonicContact OD1-CZ 3.77Å; D237-R239 PolarHBondContact OD1-N 2.92Å; D237-R239 IonicContact OD1-NE 2.74Å; D237-R239 PolarHBondContact OD1-NE 3.44Å; D237-R239 IonicContact OD1-NH2 3.53Å; D237-R239 IonicContact OD2-CZ 3.97Å; D237-R239 VanDerWaalsContact OD2-CZ 3.29Å; D237-R239 IonicContact OD2-NE 3.03Å; D237-R239 PolarHBondContact OD2-NE 2.84Å; D237-R239 IonicContact OD2-NH2 3.6Å; D237-R239 PolarHBondContact OD2-NH2 3.1Å; R239-R241 PolarHBondContact O-N 2.88Å; R239-I472 HydrophobicContact CB-CG2 4.03Å; R239-D516 PolarHBondContact NH1-O 3.29Å; R239-A520 WeakPolarHBondContact CA-O 3.42Å; R239-A520 HydrophobicContact CB-CB 4.2Å; R239-A520 HydrophobicContact CG-CB 4.1Å |
| 240 | S | 85.6 | Confident | 89.2 | Confident | 18 Ų | 18 | 48.8 Ų | 48.8 | 13% | 0.126 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -65.9 | 125.8 | 175.7 | -178.4 | 0 | 0 | 0 | 0 | 109.7 | D237 Y242 T243 T246 | D237-S240 PolarHBondContact O-N 3.35Å; S240-Y242 VanDerWaalsContact C-N 3.3Å; S240-Y242 PolarHBondContact O-N 3.44Å; S240-T243 VanDerWaalsContact OG-CG2 3.3Å; S240-T243 WeakPolarHBondContact OG-CG2 3.42Å; S240-T246 PolarHBondContact O-OG1 2.7Å |
| 241 | R | 87.4 | Confident | 89.5 | Confident | 14 Ų | 14 | 45.5 Ų | 45.5 | 5% | 0.053 | 23% | 0.231 | C | C | . | . | S | Bend | trans | -57.4 | -46 | -174.8 | -171.2 | -176.3 | 179.8 | 87.7 | -7.4 | 110.8 | E79 Y83 R239 T246 Q414 M473 S522 Y523 | E79-R241 IonicContact OE1-CZ 3.08Å; E79-R241 IonicContact OE1-NE 2.64Å; E79-R241 IonicContact OE1-NH2 3.86Å; E79-R241 PolarHBondContact OE1-NH2 2.98Å; E79-R241 IonicContact OE2-NE 3.64Å; E79-R241 IonicContact OE2-NH2 3.32Å; Y83-R241 VanDerWaalsContact CZ-CD 3.47Å; Y83-R241 WeakPolarHBondContact OH-CD 3.49Å; R239-R241 PolarHBondContact O-N 2.88Å; R241-T246 VanDerWaalsContact O-CG2 3.3Å; R241-T246 WeakPolarHBondContact O-CG2 3.32Å; R241-Q414 VanDerWaalsContact CZ-OE1 3.29Å; R241-M473 HydrophobicContact CB-CB 4.4Å; R241-M473 VanDerWaalsContact CB-O 3.3Å; R241-M473 WeakPolarHBondContact CB-O 3.46Å; R241-S522 PolarHBondContact O-OG 2.97Å; R241-Y523 HydrophobicContact CG-CE1 4.13Å; R241-Y523 VanDerWaalsContact CZ-CE1 3.43Å |
| 242 | Y | 90.6 | Very high | 89.9 | Confident | 6 Ų | 6 | 43 Ų | 43 | 2% | 0.024 | 22% | 0.218 | C | C | . | . | S | Bend | trans | -134.4 | 106.7 | -175.1 | -66.3 | -27.7 | 0 | 0 | 0 | 113.2 | E79 Y83 S240 F247 Y523 L524 | E79-Y242 HydrophobicContact CB-CE2 4.27Å; E79-Y242 PolarHBondContact OE1-OH 3.35Å; E79-Y242 WeakPolarHBondContact OE2-CE2 3.45Å; E79-Y242 VanDerWaalsContact OE2-CZ 3.23Å; E79-Y242 PolarHBondContact OE2-OH 3.42Å; Y83-Y242 HydrophobicContact CD1-CD2 4.12Å; Y83-Y242 HydrophobicContact CD1-CE2 4.4Å; Y83-Y242 AromaticContact CD2-CD2 3.99Å; Y83-Y242 HydrophobicContact CD2-CD2 3.99Å; Y83-Y242 AromaticContact CD2-CE2 3.53Å; Y83-Y242 HydrophobicContact CD2-CE2 3.53Å; Y83-Y242 HydrophobicContact CE2-CE2 4.13Å; Y83-Y242 AromaticContact CG-CD2 3.62Å; Y83-Y242 HydrophobicContact CG-CD2 3.62Å; Y83-Y242 AromaticContact CG-CE2 3.69Å; Y83-Y242 HydrophobicContact CG-CE2 3.69Å; S240-Y242 VanDerWaalsContact C-N 3.3Å; S240-Y242 PolarHBondContact O-N 3.44Å; Y242-F247 AromaticContact CD1-CE1 3.88Å; Y242-F247 HydrophobicContact CD1-CE1 3.88Å; Y242-F247 AromaticContact CD1-CE2 3.5Å; Y242-F247 HydrophobicContact CD1-CE2 3.5Å; Y242-F247 VanDerWaalsContact CD1-CE2 3.5Å; Y242-F247 AromaticContact CD1-CZ 3.06Å; Y242-F247 HydrophobicContact CD1-CZ 3.06Å; Y242-F247 HydrophobicContact CD2-CZ 4.25Å; Y242-F247 AromaticContact CE1-CE1 3.97Å; Y242-F247 HydrophobicContact CE1-CE1 3.97Å; Y242-F247 HydrophobicContact CE1-CE2 4.33Å; Y242-F247 AromaticContact CE1-CZ 3.45Å; Y242-F247 HydrophobicContact CE1-CZ 3.45Å; Y242-F247 VanDerWaalsContact CE1-CZ 3.45Å; Y242-F247 AromaticContact CG-CE2 3.66Å; Y242-F247 HydrophobicContact CG-CE2 3.66Å; Y242-F247 AromaticContact CG-CZ 3.57Å; Y242-F247 HydrophobicContact CG-CZ 3.57Å; Y242-Y523 HydrophobicContact CE1-CE1 4.28Å; Y242-Y523 WeakPolarHBondContact CE1-OH 3.49Å; Y242-Y523 PolarHBondContact OH-OH 3Å; Y242-L524 HydrophobicContact CE1-CD1 4.36Å |
| 243 | T | 91.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 20% | 0.196 | C | C | . | . | trans | -135 | 170.6 | 168.1 | 68.8 | 0 | 0 | 0 | 0 | 108.7 | D235 S240 W245 T246 F247 | D235-T243 HydrophobicContact CB-CG2 4.2Å; D235-T243 WeakPolarHBondContact O-CB 3.19Å; D235-T243 WeakPolarHBondContact O-CG2 3.43Å; D235-T243 PolarHBondContact O-OG1 3.42Å; S240-T243 VanDerWaalsContact OG-CG2 3.3Å; S240-T243 WeakPolarHBondContact OG-CG2 3.42Å; T243-W245 PolarHBondContact O-N 3.29Å; T243-W245 PolarHBondContact OG1-N 3.29Å; T243-T246 PolarHBondContact O-N 3.46Å; T243-T246 PolarHBondContact OG1-N 2.87Å; T243-T246 PolarHBondContact OG1-OG1 3.35Å; T243-T246 VanDerWaalsContact OG1-OG1 3.1Å; T243-F247 WeakPolarHBondContact O-CD2 3.22Å; T243-F247 PolarHBondContact O-N 3.43Å | ||
| 244 | F | 93.1 | Very high | 90.7 | Very high | 41 Ų | 41 | 36.8 Ų | 36.8 | 18% | 0.18 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -50.1 | -46.4 | 170.9 | 173.1 | -95.3 | 0 | 0 | 0 | 111.7 | W89 D233 F234 F247 V248 | W89-F244 AromaticContact CD2-CD2 3.66Å; W89-F244 HydrophobicContact CD2-CD2 3.66Å; W89-F244 HydrophobicContact CD2-CE2 4.23Å; W89-F244 AromaticContact CE2-CD2 3.72Å; W89-F244 AromaticContact CE3-CD2 3.69Å; W89-F244 HydrophobicContact CE3-CD2 3.69Å; W89-F244 AromaticContact CE3-CE2 3.76Å; W89-F244 HydrophobicContact CE3-CE2 3.76Å; W89-F244 HydrophobicContact CG-CD2 4.32Å; W89-F244 AromaticContact CH2-CD2 3.87Å; W89-F244 HydrophobicContact CH2-CD2 3.87Å; W89-F244 AromaticContact CH2-CE2 3.82Å; W89-F244 HydrophobicContact CH2-CE2 3.82Å; W89-F244 AromaticContact CZ2-CD2 3.83Å; W89-F244 HydrophobicContact CZ2-CD2 3.83Å; W89-F244 HydrophobicContact CZ2-CE2 4.27Å; W89-F244 AromaticContact CZ3-CD2 3.81Å; W89-F244 HydrophobicContact CZ3-CD2 3.81Å; W89-F244 AromaticContact CZ3-CE2 3.55Å; W89-F244 HydrophobicContact CZ3-CE2 3.55Å; D233-F244 WeakPolarHBondContact O-CB 3.1Å; D233-F244 PolarHBondContact O-N 3.03Å; F234-F244 HydrophobicContact CD1-CB 3.59Å; F234-F244 AromaticContact CD1-CD1 3.69Å; F234-F244 HydrophobicContact CD1-CD1 3.69Å; F234-F244 HydrophobicContact CD1-CD2 4.18Å; F234-F244 HydrophobicContact CD1-CE1 4.42Å; F234-F244 AromaticContact CD1-CG 3.55Å; F234-F244 HydrophobicContact CD1-CG 3.55Å; F234-F244 HydrophobicContact CE1-CB 3.78Å; F234-F244 AromaticContact CE1-CD1 3.78Å; F234-F244 HydrophobicContact CE1-CD1 3.78Å; F234-F244 AromaticContact CE1-CD2 3.54Å; F234-F244 HydrophobicContact CE1-CD2 3.54Å; F234-F244 HydrophobicContact CE1-CE1 4.23Å; F234-F244 HydrophobicContact CE1-CE2 4.01Å; F234-F244 AromaticContact CE1-CG 3.41Å; F234-F244 HydrophobicContact CE1-CG 3.41Å; F234-F244 VanDerWaalsContact CE1-CG 3.41Å; F234-F244 HydrophobicContact CE1-CZ 4.34Å; F234-F244 HydrophobicContact CG-CB 4.35Å; F234-F244 HydrophobicContact CZ-CD2 4.32Å; F234-F244 HydrophobicContact CZ-CG 4.46Å; F244-F247 PolarHBondContact O-N 3.38Å; F244-V248 HydrophobicContact CD1-CG2 4.48Å; F244-V248 HydrophobicContact CD2-CG2 3.95Å; F244-V248 HydrophobicContact CE1-CB 4.37Å; F244-V248 HydrophobicContact CE1-CG2 4.22Å; F244-V248 HydrophobicContact CE2-CG2 3.66Å; F244-V248 HydrophobicContact CG-CG2 4.36Å; F244-V248 HydrophobicContact CZ-CB 4.34Å; F244-V248 HydrophobicContact CZ-CG1 4.4Å; F244-V248 HydrophobicContact CZ-CG2 3.8Å; F244-V248 WeakPolarHBondContact O-CB 3.49Å; F244-V248 VanDerWaalsContact O-CG2 3.31Å; F244-V248 WeakPolarHBondContact O-CG2 3.29Å; F244-V248 PolarHBondContact O-N 3.25Å |
| 245 | W | 93.1 | Very high | 90.8 | Very high | 106 Ų | 106 | 32.6 Ų | 32.6 | 40% | 0.402 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -66.3 | -42.5 | -177.4 | -60.3 | 106.4 | 0 | 0 | 0 | 112.4 | F234 T243 F247 V248 V249 Y525 | F234-W245 PolarHBondContact O-NE1 3.29Å; T243-W245 PolarHBondContact O-N 3.29Å; T243-W245 PolarHBondContact OG1-N 3.29Å; W245-F247 VanDerWaalsContact C-N 3.29Å; W245-F247 PolarHBondContact O-N 3.31Å; W245-V248 PolarHBondContact O-N 2.68Å; W245-V249 HydrophobicContact CE3-CG2 4.06Å; W245-V249 WeakPolarHBondContact O-CA 3.45Å; W245-V249 VanDerWaalsContact O-CB 3.29Å; W245-V249 WeakPolarHBondContact O-CB 3.39Å; W245-V249 PolarHBondContact O-N 2.87Å; W245-Y525 PolarHBondContact O-OH 2.74Å |
| 246 | T | 92.5 | Very high | 91.1 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.152 | C | C | . | . | I | π-helix | trans | -62.1 | -38.7 | -178.8 | -52.2 | 0 | 0 | 0 | 0 | 111.9 | S240 R241 T243 G250 G251 S522 L524 Y525 | S240-T246 PolarHBondContact O-OG1 2.7Å; R241-T246 VanDerWaalsContact O-CG2 3.3Å; R241-T246 WeakPolarHBondContact O-CG2 3.32Å; T243-T246 PolarHBondContact O-N 3.46Å; T243-T246 PolarHBondContact OG1-N 2.87Å; T243-T246 PolarHBondContact OG1-OG1 3.35Å; T243-T246 VanDerWaalsContact OG1-OG1 3.1Å; T246-G250 VanDerWaalsContact O-CA 3.27Å; T246-G250 WeakPolarHBondContact O-CA 3.37Å; T246-G250 PolarHBondContact O-N 3.08Å; T246-G251 PolarHBondContact O-N 3.08Å; T246-S522 VanDerWaalsContact CG2-OG 3.29Å; T246-S522 WeakPolarHBondContact CG2-OG 3.48Å; T246-L524 HydrophobicContact CG2-CB 3.87Å; T246-L524 HydrophobicContact CG2-CD1 3.96Å; T246-L524 HydrophobicContact CG2-CG 4.44Å; T246-Y525 WeakPolarHBondContact CA-OH 3.3Å; T246-Y525 HydrophobicContact CG2-CD2 4.06Å; T246-Y525 HydrophobicContact CG2-CE2 3.71Å; T246-Y525 PolarHBondContact N-OH 3.34Å; T246-Y525 WeakPolarHBondContact OG1-CE2 3.33Å |
| 247 | F | 93.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 12% | 0.123 | C | C | . | . | I | π-helix | trans | -78.2 | -44.9 | 175.3 | -74.5 | -62.3 | 0 | 0 | 0 | 113.7 | K86 F87 W89 M90 Y242 T243 F244 W245 G251 T252 L524 | K86-F247 HydrophobicContact CB-CE2 4.41Å; K86-F247 WeakPolarHBondContact O-CD2 3Å; K86-F247 VanDerWaalsContact O-CE2 3.23Å; K86-F247 WeakPolarHBondContact O-CE2 3.31Å; F87-F247 VanDerWaalsContact CA-CZ 3.46Å; F87-F247 HydrophobicContact CB-CZ 4.13Å; F87-F247 AromaticContact CD2-CE1 3.83Å; F87-F247 HydrophobicContact CD2-CE1 3.83Å; F87-F247 AromaticContact CD2-CZ 3.72Å; F87-F247 HydrophobicContact CD2-CZ 3.72Å; F87-F247 HydrophobicContact CE2-CE1 4.11Å; F87-F247 HydrophobicContact CE2-CZ 4.42Å; F87-F247 HydrophobicContact CG-CE1 4.3Å; F87-F247 HydrophobicContact CG-CZ 4.12Å; W89-F247 HydrophobicContact CB-CB 3.62Å; W89-F247 HydrophobicContact CB-CD2 3.82Å; W89-F247 HydrophobicContact CB-CG 3.97Å; M90-F247 HydrophobicContact CB-CD1 3.78Å; M90-F247 HydrophobicContact CB-CE1 4.12Å; M90-F247 HydrophobicContact CE-CD1 3.61Å; M90-F247 HydrophobicContact CE-CE1 3.71Å; M90-F247 HydrophobicContact CG-CD1 4.45Å; M90-F247 HydrophobicContact SD-CD1 3.99Å; Y242-F247 AromaticContact CD1-CE1 3.88Å; Y242-F247 HydrophobicContact CD1-CE1 3.88Å; Y242-F247 AromaticContact CD1-CE2 3.5Å; Y242-F247 HydrophobicContact CD1-CE2 3.5Å; Y242-F247 VanDerWaalsContact CD1-CE2 3.5Å; Y242-F247 AromaticContact CD1-CZ 3.06Å; Y242-F247 HydrophobicContact CD1-CZ 3.06Å; Y242-F247 HydrophobicContact CD2-CZ 4.25Å; Y242-F247 AromaticContact CE1-CE1 3.97Å; Y242-F247 HydrophobicContact CE1-CE1 3.97Å; Y242-F247 HydrophobicContact CE1-CE2 4.33Å; Y242-F247 AromaticContact CE1-CZ 3.45Å; Y242-F247 HydrophobicContact CE1-CZ 3.45Å; Y242-F247 VanDerWaalsContact CE1-CZ 3.45Å; Y242-F247 AromaticContact CG-CE2 3.66Å; Y242-F247 HydrophobicContact CG-CE2 3.66Å; Y242-F247 AromaticContact CG-CZ 3.57Å; Y242-F247 HydrophobicContact CG-CZ 3.57Å; T243-F247 WeakPolarHBondContact O-CD2 3.22Å; T243-F247 PolarHBondContact O-N 3.43Å; F244-F247 PolarHBondContact O-N 3.38Å; W245-F247 VanDerWaalsContact C-N 3.29Å; W245-F247 PolarHBondContact O-N 3.31Å; F247-G251 WeakPolarHBondContact O-CA 3.28Å; F247-G251 PolarHBondContact O-N 3.31Å; F247-G251 VanDerWaalsContact O-N 3.11Å; F247-T252 PolarHBondContact O-N 3.48Å; F247-L524 HydrophobicContact CD1-CD1 3.69Å; F247-L524 HydrophobicContact CE1-CD1 3.65Å; F247-L524 HydrophobicContact CZ-CD1 4.46Å |
| 248 | V | 93.4 | Very high | 91.5 | Very high | 27 Ų | 27 | 23.1 Ų | 23.1 | 16% | 0.164 | 11% | 0.113 | C | C | . | . | I | π-helix | trans | -74.7 | -39.3 | -175.1 | 174.8 | 0 | 0 | 0 | 0 | 111.5 | A92 F244 W245 T252 | A92-V248 HydrophobicContact CB-CG2 4.38Å; F244-V248 HydrophobicContact CD1-CG2 4.48Å; F244-V248 HydrophobicContact CD2-CG2 3.95Å; F244-V248 HydrophobicContact CE1-CB 4.37Å; F244-V248 HydrophobicContact CE1-CG2 4.22Å; F244-V248 HydrophobicContact CE2-CG2 3.66Å; F244-V248 HydrophobicContact CG-CG2 4.36Å; F244-V248 HydrophobicContact CZ-CB 4.34Å; F244-V248 HydrophobicContact CZ-CG1 4.4Å; F244-V248 HydrophobicContact CZ-CG2 3.8Å; F244-V248 WeakPolarHBondContact O-CB 3.49Å; F244-V248 VanDerWaalsContact O-CG2 3.31Å; F244-V248 WeakPolarHBondContact O-CG2 3.29Å; F244-V248 PolarHBondContact O-N 3.25Å; W245-V248 PolarHBondContact O-N 2.68Å; V248-T252 WeakPolarHBondContact O-CB 3.35Å; V248-T252 PolarHBondContact O-OG1 2.94Å |
| 249 | V | 92.3 | Very high | 91.8 | Very high | 63 Ų | 63 | 20.4 Ų | 20.4 | 38% | 0.382 | 10% | 0.096 | S | C | . | . | I | π-helix | trans | -89.5 | -58.6 | 179.7 | -178.1 | 0 | 0 | 0 | 0 | 110.6 | W245 T252 L253 Y525 | W245-V249 HydrophobicContact CE3-CG2 4.06Å; W245-V249 WeakPolarHBondContact O-CA 3.45Å; W245-V249 VanDerWaalsContact O-CB 3.29Å; W245-V249 WeakPolarHBondContact O-CB 3.39Å; W245-V249 PolarHBondContact O-N 2.87Å; V249-T252 PolarHBondContact O-N 3.05Å; V249-L253 PolarHBondContact O-N 3.43Å; V249-Y525 HydrophobicContact CB-CE1 4.12Å; V249-Y525 HydrophobicContact CG1-CE1 4.13Å |
| 250 | G | 91.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.079 | C | C | . | . | I | π-helix | trans | -63.2 | -52 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | T246 T252 L253 V254 L524 | T246-G250 VanDerWaalsContact O-CA 3.27Å; T246-G250 WeakPolarHBondContact O-CA 3.37Å; T246-G250 PolarHBondContact O-N 3.08Å; G250-T252 PolarHBondContact O-N 3.29Å; G250-L253 PolarHBondContact O-N 2.95Å; G250-V254 WeakPolarHBondContact O-CG2 3.17Å; G250-V254 PolarHBondContact O-N 2.8Å; G250-L524 CarbonylContact C-O 3.59Å; G250-L524 VanDerWaalsContact CA-O 3.29Å; G250-L524 WeakPolarHBondContact CA-O 3.27Å |
| 251 | G | 92.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 7% | 0.074 | C | C | . | . | I | π-helix | trans | -57.9 | -43.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | T246 F247 L253 V254 W255 | T246-G251 PolarHBondContact O-N 3.08Å; F247-G251 WeakPolarHBondContact O-CA 3.28Å; F247-G251 PolarHBondContact O-N 3.31Å; F247-G251 VanDerWaalsContact O-N 3.11Å; G251-L253 VanDerWaalsContact C-N 3.34Å; G251-L253 PolarHBondContact O-N 3.45Å; G251-V254 PolarHBondContact O-N 3.29Å; G251-W255 WeakPolarHBondContact O-CB 3.21Å; G251-W255 PolarHBondContact O-N 3.08Å |
| 252 | T | 94.7 | Very high | 92.6 | Very high | 7 Ų | 7 | 15.3 Ų | 15.3 | 4% | 0.043 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -56.7 | -45.9 | 176.6 | -67.2 | 0 | 0 | 0 | 0 | 111.9 | G93 L96 N97 L100 F247 V248 V249 G250 W255 L256 | G93-T252 VanDerWaalsContact CA-OG1 3.28Å; G93-T252 WeakPolarHBondContact CA-OG1 3.44Å; G93-T252 PolarHBondContact O-OG1 3.33Å; L96-T252 HydrophobicContact CB-CG2 4.18Å; L96-T252 HydrophobicContact CD2-CG2 3.93Å; L96-T252 HydrophobicContact CG-CG2 3.89Å; N97-T252 HydrophobicContact CB-CG2 4.39Å; L100-T252 HydrophobicContact CD1-CG2 4Å; F247-T252 PolarHBondContact O-N 3.48Å; V248-T252 WeakPolarHBondContact O-CB 3.35Å; V248-T252 PolarHBondContact O-OG1 2.94Å; V249-T252 PolarHBondContact O-N 3.05Å; G250-T252 PolarHBondContact O-N 3.29Å; T252-W255 PolarHBondContact O-N 2.8Å; T252-L256 WeakPolarHBondContact O-CB 3.31Å; T252-L256 PolarHBondContact O-N 3.4Å |
| 253 | L | 93.3 | Very high | 92.7 | Very high | 39 Ų | 39 | 15.1 Ų | 15.1 | 20% | 0.204 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -71.4 | -38.2 | -178 | -71.5 | -179.6 | 0 | 0 | 0 | 112.9 | V249 G250 G251 L256 S257 L428 A528 | V249-L253 PolarHBondContact O-N 3.43Å; G250-L253 PolarHBondContact O-N 2.95Å; G251-L253 VanDerWaalsContact C-N 3.34Å; G251-L253 PolarHBondContact O-N 3.45Å; L253-L256 HydrophobicContact CD2-CD2 4.26Å; L253-L256 PolarHBondContact O-N 3.35Å; L253-S257 PolarHBondContact O-N 2.88Å; L253-L428 HydrophobicContact CD2-CD2 4.31Å; L253-A528 HydrophobicContact CB-CB 4.4Å; L253-A528 HydrophobicContact CD1-CB 3.51Å |
| 254 | V | 91.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -58.8 | -50.3 | 172.3 | 171.4 | 0 | 0 | 0 | 0 | 110 | G250 G251 L256 S257 M258 F417 L524 | G250-V254 WeakPolarHBondContact O-CG2 3.17Å; G250-V254 PolarHBondContact O-N 2.8Å; G251-V254 PolarHBondContact O-N 3.29Å; V254-L256 PolarHBondContact O-N 3.4Å; V254-S257 PolarHBondContact O-N 3.41Å; V254-S257 PolarHBondContact O-OG 3.29Å; V254-M258 WeakPolarHBondContact O-CG 2.99Å; V254-M258 PolarHBondContact O-N 3.12Å; V254-F417 HydrophobicContact CG1-CD1 3.95Å; V254-F417 HydrophobicContact CG1-CE1 4.49Å; V254-L524 WeakPolarHBondContact CG2-O 3.44Å |
| 255 | W | 92.9 | Very high | 92.4 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.008 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -69 | -32.4 | 179.3 | -73.1 | 112.6 | 0 | 0 | 0 | 113.2 | F67 M90 Q94 N97 G251 T252 S257 M258 Y259 F417 | F67-W255 HydrophobicContact CB-CH2 4.1Å; F67-W255 HydrophobicContact CB-CZ3 3.82Å; F67-W255 HydrophobicContact CD1-CZ3 4.35Å; F67-W255 HydrophobicContact CD2-CZ3 4.12Å; F67-W255 AromaticContact CG-CZ3 3.88Å; F67-W255 HydrophobicContact CG-CZ3 3.88Å; M90-W255 PolarHBondContact SD-NE1 3.13Å; Q94-W255 HydrophobicContact CG-CD2 3.86Å; Q94-W255 HydrophobicContact CG-CG 3.78Å; Q94-W255 HydrophobicContact CG-CZ2 4.33Å; Q94-W255 VanDerWaalsContact NE2-CE2 3.27Å; N97-W255 HydrophobicContact CB-CB 3.81Å; N97-W255 VanDerWaalsContact CG-C 3.49Å; N97-W255 VanDerWaalsContact OD1-C 3.26Å; N97-W255 PolarHBondContact OD1-O 3.03Å; N97-W255 VanDerWaalsContact OD1-O 3.08Å; G251-W255 WeakPolarHBondContact O-CB 3.21Å; G251-W255 PolarHBondContact O-N 3.08Å; T252-W255 PolarHBondContact O-N 2.8Å; W255-S257 VanDerWaalsContact C-N 3.31Å; W255-S257 PolarHBondContact O-N 2.79Å; W255-M258 HydrophobicContact CE3-CB 4.29Å; W255-M258 CarbonylContact O-C 3.29Å; W255-M258 WeakPolarHBondContact O-CA 3.45Å; W255-M258 WeakPolarHBondContact O-CB 3.22Å; W255-M258 PolarHBondContact O-N 2.79Å; W255-Y259 HydrophobicContact CE3-CD2 4.05Å; W255-Y259 AromaticContact CE3-CE2 3.55Å; W255-Y259 HydrophobicContact CE3-CE2 3.55Å; W255-Y259 AromaticContact CZ3-CE2 3.86Å; W255-Y259 HydrophobicContact CZ3-CE2 3.86Å; W255-Y259 PolarHBondContact O-N 3.01Å; W255-F417 HydrophobicContact CH2-CE1 4.35Å; W255-F417 AromaticContact CZ2-CE1 3.7Å; W255-F417 HydrophobicContact CZ2-CE1 3.7Å; W255-F417 AromaticContact CZ2-CZ 3.81Å; W255-F417 HydrophobicContact CZ2-CZ 3.81Å |
| 256 | L | 94.9 | Very high | 92.4 | Very high | 12 Ų | 12 | 8.6 Ų | 8.6 | 6% | 0.063 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -64.6 | -36.7 | 174.8 | -171.2 | 61.1 | 0 | 0 | 0 | 111.8 | N97 L100 T101 F105 T252 L253 V254 M258 G260 L428 | N97-L256 HydrophobicContact CB-CB 4.45Å; N97-L256 WeakPolarHBondContact OD1-CA 3.38Å; N97-L256 PolarHBondContact OD1-N 3.07Å; L100-L256 HydrophobicContact CB-CD1 3.83Å; L100-L256 HydrophobicContact CB-CD2 4.46Å; L100-L256 HydrophobicContact CD1-CD2 4.12Å; T101-L256 WeakPolarHBondContact OG1-CD1 3.36Å; F105-L256 HydrophobicContact CD2-CD1 4.08Å; F105-L256 HydrophobicContact CE2-CD1 3.84Å; F105-L256 HydrophobicContact CE2-CD2 4.17Å; F105-L256 HydrophobicContact CE2-CG 4.12Å; T252-L256 WeakPolarHBondContact O-CB 3.31Å; T252-L256 PolarHBondContact O-N 3.4Å; L253-L256 HydrophobicContact CD2-CD2 4.26Å; L253-L256 PolarHBondContact O-N 3.35Å; V254-L256 PolarHBondContact O-N 3.4Å; L256-M258 PolarHBondContact O-N 3.21Å; L256-G260 WeakPolarHBondContact O-CA 3.38Å; L256-G260 PolarHBondContact O-N 2.65Å; L256-L428 HydrophobicContact CB-CD2 4.11Å; L256-L428 HydrophobicContact CD2-CD1 4.36Å; L256-L428 HydrophobicContact CD2-CD2 4.22Å; L256-L428 HydrophobicContact CG-CD1 4Å; L256-L428 HydrophobicContact CG-CD2 4.14Å |
| 257 | S | 92.9 | Very high | 92.1 | Very high | 1 Ų | 1 | 8.9 Ų | 8.9 | 1% | 0.007 | 5% | 0.051 | C | C | . | . | I | π-helix | trans | -63.3 | -29.4 | 171.5 | 78.5 | 0 | 0 | 0 | 0 | 112 | L253 V254 W255 V261 N262 S424 | L253-S257 PolarHBondContact O-N 2.88Å; V254-S257 PolarHBondContact O-N 3.41Å; V254-S257 PolarHBondContact O-OG 3.29Å; W255-S257 VanDerWaalsContact C-N 3.31Å; W255-S257 PolarHBondContact O-N 2.79Å; S257-V261 WeakPolarHBondContact O-CG2 3.21Å; S257-N262 PolarHBondContact O-N 3.26Å; S257-S424 WeakPolarHBondContact OG-CB 3.29Å |
| 258 | M | 90.4 | Very high | 91.9 | Very high | 3 Ų | 3 | 9.1 Ų | 9.1 | 2% | 0.015 | 5% | 0.052 | C | C | . | . | I | π-helix | trans | -86 | -33.7 | -176.4 | -71.4 | -58.8 | 108.7 | 0 | 0 | 115.2 | F67 V254 W255 L256 N262 Q265 M420 S424 | F67-M258 HydrophobicContact CE1-CB 4.33Å; F67-M258 HydrophobicContact CE1-CG 4.2Å; F67-M258 HydrophobicContact CE1-SD 3.73Å; F67-M258 HydrophobicContact CE2-CB 3.78Å; F67-M258 HydrophobicContact CE2-CG 4.5Å; F67-M258 HydrophobicContact CZ-CB 3.59Å; F67-M258 HydrophobicContact CZ-CG 3.89Å; F67-M258 HydrophobicContact CZ-SD 3.56Å; F67-M258 VanDerWaalsContact CZ-SD 3.56Å; V254-M258 WeakPolarHBondContact O-CG 2.99Å; V254-M258 PolarHBondContact O-N 3.12Å; W255-M258 HydrophobicContact CE3-CB 4.29Å; W255-M258 CarbonylContact O-C 3.29Å; W255-M258 WeakPolarHBondContact O-CA 3.45Å; W255-M258 WeakPolarHBondContact O-CB 3.22Å; W255-M258 PolarHBondContact O-N 2.79Å; L256-M258 PolarHBondContact O-N 3.21Å; M258-N262 WeakPolarHBondContact O-CB 3.39Å; M258-N262 PolarHBondContact SD-ND2 3.37Å; M258-Q265 WeakPolarHBondContact O-CG 3.41Å; M258-M420 HydrophobicContact CB-CE 4.49Å; M258-M420 HydrophobicContact CE-CB 4.29Å; M258-M420 HydrophobicContact CE-CE 4.29Å; M258-M420 HydrophobicContact CG-CE 3.26Å; M258-M420 HydrophobicContact SD-CE 3.12Å; M258-M420 WeakPolarHBondContact SD-CE 3.16Å; M258-M420 HydrophobicContact SD-CG 4.35Å; M258-S424 WeakPolarHBondContact CE-OG 3.27Å |
| 259 | Y | 92.5 | Very high | 91.8 | Very high | 0 Ų | 0 | 7.9 Ų | 7.9 | 0% | 0 | 4% | 0.044 | C | C | . | . | I | π-helix | trans | -101.5 | -30.7 | 177.8 | -75.9 | -85.6 | 0 | 0 | 0 | 112.4 | L63 F67 N97 T101 W255 Q265 Y269 L282 N285 | L63-Y259 HydrophobicContact CB-CE1 4.35Å; F67-Y259 HydrophobicContact CD2-CE1 4.31Å; F67-Y259 AromaticContact CD2-CE2 3.88Å; F67-Y259 HydrophobicContact CD2-CE2 3.88Å; F67-Y259 AromaticContact CD2-CZ 3.66Å; F67-Y259 HydrophobicContact CE2-CE2 4.13Å; N97-Y259 WeakPolarHBondContact ND2-CD2 3.49Å; T101-Y259 WeakPolarHBondContact CG2-O 3.23Å; W255-Y259 HydrophobicContact CE3-CD2 4.05Å; W255-Y259 AromaticContact CE3-CE2 3.55Å; W255-Y259 HydrophobicContact CE3-CE2 3.55Å; W255-Y259 AromaticContact CZ3-CE2 3.86Å; W255-Y259 HydrophobicContact CZ3-CE2 3.86Å; W255-Y259 PolarHBondContact O-N 3.01Å; Y259-Q265 HydrophobicContact CD1-CB 4.31Å; Y259-Q265 HydrophobicContact CD1-CG 4.15Å; Y259-Q265 HydrophobicContact CE1-CG 4.31Å; Y259-Y269 WeakPolarHBondContact O-CE1 3.29Å; Y259-Y269 PolarHBondContact O-OH 3.44Å; Y259-L282 HydrophobicContact CD1-CD2 4.03Å; Y259-N285 WeakPolarHBondContact CE1-ND2 3.38Å; Y259-N285 VanDerWaalsContact CZ-ND2 3.32Å; Y259-N285 PolarHBondContact OH-ND2 2.77Å; Y259-N285 PolarHBondContact OH-OD1 3.46Å; Y259-N285 VanDerWaalsContact OH-OD1 3.09Å |
| 260 | G | 92.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 5.4 Ų | 5.4 | 0% | 0 | 3% | 0.029 | C | C | . | . | I | π-helix | trans | -73.3 | -44.5 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | T101 F105 F109 L256 | T101-G260 PolarHBondContact OG1-N 3.2Å; F105-G260 WeakPolarHBondContact CB-O 3.2Å; F109-G260 VanDerWaalsContact CE2-O 3.25Å; F109-G260 WeakPolarHBondContact CE2-O 3.28Å; L256-G260 WeakPolarHBondContact O-CA 3.38Å; L256-G260 PolarHBondContact O-N 2.65Å |
| 261 | V | 93.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 5.4 Ų | 5.4 | 1% | 0.006 | 3% | 0.029 | C | C | . | . | I | π-helix | trans | -131.6 | -15.8 | -167.1 | -59.2 | 0 | 0 | 0 | 0 | 115.1 | F105 T117 S257 Q263 L428 F431 | F105-V261 HydrophobicContact CD1-CG1 3.73Å; F105-V261 HydrophobicContact CE1-CG1 3.63Å; T117-V261 PolarHBondContact OG1-O 2.98Å; S257-V261 WeakPolarHBondContact O-CG2 3.21Å; V261-Q263 PolarHBondContact O-N 3.43Å; V261-L428 HydrophobicContact CG1-CD1 4.06Å; V261-L428 HydrophobicContact CG2-CB 4.34Å; V261-L428 HydrophobicContact CG2-CD1 4.4Å; V261-F431 HydrophobicContact CB-CD2 3.59Å; V261-F431 HydrophobicContact CB-CE2 3.89Å; V261-F431 HydrophobicContact CB-CG 4.07Å; V261-F431 HydrophobicContact CG1-CB 3.54Å; V261-F431 HydrophobicContact CG1-CD1 4.24Å; V261-F431 HydrophobicContact CG1-CD2 3.54Å; V261-F431 HydrophobicContact CG1-CE2 4.27Å; V261-F431 HydrophobicContact CG1-CG 3.52Å; V261-F431 HydrophobicContact CG2-CD2 4.23Å |
| 262 | N | 92 | Very high | 91.1 | Very high | 13 Ų | 13 | 5.4 Ų | 5.4 | 7% | 0.07 | 3% | 0.029 | C | C | . | . | trans | -66.5 | 123.5 | 177.6 | -174.9 | -40.4 | 0 | 0 | 0 | 110.4 | Y137 S257 M258 A264 Q265 V266 | Y137-N262 WeakPolarHBondContact CE2-OD1 3.23Å; S257-N262 PolarHBondContact O-N 3.26Å; M258-N262 WeakPolarHBondContact O-CB 3.39Å; M258-N262 PolarHBondContact SD-ND2 3.37Å; N262-A264 VanDerWaalsContact C-N 3.27Å; N262-A264 PolarHBondContact O-N 2.93Å; N262-A264 WeakPolarHBondContact OD1-CB 3.4Å; N262-A264 PolarHBondContact OD1-N 2.99Å; N262-Q265 PolarHBondContact O-N 3.49Å; N262-V266 WeakPolarHBondContact O-CG2 3.29Å; N262-V266 PolarHBondContact O-N 3.46Å | ||
| 263 | Q | 90.9 | Very high | 90.6 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.009 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -50 | -46.8 | -179 | 174.7 | 73.4 | 11.6 | 0 | 0 | 112.9 | T115 T117 Y118 Y137 V261 Q265 V266 Q267 A361 V365 | T115-Q263 PolarHBondContact O-NE2 2.88Å; T117-Q263 PolarHBondContact OG1-OE1 2.65Å; Y118-Q263 HydrophobicContact CE2-CB 4.32Å; Y137-Q263 HydrophobicContact CE1-CB 4.07Å; Y137-Q263 HydrophobicContact CE2-CB 3.91Å; V261-Q263 PolarHBondContact O-N 3.43Å; Q263-Q265 PolarHBondContact O-N 2.94Å; Q263-V266 PolarHBondContact O-N 3.44Å; Q263-Q267 VanDerWaalsContact NE2-OE1 3.11Å; Q263-Q267 WeakPolarHBondContact O-CB 3.21Å; Q263-Q267 PolarHBondContact O-N 3.45Å; Q263-A361 HydrophobicContact CG-CB 4.14Å; Q263-V365 HydrophobicContact CB-CG2 3.89Å; Q263-V365 HydrophobicContact CG-CG2 3.39Å |
| 264 | A | 88.9 | Confident | 90.5 | Very high | 4 Ų | 4 | 14.1 Ų | 14.1 | 3% | 0.033 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -53.5 | -43.1 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | N262 R268 T357 A361 | N262-A264 VanDerWaalsContact C-N 3.27Å; N262-A264 PolarHBondContact O-N 2.93Å; N262-A264 WeakPolarHBondContact OD1-CB 3.4Å; N262-A264 PolarHBondContact OD1-N 2.99Å; A264-R268 WeakPolarHBondContact O-CD 3.28Å; A264-R268 WeakPolarHBondContact O-CG 3.4Å; A264-T357 HydrophobicContact CB-CG2 3.78Å; A264-A361 HydrophobicContact CB-CB 3.86Å |
| 265 | Q | 91.2 | Very high | 90.4 | Very high | 2 Ų | 2 | 15.6 Ų | 15.6 | 1% | 0.009 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -81.3 | -43 | 178.9 | -57.3 | -45.4 | -40 | 0 | 0 | 112.2 | L63 F67 M258 Y259 N262 Q263 Q267 R268 Y269 | L63-Q265 HydrophobicContact CD2-CB 4.15Å; F67-Q265 HydrophobicContact CD2-CG 4.11Å; F67-Q265 HydrophobicContact CE2-CG 3.27Å; F67-Q265 HydrophobicContact CZ-CG 3.94Å; M258-Q265 WeakPolarHBondContact O-CG 3.41Å; Y259-Q265 HydrophobicContact CD1-CB 4.31Å; Y259-Q265 HydrophobicContact CD1-CG 4.15Å; Y259-Q265 HydrophobicContact CE1-CG 4.31Å; N262-Q265 PolarHBondContact O-N 3.49Å; Q263-Q265 PolarHBondContact O-N 2.94Å; Q265-Q267 VanDerWaalsContact C-N 3.26Å; Q265-Q267 PolarHBondContact O-N 2.93Å; Q265-R268 WeakPolarHBondContact O-CB 3.37Å; Q265-R268 PolarHBondContact O-N 3.07Å; Q265-Y269 HydrophobicContact CB-CE1 4.36Å; Q265-Y269 WeakPolarHBondContact O-CD1 3.17Å; Q265-Y269 WeakPolarHBondContact O-CE1 3.3Å; Q265-Y269 PolarHBondContact O-N 2.98Å |
| 266 | V | 91.9 | Very high | 90.3 | Very high | 5 Ų | 5 | 19.8 Ų | 19.8 | 3% | 0.03 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -57.3 | -45.9 | -178.3 | -179.8 | 0 | 0 | 0 | 0 | 110.6 | F109 T117 N262 Q263 R268 Y269 V270 | F109-V266 HydrophobicContact CB-CG1 3.83Å; F109-V266 HydrophobicContact CD1-CG1 4.36Å; F109-V266 HydrophobicContact CD2-CG1 3.81Å; F109-V266 HydrophobicContact CD2-CG2 4.37Å; F109-V266 HydrophobicContact CE2-CG1 4.47Å; F109-V266 HydrophobicContact CE2-CG2 4.37Å; F109-V266 HydrophobicContact CG-CG1 3.74Å; T117-V266 HydrophobicContact CG2-CB 3.51Å; T117-V266 HydrophobicContact CG2-CG1 3.45Å; T117-V266 VanDerWaalsContact CG2-CG1 3.45Å; T117-V266 HydrophobicContact CG2-CG2 3.68Å; N262-V266 WeakPolarHBondContact O-CG2 3.29Å; N262-V266 PolarHBondContact O-N 3.46Å; Q263-V266 PolarHBondContact O-N 3.44Å; V266-R268 PolarHBondContact O-N 3.47Å; V266-R268 VanDerWaalsContact O-N 3.15Å; V266-Y269 VanDerWaalsContact CA-CE1 3.49Å; V266-Y269 VanDerWaalsContact CA-CZ 3.42Å; V266-Y269 HydrophobicContact CB-CE1 4.36Å; V266-Y269 HydrophobicContact CB-CE2 4.35Å; V266-Y269 HydrophobicContact CG1-CE2 3.95Å; V266-Y269 HydrophobicContact CG2-CE1 4.24Å; V266-Y269 WeakPolarHBondContact CG2-OH 3.32Å; V266-Y269 PolarHBondContact O-N 2.84Å; V266-V270 HydrophobicContact CG1-CG1 4.07Å; V266-V270 WeakPolarHBondContact O-CG1 3.43Å; V266-V270 WeakPolarHBondContact O-CG2 3.32Å; V266-V270 PolarHBondContact O-N 3.02Å; V266-V270 VanDerWaalsContact O-N 3.08Å |
| 267 | Q | 87.4 | Confident | 90.2 | Very high | 6 Ų | 6 | 24.6 Ų | 24.6 | 3% | 0.028 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -58.2 | -30.3 | 179.5 | -159.1 | -179.6 | -24.6 | 0 | 0 | 113.2 | F48 M184 Q263 Q265 A271 | F48-Q267 PolarHBondContact O-NE2 3.14Å; M184-Q267 HydrophobicContact CE-CB 4.05Å; M184-Q267 HydrophobicContact CE-CG 3.58Å; Q263-Q267 VanDerWaalsContact NE2-OE1 3.11Å; Q263-Q267 WeakPolarHBondContact O-CB 3.21Å; Q263-Q267 PolarHBondContact O-N 3.45Å; Q265-Q267 VanDerWaalsContact C-N 3.26Å; Q265-Q267 PolarHBondContact O-N 2.93Å; Q267-A271 WeakPolarHBondContact O-CB 3.24Å; Q267-A271 PolarHBondContact O-N 3.09Å |
| 268 | R | 88.9 | Confident | 90.2 | Very high | 5 Ų | 5 | 24.5 Ų | 24.5 | 2% | 0.019 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -80.8 | -47.5 | -178 | -73 | 169.2 | 162.9 | -147.5 | -16.1 | 113.1 | V59 S62 L63 S66 M184 D191 A264 Q265 V266 A271 T357 | V59-R268 HydrophobicContact CG1-CB 4.36Å; V59-R268 WeakPolarHBondContact CG1-O 3.17Å; S62-R268 PolarHBondContact O-NH1 2.97Å; S62-R268 PolarHBondContact OG-NH1 3.5Å; S62-R268 PolarHBondContact OG-NH2 2.91Å; L63-R268 HydrophobicContact CD2-CB 3.78Å; S66-R268 PolarHBondContact OG-NH1 3.32Å; S66-R268 PolarHBondContact OG-NH2 3.46Å; M184-R268 HydrophobicContact CE-CG 4.13Å; D191-R268 IonicContact OD2-CZ 2.65Å; D191-R268 IonicContact OD2-NH1 3.5Å; D191-R268 IonicContact OD2-NH2 2.94Å; D191-R268 PolarHBondContact OD2-NH2 3.23Å; A264-R268 WeakPolarHBondContact O-CD 3.28Å; A264-R268 WeakPolarHBondContact O-CG 3.4Å; Q265-R268 WeakPolarHBondContact O-CB 3.37Å; Q265-R268 PolarHBondContact O-N 3.07Å; V266-R268 PolarHBondContact O-N 3.47Å; V266-R268 VanDerWaalsContact O-N 3.15Å; R268-A271 WeakPolarHBondContact O-CB 3.35Å; R268-A271 PolarHBondContact O-N 2.87Å; R268-T357 VanDerWaalsContact CZ-OG1 3.3Å; R268-T357 PolarHBondContact NH2-OG1 3.25Å |
| 269 | Y | 90.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -73.9 | -28.3 | 179.6 | 58.2 | -113.2 | 0 | 0 | 0 | 112.2 | L63 T101 L106 Y259 Q265 V266 A271 C272 A278 L282 | L63-Y269 HydrophobicContact CD2-CD1 4.42Å; T101-Y269 HydrophobicContact CG2-CE1 4.35Å; L106-Y269 HydrophobicContact CB-CE2 4.11Å; L106-Y269 HydrophobicContact CD1-CD2 3.87Å; L106-Y269 HydrophobicContact CD1-CE2 4.18Å; L106-Y269 HydrophobicContact CD1-CG 4.35Å; L106-Y269 HydrophobicContact CG-CD2 3.94Å; L106-Y269 HydrophobicContact CG-CE2 3.91Å; Y259-Y269 WeakPolarHBondContact O-CE1 3.29Å; Y259-Y269 PolarHBondContact O-OH 3.44Å; Q265-Y269 HydrophobicContact CB-CE1 4.36Å; Q265-Y269 WeakPolarHBondContact O-CD1 3.17Å; Q265-Y269 WeakPolarHBondContact O-CE1 3.3Å; Q265-Y269 PolarHBondContact O-N 2.98Å; V266-Y269 VanDerWaalsContact CA-CE1 3.49Å; V266-Y269 VanDerWaalsContact CA-CZ 3.42Å; V266-Y269 HydrophobicContact CB-CE1 4.36Å; V266-Y269 HydrophobicContact CB-CE2 4.35Å; V266-Y269 HydrophobicContact CG1-CE2 3.95Å; V266-Y269 HydrophobicContact CG2-CE1 4.24Å; V266-Y269 WeakPolarHBondContact CG2-OH 3.32Å; V266-Y269 PolarHBondContact O-N 2.84Å; Y269-A271 PolarHBondContact O-N 3.17Å; Y269-C272 VanDerWaalsContact O-CB 3.3Å; Y269-C272 WeakPolarHBondContact O-CB 3.26Å; Y269-C272 PolarHBondContact O-N 2.88Å; Y269-C272 VanDerWaalsContact O-N 3.17Å; Y269-A278 WeakPolarHBondContact O-CB 3.39Å; Y269-L282 HydrophobicContact CD1-CD2 4.01Å; Y269-L282 HydrophobicContact CE1-CD2 4.37Å |
| 270 | V | 87.8 | Confident | 90.5 | Very high | 12 Ų | 12 | 32.1 Ų | 32.1 | 7% | 0.073 | 16% | 0.155 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -13.2 | 172.7 | -56.8 | 0 | 0 | 0 | 0 | 113.6 | R52 F109 Y110 V266 C272 | R52-V270 PolarHBondContact NE-O 3.37Å; F109-V270 HydrophobicContact CB-CG1 4.15Å; Y110-V270 HydrophobicContact CD2-CB 4.37Å; Y110-V270 HydrophobicContact CD2-CG1 4.41Å; V266-V270 HydrophobicContact CG1-CG1 4.07Å; V266-V270 WeakPolarHBondContact O-CG1 3.43Å; V266-V270 WeakPolarHBondContact O-CG2 3.32Å; V266-V270 PolarHBondContact O-N 3.02Å; V266-V270 VanDerWaalsContact O-N 3.08Å; V270-C272 PolarHBondContact O-N 3.38Å |
| 271 | A | 85.8 | Confident | 90.6 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 16% | 0.155 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -2.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | T49 R52 Q53 L54 M184 Q267 R268 Y269 | T49-A271 WeakPolarHBondContact O-CB 3.15Å; R52-A271 CarbonylContact C-O 3.35Å; R52-A271 WeakPolarHBondContact CA-O 3.3Å; Q53-A271 PolarHBondContact N-O 3.27Å; L54-A271 HydrophobicContact CD1-CB 3.92Å; L54-A271 PolarHBondContact N-O 2.96Å; M184-A271 HydrophobicContact SD-CB 4.02Å; Q267-A271 WeakPolarHBondContact O-CB 3.24Å; Q267-A271 PolarHBondContact O-N 3.09Å; R268-A271 WeakPolarHBondContact O-CB 3.35Å; R268-A271 PolarHBondContact O-N 2.87Å; Y269-A271 PolarHBondContact O-N 3.17Å |
| 272 | C | 88.3 | Confident | 90.7 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 16% | 0.155 | C | C | . | . | B | Isolated β-bridge | trans | -70.7 | 153.1 | 168.2 | -71.2 | 0 | 0 | 0 | 0 | 111.2 | Y110 Y269 V270 T274 R277 A278 | Y110-C272 PolarHBondContact OH-O 2.97Å; Y269-C272 VanDerWaalsContact O-CB 3.3Å; Y269-C272 WeakPolarHBondContact O-CB 3.26Å; Y269-C272 PolarHBondContact O-N 2.88Å; Y269-C272 VanDerWaalsContact O-N 3.17Å; V270-C272 PolarHBondContact O-N 3.38Å; C272-T274 VanDerWaalsContact C-N 3.34Å; C272-T274 PolarHBondContact O-N 2.73Å; C272-R277 HydrophobicContact CB-CB 4.19Å; C272-A278 HydrophobicContact CB-CB 4Å |
| 273 | R | 85.3 | Confident | 90.8 | Very high | 174 Ų | 174 | 36.5 Ų | 36.5 | 66% | 0.657 | 18% | 0.178 | S | C | * | . | S | Bend | trans | -66.2 | -30 | -178.9 | -175.5 | 176.8 | 172.4 | 170.2 | -2.2 | 114.8 | R52 Y110 | R52-R273 VanDerWaalsContact O-CA 3.24Å; R52-R273 WeakPolarHBondContact O-CA 3.29Å; R52-R273 PolarHBondContact O-N 3.36Å; Y110-R273 PolarHBondContact OH-O 3.27Å |
| 274 | T | 90.1 | Very high | 91 | Very high | 55 Ų | 55 | 37.7 Ų | 37.7 | 34% | 0.337 | 19% | 0.185 | S | C | . | . | S | Bend | trans | -141.6 | 151.3 | -175.8 | 59.2 | 0 | 0 | 0 | 0 | 110.2 | Y110 C272 S276 R277 A278 | Y110-T274 VanDerWaalsContact CZ-C 3.5Å; Y110-T274 VanDerWaalsContact OH-C 3.3Å; Y110-T274 WeakPolarHBondContact OH-CA 3.34Å; Y110-T274 PolarHBondContact OH-N 2.94Å; C272-T274 VanDerWaalsContact C-N 3.34Å; C272-T274 PolarHBondContact O-N 2.73Å; T274-S276 VanDerWaalsContact C-N 3.28Å; T274-S276 PolarHBondContact O-N 2.97Å; T274-R277 WeakPolarHBondContact O-CB 3.46Å; T274-R277 PolarHBondContact O-N 2.97Å; T274-R277 VanDerWaalsContact OG1-CB 3.32Å; T274-R277 WeakPolarHBondContact OG1-CB 3.26Å; T274-R277 WeakPolarHBondContact OG1-CG 3.44Å; T274-R277 PolarHBondContact OG1-N 2.88Å; T274-A278 PolarHBondContact O-N 2.54Å |
| 275 | E | 89.9 | Confident | 91.2 | Very high | 31 Ų | 31 | 37.5 Ų | 37.5 | 15% | 0.145 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -53.8 | -43.4 | 176.4 | -164.3 | -169.9 | 129.7 | 0 | 0 | 111.7 | L106 Y110 R111 R277 A278 K279 | L106-E275 HydrophobicContact CD2-CG 3.63Å; Y110-E275 HydrophobicContact CD1-CB 4.02Å; Y110-E275 HydrophobicContact CD1-CG 4.37Å; Y110-E275 HydrophobicContact CE1-CB 4.19Å; Y110-E275 HydrophobicContact CG-CB 4.34Å; Y110-E275 HydrophobicContact CG-CG 4.34Å; R111-E275 IonicContact CZ-OE2 3.53Å; R111-E275 IonicContact NE-OE2 3.87Å; R111-E275 PolarHBondContact NE-OE2 2.92Å; R111-E275 IonicContact NH2-OE2 3.14Å; R111-E275 PolarHBondContact NH2-OE2 3.21Å; R111-E275 VanDerWaalsContact NH2-OE2 3.14Å; E275-R277 VanDerWaalsContact C-N 3.33Å; E275-R277 PolarHBondContact O-N 3.04Å; E275-A278 WeakPolarHBondContact O-CB 3.34Å; E275-A278 PolarHBondContact O-N 3.19Å; E275-A278 VanDerWaalsContact O-N 3.11Å; E275-K279 PolarHBondContact O-N 3.35Å; E275-K279 WeakPolarHBondContact OE1-CE 3.44Å; E275-K279 IonicContact OE1-NZ 2.73Å; E275-K279 PolarHBondContact OE1-NZ 3.32Å |
| 276 | S | 90.7 | Very high | 91.3 | Very high | 90 Ų | 90 | 38.1 Ų | 38.1 | 63% | 0.629 | 19% | 0.186 | S | C | * | . | H | α-helix | trans | -62.8 | -36.5 | 178 | -51 | 0 | 0 | 0 | 0 | 113.1 | T274 K279 L280 | T274-S276 VanDerWaalsContact C-N 3.28Å; T274-S276 PolarHBondContact O-N 2.97Å; S276-K279 PolarHBondContact O-N 3.47Å; S276-L280 WeakPolarHBondContact O-CB 3.43Å; S276-L280 PolarHBondContact O-N 3.38Å |
| 277 | R | 93 | Very high | 91.5 | Very high | 112 Ų | 112 | 43 Ų | 43 | 42% | 0.423 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -69.9 | -34.4 | 173.8 | -75.1 | 179 | -179.2 | -159.1 | 0.1 | 112 | A56 C272 T274 E275 L280 A281 | A56-R277 HydrophobicContact CB-CB 4.24Å; A56-R277 VanDerWaalsContact CB-O 3.3Å; A56-R277 WeakPolarHBondContact CB-O 3.48Å; C272-R277 HydrophobicContact CB-CB 4.19Å; T274-R277 WeakPolarHBondContact O-CB 3.46Å; T274-R277 PolarHBondContact O-N 2.97Å; T274-R277 VanDerWaalsContact OG1-CB 3.32Å; T274-R277 WeakPolarHBondContact OG1-CB 3.26Å; T274-R277 WeakPolarHBondContact OG1-CG 3.44Å; T274-R277 PolarHBondContact OG1-N 2.88Å; E275-R277 VanDerWaalsContact C-N 3.33Å; E275-R277 PolarHBondContact O-N 3.04Å; R277-L280 PolarHBondContact O-N 3.37Å; R277-A281 WeakPolarHBondContact O-CB 3.4Å; R277-A281 PolarHBondContact O-N 3.16Å |
| 278 | A | 92.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.9 | -42.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | L106 Y110 Y269 C272 T274 E275 A281 L282 | L106-A278 HydrophobicContact CD1-CB 3.84Å; L106-A278 HydrophobicContact CD2-CB 4.27Å; L106-A278 HydrophobicContact CG-CB 4.39Å; Y110-A278 HydrophobicContact CD2-CB 4.21Å; Y110-A278 HydrophobicContact CE2-CB 4.28Å; Y269-A278 WeakPolarHBondContact O-CB 3.39Å; C272-A278 HydrophobicContact CB-CB 4Å; T274-A278 PolarHBondContact O-N 2.54Å; E275-A278 WeakPolarHBondContact O-CB 3.34Å; E275-A278 PolarHBondContact O-N 3.19Å; E275-A278 VanDerWaalsContact O-N 3.11Å; A278-A281 WeakPolarHBondContact O-CB 3.35Å; A278-A281 PolarHBondContact O-N 3.46Å; A278-L282 PolarHBondContact O-N 2.85Å |
| 279 | K | 94.6 | Very high | 91.9 | Very high | 78 Ų | 78 | 42.7 Ų | 42.7 | 34% | 0.339 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -62.9 | -42.5 | 172.9 | -66.8 | 178.4 | -175.4 | 169.1 | 0 | 112 | A102 L106 E275 S276 A281 L282 L283 | A102-K279 HydrophobicContact CB-CG 4.18Å; A102-K279 WeakPolarHBondContact O-CE 3.32Å; L106-K279 HydrophobicContact CD1-CG 4.12Å; L106-K279 HydrophobicContact CD2-CG 4.1Å; E275-K279 PolarHBondContact O-N 3.35Å; E275-K279 WeakPolarHBondContact OE1-CE 3.44Å; E275-K279 IonicContact OE1-NZ 2.73Å; E275-K279 PolarHBondContact OE1-NZ 3.32Å; S276-K279 PolarHBondContact O-N 3.47Å; K279-A281 VanDerWaalsContact C-N 3.3Å; K279-A281 PolarHBondContact O-N 3.46Å; K279-L282 PolarHBondContact O-N 3.46Å; K279-L283 PolarHBondContact O-N 3.19Å |
| 280 | L | 94.8 | Very high | 92.1 | Very high | 85 Ų | 85 | 47.4 Ų | 47.4 | 45% | 0.445 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61.8 | -38 | 174 | -178.9 | 62.5 | 0 | 0 | 0 | 111.8 | A56 S276 R277 L282 L283 V284 | A56-L280 HydrophobicContact CB-CB 4.04Å; A56-L280 HydrophobicContact CB-CD2 3.81Å; A56-L280 HydrophobicContact CB-CG 3.92Å; S276-L280 WeakPolarHBondContact O-CB 3.43Å; S276-L280 PolarHBondContact O-N 3.38Å; R277-L280 PolarHBondContact O-N 3.37Å; L280-L282 VanDerWaalsContact C-N 3.33Å; L280-L282 PolarHBondContact O-N 3.4Å; L280-L283 HydrophobicContact CD1-CD2 4.48Å; L280-L283 WeakPolarHBondContact O-CB 3.46Å; L280-L283 PolarHBondContact O-N 2.97Å; L280-L283 VanDerWaalsContact O-N 3.13Å; L280-V284 WeakPolarHBondContact O-CG2 3.23Å; L280-V284 PolarHBondContact O-N 3.36Å |
| 281 | A | 95 | Very high | 92.4 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62 | -39.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | A56 V59 G60 L63 R277 A278 K279 L283 V284 N285 | A56-A281 HydrophobicContact CB-CB 4.31Å; A56-A281 WeakPolarHBondContact O-CA 3.26Å; A56-A281 WeakPolarHBondContact O-CB 3.39Å; V59-A281 HydrophobicContact CB-CB 4.09Å; V59-A281 HydrophobicContact CG1-CB 3.87Å; G60-A281 WeakPolarHBondContact CA-O 3.46Å; L63-A281 HydrophobicContact CD1-CB 4.4Å; R277-A281 WeakPolarHBondContact O-CB 3.4Å; R277-A281 PolarHBondContact O-N 3.16Å; A278-A281 WeakPolarHBondContact O-CB 3.35Å; A278-A281 PolarHBondContact O-N 3.46Å; K279-A281 VanDerWaalsContact C-N 3.3Å; K279-A281 PolarHBondContact O-N 3.46Å; A281-L283 VanDerWaalsContact C-N 3.31Å; A281-L283 PolarHBondContact O-N 3.49Å; A281-V284 PolarHBondContact O-N 3.21Å; A281-N285 WeakPolarHBondContact O-CB 3.33Å; A281-N285 PolarHBondContact O-N 3Å |
| 282 | L | 94.6 | Very high | 92.8 | Very high | 2 Ų | 2 | 50.2 Ų | 50.2 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.3 | -34.7 | 172.9 | -71.4 | 173.4 | 0 | 0 | 0 | 112.7 | L63 T101 A102 L106 Y259 Y269 A278 K279 L280 N285 Q286 | L63-L282 HydrophobicContact CD1-CD2 4.16Å; T101-L282 HydrophobicContact CG2-CD1 3.79Å; T101-L282 HydrophobicContact CG2-CD2 4.4Å; A102-L282 HydrophobicContact CB-CD1 3.9Å; L106-L282 HydrophobicContact CD1-CD1 3.51Å; L106-L282 HydrophobicContact CD1-CG 4.35Å; Y259-L282 HydrophobicContact CD1-CD2 4.03Å; Y269-L282 HydrophobicContact CD1-CD2 4.01Å; Y269-L282 HydrophobicContact CE1-CD2 4.37Å; A278-L282 PolarHBondContact O-N 2.85Å; K279-L282 PolarHBondContact O-N 3.46Å; L280-L282 VanDerWaalsContact C-N 3.33Å; L280-L282 PolarHBondContact O-N 3.4Å; L282-N285 WeakPolarHBondContact O-CB 3.38Å; L282-Q286 PolarHBondContact O-N 2.91Å; L282-Q286 VanDerWaalsContact O-N 3.11Å |
| 283 | L | 93.8 | Very high | 93 | Very high | 104 Ų | 104 | 50.2 Ų | 50.2 | 55% | 0.545 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -71 | -42.6 | 175.5 | -176 | 64.8 | 0 | 0 | 0 | 112.1 | K279 L280 A281 N285 Q286 L287 | K279-L283 PolarHBondContact O-N 3.19Å; L280-L283 HydrophobicContact CD1-CD2 4.48Å; L280-L283 WeakPolarHBondContact O-CB 3.46Å; L280-L283 PolarHBondContact O-N 2.97Å; L280-L283 VanDerWaalsContact O-N 3.13Å; A281-L283 VanDerWaalsContact C-N 3.31Å; A281-L283 PolarHBondContact O-N 3.49Å; L283-N285 VanDerWaalsContact C-N 3.28Å; L283-N285 PolarHBondContact O-N 2.9Å; L283-Q286 WeakPolarHBondContact O-CB 3.29Å; L283-Q286 PolarHBondContact O-N 3.35Å; L283-Q286 VanDerWaalsContact O-N 3.16Å; L283-L287 PolarHBondContact O-N 3.14Å; L283-L287 VanDerWaalsContact O-N 3.12Å |
| 284 | V | 95.3 | Very high | 93.5 | Very high | 27 Ų | 27 | 43.8 Ų | 43.8 | 16% | 0.164 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.1 | -41.1 | 174.1 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | V57 L61 L280 A281 Q286 L287 G288 | V57-V284 HydrophobicContact CG2-CG2 4.27Å; L61-V284 HydrophobicContact CD2-CG1 4.44Å; L61-V284 HydrophobicContact CG-CG1 4.31Å; L280-V284 WeakPolarHBondContact O-CG2 3.23Å; L280-V284 PolarHBondContact O-N 3.36Å; A281-V284 PolarHBondContact O-N 3.21Å; V284-Q286 VanDerWaalsContact C-N 3.32Å; V284-Q286 PolarHBondContact O-N 3.28Å; V284-L287 PolarHBondContact O-N 3.46Å; V284-G288 PolarHBondContact O-N 3.27Å |
| 285 | N | 94.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -54.2 | -48.1 | 172.2 | 167.4 | 64.2 | 0 | 0 | 0 | 111.7 | G60 L63 A64 Y259 A281 L282 L283 L287 G288 L289 | G60-N285 VanDerWaalsContact O-CA 3.29Å; G60-N285 WeakPolarHBondContact O-CA 3.4Å; G60-N285 WeakPolarHBondContact O-CB 3.3Å; L63-N285 VanDerWaalsContact C-OD1 3.22Å; L63-N285 HydrophobicContact CB-CB 3.87Å; L63-N285 HydrophobicContact CD1-CB 4.22Å; A64-N285 WeakPolarHBondContact CA-OD1 3.44Å; A64-N285 WeakPolarHBondContact CB-OD1 3.03Å; A64-N285 PolarHBondContact N-OD1 2.89Å; Y259-N285 WeakPolarHBondContact CE1-ND2 3.38Å; Y259-N285 VanDerWaalsContact CZ-ND2 3.32Å; Y259-N285 PolarHBondContact OH-ND2 2.77Å; Y259-N285 PolarHBondContact OH-OD1 3.46Å; Y259-N285 VanDerWaalsContact OH-OD1 3.09Å; A281-N285 WeakPolarHBondContact O-CB 3.33Å; A281-N285 PolarHBondContact O-N 3Å; L282-N285 WeakPolarHBondContact O-CB 3.38Å; L283-N285 VanDerWaalsContact C-N 3.28Å; L283-N285 PolarHBondContact O-N 2.9Å; N285-L287 VanDerWaalsContact C-N 3.31Å; N285-L287 PolarHBondContact O-N 3.01Å; N285-G288 PolarHBondContact O-N 3.4Å; N285-G288 VanDerWaalsContact O-N 3.12Å; N285-L289 WeakPolarHBondContact O-CG 3.3Å; N285-L289 PolarHBondContact O-N 3.44Å |
| 286 | Q | 93.9 | Very high | 94 | Very high | 15 Ų | 15 | 40.2 Ų | 40.2 | 7% | 0.07 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.2 | -39.5 | 179.7 | -178 | 58.2 | 24.2 | 0 | 0 | 112.8 | C91 Q94 L95 L282 L283 V284 F290 | C91-Q286 PolarHBondContact O-NE2 2.96Å; Q94-Q286 VanDerWaalsContact C-OE1 3.3Å; Q94-Q286 PolarHBondContact O-OE1 3.4Å; L95-Q286 HydrophobicContact CB-CG 4.27Å; L95-Q286 HydrophobicContact CD1-CG 3.86Å; L282-Q286 PolarHBondContact O-N 2.91Å; L282-Q286 VanDerWaalsContact O-N 3.11Å; L283-Q286 WeakPolarHBondContact O-CB 3.29Å; L283-Q286 PolarHBondContact O-N 3.35Å; L283-Q286 VanDerWaalsContact O-N 3.16Å; V284-Q286 VanDerWaalsContact C-N 3.32Å; V284-Q286 PolarHBondContact O-N 3.28Å; Q286-F290 WeakPolarHBondContact O-CB 3.5Å; Q286-F290 PolarHBondContact O-N 3.43Å |
| 287 | L | 94.3 | Very high | 94.2 | Very high | 106 Ų | 106 | 36 Ų | 36 | 56% | 0.555 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -63.2 | -43.8 | 174.3 | 179.7 | 62.3 | 0 | 0 | 0 | 111.3 | L283 V284 N285 F290 L291 | L283-L287 PolarHBondContact O-N 3.14Å; L283-L287 VanDerWaalsContact O-N 3.12Å; V284-L287 PolarHBondContact O-N 3.46Å; N285-L287 VanDerWaalsContact C-N 3.31Å; N285-L287 PolarHBondContact O-N 3.01Å; L287-F290 PolarHBondContact O-N 3.17Å; L287-L291 HydrophobicContact CD1-CD1 4.44Å; L287-L291 HydrophobicContact CD1-CG 4.42Å; L287-L291 HydrophobicContact CG-CD1 4.34Å; L287-L291 WeakPolarHBondContact O-CG 3.21Å; L287-L291 PolarHBondContact O-N 3.05Å |
| 288 | G | 92.8 | Very high | 94.3 | Very high | 6 Ų | 6 | 32.6 Ų | 32.6 | 6% | 0.062 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.8 | -49.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V284 N285 F290 L291 I292 | V284-G288 PolarHBondContact O-N 3.27Å; N285-G288 PolarHBondContact O-N 3.4Å; N285-G288 VanDerWaalsContact O-N 3.12Å; G288-F290 PolarHBondContact O-N 2.67Å; G288-L291 PolarHBondContact O-N 2.88Å; G288-I292 WeakPolarHBondContact O-CD1 3.28Å; G288-I292 VanDerWaalsContact O-CG1 3.26Å; G288-I292 WeakPolarHBondContact O-CG1 3.29Å; G288-I292 PolarHBondContact O-N 2.86Å; G288-I292 VanDerWaalsContact O-N 3.08Å |
| 289 | L | 92.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.1 | -45.8 | 176.6 | -68.6 | 177.2 | 0 | 0 | 0 | 111.8 | A64 M68 N285 L291 I292 V293 | A64-L289 HydrophobicContact CB-CD2 4.31Å; A64-L289 HydrophobicContact CB-CG 4.32Å; M68-L289 HydrophobicContact CG-CD2 3.58Å; M68-L289 HydrophobicContact SD-CD2 3.59Å; M68-L289 VanDerWaalsContact SD-CD2 3.59Å; N285-L289 WeakPolarHBondContact O-CG 3.3Å; N285-L289 PolarHBondContact O-N 3.44Å; L289-L291 PolarHBondContact O-N 3.31Å; L289-I292 PolarHBondContact O-N 2.86Å; L289-V293 WeakPolarHBondContact O-CB 3.35Å; L289-V293 VanDerWaalsContact O-CG2 3.26Å; L289-V293 WeakPolarHBondContact O-CG2 3.41Å; L289-V293 PolarHBondContact O-N 2.67Å |
| 290 | F | 94.4 | Very high | 94.5 | Very high | 99 Ų | 99 | 28.9 Ų | 28.9 | 43% | 0.434 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -57 | -49 | 178.5 | 178.6 | -98 | 0 | 0 | 0 | 111.6 | C91 Q286 L287 G288 I292 V294 | C91-F290 HydrophobicContact CB-CD2 3.91Å; Q286-F290 WeakPolarHBondContact O-CB 3.5Å; Q286-F290 PolarHBondContact O-N 3.43Å; L287-F290 PolarHBondContact O-N 3.17Å; G288-F290 PolarHBondContact O-N 2.67Å; F290-I292 PolarHBondContact O-N 3.32Å; F290-V294 HydrophobicContact CD1-CG2 4.4Å; F290-V294 HydrophobicContact CD2-CG2 4.09Å; F290-V294 HydrophobicContact CE1-CG2 4.13Å; F290-V294 HydrophobicContact CE2-CG2 3.8Å; F290-V294 HydrophobicContact CG-CG2 4.39Å; F290-V294 HydrophobicContact CZ-CG2 3.83Å; F290-V294 VanDerWaalsContact O-CB 3.29Å; F290-V294 WeakPolarHBondContact O-CB 3.06Å; F290-V294 WeakPolarHBondContact O-CG2 3.21Å; F290-V294 PolarHBondContact O-N 2.98Å |
| 291 | L | 94.6 | Very high | 94.5 | Very high | 70 Ų | 70 | 25.4 Ų | 25.4 | 37% | 0.366 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -61.8 | -43.8 | 179.9 | -70.2 | 174.3 | 0 | 0 | 0 | 112.3 | L199 L287 G288 L289 S295 | L199-L291 HydrophobicContact CD2-CB 4.2Å; L287-L291 HydrophobicContact CD1-CD1 4.44Å; L287-L291 HydrophobicContact CD1-CG 4.42Å; L287-L291 HydrophobicContact CG-CD1 4.34Å; L287-L291 WeakPolarHBondContact O-CG 3.21Å; L287-L291 PolarHBondContact O-N 3.05Å; G288-L291 PolarHBondContact O-N 2.88Å; L289-L291 PolarHBondContact O-N 3.31Å; L291-S295 VanDerWaalsContact O-CB 3.29Å; L291-S295 WeakPolarHBondContact O-CB 2.98Å; L291-S295 PolarHBondContact O-N 2.9Å; L291-S295 PolarHBondContact O-OG 2.96Å |
| 292 | I | 93.2 | Very high | 94.5 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -72.5 | -45 | -176.9 | -56 | 162.7 | 0 | 0 | 0 | 110.6 | M68 V195 M198 L199 F202 G288 L289 F290 S295 A296 | M68-I292 HydrophobicContact CB-CD1 4.22Å; M68-I292 HydrophobicContact CE-CB 3.68Å; M68-I292 HydrophobicContact CE-CG2 3.17Å; M68-I292 HydrophobicContact CG-CB 4.31Å; M68-I292 HydrophobicContact CG-CD1 3.71Å; M68-I292 HydrophobicContact CG-CG2 4.27Å; M68-I292 HydrophobicContact SD-CB 4.44Å; M68-I292 HydrophobicContact SD-CG2 4.38Å; V195-I292 HydrophobicContact CG1-CD1 4.28Å; M198-I292 HydrophobicContact CE-CG2 4.3Å; L199-I292 HydrophobicContact CD2-CB 4.34Å; L199-I292 HydrophobicContact CD2-CG1 3.61Å; L199-I292 HydrophobicContact CG-CG1 4.03Å; F202-I292 HydrophobicContact CD2-CG2 4.15Å; F202-I292 HydrophobicContact CE2-CG2 3.6Å; G288-I292 WeakPolarHBondContact O-CD1 3.28Å; G288-I292 VanDerWaalsContact O-CG1 3.26Å; G288-I292 WeakPolarHBondContact O-CG1 3.29Å; G288-I292 PolarHBondContact O-N 2.86Å; G288-I292 VanDerWaalsContact O-N 3.08Å; L289-I292 PolarHBondContact O-N 2.86Å; F290-I292 PolarHBondContact O-N 3.32Å; I292-S295 PolarHBondContact O-N 3.23Å; I292-A296 WeakPolarHBondContact O-CB 3.23Å; I292-A296 PolarHBondContact O-N 2.65Å |
| 293 | V | 93.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.3 | -43 | 179.4 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | M68 V76 F87 L88 L289 A296 A297 | M68-V293 HydrophobicContact CE-CG2 4Å; M68-V293 HydrophobicContact SD-CG2 4.13Å; V76-V293 HydrophobicContact CG1-CG1 4.46Å; F87-V293 HydrophobicContact CD1-CG1 4.06Å; F87-V293 HydrophobicContact CE1-CG1 4.05Å; L88-V293 HydrophobicContact CD2-CG1 4.34Å; L289-V293 WeakPolarHBondContact O-CB 3.35Å; L289-V293 VanDerWaalsContact O-CG2 3.26Å; L289-V293 WeakPolarHBondContact O-CG2 3.41Å; L289-V293 PolarHBondContact O-N 2.67Å; V293-A296 PolarHBondContact O-N 2.85Å; V293-A297 WeakPolarHBondContact O-CB 3.47Å; V293-A297 PolarHBondContact O-N 3.44Å |
| 294 | V | 95.1 | Very high | 94.6 | Very high | 39 Ų | 39 | 21.1 Ų | 21.1 | 24% | 0.236 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.7 | -45.9 | 175.8 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | L88 F290 A296 A297 C298 | L88-V294 HydrophobicContact CD2-CB 4.44Å; L88-V294 HydrophobicContact CD2-CG2 3.88Å; F290-V294 HydrophobicContact CD1-CG2 4.4Å; F290-V294 HydrophobicContact CD2-CG2 4.09Å; F290-V294 HydrophobicContact CE1-CG2 4.13Å; F290-V294 HydrophobicContact CE2-CG2 3.8Å; F290-V294 HydrophobicContact CG-CG2 4.39Å; F290-V294 HydrophobicContact CZ-CG2 3.83Å; F290-V294 VanDerWaalsContact O-CB 3.29Å; F290-V294 WeakPolarHBondContact O-CB 3.06Å; F290-V294 WeakPolarHBondContact O-CG2 3.21Å; F290-V294 PolarHBondContact O-N 2.98Å; V294-A296 VanDerWaalsContact C-N 3.35Å; V294-A296 PolarHBondContact O-N 3.1Å; V294-A297 PolarHBondContact O-N 2.76Å; V294-C298 WeakPolarHBondContact O-CB 3.34Å; V294-C298 PolarHBondContact O-N 3.25Å; V294-C298 PolarHBondContact O-SG 2.85Å |
| 295 | S | 95.3 | Very high | 94.5 | Very high | 12 Ų | 12 | 19.8 Ų | 19.8 | 8% | 0.084 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.3 | -44.9 | 178.2 | -57.9 | 0 | 0 | 0 | 0 | 111.5 | W203 L291 I292 C298 C299 | W203-S295 PolarHBondContact NE1-OG 2.87Å; L291-S295 VanDerWaalsContact O-CB 3.29Å; L291-S295 WeakPolarHBondContact O-CB 2.98Å; L291-S295 PolarHBondContact O-N 2.9Å; L291-S295 PolarHBondContact O-OG 2.96Å; I292-S295 PolarHBondContact O-N 3.23Å; S295-C298 PolarHBondContact O-N 3.02Å; S295-C299 PolarHBondContact O-N 3.3Å; S295-C299 PolarHBondContact O-SG 3.41Å; S295-C299 VanDerWaalsContact O-SG 3.37Å |
| 296 | A | 94.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -64.1 | -44.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V76 P77 F202 I292 V293 V294 C298 C299 G300 | V76-A296 HydrophobicContact CB-CB 3.96Å; V76-A296 HydrophobicContact CG1-CB 3.81Å; P77-A296 HydrophobicContact CG-CB 4.17Å; P77-A296 WeakPolarHBondContact CG-O 3.38Å; F202-A296 HydrophobicContact CD1-CB 4.24Å; F202-A296 HydrophobicContact CE1-CB 3.62Å; F202-A296 HydrophobicContact CE2-CB 4.34Å; F202-A296 HydrophobicContact CZ-CB 3.65Å; I292-A296 WeakPolarHBondContact O-CB 3.23Å; I292-A296 PolarHBondContact O-N 2.65Å; V293-A296 PolarHBondContact O-N 2.85Å; V294-A296 VanDerWaalsContact C-N 3.35Å; V294-A296 PolarHBondContact O-N 3.1Å; A296-C298 VanDerWaalsContact C-N 3.34Å; A296-C298 PolarHBondContact O-N 3.48Å; A296-C299 WeakPolarHBondContact O-CB 3.11Å; A296-C299 PolarHBondContact O-N 3.31Å; A296-G300 PolarHBondContact O-N 3.34Å |
| 297 | A | 95.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -63.4 | -40.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | V76 A80 L85 L88 V293 V294 G300 I301 | V76-A297 HydrophobicContact CG1-CB 4.3Å; A80-A297 HydrophobicContact CB-CB 4.19Å; L85-A297 HydrophobicContact CD2-CB 3.94Å; L88-A297 HydrophobicContact CD2-CB 3.69Å; L88-A297 HydrophobicContact CG-CB 4.34Å; V293-A297 WeakPolarHBondContact O-CB 3.47Å; V293-A297 PolarHBondContact O-N 3.44Å; V294-A297 PolarHBondContact O-N 2.76Å; A297-G300 WeakPolarHBondContact O-CA 3.32Å; A297-G300 PolarHBondContact O-N 3.26Å; A297-G300 VanDerWaalsContact O-N 3.11Å; A297-I301 PolarHBondContact O-N 3.47Å |
| 298 | C | 95.7 | Very high | 94 | Very high | 42 Ų | 42 | 21.5 Ų | 21.5 | 28% | 0.284 | 11% | 0.106 | S | C | . | . | H | α-helix | trans | -62 | -41.1 | 173.6 | -71.7 | 0 | 0 | 0 | 0 | 112.2 | L206 V294 S295 A296 G300 I301 V302 | L206-C298 HydrophobicContact CD1-CB 3.72Å; L206-C298 HydrophobicContact CD2-CB 4.18Å; V294-C298 WeakPolarHBondContact O-CB 3.34Å; V294-C298 PolarHBondContact O-N 3.25Å; V294-C298 PolarHBondContact O-SG 2.85Å; S295-C298 PolarHBondContact O-N 3.02Å; A296-C298 VanDerWaalsContact C-N 3.34Å; A296-C298 PolarHBondContact O-N 3.48Å; C298-G300 VanDerWaalsContact C-N 3.27Å; C298-G300 PolarHBondContact O-N 3.39Å; C298-I301 PolarHBondContact O-N 2.97Å; C298-I301 VanDerWaalsContact O-N 3.16Å; C298-V302 PolarHBondContact O-N 3.35Å; C298-V302 VanDerWaalsContact O-N 3.07Å |
| 299 | C | 95.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.1 | -39.9 | 171.2 | -69.1 | 0 | 0 | 0 | 0 | 111.7 | F202 S295 A296 I301 V302 M303 M325 | F202-C299 PolarHBondContact O-SG 3.2Å; F202-C299 VanDerWaalsContact O-SG 3.41Å; S295-C299 PolarHBondContact O-N 3.3Å; S295-C299 PolarHBondContact O-SG 3.41Å; S295-C299 VanDerWaalsContact O-SG 3.37Å; A296-C299 WeakPolarHBondContact O-CB 3.11Å; A296-C299 PolarHBondContact O-N 3.31Å; C299-I301 VanDerWaalsContact C-N 3.32Å; C299-I301 PolarHBondContact O-N 3.22Å; C299-V302 PolarHBondContact O-N 3.12Å; C299-M303 WeakPolarHBondContact O-CB 3.48Å; C299-M303 PolarHBondContact O-N 2.73Å; C299-M325 HydrophobicContact CB-CE 4.12Å; C299-M325 HydrophobicContact CB-SD 4.42Å |
| 300 | G | 95.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.3 | -34.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114 | P77 A81 A296 A297 C298 M303 F304 | P77-G300 WeakPolarHBondContact O-CA 3.35Å; A81-G300 WeakPolarHBondContact CB-O 3.39Å; A296-G300 PolarHBondContact O-N 3.34Å; A297-G300 WeakPolarHBondContact O-CA 3.32Å; A297-G300 PolarHBondContact O-N 3.26Å; A297-G300 VanDerWaalsContact O-N 3.11Å; C298-G300 VanDerWaalsContact C-N 3.27Å; C298-G300 PolarHBondContact O-N 3.39Å; G300-M303 WeakPolarHBondContact O-CB 3.31Å; G300-M303 PolarHBondContact O-N 3.01Å; G300-F304 PolarHBondContact O-N 3.04Å |
| 301 | I | 95.7 | Very high | 93 | Very high | 11 Ų | 11 | 21.9 Ų | 21.9 | 6% | 0.056 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -69.4 | -43.2 | 174 | -62.9 | -56.5 | 0 | 0 | 0 | 111.7 | L85 V219 A223 R228 A297 C298 C299 M303 F304 V305 | L85-I301 HydrophobicContact CD1-CG1 4.32Å; L85-I301 HydrophobicContact CD2-CD1 3.9Å; L85-I301 HydrophobicContact CD2-CG1 3.48Å; L85-I301 VanDerWaalsContact CD2-CG1 3.48Å; L85-I301 HydrophobicContact CG-CD1 3.84Å; L85-I301 HydrophobicContact CG-CG1 3.81Å; V219-I301 HydrophobicContact CG1-CG2 4.05Å; A223-I301 HydrophobicContact CB-CG2 3.44Å; A223-I301 VanDerWaalsContact CB-CG2 3.44Å; R228-I301 HydrophobicContact CB-CD1 3.93Å; A297-I301 PolarHBondContact O-N 3.47Å; C298-I301 PolarHBondContact O-N 2.97Å; C298-I301 VanDerWaalsContact O-N 3.16Å; C299-I301 VanDerWaalsContact C-N 3.32Å; C299-I301 PolarHBondContact O-N 3.22Å; I301-M303 VanDerWaalsContact C-N 3.28Å; I301-M303 PolarHBondContact O-N 2.89Å; I301-F304 PolarHBondContact O-N 2.94Å; I301-V305 WeakPolarHBondContact O-CG2 3.36Å; I301-V305 PolarHBondContact O-N 3.43Å |
| 302 | V | 95.6 | Very high | 92.7 | Very high | 3 Ų | 3 | 18.6 Ų | 18.6 | 2% | 0.018 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -59.5 | -43.4 | 173.3 | 170.1 | 0 | 0 | 0 | 0 | 110.7 | L206 T210 V219 C298 C299 F304 V305 F306 | L206-V302 HydrophobicContact CD1-CG2 3.81Å; T210-V302 HydrophobicContact CG2-CG2 3.73Å; V219-V302 HydrophobicContact CG1-CG2 4.02Å; C298-V302 PolarHBondContact O-N 3.35Å; C298-V302 VanDerWaalsContact O-N 3.07Å; C299-V302 PolarHBondContact O-N 3.12Å; V302-F304 PolarHBondContact O-N 3.34Å; V302-V305 PolarHBondContact O-N 3.01Å; V302-F306 WeakPolarHBondContact O-CB 3.46Å; V302-F306 PolarHBondContact O-N 3.49Å |
| 303 | M | 94.7 | Very high | 92.3 | Very high | 1 Ų | 1 | 20.7 Ų | 20.7 | 1% | 0.005 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -59.1 | -46.2 | 176.7 | -168.8 | 166.7 | 76.4 | 0 | 0 | 112.4 | P77 A81 C299 G300 I301 F306 Y307 Y324 M325 L328 | P77-M303 HydrophobicContact CB-CE 4.2Å; P77-M303 VanDerWaalsContact O-CE 3.27Å; P77-M303 WeakPolarHBondContact O-CE 3.49Å; A81-M303 HydrophobicContact CB-CE 3.4Å; C299-M303 WeakPolarHBondContact O-CB 3.48Å; C299-M303 PolarHBondContact O-N 2.73Å; G300-M303 WeakPolarHBondContact O-CB 3.31Å; G300-M303 PolarHBondContact O-N 3.01Å; I301-M303 VanDerWaalsContact C-N 3.28Å; I301-M303 PolarHBondContact O-N 2.89Å; M303-F306 PolarHBondContact O-N 2.98Å; M303-Y307 HydrophobicContact CG-CD2 3.97Å; M303-Y307 HydrophobicContact CG-CE2 4.11Å; M303-Y307 WeakPolarHBondContact O-CD2 3.48Å; M303-Y307 PolarHBondContact O-N 2.89Å; M303-Y324 HydrophobicContact CE-CG 4.08Å; M303-Y324 VanDerWaalsContact SD-CB 3.53Å; M303-Y324 HydrophobicContact SD-CG 4.38Å; M303-M325 HydrophobicContact SD-SD 4.3Å; M303-L328 HydrophobicContact CB-CD2 3.76Å; M303-L328 HydrophobicContact CG-CB 4.33Å; M303-L328 HydrophobicContact CG-CD1 4.38Å; M303-L328 HydrophobicContact CG-CD2 3.87Å; M303-L328 HydrophobicContact CG-CG 4.42Å; M303-L328 HydrophobicContact SD-CB 4.43Å; M303-L328 HydrophobicContact SD-CD2 4.24Å |
| 304 | F | 93.9 | Very high | 91.9 | Very high | 12 Ų | 12 | 24.7 Ų | 24.7 | 5% | 0.053 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.2 | -47.8 | 174 | 165.3 | -97.5 | 0 | 0 | 0 | 111.4 | A81 H226 R228 G300 I301 V302 F306 Y307 R308 T478 | A81-F304 HydrophobicContact CB-CB 4.18Å; H226-F304 HydrophobicContact CB-CE1 3.7Å; H226-F304 HydrophobicContact CB-CZ 3.49Å; H226-F304 VanDerWaalsContact CB-CZ 3.49Å; H226-F304 AromaticContact CD2-CZ 4Å; H226-F304 AromaticContact CG-CE1 3.94Å; H226-F304 AromaticContact CG-CZ 3.64Å; R228-F304 HydrophobicContact CG-CD1 3.69Å; R228-F304 HydrophobicContact CG-CD2 4.41Å; R228-F304 HydrophobicContact CG-CE1 3.63Å; R228-F304 HydrophobicContact CG-CE2 4.36Å; R228-F304 HydrophobicContact CG-CG 4.09Å; R228-F304 HydrophobicContact CG-CZ 3.99Å; G300-F304 PolarHBondContact O-N 3.04Å; I301-F304 PolarHBondContact O-N 2.94Å; V302-F304 PolarHBondContact O-N 3.34Å; F304-F306 VanDerWaalsContact C-N 3.3Å; F304-F306 PolarHBondContact O-N 3.37Å; F304-Y307 CarbonylContact O-C 3.55Å; F304-Y307 PolarHBondContact O-N 2.69Å; F304-R308 HydrophobicContact CZ-CB 4.41Å; F304-R308 VanDerWaalsContact O-CA 3.3Å; F304-R308 WeakPolarHBondContact O-CA 3.46Å; F304-R308 WeakPolarHBondContact O-CB 3.33Å; F304-R308 PolarHBondContact O-N 2.9Å; F304-T478 HydrophobicContact CE2-CG2 4.39Å |
| 305 | V | 93.6 | Very high | 91.4 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64 | -38.5 | -178.2 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | M213 V219 L222 A223 I301 V302 R308 | M213-V305 HydrophobicContact CB-CG1 4.23Å; M213-V305 HydrophobicContact CE-CG1 3.64Å; M213-V305 HydrophobicContact CG-CG1 4.02Å; V219-V305 HydrophobicContact CG1-CG2 4.14Å; V219-V305 HydrophobicContact CG2-CG1 4.5Å; L222-V305 HydrophobicContact CB-CG1 4.24Å; L222-V305 HydrophobicContact CB-CG2 4.02Å; L222-V305 HydrophobicContact CD1-CG1 3.63Å; A223-V305 HydrophobicContact CB-CG2 4.37Å; I301-V305 WeakPolarHBondContact O-CG2 3.36Å; I301-V305 PolarHBondContact O-N 3.43Å; V302-V305 PolarHBondContact O-N 3.01Å; V305-R308 WeakPolarHBondContact O-CD 3.33Å; V305-R308 WeakPolarHBondContact O-CG 3.28Å |
| 306 | F | 92.6 | Very high | 90.9 | Very high | 64 Ų | 64 | 32.2 Ų | 32.2 | 28% | 0.281 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -64.2 | -43.6 | 176.6 | -171.8 | -93.4 | 0 | 0 | 0 | 112.3 | M213 V302 M303 F304 L328 D331 I332 | M213-F306 HydrophobicContact SD-CB 4.2Å; M213-F306 HydrophobicContact SD-CD2 3.72Å; M213-F306 HydrophobicContact SD-CG 4.39Å; V302-F306 WeakPolarHBondContact O-CB 3.46Å; V302-F306 PolarHBondContact O-N 3.49Å; M303-F306 PolarHBondContact O-N 2.98Å; F304-F306 VanDerWaalsContact C-N 3.3Å; F304-F306 PolarHBondContact O-N 3.37Å; F306-L328 HydrophobicContact CB-CD1 4.06Å; F306-L328 HydrophobicContact CD1-CD1 3.68Å; F306-L328 HydrophobicContact CE1-CD1 4.26Å; F306-L328 HydrophobicContact CG-CD1 3.86Å; F306-D331 HydrophobicContact CE1-CB 4.02Å; F306-D331 HydrophobicContact CZ-CB 4.15Å; F306-I332 HydrophobicContact CD2-CG2 4.21Å; F306-I332 HydrophobicContact CE2-CG2 3.86Å; F306-I332 HydrophobicContact CZ-CG2 4.05Å |
| 307 | Y | 92.1 | Very high | 90.3 | Very high | 15 Ų | 15 | 37.5 Ų | 37.5 | 6% | 0.059 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | 13 | -179.4 | -65.1 | -56.7 | 0 | 0 | 0 | 114.8 | M303 F304 D309 C310 D311 P312 Y324 L327 L328 D331 | M303-Y307 HydrophobicContact CG-CD2 3.97Å; M303-Y307 HydrophobicContact CG-CE2 4.11Å; M303-Y307 WeakPolarHBondContact O-CD2 3.48Å; M303-Y307 PolarHBondContact O-N 2.89Å; F304-Y307 CarbonylContact O-C 3.55Å; F304-Y307 PolarHBondContact O-N 2.69Å; Y307-D309 VanDerWaalsContact C-N 3.25Å; Y307-D309 PolarHBondContact O-N 3.08Å; Y307-D309 VanDerWaalsContact O-N 3.15Å; Y307-C310 CarbonylContact O-C 3.49Å; Y307-C310 PolarHBondContact O-N 2.9Å; Y307-D311 PolarHBondContact O-N 3.03Å; Y307-P312 HydrophobicContact CD1-CG 4.09Å; Y307-P312 HydrophobicContact CD2-CG 4.1Å; Y307-P312 HydrophobicContact CE1-CG 4.28Å; Y307-P312 HydrophobicContact CE2-CG 4.27Å; Y307-P312 HydrophobicContact CG-CG 4.01Å; Y307-Y324 HydrophobicContact CD2-CD1 4.48Å; Y307-L327 WeakPolarHBondContact OH-CG 3.3Å; Y307-L328 HydrophobicContact CE2-CB 4.15Å; Y307-L328 HydrophobicContact CE2-CD1 3.88Å; Y307-L328 WeakPolarHBondContact OH-CA 3.44Å; Y307-L328 PolarHBondContact OH-N 3Å; Y307-D331 WeakPolarHBondContact CE1-OD2 3.46Å; Y307-D331 PolarHBondContact OH-OD2 3.01Å |
| 308 | R | 87.4 | Confident | 89.9 | Confident | 78 Ų | 78 | 37.7 Ų | 37.7 | 29% | 0.294 | 18% | 0.183 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.8 | -36.4 | -170.3 | 72.8 | -174.2 | -173.2 | 178.2 | 0.5 | 113.8 | F304 V305 | F304-R308 HydrophobicContact CZ-CB 4.41Å; F304-R308 VanDerWaalsContact O-CA 3.3Å; F304-R308 WeakPolarHBondContact O-CA 3.46Å; F304-R308 WeakPolarHBondContact O-CB 3.33Å; F304-R308 PolarHBondContact O-N 2.9Å; V305-R308 WeakPolarHBondContact O-CD 3.33Å; V305-R308 WeakPolarHBondContact O-CG 3.28Å |
| 309 | D | 85.3 | Confident | 89.2 | Confident | 73 Ų | 73 | 41 Ų | 41 | 39% | 0.39 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -94.6 | -17.9 | -173.4 | -64.9 | -43.8 | 0 | 0 | 0 | 111.9 | Y307 S482 | Y307-D309 VanDerWaalsContact C-N 3.25Å; Y307-D309 PolarHBondContact O-N 3.08Å; Y307-D309 VanDerWaalsContact O-N 3.15Å; D309-S482 PolarHBondContact O-N 2.98Å |
| 310 | C | 86.6 | Confident | 88.7 | Confident | 33 Ų | 33 | 42.4 Ų | 42.4 | 22% | 0.223 | 22% | 0.218 | C | C | . | . | S | Bend | trans | -147.6 | 86.4 | -178.9 | -169.3 | 0 | 0 | 0 | 0 | 110.6 | Y307 P312 C483 | Y307-C310 CarbonylContact O-C 3.49Å; Y307-C310 PolarHBondContact O-N 2.9Å; C310-P312 WeakPolarHBondContact O-CD 3.1Å; C310-C483 WeakPolarHBondContact CA-SG 3.44Å; C310-C483 HydrophobicContact CB-CB 4.15Å; C310-C483 WeakPolarHBondContact CB-SG 3.3Å; C310-C483 VanDerWaalsContact SG-CA 3.6Å; C310-C483 WeakPolarHBondContact SG-CB 3.41Å; C310-C483 CovalentContact SG-SG 2.04Å; C310-C483 PolarHBondContact SG-SG 3.4Å |
| 311 | D | 87.9 | Confident | 88.3 | Confident | 7 Ų | 7 | 43.5 Ų | 43.5 | 4% | 0.037 | 23% | 0.225 | C | C | . | . | trans | -70.6 | 115.3 | 179.3 | -173 | -17.4 | 0 | 0 | 0 | 110.8 | Y307 L313 L314 T315 Y324 T478 S479 | Y307-D311 PolarHBondContact O-N 3.03Å; D311-L313 PolarHBondContact O-N 3.41Å; D311-L313 VanDerWaalsContact O-N 3.12Å; D311-L313 WeakPolarHBondContact OD1-CB 3.49Å; D311-L313 PolarHBondContact OD1-N 3.32Å; D311-L314 HydrophobicContact CB-CB 4.2Å; D311-L314 HydrophobicContact CB-CD1 4.01Å; D311-L314 HydrophobicContact CB-CG 4.02Å; D311-L314 PolarHBondContact O-N 3.03Å; D311-T315 PolarHBondContact O-N 3.14Å; D311-T315 VanDerWaalsContact O-N 3.13Å; D311-Y324 WeakPolarHBondContact OD1-CE1 3.49Å; D311-Y324 PolarHBondContact OD1-OH 2.93Å; D311-Y324 PolarHBondContact OD2-OH 3.4Å; D311-T478 WeakPolarHBondContact OD2-CB 3.48Å; D311-T478 WeakPolarHBondContact OD2-CG2 3.24Å; D311-T478 PolarHBondContact OD2-OG1 3.33Å; D311-S479 PolarHBondContact N-O 3Å | ||
| 312 | P | 86.6 | Confident | 87.9 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -20.9 | -176.9 | 26.4 | -36.2 | 0 | 0 | 0 | 113.7 | Y307 C310 T315 E316 R317 I318 Y324 L327 | Y307-P312 HydrophobicContact CD1-CG 4.09Å; Y307-P312 HydrophobicContact CD2-CG 4.1Å; Y307-P312 HydrophobicContact CE1-CG 4.28Å; Y307-P312 HydrophobicContact CE2-CG 4.27Å; Y307-P312 HydrophobicContact CG-CG 4.01Å; C310-P312 WeakPolarHBondContact O-CD 3.1Å; P312-T315 WeakPolarHBondContact CA-OG1 3.43Å; P312-T315 PolarHBondContact O-OG1 3.1Å; P312-E316 PolarHBondContact O-N 3.17Å; P312-R317 HydrophobicContact CB-CB 3.9Å; P312-R317 PolarHBondContact O-N 2.83Å; P312-I318 HydrophobicContact CB-CD1 4.38Å; P312-I318 HydrophobicContact CB-CG1 4.18Å; P312-I318 HydrophobicContact CG-CD1 4.12Å; P312-I318 HydrophobicContact CG-CG1 4.45Å; P312-I318 PolarHBondContact O-N 3.49Å; P312-Y324 HydrophobicContact CG-CD1 3.74Å; P312-Y324 HydrophobicContact CG-CE1 3.51Å; P312-L327 HydrophobicContact CB-CD2 3.61Å; P312-L327 HydrophobicContact CG-CD2 3.99Å |
| 313 | L | 86.5 | Confident | 87.6 | Confident | 45 Ų | 45 | 44.3 Ų | 44.3 | 24% | 0.236 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.6 | -36.3 | 175.3 | -172.4 | 65.9 | 0 | 0 | 0 | 111.5 | D311 I318 P321 Y324 | D311-L313 PolarHBondContact O-N 3.41Å; D311-L313 VanDerWaalsContact O-N 3.12Å; D311-L313 WeakPolarHBondContact OD1-CB 3.49Å; D311-L313 PolarHBondContact OD1-N 3.32Å; L313-I318 HydrophobicContact CB-CD1 4.11Å; L313-I318 HydrophobicContact CB-CG1 4.02Å; L313-I318 HydrophobicContact CD1-CD1 4.34Å; L313-I318 HydrophobicContact CD1-CG1 3.99Å; L313-P321 HydrophobicContact CD2-CG 4.48Å; L313-Y324 HydrophobicContact CB-CE1 4.46Å; L313-Y324 HydrophobicContact CB-CE2 4.37Å; L313-Y324 WeakPolarHBondContact CB-OH 3.03Å; L313-Y324 HydrophobicContact CD2-CE2 4.27Å |
| 314 | L | 85.1 | Confident | 87.4 | Confident | 84 Ų | 84 | 44.8 Ų | 44.8 | 44% | 0.44 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | -28.5 | 177 | -65.8 | -179 | 0 | 0 | 0 | 112.2 | D311 E316 A480 | D311-L314 HydrophobicContact CB-CB 4.2Å; D311-L314 HydrophobicContact CB-CD1 4.01Å; D311-L314 HydrophobicContact CB-CG 4.02Å; D311-L314 PolarHBondContact O-N 3.03Å; L314-E316 VanDerWaalsContact C-N 3.3Å; L314-A480 HydrophobicContact CB-CB 4.02Å; L314-A480 HydrophobicContact CD1-CB 4.29Å |
| 315 | T | 84.4 | Confident | 87.3 | Confident | 35 Ų | 35 | 44.2 Ų | 44.2 | 22% | 0.215 | 23% | 0.228 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89 | 7.6 | 176.2 | 67.6 | 0 | 0 | 0 | 0 | 113.8 | D311 P312 R317 A480 C483 | D311-T315 PolarHBondContact O-N 3.14Å; D311-T315 VanDerWaalsContact O-N 3.13Å; P312-T315 WeakPolarHBondContact CA-OG1 3.43Å; P312-T315 PolarHBondContact O-OG1 3.1Å; T315-R317 PolarHBondContact O-N 3.33Å; T315-A480 HydrophobicContact CG2-CB 4.36Å; T315-C483 HydrophobicContact CG2-CB 4.17Å; T315-C483 WeakPolarHBondContact CG2-SG 3.4Å |
| 316 | E | 83.7 | Confident | 87.2 | Confident | 173 Ų | 173 | 44.2 Ų | 44.2 | 81% | 0.808 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 57.2 | 21.7 | -178 | -54.8 | -177.8 | 173.4 | 0 | 0 | 114.5 | P312 L314 I318 | P312-E316 PolarHBondContact O-N 3.17Å; L314-E316 VanDerWaalsContact C-N 3.3Å; E316-I318 PolarHBondContact O-N 3.31Å |
| 317 | R | 82.8 | Confident | 87.1 | Confident | 112 Ų | 112 | 41.9 Ų | 41.9 | 42% | 0.423 | 22% | 0.219 | S | C | . | . | S | Bend | trans | -68.6 | -29.6 | 169.9 | -79.1 | 179.2 | 68.2 | -162 | -1.3 | 110.8 | P312 T315 D331 | P312-R317 HydrophobicContact CB-CB 3.9Å; P312-R317 PolarHBondContact O-N 2.83Å; T315-R317 PolarHBondContact O-N 3.33Å; R317-D331 IonicContact CZ-OD2 3.29Å; R317-D331 IonicContact NH1-OD2 2.71Å; R317-D331 IonicContact NH2-OD1 3.06Å; R317-D331 PolarHBondContact NH2-OD1 3.3Å; R317-D331 IonicContact NH2-OD2 4Å; R317-D331 PolarHBondContact NH2-OD2 3.35Å; R317-D331 VanDerWaalsContact NH2-OD2 3.08Å |
| 318 | I | 86.2 | Confident | 87.1 | Confident | 3 Ų | 3 | 41.2 Ų | 41.2 | 2% | 0.015 | 22% | 0.216 | C | C | . | . | trans | -125.7 | 148.6 | 170.8 | 60.7 | 175.6 | 0 | 0 | 0 | 109.8 | P312 L313 E316 Q323 Y324 L327 | P312-I318 HydrophobicContact CB-CD1 4.38Å; P312-I318 HydrophobicContact CB-CG1 4.18Å; P312-I318 HydrophobicContact CG-CD1 4.12Å; P312-I318 HydrophobicContact CG-CG1 4.45Å; P312-I318 PolarHBondContact O-N 3.49Å; L313-I318 HydrophobicContact CB-CD1 4.11Å; L313-I318 HydrophobicContact CB-CG1 4.02Å; L313-I318 HydrophobicContact CD1-CD1 4.34Å; L313-I318 HydrophobicContact CD1-CG1 3.99Å; E316-I318 PolarHBondContact O-N 3.31Å; I318-Q323 HydrophobicContact CB-CB 3.89Å; I318-Q323 HydrophobicContact CG2-CB 3.74Å; I318-Y324 HydrophobicContact CD1-CD1 3.54Å; I318-Y324 HydrophobicContact CD1-CD2 3.87Å; I318-Y324 HydrophobicContact CD1-CE1 3.69Å; I318-Y324 HydrophobicContact CD1-CE2 3.95Å; I318-Y324 HydrophobicContact CD1-CG 3.62Å; I318-L327 HydrophobicContact CG2-CB 4.37Å; I318-L327 HydrophobicContact CG2-CD2 3.8Å | ||
| 319 | S | 82.9 | Confident | 87.4 | Confident | 112 Ų | 112 | 37.5 Ų | 37.5 | 78% | 0.783 | 20% | 0.202 | S | C | * | . | S | Bend | trans | -98.9 | -17.3 | 178.7 | -48.6 | 0 | 0 | 0 | 0 | 112.7 | ||
| 320 | A | 84.4 | Confident | 87.6 | Confident | 29 Ų | 29 | 34.7 Ų | 34.7 | 24% | 0.24 | 19% | 0.187 | C | C | . | . | S | Bend | trans | -141.1 | 146.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | D322 Q323 | A320-D322 PolarHBondContact O-N 3.5Å; A320-D322 VanDerWaalsContact O-N 3.15Å; A320-Q323 WeakPolarHBondContact O-CB 3.41Å; A320-Q323 PolarHBondContact O-N 3.36Å |
| 321 | P | 86.1 | Confident | 87.7 | Confident | 23 Ų | 23 | 35.5 Ų | 35.5 | 15% | 0.149 | 19% | 0.189 | C | C | . | . | G | 310 helix | trans | -57.2 | -29.1 | 177.4 | -25 | 33.9 | 0 | 0 | 0 | 114.1 | A78 R82 L313 Q323 Y324 | A78-P321 HydrophobicContact CB-CB 4.34Å; A78-P321 WeakPolarHBondContact CB-O 3.46Å; R82-P321 VanDerWaalsContact NH1-CG 3.33Å; L313-P321 HydrophobicContact CD2-CG 4.48Å; P321-Q323 PolarHBondContact O-N 3.06Å; P321-Q323 VanDerWaalsContact O-N 3.12Å; P321-Y324 HydrophobicContact CB-CD2 4.19Å; P321-Y324 HydrophobicContact CB-CE2 4.24Å; P321-Y324 WeakPolarHBondContact O-CB 3.43Å; P321-Y324 WeakPolarHBondContact O-CD2 3.39Å; P321-Y324 PolarHBondContact O-N 3.37Å; P321-Y324 VanDerWaalsContact O-N 3.15Å |
| 322 | D | 86.9 | Confident | 87.9 | Confident | 11 Ų | 11 | 35.3 Ų | 35.3 | 6% | 0.059 | 19% | 0.188 | C | C | . | . | G | 310 helix | trans | -67.2 | -14.3 | -179.7 | -57.9 | -43.8 | 0 | 0 | 0 | 113 | L74 L154 A320 P326 G411 V412 | L74-D322 HydrophobicContact CB-CB 4.5Å; L74-D322 HydrophobicContact CD1-CB 4.45Å; L154-D322 HydrophobicContact CD2-CB 3.77Å; A320-D322 PolarHBondContact O-N 3.5Å; A320-D322 VanDerWaalsContact O-N 3.15Å; D322-P326 WeakPolarHBondContact O-CD 3.49Å; D322-G411 WeakPolarHBondContact OD2-CA 3.17Å; D322-V412 HydrophobicContact CB-CG2 4.43Å; D322-V412 PolarHBondContact OD2-N 3.41Å |
| 323 | Q | 89.9 | Confident | 88.1 | Confident | 20 Ų | 20 | 35.6 Ų | 35.6 | 9% | 0.093 | 19% | 0.189 | C | C | . | . | G | 310 helix | trans | -87.9 | -6.6 | 177.8 | -63.3 | 175.5 | -20.4 | 0 | 0 | 113.4 | L154 Q158 I318 A320 P321 M325 P326 L327 | L154-Q323 HydrophobicContact CD1-CG 4.42Å; L154-Q323 HydrophobicContact CD2-CG 4.35Å; Q158-Q323 HydrophobicContact CG-CG 4.21Å; I318-Q323 HydrophobicContact CB-CB 3.89Å; I318-Q323 HydrophobicContact CG2-CB 3.74Å; A320-Q323 WeakPolarHBondContact O-CB 3.41Å; A320-Q323 PolarHBondContact O-N 3.36Å; P321-Q323 PolarHBondContact O-N 3.06Å; P321-Q323 VanDerWaalsContact O-N 3.12Å; Q323-M325 PolarHBondContact O-N 2.93Å; Q323-P326 WeakPolarHBondContact O-CD 3.35Å; Q323-L327 WeakPolarHBondContact O-CB 3.19Å; Q323-L327 PolarHBondContact O-N 2.82Å; Q323-L327 VanDerWaalsContact O-N 3.16Å |
| 324 | Y | 90.8 | Very high | 88.1 | Confident | 11 Ų | 11 | 40.6 Ų | 40.6 | 4% | 0.043 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.1 | -48.6 | 177.8 | -86.3 | -68.3 | 0 | 0 | 0 | 112.3 | A78 R82 M303 Y307 D311 P312 L313 I318 P321 L327 L328 | A78-Y324 HydrophobicContact CB-CD2 4.37Å; R82-Y324 HydrophobicContact CG-CE2 4.45Å; M303-Y324 HydrophobicContact CE-CG 4.08Å; M303-Y324 VanDerWaalsContact SD-CB 3.53Å; M303-Y324 HydrophobicContact SD-CG 4.38Å; Y307-Y324 HydrophobicContact CD2-CD1 4.48Å; D311-Y324 WeakPolarHBondContact OD1-CE1 3.49Å; D311-Y324 PolarHBondContact OD1-OH 2.93Å; D311-Y324 PolarHBondContact OD2-OH 3.4Å; P312-Y324 HydrophobicContact CG-CD1 3.74Å; P312-Y324 HydrophobicContact CG-CE1 3.51Å; L313-Y324 HydrophobicContact CB-CE1 4.46Å; L313-Y324 HydrophobicContact CB-CE2 4.37Å; L313-Y324 WeakPolarHBondContact CB-OH 3.03Å; L313-Y324 HydrophobicContact CD2-CE2 4.27Å; I318-Y324 HydrophobicContact CD1-CD1 3.54Å; I318-Y324 HydrophobicContact CD1-CD2 3.87Å; I318-Y324 HydrophobicContact CD1-CE1 3.69Å; I318-Y324 HydrophobicContact CD1-CE2 3.95Å; I318-Y324 HydrophobicContact CD1-CG 3.62Å; P321-Y324 HydrophobicContact CB-CD2 4.19Å; P321-Y324 HydrophobicContact CB-CE2 4.24Å; P321-Y324 WeakPolarHBondContact O-CB 3.43Å; P321-Y324 WeakPolarHBondContact O-CD2 3.39Å; P321-Y324 PolarHBondContact O-N 3.37Å; P321-Y324 VanDerWaalsContact O-N 3.15Å; Y324-L327 PolarHBondContact O-N 3.11Å; Y324-L328 WeakPolarHBondContact O-CB 3.42Å; Y324-L328 PolarHBondContact O-N 2.91Å |
| 325 | M | 91.9 | Very high | 88.1 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -68.1 | -45.6 | -174.1 | -168.2 | 74.1 | -164.8 | 0 | 0 | 112.6 | L74 P77 I205 C299 M303 Q323 L327 L328 V329 F343 | L74-M325 HydrophobicContact CD2-CB 4.06Å; P77-M325 HydrophobicContact CB-SD 3.75Å; P77-M325 HydrophobicContact CG-CG 4.49Å; P77-M325 HydrophobicContact CG-SD 3.9Å; I205-M325 HydrophobicContact CB-CE 4.24Å; I205-M325 HydrophobicContact CD1-CE 3.44Å; I205-M325 VanDerWaalsContact CD1-CE 3.44Å; I205-M325 HydrophobicContact CG1-CE 4.26Å; I205-M325 HydrophobicContact CG2-CE 3.58Å; C299-M325 HydrophobicContact CB-CE 4.12Å; C299-M325 HydrophobicContact CB-SD 4.42Å; M303-M325 HydrophobicContact SD-SD 4.3Å; Q323-M325 PolarHBondContact O-N 2.93Å; M325-L327 VanDerWaalsContact C-N 3.31Å; M325-L327 PolarHBondContact O-N 3.41Å; M325-L328 PolarHBondContact O-N 3.4Å; M325-L328 HydrophobicContact SD-CD2 4.41Å; M325-V329 HydrophobicContact CE-CG2 4.32Å; M325-V329 WeakPolarHBondContact O-CG2 3.43Å; M325-V329 PolarHBondContact O-N 2.95Å; M325-V329 VanDerWaalsContact O-N 3.08Å; M325-F343 HydrophobicContact CB-CZ 4.18Å; M325-F343 HydrophobicContact CE-CE2 4.08Å; M325-F343 HydrophobicContact CG-CE2 3.58Å; M325-F343 HydrophobicContact CG-CZ 3.54Å |
| 326 | P | 91.4 | Very high | 88.3 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.3 | -41.2 | 172.9 | -25.4 | 36.2 | 0 | 0 | 0 | 112.7 | L74 I155 Q158 V159 D322 Q323 V329 L330 F343 | L74-P326 HydrophobicContact CD2-CG 3.81Å; I155-P326 HydrophobicContact CG1-CG 4.06Å; I155-P326 HydrophobicContact CG2-CG 4.47Å; Q158-P326 HydrophobicContact CB-CB 4.06Å; V159-P326 HydrophobicContact CG1-CB 4.46Å; D322-P326 WeakPolarHBondContact O-CD 3.49Å; Q323-P326 WeakPolarHBondContact O-CD 3.35Å; P326-V329 PolarHBondContact O-N 2.9Å; P326-L330 WeakPolarHBondContact O-CG 3.49Å; P326-L330 PolarHBondContact O-N 3.15Å; P326-L330 VanDerWaalsContact O-N 3.15Å; P326-F343 HydrophobicContact CB-CE1 4.34Å; P326-F343 HydrophobicContact CG-CE1 4.16Å; P326-F343 HydrophobicContact CG-CZ 4.49Å |
| 327 | L | 90.7 | Very high | 88.4 | Confident | 15 Ų | 15 | 40.3 Ų | 40.3 | 8% | 0.079 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63 | -46.4 | 177.5 | -175.8 | 68 | 0 | 0 | 0 | 111.4 | Y307 P312 I318 Q323 Y324 M325 V329 L330 D331 | Y307-L327 WeakPolarHBondContact OH-CG 3.3Å; P312-L327 HydrophobicContact CB-CD2 3.61Å; P312-L327 HydrophobicContact CG-CD2 3.99Å; I318-L327 HydrophobicContact CG2-CB 4.37Å; I318-L327 HydrophobicContact CG2-CD2 3.8Å; Q323-L327 WeakPolarHBondContact O-CB 3.19Å; Q323-L327 PolarHBondContact O-N 2.82Å; Q323-L327 VanDerWaalsContact O-N 3.16Å; Y324-L327 PolarHBondContact O-N 3.11Å; M325-L327 VanDerWaalsContact C-N 3.31Å; M325-L327 PolarHBondContact O-N 3.41Å; L327-V329 VanDerWaalsContact C-N 3.28Å; L327-V329 PolarHBondContact O-N 3.47Å; L327-L330 PolarHBondContact O-N 3.31Å; L327-D331 PolarHBondContact O-N 2.96Å |
| 328 | L | 92.1 | Very high | 88.5 | Confident | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.005 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -56.7 | -44.6 | 177.6 | -177.6 | 72.8 | 0 | 0 | 0 | 111.4 | I205 M303 F306 Y307 Y324 M325 L330 D331 I332 | I205-L328 HydrophobicContact CG2-CD2 4.36Å; M303-L328 HydrophobicContact CB-CD2 3.76Å; M303-L328 HydrophobicContact CG-CB 4.33Å; M303-L328 HydrophobicContact CG-CD1 4.38Å; M303-L328 HydrophobicContact CG-CD2 3.87Å; M303-L328 HydrophobicContact CG-CG 4.42Å; M303-L328 HydrophobicContact SD-CB 4.43Å; M303-L328 HydrophobicContact SD-CD2 4.24Å; F306-L328 HydrophobicContact CB-CD1 4.06Å; F306-L328 HydrophobicContact CD1-CD1 3.68Å; F306-L328 HydrophobicContact CE1-CD1 4.26Å; F306-L328 HydrophobicContact CG-CD1 3.86Å; Y307-L328 HydrophobicContact CE2-CB 4.15Å; Y307-L328 HydrophobicContact CE2-CD1 3.88Å; Y307-L328 WeakPolarHBondContact OH-CA 3.44Å; Y307-L328 PolarHBondContact OH-N 3Å; Y324-L328 WeakPolarHBondContact O-CB 3.42Å; Y324-L328 PolarHBondContact O-N 2.91Å; M325-L328 PolarHBondContact O-N 3.4Å; M325-L328 HydrophobicContact SD-CD2 4.41Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 3.03Å; L328-D331 PolarHBondContact O-N 3.34Å; L328-I332 HydrophobicContact CD1-CG2 3.85Å; L328-I332 HydrophobicContact CG-CD1 4.3Å; L328-I332 HydrophobicContact CG-CG2 4.22Å; L328-I332 VanDerWaalsContact O-CG1 3.29Å; L328-I332 WeakPolarHBondContact O-CG1 3.5Å; L328-I332 WeakPolarHBondContact O-CG2 3.33Å; L328-I332 PolarHBondContact O-N 3.36Å |
| 329 | V | 92.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62 | -41.9 | -179.8 | 170.2 | 0 | 0 | 0 | 0 | 111.3 | I205 M325 P326 L327 F333 P340 F343 | I205-V329 HydrophobicContact CD1-CG2 3.76Å; I205-V329 HydrophobicContact CG1-CG2 4.1Å; M325-V329 HydrophobicContact CE-CG2 4.32Å; M325-V329 WeakPolarHBondContact O-CG2 3.43Å; M325-V329 PolarHBondContact O-N 2.95Å; M325-V329 VanDerWaalsContact O-N 3.08Å; P326-V329 PolarHBondContact O-N 2.9Å; L327-V329 VanDerWaalsContact C-N 3.28Å; L327-V329 PolarHBondContact O-N 3.47Å; V329-F333 HydrophobicContact CG1-CD2 4.12Å; V329-F333 WeakPolarHBondContact O-CB 3.3Å; V329-F333 WeakPolarHBondContact O-CD2 3.49Å; V329-F333 PolarHBondContact O-N 3Å; V329-P340 HydrophobicContact CG1-CB 4.11Å; V329-P340 HydrophobicContact CG1-CG 4.41Å; V329-F343 HydrophobicContact CB-CD1 4.2Å; V329-F343 HydrophobicContact CB-CG 4.36Å; V329-F343 HydrophobicContact CG1-CB 3.89Å; V329-F343 HydrophobicContact CG1-CD1 4.12Å; V329-F343 HydrophobicContact CG1-CG 4.13Å; V329-F343 HydrophobicContact CG2-CB 4.16Å; V329-F343 HydrophobicContact CG2-CD1 3.89Å; V329-F343 HydrophobicContact CG2-CD2 3.9Å; V329-F343 HydrophobicContact CG2-CE1 4.23Å; V329-F343 HydrophobicContact CG2-CE2 4.24Å; V329-F343 HydrophobicContact CG2-CG 3.71Å; V329-F343 HydrophobicContact CG2-CZ 4.4Å |
| 330 | L | 89.6 | Confident | 88.8 | Confident | 13 Ų | 13 | 31.9 Ų | 31.9 | 7% | 0.068 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -65.5 | -42.8 | 175.7 | -65.4 | 173.5 | 0 | 0 | 0 | 111.4 | F12 V159 P326 L327 L328 E334 | F12-L330 HydrophobicContact CE1-CD2 4.43Å; V159-L330 HydrophobicContact CG1-CD1 4.44Å; V159-L330 HydrophobicContact CG1-CD2 4.39Å; P326-L330 WeakPolarHBondContact O-CG 3.49Å; P326-L330 PolarHBondContact O-N 3.15Å; P326-L330 VanDerWaalsContact O-N 3.15Å; L327-L330 PolarHBondContact O-N 3.31Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 3.03Å; L330-E334 PolarHBondContact O-N 3.5Å |
| 331 | D | 90.3 | Very high | 89.1 | Confident | 50 Ų | 50 | 30.5 Ų | 30.5 | 27% | 0.267 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -68.8 | -37.8 | -177.9 | -73.2 | -3.6 | 0 | 0 | 0 | 112.5 | F306 Y307 R317 L327 L328 | F306-D331 HydrophobicContact CE1-CB 4.02Å; F306-D331 HydrophobicContact CZ-CB 4.15Å; Y307-D331 WeakPolarHBondContact CE1-OD2 3.46Å; Y307-D331 PolarHBondContact OH-OD2 3.01Å; R317-D331 IonicContact CZ-OD2 3.29Å; R317-D331 IonicContact NH1-OD2 2.71Å; R317-D331 IonicContact NH2-OD1 3.06Å; R317-D331 PolarHBondContact NH2-OD1 3.3Å; R317-D331 IonicContact NH2-OD2 4Å; R317-D331 PolarHBondContact NH2-OD2 3.35Å; R317-D331 VanDerWaalsContact NH2-OD2 3.08Å; L327-D331 PolarHBondContact O-N 2.96Å; L328-D331 PolarHBondContact O-N 3.34Å |
| 332 | I | 91.8 | Very high | 89.4 | Confident | 3 Ų | 3 | 31.3 Ų | 31.3 | 2% | 0.015 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -89.6 | -16.8 | -175.3 | 73.2 | -177 | 0 | 0 | 0 | 114.6 | I205 R208 L212 F306 L328 | I205-I332 HydrophobicContact CG2-CD1 3.93Å; R208-I332 HydrophobicContact CB-CD1 4.48Å; R208-I332 HydrophobicContact CG-CB 4.24Å; R208-I332 HydrophobicContact CG-CD1 4.35Å; R208-I332 HydrophobicContact CG-CG1 4.22Å; R208-I332 PolarHBondContact NE-O 3.45Å; L212-I332 HydrophobicContact CD1-CB 3.65Å; L212-I332 HydrophobicContact CD1-CG2 3.82Å; F306-I332 HydrophobicContact CD2-CG2 4.21Å; F306-I332 HydrophobicContact CE2-CG2 3.86Å; F306-I332 HydrophobicContact CZ-CG2 4.05Å; L328-I332 HydrophobicContact CD1-CG2 3.85Å; L328-I332 HydrophobicContact CG-CD1 4.3Å; L328-I332 HydrophobicContact CG-CG2 4.22Å; L328-I332 VanDerWaalsContact O-CG1 3.29Å; L328-I332 WeakPolarHBondContact O-CG1 3.5Å; L328-I332 WeakPolarHBondContact O-CG2 3.33Å; L328-I332 PolarHBondContact O-N 3.36Å |
| 333 | F | 91.1 | Very high | 89.6 | Confident | 7 Ų | 7 | 30.9 Ų | 30.9 | 3% | 0.031 | 17% | 0.166 | C | C | . | . | S | Bend | trans | -117.2 | 19.8 | -178.1 | -65.9 | -70.6 | 0 | 0 | 0 | 113.7 | V204 I205 R208 V329 D335 L336 V339 P340 | V204-F333 HydrophobicContact CG1-CE1 4Å; V204-F333 HydrophobicContact CG1-CZ 3.68Å; I205-F333 HydrophobicContact CG1-CE2 3.9Å; R208-F333 HydrophobicContact CB-CD1 4.5Å; R208-F333 HydrophobicContact CB-CE1 3.5Å; R208-F333 VanDerWaalsContact CB-CE1 3.5Å; R208-F333 HydrophobicContact CB-CE2 4.38Å; R208-F333 HydrophobicContact CB-CZ 3.41Å; R208-F333 VanDerWaalsContact CB-CZ 3.41Å; R208-F333 HydrophobicContact CG-CD1 4.05Å; R208-F333 HydrophobicContact CG-CE1 3.51Å; R208-F333 HydrophobicContact CG-CZ 3.76Å; V329-F333 HydrophobicContact CG1-CD2 4.12Å; V329-F333 WeakPolarHBondContact O-CB 3.3Å; V329-F333 WeakPolarHBondContact O-CD2 3.49Å; V329-F333 PolarHBondContact O-N 3Å; F333-D335 PolarHBondContact O-N 3.48Å; F333-D335 VanDerWaalsContact O-N 3.12Å; F333-L336 HydrophobicContact CB-CB 4.39Å; F333-L336 HydrophobicContact CD1-CB 3.98Å; F333-L336 HydrophobicContact CD1-CD1 3.77Å; F333-L336 HydrophobicContact CE1-CD1 4.18Å; F333-L336 PolarHBondContact O-N 2.89Å; F333-V339 HydrophobicContact CD1-CB 3.84Å; F333-V339 HydrophobicContact CD1-CG1 3.64Å; F333-V339 HydrophobicContact CD1-CG2 4.25Å; F333-V339 HydrophobicContact CD2-CG1 3.89Å; F333-V339 HydrophobicContact CE1-CB 4.15Å; F333-V339 HydrophobicContact CE1-CG1 3.5Å; F333-V339 VanDerWaalsContact CE1-CG1 3.5Å; F333-V339 HydrophobicContact CE1-CG2 4.41Å; F333-V339 HydrophobicContact CE2-CG1 3.76Å; F333-V339 HydrophobicContact CG-CB 4.07Å; F333-V339 HydrophobicContact CG-CG1 3.86Å; F333-V339 HydrophobicContact CZ-CG1 3.58Å; F333-P340 HydrophobicContact CB-CG 4.03Å |
| 334 | E | 85.6 | Confident | 89.7 | Confident | 150 Ų | 150 | 30 Ų | 30 | 70% | 0.701 | 16% | 0.162 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -49.4 | -39.3 | 176.2 | -170.7 | 176 | -179 | 0 | 0 | 112.5 | L330 | L330-E334 PolarHBondContact O-N 3.5Š|
| 335 | D | 86.3 | Confident | 89.8 | Confident | 128 Ų | 128 | 29.5 Ų | 29.5 | 68% | 0.684 | 16% | 0.16 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -89.1 | -1.2 | -179.3 | -54.4 | -51.6 | 0 | 0 | 0 | 115.1 | F333 P337 | F333-D335 PolarHBondContact O-N 3.48Å; F333-D335 VanDerWaalsContact O-N 3.12Å; D335-P337 WeakPolarHBondContact O-CD 3.31Å |
| 336 | L | 87.1 | Confident | 89.8 | Confident | 72 Ų | 72 | 29.5 Ų | 29.5 | 38% | 0.377 | 16% | 0.16 | S | C | . | . | trans | -126.1 | 81.5 | -168.7 | -73.2 | 170.4 | 0 | 0 | 0 | 111.4 | F333 V339 P340 | F333-L336 HydrophobicContact CB-CB 4.39Å; F333-L336 HydrophobicContact CD1-CB 3.98Å; F333-L336 HydrophobicContact CD1-CD1 3.77Å; F333-L336 HydrophobicContact CE1-CD1 4.18Å; F333-L336 PolarHBondContact O-N 2.89Å; L336-V339 HydrophobicContact CB-CG2 4.38Å; L336-P340 WeakPolarHBondContact O-CD 3.45Å | ||
| 337 | P | 85.5 | Confident | 89.9 | Confident | 86 Ų | 86 | 29.5 Ų | 29.5 | 56% | 0.558 | 16% | 0.16 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | 144.1 | -178.7 | 27.3 | -34.9 | 0 | 0 | 0 | 111.8 | W15 D335 | W15-P337 HydrophobicContact CB-CB 4.2Å; W15-P337 HydrophobicContact CG-CB 4.45Å; D335-P337 WeakPolarHBondContact O-CD 3.31Å |
| 338 | G | 85.6 | Confident | 89.9 | Confident | 8 Ų | 8 | 28.8 Ų | 28.8 | 8% | 0.082 | 16% | 0.156 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 96.4 | -28.2 | -180 | 0 | 0 | 0 | 0 | 0 | 114.1 | D16 G341 L342 | D16-G338 VanDerWaalsContact OD1-C 3.31Å; D16-G338 WeakPolarHBondContact OD1-CA 3.3Å; D16-G338 PolarHBondContact OD1-N 3.2Å; G338-G341 PolarHBondContact O-N 3.44Å; G338-L342 PolarHBondContact O-N 3.45Å; G338-L342 VanDerWaalsContact O-N 3.11Å |
| 339 | V | 86.7 | Confident | 89.8 | Confident | 34 Ų | 34 | 28.7 Ų | 28.7 | 21% | 0.206 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -72.5 | -41.1 | 178.7 | -176.1 | 0 | 0 | 0 | 0 | 112.6 | V204 F333 L336 G341 L342 F343 | V204-V339 HydrophobicContact CG1-CG1 3.46Å; V204-V339 VanDerWaalsContact CG1-CG1 3.46Å; F333-V339 HydrophobicContact CD1-CB 3.84Å; F333-V339 HydrophobicContact CD1-CG1 3.64Å; F333-V339 HydrophobicContact CD1-CG2 4.25Å; F333-V339 HydrophobicContact CD2-CG1 3.89Å; F333-V339 HydrophobicContact CE1-CB 4.15Å; F333-V339 HydrophobicContact CE1-CG1 3.5Å; F333-V339 VanDerWaalsContact CE1-CG1 3.5Å; F333-V339 HydrophobicContact CE1-CG2 4.41Å; F333-V339 HydrophobicContact CE2-CG1 3.76Å; F333-V339 HydrophobicContact CG-CB 4.07Å; F333-V339 HydrophobicContact CG-CG1 3.86Å; F333-V339 HydrophobicContact CZ-CG1 3.58Å; L336-V339 HydrophobicContact CB-CG2 4.38Å; V339-G341 PolarHBondContact O-N 2.96Å; V339-L342 WeakPolarHBondContact O-CA 3.37Å; V339-L342 VanDerWaalsContact O-CB 3.31Å; V339-L342 WeakPolarHBondContact O-CB 3.31Å; V339-L342 PolarHBondContact O-N 3.42Å; V339-F343 PolarHBondContact O-N 3.39Å; V339-F343 VanDerWaalsContact O-N 3.1Å |
| 340 | P | 89.5 | Confident | 89.7 | Confident | 8 Ų | 8 | 28.7 Ų | 28.7 | 5% | 0.052 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -54.7 | -39 | 167.5 | -25.9 | 34.1 | 0 | 0 | 0 | 112.6 | F12 D16 V329 F333 L336 L342 F343 L344 | F12-P340 HydrophobicContact CD1-CB 4.05Å; F12-P340 HydrophobicContact CE1-CB 3.33Å; F12-P340 VanDerWaalsContact CZ-C 3.44Å; F12-P340 HydrophobicContact CZ-CB 3.91Å; F12-P340 VanDerWaalsContact CZ-O 3.28Å; F12-P340 WeakPolarHBondContact CZ-O 3.44Å; D16-P340 VanDerWaalsContact OD1-CD 3.28Å; D16-P340 WeakPolarHBondContact OD1-CD 3.44Å; V329-P340 HydrophobicContact CG1-CB 4.11Å; V329-P340 HydrophobicContact CG1-CG 4.41Å; F333-P340 HydrophobicContact CB-CG 4.03Å; L336-P340 WeakPolarHBondContact O-CD 3.45Å; P340-L342 VanDerWaalsContact C-N 3.32Å; P340-L342 PolarHBondContact O-N 3.03Å; P340-F343 WeakPolarHBondContact O-CB 3.29Å; P340-F343 PolarHBondContact O-N 2.65Å; P340-F343 VanDerWaalsContact O-N 3.14Å; P340-L344 PolarHBondContact O-N 3.04Å |
| 341 | G | 90.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.5 | -37.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | D16 G338 V339 L344 A345 | D16-G341 WeakPolarHBondContact O-CA 3.49Å; D16-G341 PolarHBondContact OD1-N 3.15Å; G338-G341 PolarHBondContact O-N 3.44Å; V339-G341 PolarHBondContact O-N 2.96Å; G341-L344 PolarHBondContact O-N 3.45Å; G341-A345 WeakPolarHBondContact O-CB 3.09Å; G341-A345 PolarHBondContact O-N 2.83Å |
| 342 | L | 92.3 | Very high | 89.8 | Confident | 39 Ų | 39 | 25.7 Ų | 25.7 | 20% | 0.204 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -65.9 | -37 | 173.5 | -179.4 | 64.4 | 0 | 0 | 0 | 112.2 | V19 V197 V204 G338 V339 P340 A345 C346 | V19-L342 HydrophobicContact CG1-CB 4.2Å; V197-L342 HydrophobicContact CG1-CD1 4.35Å; V204-L342 HydrophobicContact CG2-CD2 4.12Å; G338-L342 PolarHBondContact O-N 3.45Å; G338-L342 VanDerWaalsContact O-N 3.11Å; V339-L342 WeakPolarHBondContact O-CA 3.37Å; V339-L342 VanDerWaalsContact O-CB 3.31Å; V339-L342 WeakPolarHBondContact O-CB 3.31Å; V339-L342 PolarHBondContact O-N 3.42Å; P340-L342 VanDerWaalsContact C-N 3.32Å; P340-L342 PolarHBondContact O-N 3.03Å; L342-A345 WeakPolarHBondContact O-CB 3.33Å; L342-A345 PolarHBondContact O-N 2.84Å; L342-C346 WeakPolarHBondContact O-CB 3.33Å; L342-C346 PolarHBondContact O-N 3.25Å |
| 343 | F | 91.4 | Very high | 89.7 | Confident | 3 Ų | 3 | 25.6 Ų | 25.6 | 1% | 0.013 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.6 | -43.6 | 173.8 | 173.2 | -109.3 | 0 | 0 | 0 | 111.9 | V73 L74 I155 I205 M325 P326 V329 V339 P340 A345 C346 A347 | V73-F343 HydrophobicContact CG1-CE2 3.78Å; V73-F343 HydrophobicContact CG1-CZ 4.36Å; L74-F343 HydrophobicContact CD2-CZ 4.07Å; I155-F343 HydrophobicContact CD1-CE1 4.23Å; I155-F343 HydrophobicContact CD1-CZ 4.3Å; I155-F343 HydrophobicContact CG2-CD1 4.19Å; I155-F343 HydrophobicContact CG2-CE1 3.79Å; I205-F343 HydrophobicContact CD1-CB 4.35Å; I205-F343 HydrophobicContact CD1-CD2 3.54Å; I205-F343 HydrophobicContact CD1-CE2 4.23Å; I205-F343 HydrophobicContact CD1-CG 4.26Å; M325-F343 HydrophobicContact CB-CZ 4.18Å; M325-F343 HydrophobicContact CE-CE2 4.08Å; M325-F343 HydrophobicContact CG-CE2 3.58Å; M325-F343 HydrophobicContact CG-CZ 3.54Å; P326-F343 HydrophobicContact CB-CE1 4.34Å; P326-F343 HydrophobicContact CG-CE1 4.16Å; P326-F343 HydrophobicContact CG-CZ 4.49Å; V329-F343 HydrophobicContact CB-CD1 4.2Å; V329-F343 HydrophobicContact CB-CG 4.36Å; V329-F343 HydrophobicContact CG1-CB 3.89Å; V329-F343 HydrophobicContact CG1-CD1 4.12Å; V329-F343 HydrophobicContact CG1-CG 4.13Å; V329-F343 HydrophobicContact CG2-CB 4.16Å; V329-F343 HydrophobicContact CG2-CD1 3.89Å; V329-F343 HydrophobicContact CG2-CD2 3.9Å; V329-F343 HydrophobicContact CG2-CE1 4.23Å; V329-F343 HydrophobicContact CG2-CE2 4.24Å; V329-F343 HydrophobicContact CG2-CG 3.71Å; V329-F343 HydrophobicContact CG2-CZ 4.4Å; V339-F343 PolarHBondContact O-N 3.39Å; V339-F343 VanDerWaalsContact O-N 3.1Å; P340-F343 WeakPolarHBondContact O-CB 3.29Å; P340-F343 PolarHBondContact O-N 2.65Å; P340-F343 VanDerWaalsContact O-N 3.14Å; F343-A345 VanDerWaalsContact C-N 3.27Å; F343-A345 PolarHBondContact O-N 3.36Å; F343-C346 WeakPolarHBondContact O-CB 3.41Å; F343-C346 PolarHBondContact O-N 3.41Å; F343-A347 PolarHBondContact O-N 3.23Å |
| 344 | L | 91.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -58.8 | -43.4 | 173.1 | -173.3 | 69 | 0 | 0 | 0 | 110.7 | F12 F20 I155 L156 P340 G341 C346 A347 Y348 | F12-L344 HydrophobicContact CD2-CD2 4.4Å; F12-L344 HydrophobicContact CE2-CB 3.89Å; F12-L344 HydrophobicContact CE2-CD2 3.58Å; F12-L344 HydrophobicContact CE2-CG 4.29Å; F12-L344 HydrophobicContact CZ-CB 3.94Å; F12-L344 HydrophobicContact CZ-CD2 4.36Å; F20-L344 HydrophobicContact CB-CD2 4.32Å; F20-L344 HydrophobicContact CD1-CD2 3.85Å; F20-L344 HydrophobicContact CD2-CB 4.47Å; F20-L344 HydrophobicContact CD2-CD2 3.95Å; F20-L344 HydrophobicContact CD2-CG 3.98Å; F20-L344 HydrophobicContact CE1-CD2 4.1Å; F20-L344 HydrophobicContact CE2-CD2 4.21Å; F20-L344 HydrophobicContact CE2-CG 4.11Å; F20-L344 HydrophobicContact CG-CD2 3.77Å; F20-L344 HydrophobicContact CG-CG 4.31Å; F20-L344 HydrophobicContact CZ-CD2 4.27Å; I155-L344 HydrophobicContact CB-CD1 4.21Å; I155-L344 HydrophobicContact CG2-CD1 3.66Å; L156-L344 HydrophobicContact CB-CD1 4.44Å; L156-L344 HydrophobicContact CD1-CD1 4.34Å; L156-L344 HydrophobicContact CD1-CD2 3.84Å; P340-L344 PolarHBondContact O-N 3.04Å; G341-L344 PolarHBondContact O-N 3.45Å; L344-C346 PolarHBondContact O-N 3.05Å; L344-A347 PolarHBondContact O-N 3.37Å; L344-Y348 HydrophobicContact CD1-CD2 3.77Å; L344-Y348 HydrophobicContact CD1-CE2 3.58Å; L344-Y348 HydrophobicContact CG-CD2 3.94Å; L344-Y348 HydrophobicContact CG-CE2 4.06Å; L344-Y348 WeakPolarHBondContact O-CB 3.06Å; L344-Y348 WeakPolarHBondContact O-CD2 3.48Å; L344-Y348 PolarHBondContact O-N 2.83Å |
| 345 | A | 92.9 | Very high | 90 | Very high | 1 Ų | 1 | 18.1 Ų | 18.1 | 1% | 0.008 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -61.3 | -41.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F20 M23 V197 G341 L342 F343 A347 S349 | F20-A345 HydrophobicContact CD2-CB 4.31Å; M23-A345 HydrophobicContact CB-CB 3.92Å; M23-A345 HydrophobicContact CE-CB 3.92Å; M23-A345 VanDerWaalsContact CE-O 3.27Å; M23-A345 WeakPolarHBondContact CE-O 3.43Å; M23-A345 HydrophobicContact CG-CB 4Å; V197-A345 HydrophobicContact CG1-CB 4.11Å; G341-A345 WeakPolarHBondContact O-CB 3.09Å; G341-A345 PolarHBondContact O-N 2.83Å; L342-A345 WeakPolarHBondContact O-CB 3.33Å; L342-A345 PolarHBondContact O-N 2.84Å; F343-A345 VanDerWaalsContact C-N 3.27Å; F343-A345 PolarHBondContact O-N 3.36Å; A345-A347 PolarHBondContact O-N 3.35Å; A345-S349 WeakPolarHBondContact O-CB 3.27Å; A345-S349 PolarHBondContact O-N 2.94Å; A345-S349 PolarHBondContact O-OG 3.02Å |
| 346 | C | 92.7 | Very high | 90 | Very high | 1 Ų | 1 | 12 Ų | 12 | 1% | 0.007 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -56.5 | -50.7 | 173.6 | 167.7 | 0 | 0 | 0 | 0 | 111.4 | M198 L342 F343 L344 S349 G350 | M198-C346 VanDerWaalsContact CA-SG 3.56Å; M198-C346 WeakPolarHBondContact CG-O 3.28Å; M198-C346 PolarHBondContact O-SG 3.45Å; L342-C346 WeakPolarHBondContact O-CB 3.33Å; L342-C346 PolarHBondContact O-N 3.25Å; F343-C346 WeakPolarHBondContact O-CB 3.41Å; F343-C346 PolarHBondContact O-N 3.41Å; L344-C346 PolarHBondContact O-N 3.05Å; C346-S349 WeakPolarHBondContact O-CB 3.46Å; C346-S349 PolarHBondContact O-N 3.25Å; C346-G350 PolarHBondContact O-N 3.26Å |
| 347 | A | 91.7 | Very high | 90.1 | Very high | 0 Ų | 0 | 9 Ų | 9 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -65.8 | -45.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113 | A70 V73 I155 F343 L344 A345 S349 G350 T351 | A70-A347 HydrophobicContact CB-CB 4.06Å; A70-A347 WeakPolarHBondContact CB-O 3.36Å; V73-A347 HydrophobicContact CG1-CB 4.35Å; I155-A347 HydrophobicContact CD1-CB 3.16Å; F343-A347 PolarHBondContact O-N 3.23Å; L344-A347 PolarHBondContact O-N 3.37Å; A345-A347 PolarHBondContact O-N 3.35Å; A347-S349 VanDerWaalsContact C-N 3.3Å; A347-S349 PolarHBondContact O-N 3.46Å; A347-G350 PolarHBondContact O-N 3.1Å; A347-T351 PolarHBondContact O-N 3.45Å; A347-T351 VanDerWaalsContact O-N 3.12Å |
| 348 | Y | 91.5 | Very high | 90.3 | Very high | 0 Ų | 0 | 5.3 Ų | 5.3 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -63.9 | -35.8 | 177.1 | -93.1 | -103.1 | 0 | 0 | 0 | 112.2 | F20 P152 L156 T171 I174 L344 G350 T351 L352 | F20-Y348 AromaticContact CE2-CD1 3.95Å; F20-Y348 HydrophobicContact CE2-CD1 3.95Å; F20-Y348 AromaticContact CE2-CD2 3.77Å; F20-Y348 HydrophobicContact CE2-CD2 3.77Å; F20-Y348 HydrophobicContact CE2-CE1 4.48Å; F20-Y348 HydrophobicContact CE2-CE2 4.35Å; F20-Y348 AromaticContact CE2-CG 3.53Å; F20-Y348 HydrophobicContact CE2-CG 3.53Å; F20-Y348 AromaticContact CZ-CD1 3.72Å; F20-Y348 HydrophobicContact CZ-CD1 3.72Å; F20-Y348 AromaticContact CZ-CD2 3.93Å; F20-Y348 HydrophobicContact CZ-CD2 3.93Å; F20-Y348 AromaticContact CZ-CE1 3.84Å; F20-Y348 HydrophobicContact CZ-CE1 3.84Å; F20-Y348 HydrophobicContact CZ-CE2 4.07Å; F20-Y348 AromaticContact CZ-CG 3.74Å; F20-Y348 HydrophobicContact CZ-CG 3.74Å; P152-Y348 HydrophobicContact CB-CD2 3.71Å; P152-Y348 HydrophobicContact CB-CE2 3.64Å; P152-Y348 HydrophobicContact CB-CG 4.27Å; L156-Y348 WeakPolarHBondContact CD2-OH 3.1Å; T171-Y348 HydrophobicContact CG2-CE1 3.98Å; T171-Y348 PolarHBondContact OG1-OH 3.33Å; I174-Y348 HydrophobicContact CD1-CE1 4.09Å; L344-Y348 HydrophobicContact CD1-CD2 3.77Å; L344-Y348 HydrophobicContact CD1-CE2 3.58Å; L344-Y348 HydrophobicContact CG-CD2 3.94Å; L344-Y348 HydrophobicContact CG-CE2 4.06Å; L344-Y348 WeakPolarHBondContact O-CB 3.06Å; L344-Y348 WeakPolarHBondContact O-CD2 3.48Å; L344-Y348 PolarHBondContact O-N 2.83Å; Y348-G350 VanDerWaalsContact C-N 3.34Å; Y348-G350 PolarHBondContact O-N 3.16Å; Y348-T351 PolarHBondContact O-N 2.8Å; Y348-L352 VanDerWaalsContact O-CB 3.28Å; Y348-L352 WeakPolarHBondContact O-CB 3.29Å; Y348-L352 WeakPolarHBondContact O-CG 3.31Å; Y348-L352 PolarHBondContact O-N 2.91Å |
| 349 | S | 91.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 5 Ų | 5 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -57.1 | -48.2 | 175.9 | -68.3 | 0 | 0 | 0 | 0 | 111.3 | M23 Q194 A345 C346 A347 L352 S353 | M23-S349 WeakPolarHBondContact CE-OG 3.29Å; Q194-S349 PolarHBondContact OE1-O 2.97Å; A345-S349 WeakPolarHBondContact O-CB 3.27Å; A345-S349 PolarHBondContact O-N 2.94Å; A345-S349 PolarHBondContact O-OG 3.02Å; C346-S349 WeakPolarHBondContact O-CB 3.46Å; C346-S349 PolarHBondContact O-N 3.25Å; A347-S349 VanDerWaalsContact C-N 3.3Å; A347-S349 PolarHBondContact O-N 3.46Å; S349-L352 PolarHBondContact O-N 2.98Å; S349-S353 PolarHBondContact O-N 3.21Å; S349-S353 VanDerWaalsContact O-N 3.08Å |
| 350 | G | 90.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 3.9 Ų | 3.9 | 0% | 0 | 2% | 0.022 | C | C | . | . | H | α-helix | trans | -63.2 | -43.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | M68 C346 A347 Y348 T354 | M68-G350 WeakPolarHBondContact O-CA 3.23Å; C346-G350 PolarHBondContact O-N 3.26Å; A347-G350 PolarHBondContact O-N 3.1Å; Y348-G350 VanDerWaalsContact C-N 3.34Å; Y348-G350 PolarHBondContact O-N 3.16Å; G350-T354 WeakPolarHBondContact O-CB 3.34Å; G350-T354 PolarHBondContact O-N 2.89Å; G350-T354 VanDerWaalsContact O-N 3.08Å; G350-T354 PolarHBondContact O-OG1 3.41Å |
| 351 | T | 91.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 3.6 Ų | 3.6 | 0% | 0 | 2% | 0.02 | C | C | . | . | H | α-helix | trans | -67.3 | -41.4 | 177.8 | -71.6 | 0 | 0 | 0 | 0 | 112.6 | A70 V148 I149 P152 A347 Y348 T354 A355 | A70-T351 WeakPolarHBondContact CB-OG1 3.48Å; V148-T351 HydrophobicContact CG1-CG2 3.91Å; V148-T351 WeakPolarHBondContact O-CG2 3.36Å; V148-T351 PolarHBondContact O-OG1 3.27Å; I149-T351 HydrophobicContact CG1-CG2 4.33Å; P152-T351 WeakPolarHBondContact CD-OG1 3.43Å; P152-T351 HydrophobicContact CG-CG2 3.76Å; P152-T351 WeakPolarHBondContact CG-OG1 3.28Å; A347-T351 PolarHBondContact O-N 3.45Å; A347-T351 VanDerWaalsContact O-N 3.12Å; Y348-T351 PolarHBondContact O-N 2.8Å; T351-T354 PolarHBondContact O-N 3.11Å; T351-A355 WeakPolarHBondContact O-CB 3.39Å; T351-A355 PolarHBondContact O-N 3.08Å |
| 352 | L | 89.5 | Confident | 90.5 | Very high | 0 Ų | 0 | 3.6 Ų | 3.6 | 0% | 0 | 2% | 0.02 | C | C | . | . | H | α-helix | trans | -63.8 | -42.5 | 178.9 | -72.8 | 171.5 | 0 | 0 | 0 | 111.6 | L24 I174 C175 Y178 Y348 S349 S356 | L24-L352 HydrophobicContact CD2-CD1 3.74Å; I174-L352 HydrophobicContact CG2-CD2 4.18Å; C175-L352 HydrophobicContact CB-CD2 4.29Å; Y178-L352 HydrophobicContact CD1-CB 4.11Å; Y178-L352 HydrophobicContact CD1-CD2 3.84Å; Y178-L352 HydrophobicContact CD1-CG 4.47Å; Y178-L352 HydrophobicContact CE1-CB 3.95Å; Y178-L352 HydrophobicContact CG-CD2 3.96Å; Y348-L352 VanDerWaalsContact O-CB 3.28Å; Y348-L352 WeakPolarHBondContact O-CB 3.29Å; Y348-L352 WeakPolarHBondContact O-CG 3.31Å; Y348-L352 PolarHBondContact O-N 2.91Å; S349-L352 PolarHBondContact O-N 2.98Å; L352-S356 VanDerWaalsContact O-CB 3.23Å; L352-S356 WeakPolarHBondContact O-CB 3.2Å; L352-S356 PolarHBondContact O-N 3.04Å; L352-S356 PolarHBondContact O-OG 3.33Å |
| 353 | S | 89.6 | Confident | 90.4 | Very high | 0 Ų | 0 | 1.7 Ų | 1.7 | 0% | 0 | 1% | 0.011 | C | C | . | . | H | α-helix | trans | -58.9 | -49.3 | 173.4 | -176.6 | 0 | 0 | 0 | 0 | 111.5 | A65 S66 D191 S349 S356 T357 | A65-S353 VanDerWaalsContact C-OG 3.32Å; A65-S353 VanDerWaalsContact CB-OG 3.23Å; A65-S353 WeakPolarHBondContact CB-OG 3.38Å; S66-S353 WeakPolarHBondContact CA-OG 3.45Å; S66-S353 PolarHBondContact N-OG 3.07Å; S66-S353 PolarHBondContact OG-O 3.33Å; S66-S353 PolarHBondContact OG-OG 2.93Å; D191-S353 WeakPolarHBondContact OD1-CA 3.31Å; D191-S353 WeakPolarHBondContact OD1-CB 3.43Å; D191-S353 PolarHBondContact OD1-OG 3.11Å; D191-S353 PolarHBondContact OD2-OG 2.92Å; S349-S353 PolarHBondContact O-N 3.21Å; S349-S353 VanDerWaalsContact O-N 3.08Å; S353-S356 PolarHBondContact O-OG 3.43Å; S353-S356 VanDerWaalsContact O-OG 3.13Å; S353-T357 VanDerWaalsContact O-CB 3.3Å; S353-T357 WeakPolarHBondContact O-CB 3.36Å; S353-T357 PolarHBondContact O-N 3.17Å; S353-T357 PolarHBondContact O-OG1 3.15Å |
| 354 | T | 91.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 1.6 Ų | 1.6 | 0% | 0 | 1% | 0.01 | C | C | . | . | H | α-helix | trans | -66.8 | -49.9 | -176.7 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | S66 S69 Y144 V148 G350 T351 T357 S358 | S66-T354 WeakPolarHBondContact O-CB 3.43Å; S66-T354 WeakPolarHBondContact O-CG2 3.37Å; S66-T354 PolarHBondContact O-OG1 3.18Å; S66-T354 VanDerWaalsContact O-OG1 3.05Å; S69-T354 WeakPolarHBondContact CB-OG1 3.26Å; Y144-T354 HydrophobicContact CE1-CG2 3.55Å; V148-T354 HydrophobicContact CB-CG2 4.37Å; V148-T354 HydrophobicContact CG1-CG2 3.8Å; V148-T354 HydrophobicContact CG2-CG2 4.07Å; G350-T354 WeakPolarHBondContact O-CB 3.34Å; G350-T354 PolarHBondContact O-N 2.89Å; G350-T354 VanDerWaalsContact O-N 3.08Å; G350-T354 PolarHBondContact O-OG1 3.41Å; T351-T354 PolarHBondContact O-N 3.11Å; T354-T357 PolarHBondContact O-N 2.86Å; T354-S358 WeakPolarHBondContact O-CB 3.34Å; T354-S358 PolarHBondContact O-N 3Å; T354-S358 PolarHBondContact O-OG 3.07Å |
| 355 | A | 90.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 1.6 Ų | 1.6 | 0% | 0 | 1% | 0.01 | C | C | . | . | H | α-helix | trans | -64 | -45.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | T145 I149 C175 T351 T357 S358 I359 | T145-A355 HydrophobicContact CG2-CB 4.01Å; I149-A355 HydrophobicContact CG1-CB 4.43Å; C175-A355 HydrophobicContact CB-CB 4.47Å; T351-A355 WeakPolarHBondContact O-CB 3.39Å; T351-A355 PolarHBondContact O-N 3.08Å; A355-T357 VanDerWaalsContact C-N 3.29Å; A355-T357 PolarHBondContact O-N 3.35Å; A355-S358 PolarHBondContact O-N 2.73Å; A355-I359 VanDerWaalsContact O-CB 3.31Å; A355-I359 WeakPolarHBondContact O-CB 3.3Å; A355-I359 WeakPolarHBondContact O-CD1 3.46Å; A355-I359 VanDerWaalsContact O-CG1 3.22Å; A355-I359 WeakPolarHBondContact O-CG1 3.34Å; A355-I359 PolarHBondContact O-N 2.98Å |
| 356 | S | 86.8 | Confident | 90.2 | Very high | 1 Ų | 1 | 2 Ų | 2 | 1% | 0.007 | 1% | 0.012 | C | C | . | . | H | α-helix | trans | -62.4 | -39.2 | 178.8 | 62.9 | 0 | 0 | 0 | 0 | 112.2 | T179 L352 S353 N360 | T179-S356 WeakPolarHBondContact OG1-CA 3.3Å; T179-S356 WeakPolarHBondContact OG1-CB 3.42Å; L352-S356 VanDerWaalsContact O-CB 3.23Å; L352-S356 WeakPolarHBondContact O-CB 3.2Å; L352-S356 PolarHBondContact O-N 3.04Å; L352-S356 PolarHBondContact O-OG 3.33Å; S353-S356 PolarHBondContact O-OG 3.43Å; S353-S356 VanDerWaalsContact O-OG 3.13Å; S356-N360 WeakPolarHBondContact O-CB 3.44Å; S356-N360 PolarHBondContact O-N 3.37Å |
| 357 | T | 88.8 | Confident | 90 | Very high | 8 Ų | 8 | 2 Ų | 2 | 5% | 0.049 | 1% | 0.012 | C | C | . | . | H | α-helix | trans | -64.7 | -51.7 | 177.1 | -58.9 | 0 | 0 | 0 | 0 | 112.1 | S66 A264 R268 S353 T354 A355 A361 | S66-T357 PolarHBondContact OG-OG1 3.44Å; A264-T357 HydrophobicContact CB-CG2 3.78Å; R268-T357 VanDerWaalsContact CZ-OG1 3.3Å; R268-T357 PolarHBondContact NH2-OG1 3.25Å; S353-T357 VanDerWaalsContact O-CB 3.3Å; S353-T357 WeakPolarHBondContact O-CB 3.36Å; S353-T357 PolarHBondContact O-N 3.17Å; S353-T357 PolarHBondContact O-OG1 3.15Å; T354-T357 PolarHBondContact O-N 2.86Å; A355-T357 VanDerWaalsContact C-N 3.29Å; A355-T357 PolarHBondContact O-N 3.35Å; T357-A361 VanDerWaalsContact O-CB 3.26Å; T357-A361 WeakPolarHBondContact O-CB 3.38Å; T357-A361 PolarHBondContact O-N 3.01Å |
| 358 | S | 91.1 | Very high | 89.8 | Confident | 8 Ų | 8 | 3 Ų | 3 | 6% | 0.056 | 2% | 0.017 | C | C | . | . | H | α-helix | trans | -60.2 | -49.6 | 179.8 | -72.8 | 0 | 0 | 0 | 0 | 112.1 | T145 T354 A355 A361 M362 | T145-S358 WeakPolarHBondContact OG1-CB 3.32Å; T145-S358 PolarHBondContact OG1-OG 3.41Å; T354-S358 WeakPolarHBondContact O-CB 3.34Å; T354-S358 PolarHBondContact O-N 3Å; T354-S358 PolarHBondContact O-OG 3.07Å; A355-S358 PolarHBondContact O-N 2.73Å; S358-A361 PolarHBondContact O-N 3.47Å; S358-M362 WeakPolarHBondContact O-CG 3.34Å; S358-M362 PolarHBondContact O-N 3.5Å |
| 359 | I | 89.2 | Confident | 89.8 | Confident | 1 Ų | 1 | 3.1 Ų | 3.1 | 1% | 0.005 | 2% | 0.017 | C | C | . | . | H | α-helix | trans | -63.8 | -45.2 | -178.1 | -69.4 | 166.8 | 0 | 0 | 0 | 110.7 | T179 A355 A361 M362 A363 S391 | T179-I359 HydrophobicContact CG2-CB 3.82Å; T179-I359 HydrophobicContact CG2-CD1 4.28Å; T179-I359 HydrophobicContact CG2-CG2 3.65Å; A355-I359 VanDerWaalsContact O-CB 3.31Å; A355-I359 WeakPolarHBondContact O-CB 3.3Å; A355-I359 WeakPolarHBondContact O-CD1 3.46Å; A355-I359 VanDerWaalsContact O-CG1 3.22Å; A355-I359 WeakPolarHBondContact O-CG1 3.34Å; A355-I359 PolarHBondContact O-N 2.98Å; I359-A361 VanDerWaalsContact C-N 3.33Å; I359-A361 PolarHBondContact O-N 3.38Å; I359-M362 HydrophobicContact CG1-CE 4.23Å; I359-M362 PolarHBondContact O-N 2.88Å; I359-A363 WeakPolarHBondContact O-CB 3.47Å; I359-A363 PolarHBondContact O-N 3.41Å; I359-S391 WeakPolarHBondContact CG2-O 3.46Å |
| 360 | N | 85.4 | Confident | 89.8 | Confident | 11 Ų | 11 | 5.6 Ų | 5.6 | 6% | 0.059 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -63 | -41.2 | 177.6 | -176.9 | 43.5 | 0 | 0 | 0 | 111.7 | F47 S356 A363 A364 | F47-N360 VanDerWaalsContact CE1-OD1 3.31Å; F47-N360 WeakPolarHBondContact CE1-OD1 3.46Å; S356-N360 WeakPolarHBondContact O-CB 3.44Å; S356-N360 PolarHBondContact O-N 3.37Å; N360-A363 PolarHBondContact O-N 3.23Å; N360-A364 WeakPolarHBondContact O-CB 3.42Å; N360-A364 PolarHBondContact O-N 2.83Å |
| 361 | A | 89.5 | Confident | 89.9 | Confident | 2 Ų | 2 | 6.9 Ų | 6.9 | 2% | 0.017 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -68.3 | -38.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y137 Q263 A264 T357 S358 I359 A364 V365 | Y137-A361 WeakPolarHBondContact OH-CB 3.21Å; Q263-A361 HydrophobicContact CG-CB 4.14Å; A264-A361 HydrophobicContact CB-CB 3.86Å; T357-A361 VanDerWaalsContact O-CB 3.26Å; T357-A361 WeakPolarHBondContact O-CB 3.38Å; T357-A361 PolarHBondContact O-N 3.01Å; S358-A361 PolarHBondContact O-N 3.47Å; I359-A361 VanDerWaalsContact C-N 3.33Å; I359-A361 PolarHBondContact O-N 3.38Å; A361-A364 PolarHBondContact O-N 3.05Å; A361-V365 WeakPolarHBondContact O-CB 3.43Å; A361-V365 VanDerWaalsContact O-CG2 3.28Å; A361-V365 WeakPolarHBondContact O-CG2 3.45Å; A361-V365 PolarHBondContact O-N 2.96Å |
| 362 | M | 92.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 10.1 Ų | 10.1 | 0% | 0 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -62.9 | -42.9 | 172.1 | -71.7 | -170.8 | -70.4 | 0 | 0 | 111.8 | Y137 L138 T141 M142 S358 I359 V365 T366 Y394 | Y137-M362 HydrophobicContact CE1-CG 4.13Å; L138-M362 HydrophobicContact CD2-CB 3.69Å; L138-M362 HydrophobicContact CD2-CG 3.76Å; L138-M362 HydrophobicContact CD2-SD 4.41Å; T141-M362 HydrophobicContact CG2-CE 4.21Å; T141-M362 HydrophobicContact CG2-CG 3.83Å; T141-M362 HydrophobicContact CG2-SD 3.9Å; M142-M362 HydrophobicContact CB-SD 4.14Å; S358-M362 WeakPolarHBondContact O-CG 3.34Å; S358-M362 PolarHBondContact O-N 3.5Å; I359-M362 HydrophobicContact CG1-CE 4.23Å; I359-M362 PolarHBondContact O-N 2.88Å; M362-V365 PolarHBondContact O-N 3.01Å; M362-T366 WeakPolarHBondContact O-CB 3.37Å; M362-T366 PolarHBondContact O-N 3Å; M362-T366 PolarHBondContact O-OG1 3.41Å; M362-Y394 HydrophobicContact CB-CD1 4.3Å; M362-Y394 HydrophobicContact CB-CD2 3.83Å; M362-Y394 HydrophobicContact CB-CE1 4.37Å; M362-Y394 HydrophobicContact CB-CE2 3.9Å; M362-Y394 HydrophobicContact CB-CG 4.06Å; M362-Y394 HydrophobicContact CE-CD1 4.14Å; M362-Y394 HydrophobicContact CE-CG 4.07Å; M362-Y394 HydrophobicContact SD-CD1 3.94Å; M362-Y394 HydrophobicContact SD-CE1 4.32Å; M362-Y394 HydrophobicContact SD-CG 4.33Å |
| 363 | A | 89.4 | Confident | 89.6 | Confident | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -61.8 | -44.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I359 N360 T366 V367 L390 | I359-A363 WeakPolarHBondContact O-CB 3.47Å; I359-A363 PolarHBondContact O-N 3.41Å; N360-A363 PolarHBondContact O-N 3.23Å; A363-T366 PolarHBondContact O-N 3.03Å; A363-V367 WeakPolarHBondContact O-CB 3.42Å; A363-V367 VanDerWaalsContact O-CG2 3.3Å; A363-V367 WeakPolarHBondContact O-CG2 3.33Å; A363-V367 PolarHBondContact O-N 3.49Å; A363-L390 HydrophobicContact CB-CB 3.98Å |
| 364 | A | 86.4 | Confident | 89.5 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.3 | -49.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | F48 N360 A361 T366 V367 E368 | F48-A364 HydrophobicContact CD1-CB 3.45Å; F48-A364 VanDerWaalsContact CD1-CB 3.45Å; F48-A364 HydrophobicContact CE1-CB 3.45Å; F48-A364 VanDerWaalsContact CE1-CB 3.45Å; F48-A364 HydrophobicContact CG-CB 4.14Å; F48-A364 HydrophobicContact CZ-CB 4.14Å; N360-A364 WeakPolarHBondContact O-CB 3.42Å; N360-A364 PolarHBondContact O-N 2.83Å; A361-A364 PolarHBondContact O-N 3.05Å; A364-T366 PolarHBondContact O-N 2.94Å; A364-V367 PolarHBondContact O-N 3.31Å; A364-E368 WeakPolarHBondContact O-CG 3.44Å; A364-E368 PolarHBondContact O-N 2.97Å |
| 365 | V | 91.6 | Very high | 89.3 | Confident | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -63.2 | -44.7 | -179.4 | 169 | 0 | 0 | 0 | 0 | 111 | Y118 T134 Y137 Q263 A361 M362 V367 E368 D369 | Y118-V365 HydrophobicContact CD2-CG1 3.92Å; Y118-V365 HydrophobicContact CD2-CG2 4.33Å; Y118-V365 HydrophobicContact CE2-CG1 4.11Å; Y118-V365 HydrophobicContact CE2-CG2 4.13Å; T134-V365 HydrophobicContact CG2-CG1 3.42Å; T134-V365 VanDerWaalsContact CG2-CG1 3.42Å; Y137-V365 HydrophobicContact CD1-CB 4.43Å; Y137-V365 HydrophobicContact CD1-CG1 4.2Å; Y137-V365 HydrophobicContact CD1-CG2 4.19Å; Y137-V365 HydrophobicContact CE1-CB 4.24Å; Y137-V365 HydrophobicContact CE1-CG2 3.85Å; Q263-V365 HydrophobicContact CB-CG2 3.89Å; Q263-V365 HydrophobicContact CG-CG2 3.39Å; A361-V365 WeakPolarHBondContact O-CB 3.43Å; A361-V365 VanDerWaalsContact O-CG2 3.28Å; A361-V365 WeakPolarHBondContact O-CG2 3.45Å; A361-V365 PolarHBondContact O-N 2.96Å; M362-V365 PolarHBondContact O-N 3.01Å; V365-V367 VanDerWaalsContact C-N 3.29Å; V365-V367 PolarHBondContact O-N 2.9Å; V365-E368 PolarHBondContact O-N 2.9Å; V365-D369 WeakPolarHBondContact CG1-OD2 3.28Å; V365-D369 WeakPolarHBondContact O-CB 3.19Å; V365-D369 PolarHBondContact O-N 3.4Å |
| 366 | T | 93.1 | Very high | 88.7 | Confident | 10 Ų | 10 | 30.2 Ų | 30.2 | 6% | 0.061 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.7 | -40.1 | 177.1 | -69.6 | 0 | 0 | 0 | 0 | 111.7 | M362 A363 A364 L370 I371 L390 Y394 | M362-T366 WeakPolarHBondContact O-CB 3.37Å; M362-T366 PolarHBondContact O-N 3Å; M362-T366 PolarHBondContact O-OG1 3.41Å; A363-T366 PolarHBondContact O-N 3.03Å; A364-T366 PolarHBondContact O-N 2.94Å; T366-L370 HydrophobicContact CG2-CD1 4.2Å; T366-L370 WeakPolarHBondContact O-CA 3.43Å; T366-L370 VanDerWaalsContact O-CB 3.31Å; T366-L370 WeakPolarHBondContact O-CB 3.12Å; T366-L370 PolarHBondContact O-N 3.47Å; T366-I371 HydrophobicContact CG2-CD1 4.32Å; T366-I371 HydrophobicContact CG2-CG1 4.49Å; T366-I371 PolarHBondContact O-N 2.94Å; T366-I371 VanDerWaalsContact O-N 3.15Å; T366-L390 HydrophobicContact CG2-CD1 3.75Å; T366-L390 HydrophobicContact CG2-CD2 3.91Å; T366-Y394 PolarHBondContact OG1-OH 2.59Å |
| 367 | V | 89.3 | Confident | 88.4 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.192 | C | C | . | . | I | π-helix | trans | -62.9 | -51.9 | 175.1 | 166.7 | 0 | 0 | 0 | 0 | 111.7 | A363 A364 V365 I371 K372 L383 I386 L390 | A363-V367 WeakPolarHBondContact O-CB 3.42Å; A363-V367 VanDerWaalsContact O-CG2 3.3Å; A363-V367 WeakPolarHBondContact O-CG2 3.33Å; A363-V367 PolarHBondContact O-N 3.49Å; A364-V367 PolarHBondContact O-N 3.31Å; V365-V367 VanDerWaalsContact C-N 3.29Å; V365-V367 PolarHBondContact O-N 2.9Å; V367-I371 HydrophobicContact CG2-CD1 4.22Å; V367-I371 PolarHBondContact O-N 3.5Å; V367-K372 HydrophobicContact CG1-CG 4.29Å; V367-K372 PolarHBondContact O-N 3.07Å; V367-L383 HydrophobicContact CG1-CD1 3.44Å; V367-L383 VanDerWaalsContact CG1-CD1 3.44Å; V367-L383 HydrophobicContact CG1-CD2 4.21Å; V367-L383 HydrophobicContact CG1-CG 3.99Å; V367-L383 HydrophobicContact CG2-CD1 4.45Å; V367-I386 HydrophobicContact CG2-CG2 4.4Å; V367-L390 HydrophobicContact CG2-CD1 3.78Å |
| 368 | E | 87.7 | Confident | 88.1 | Confident | 22 Ų | 22 | 37.5 Ų | 37.5 | 10% | 0.103 | 20% | 0.201 | C | C | . | . | I | π-helix | trans | -71.1 | -38.2 | -175.3 | -65.9 | -61 | 157.6 | 0 | 0 | 113.2 | T115 R130 A364 V365 K372 P373 | T115-E368 HydrophobicContact CG2-CG 3.86Å; R130-E368 PolarHBondContact NH2-O 3.03Å; A364-E368 WeakPolarHBondContact O-CG 3.44Å; A364-E368 PolarHBondContact O-N 2.97Å; V365-E368 PolarHBondContact O-N 2.9Å; E368-K372 WeakPolarHBondContact OE1-CE 3.47Å; E368-K372 IonicContact OE1-NZ 3.69Å; E368-K372 PolarHBondContact OE1-NZ 3.34Å; E368-K372 VanDerWaalsContact OE2-CD 3.31Å; E368-K372 WeakPolarHBondContact OE2-CD 3.28Å; E368-K372 WeakPolarHBondContact OE2-CE 3.31Å; E368-K372 IonicContact OE2-NZ 2.65Å; E368-K372 PolarHBondContact OE2-NZ 3.33Å; E368-P373 VanDerWaalsContact O-CD 3.31Å; E368-P373 WeakPolarHBondContact O-CD 3.47Å; E368-P373 WeakPolarHBondContact O-CG 3.38Å |
| 369 | D | 91.1 | Very high | 87.7 | Confident | 2 Ų | 2 | 39.5 Ų | 39.5 | 1% | 0.011 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | -96.4 | -29.8 | -170.3 | -62.1 | -13.8 | 0 | 0 | 0 | 113.5 | S116 R130 T134 V365 | S116-D369 VanDerWaalsContact CB-OD1 3.23Å; S116-D369 WeakPolarHBondContact CB-OD1 2.99Å; S116-D369 PolarHBondContact OG-OD1 3.24Å; S116-D369 PolarHBondContact OG-OD2 3.2Å; R130-D369 IonicContact CZ-OD1 3.96Å; R130-D369 IonicContact NE-OD1 2.59Å; R130-D369 PolarHBondContact NE-OD1 2.8Å; R130-D369 IonicContact NH2-OD1 3.9Å; R130-D369 PolarHBondContact NH2-OD1 3.16Å; T134-D369 HydrophobicContact CG2-CB 4.06Å; T134-D369 PolarHBondContact OG1-OD2 3.23Å; V365-D369 WeakPolarHBondContact CG1-OD2 3.28Å; V365-D369 WeakPolarHBondContact O-CB 3.19Å; V365-D369 PolarHBondContact O-N 3.4Å |
| 370 | L | 91.6 | Very high | 87.1 | Confident | 53 Ų | 53 | 43 Ų | 43 | 28% | 0.277 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -112.5 | -37.1 | -173.9 | -56.8 | 178.9 | 0 | 0 | 0 | 113.4 | L131 T366 R374 | L131-L370 HydrophobicContact CD2-CD2 3.46Å; L131-L370 VanDerWaalsContact CD2-CD2 3.46Å; T366-L370 HydrophobicContact CG2-CD1 4.2Å; T366-L370 WeakPolarHBondContact O-CA 3.43Å; T366-L370 VanDerWaalsContact O-CB 3.31Å; T366-L370 WeakPolarHBondContact O-CB 3.12Å; T366-L370 PolarHBondContact O-N 3.47Å; L370-R374 PolarHBondContact O-NH1 3.39Å |
| 371 | I | 91.1 | Very high | 86.8 | Confident | 27 Ų | 27 | 53.4 Ų | 53.4 | 14% | 0.138 | 28% | 0.28 | C | S | . | . | I | π-helix | trans | -91.3 | -60.4 | -172.4 | -59.4 | -176.8 | 0 | 0 | 0 | 111.4 | T366 V367 P373 R374 M375 L378 I386 L390 | T366-I371 HydrophobicContact CG2-CD1 4.32Å; T366-I371 HydrophobicContact CG2-CG1 4.49Å; T366-I371 PolarHBondContact O-N 2.94Å; T366-I371 VanDerWaalsContact O-N 3.15Å; V367-I371 HydrophobicContact CG2-CD1 4.22Å; V367-I371 PolarHBondContact O-N 3.5Å; I371-P373 VanDerWaalsContact C-CD 3.47Å; I371-R374 PolarHBondContact O-N 3.39Å; I371-M375 HydrophobicContact CG2-CE 3.63Å; I371-M375 PolarHBondContact O-N 2.91Å; I371-L378 HydrophobicContact CG2-CD1 3.79Å; I371-I386 HydrophobicContact CD1-CG2 3.58Å; I371-L390 HydrophobicContact CD1-CD1 3.98Å |
| 372 | K | 87.4 | Confident | 86.6 | Confident | 68 Ų | 68 | 59.8 Ų | 59.8 | 30% | 0.296 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -40.4 | -177.5 | -74.4 | -170.5 | -171.3 | 173.4 | 0 | 113.9 | V367 E368 R374 M375 P376 | V367-K372 HydrophobicContact CG1-CG 4.29Å; V367-K372 PolarHBondContact O-N 3.07Å; E368-K372 WeakPolarHBondContact OE1-CE 3.47Å; E368-K372 IonicContact OE1-NZ 3.69Å; E368-K372 PolarHBondContact OE1-NZ 3.34Å; E368-K372 VanDerWaalsContact OE2-CD 3.31Å; E368-K372 WeakPolarHBondContact OE2-CD 3.28Å; E368-K372 WeakPolarHBondContact OE2-CE 3.31Å; E368-K372 IonicContact OE2-NZ 2.65Å; E368-K372 PolarHBondContact OE2-NZ 3.33Å; K372-R374 PolarHBondContact O-N 3.43Å; K372-R374 VanDerWaalsContact O-N 3.15Å; K372-M375 CarbonylContact O-C 3.59Å; K372-M375 VanDerWaalsContact O-C 3.29Å; K372-M375 PolarHBondContact O-N 3.49Å; K372-P376 WeakPolarHBondContact O-CA 3.2Å |
| 373 | P | 87.6 | Confident | 86 | Confident | 53 Ų | 53 | 60.3 Ų | 60.3 | 34% | 0.344 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -17.7 | 178.6 | -25.3 | 38 | 0 | 0 | 0 | 114 | E368 I371 | E368-P373 VanDerWaalsContact O-CD 3.31Å; E368-P373 WeakPolarHBondContact O-CD 3.47Å; E368-P373 WeakPolarHBondContact O-CG 3.38Å; I371-P373 VanDerWaalsContact C-CD 3.47Å |
| 374 | R | 88.3 | Confident | 85.4 | Confident | 161 Ų | 161 | 61.5 Ų | 61.5 | 61% | 0.608 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.6 | -25.6 | 175.4 | -65.9 | -173.7 | 175.3 | 93.2 | -5 | 112.7 | L370 I371 K372 | L370-R374 PolarHBondContact O-NH1 3.39Å; I371-R374 PolarHBondContact O-N 3.39Å; K372-R374 PolarHBondContact O-N 3.43Å; K372-R374 VanDerWaalsContact O-N 3.15Å |
| 375 | M | 87.2 | Confident | 85.2 | Confident | 93 Ų | 93 | 67.6 Ų | 67.6 | 46% | 0.458 | 35% | 0.349 | S | S | . | . | trans | -136.7 | 74.7 | -177.2 | -63.3 | -171.7 | -71.8 | 0 | 0 | 110.8 | I371 K372 S377 L378 | I371-M375 HydrophobicContact CG2-CE 3.63Å; I371-M375 PolarHBondContact O-N 2.91Å; K372-M375 CarbonylContact O-C 3.59Å; K372-M375 VanDerWaalsContact O-C 3.29Å; K372-M375 PolarHBondContact O-N 3.49Å; M375-S377 VanDerWaalsContact C-N 3.33Å; M375-S377 PolarHBondContact O-N 2.84Å; M375-L378 HydrophobicContact CB-CD1 3.77Å; M375-L378 HydrophobicContact CB-CG 3.9Å; M375-L378 HydrophobicContact CE-CD1 4.08Å | ||
| 376 | P | 77.4 | Confident | 85 | Confident | 114 Ų | 114 | 70 Ų | 70 | 74% | 0.74 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -21.4 | -172.6 | 26.7 | -34.2 | 0 | 0 | 0 | 114.2 | K372 | K372-P376 WeakPolarHBondContact O-CA 3.2Š|
| 377 | S | 81 | Confident | 84.5 | Confident | 116 Ų | 116 | 69.6 Ų | 69.6 | 81% | 0.811 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.8 | 20.4 | -174.4 | 56.5 | 0 | 0 | 0 | 0 | 114.6 | M375 A379 | M375-S377 VanDerWaalsContact C-N 3.33Å; M375-S377 PolarHBondContact O-N 2.84Å; S377-A379 PolarHBondContact O-N 3.41Å |
| 378 | L | 82.5 | Confident | 84.1 | Confident | 46 Ų | 46 | 73.8 Ų | 73.8 | 24% | 0.241 | 38% | 0.377 | C | S | . | . | trans | -68.6 | 127.2 | -179.7 | -74.6 | 171.1 | 0 | 0 | 0 | 111.9 | I371 M375 L383 I386 | I371-L378 HydrophobicContact CG2-CD1 3.79Å; M375-L378 HydrophobicContact CB-CD1 3.77Å; M375-L378 HydrophobicContact CB-CG 3.9Å; M375-L378 HydrophobicContact CE-CD1 4.08Å; L378-L383 HydrophobicContact CD1-CD1 4.46Å; L378-I386 HydrophobicContact CD1-CD1 4.12Å | ||
| 379 | A | 82.8 | Confident | 84.1 | Confident | 50 Ų | 50 | 74.1 Ų | 74.1 | 41% | 0.413 | 39% | 0.387 | S | S | . | . | trans | -59.5 | 142.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | S377 R381 K382 L383 | S377-A379 PolarHBondContact O-N 3.41Å; A379-R381 VanDerWaalsContact C-N 3.26Å; A379-R381 PolarHBondContact O-N 2.9Å; A379-R381 VanDerWaalsContact O-N 3.11Å; A379-K382 PolarHBondContact O-N 3.37Å; A379-L383 PolarHBondContact O-N 3.06Å; A379-L383 VanDerWaalsContact O-N 3.15Å | ||
| 380 | P | 77.1 | Confident | 84 | Confident | 76 Ų | 76 | 75.2 Ų | 75.2 | 49% | 0.494 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -52.9 | -38.4 | -177.3 | -29.1 | 34.5 | 0 | 0 | 0 | 114.3 | K382 L383 V384 | P380-K382 PolarHBondContact O-N 3.23Å; P380-L383 WeakPolarHBondContact O-CB 3.44Å; P380-L383 PolarHBondContact O-N 2.68Å; P380-V384 WeakPolarHBondContact O-CG2 3.26Å; P380-V384 PolarHBondContact O-N 2.91Å |
| 381 | R | 78.9 | Confident | 83.7 | Confident | 229 Ų | 229 | 72.9 Ų | 72.9 | 86% | 0.864 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -62.4 | -41 | 177 | -67.8 | -175.5 | -179.8 | 174.9 | 0.7 | 112.9 | A379 L383 V384 L385 | A379-R381 VanDerWaalsContact C-N 3.26Å; A379-R381 PolarHBondContact O-N 2.9Å; A379-R381 VanDerWaalsContact O-N 3.11Å; R381-L383 VanDerWaalsContact C-N 3.33Å; R381-V384 PolarHBondContact O-N 3.39Å; R381-L385 PolarHBondContact O-N 3.38Å; R381-L385 VanDerWaalsContact O-N 3.14Å |
| 382 | K | 84 | Confident | 83.5 | Confident | 135 Ų | 135 | 75.9 Ų | 75.9 | 59% | 0.587 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -67.5 | -37.9 | 177 | -70.8 | -175.5 | 177.8 | -179.4 | 0 | 110.6 | A379 P380 V384 L385 I386 | A379-K382 PolarHBondContact O-N 3.37Å; P380-K382 PolarHBondContact O-N 3.23Å; K382-V384 PolarHBondContact O-N 3.48Å; K382-L385 PolarHBondContact O-N 3.38Å; K382-I386 WeakPolarHBondContact O-CB 3.41Å; K382-I386 VanDerWaalsContact O-CG1 3.27Å; K382-I386 WeakPolarHBondContact O-CG1 3.31Å; K382-I386 PolarHBondContact O-N 2.93Å |
| 383 | L | 80.6 | Confident | 83.7 | Confident | 12 Ų | 12 | 77.5 Ų | 77.5 | 6% | 0.063 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -63.5 | -40.8 | 178 | -160.1 | 61.4 | 0 | 0 | 0 | 112.1 | A44 V367 L378 A379 P380 R381 I386 S387 | A44-L383 HydrophobicContact CB-CD2 3.57Å; A44-L383 HydrophobicContact CB-CG 4.33Å; V367-L383 HydrophobicContact CG1-CD1 3.44Å; V367-L383 VanDerWaalsContact CG1-CD1 3.44Å; V367-L383 HydrophobicContact CG1-CD2 4.21Å; V367-L383 HydrophobicContact CG1-CG 3.99Å; V367-L383 HydrophobicContact CG2-CD1 4.45Å; L378-L383 HydrophobicContact CD1-CD1 4.46Å; A379-L383 PolarHBondContact O-N 3.06Å; A379-L383 VanDerWaalsContact O-N 3.15Å; P380-L383 WeakPolarHBondContact O-CB 3.44Å; P380-L383 PolarHBondContact O-N 2.68Å; R381-L383 VanDerWaalsContact C-N 3.33Å; L383-I386 PolarHBondContact O-N 3.48Å; L383-S387 WeakPolarHBondContact O-CB 3.34Å; L383-S387 PolarHBondContact O-N 3.19Å; L383-S387 PolarHBondContact O-OG 2.97Å |
| 384 | V | 76.7 | Confident | 83.9 | Confident | 24 Ų | 24 | 76.5 Ų | 76.5 | 15% | 0.145 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 173.3 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | P380 R381 K382 S387 K388 | P380-V384 WeakPolarHBondContact O-CG2 3.26Å; P380-V384 PolarHBondContact O-N 2.91Å; R381-V384 PolarHBondContact O-N 3.39Å; K382-V384 PolarHBondContact O-N 3.48Å; V384-S387 PolarHBondContact O-N 3.36Å; V384-K388 WeakPolarHBondContact O-CG 3.3Å; V384-K388 PolarHBondContact O-N 3.07Å |
| 385 | L | 82.9 | Confident | 84 | Confident | 129 Ų | 129 | 68.9 Ų | 68.9 | 68% | 0.675 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -63.4 | -43.6 | 178.1 | -171 | 69 | 0 | 0 | 0 | 112.1 | R381 K382 S387 K388 G389 | R381-L385 PolarHBondContact O-N 3.38Å; R381-L385 VanDerWaalsContact O-N 3.14Å; K382-L385 PolarHBondContact O-N 3.38Å; L385-S387 VanDerWaalsContact C-N 3.33Å; L385-S387 PolarHBondContact O-N 2.96Å; L385-K388 PolarHBondContact O-N 3.01Å; L385-G389 PolarHBondContact O-N 3.33Å |
| 386 | I | 87.3 | Confident | 84.1 | Confident | 51 Ų | 51 | 67.6 Ų | 67.6 | 26% | 0.262 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60 | -45.1 | 174.4 | -70.7 | 166.8 | 0 | 0 | 0 | 110.4 | V367 I371 L378 K382 L383 K388 G389 L390 | V367-I386 HydrophobicContact CG2-CG2 4.4Å; I371-I386 HydrophobicContact CD1-CG2 3.58Å; L378-I386 HydrophobicContact CD1-CD1 4.12Å; K382-I386 WeakPolarHBondContact O-CB 3.41Å; K382-I386 VanDerWaalsContact O-CG1 3.27Å; K382-I386 WeakPolarHBondContact O-CG1 3.31Å; K382-I386 PolarHBondContact O-N 2.93Å; L383-I386 PolarHBondContact O-N 3.48Å; I386-K388 VanDerWaalsContact C-N 3.33Å; I386-K388 PolarHBondContact O-N 3.37Å; I386-G389 PolarHBondContact O-N 3.22Å; I386-L390 HydrophobicContact CG2-CD1 3.99Å; I386-L390 HydrophobicContact CG2-CG 4.34Å; I386-L390 WeakPolarHBondContact O-CG 3.38Å; I386-L390 PolarHBondContact O-N 3.31Å |
| 387 | S | 81.9 | Confident | 84.8 | Confident | 1 Ų | 1 | 63.4 Ų | 63.4 | 1% | 0.007 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -62.7 | -39.7 | -180 | -55.3 | 0 | 0 | 0 | 0 | 112 | F48 L383 V384 L385 L390 S391 | F48-S387 WeakPolarHBondContact CZ-OG 3.31Å; L383-S387 WeakPolarHBondContact O-CB 3.34Å; L383-S387 PolarHBondContact O-N 3.19Å; L383-S387 PolarHBondContact O-OG 2.97Å; V384-S387 PolarHBondContact O-N 3.36Å; L385-S387 VanDerWaalsContact C-N 3.33Å; L385-S387 PolarHBondContact O-N 2.96Å; S387-L390 PolarHBondContact O-N 2.95Å; S387-S391 WeakPolarHBondContact O-CB 3.46Å; S387-S391 PolarHBondContact O-N 2.76Å; S387-S391 PolarHBondContact O-OG 3.04Å |
| 388 | K | 81.2 | Confident | 85.4 | Confident | 87 Ų | 87 | 57.9 Ų | 57.9 | 38% | 0.378 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.4 | -43 | 172.8 | -73.3 | -175 | 173.1 | -169.3 | 0 | 112.1 | V384 L385 I386 S391 L392 | V384-K388 WeakPolarHBondContact O-CG 3.3Å; V384-K388 PolarHBondContact O-N 3.07Å; L385-K388 PolarHBondContact O-N 3.01Å; I386-K388 VanDerWaalsContact C-N 3.33Å; I386-K388 PolarHBondContact O-N 3.37Å; K388-S391 WeakPolarHBondContact O-CB 3.38Å; K388-S391 PolarHBondContact O-N 3.03Å; K388-L392 PolarHBondContact O-N 2.96Å; K388-L392 VanDerWaalsContact O-N 3.15Å |
| 389 | G | 87.1 | Confident | 85.8 | Confident | 30 Ų | 30 | 57.4 Ų | 57.4 | 31% | 0.309 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L385 I386 S391 L392 I393 | L385-G389 PolarHBondContact O-N 3.33Å; I386-G389 PolarHBondContact O-N 3.22Å; G389-S391 VanDerWaalsContact C-N 3.31Å; G389-S391 PolarHBondContact O-N 3.25Å; G389-L392 WeakPolarHBondContact O-CB 3.39Å; G389-L392 PolarHBondContact O-N 2.77Å; G389-I393 WeakPolarHBondContact O-CG1 3.45Å; G389-I393 PolarHBondContact O-N 2.88Å; G389-I393 VanDerWaalsContact O-N 3.08Å |
| 390 | L | 89.3 | Confident | 86.2 | Confident | 24 Ų | 24 | 59.3 Ų | 59.3 | 13% | 0.126 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.6 | -39.2 | 174.6 | -73.5 | 171.8 | 0 | 0 | 0 | 111.9 | A363 T366 V367 I371 I386 S387 L392 I393 Y394 | A363-L390 HydrophobicContact CB-CB 3.98Å; T366-L390 HydrophobicContact CG2-CD1 3.75Å; T366-L390 HydrophobicContact CG2-CD2 3.91Å; V367-L390 HydrophobicContact CG2-CD1 3.78Å; I371-L390 HydrophobicContact CD1-CD1 3.98Å; I386-L390 HydrophobicContact CG2-CD1 3.99Å; I386-L390 HydrophobicContact CG2-CG 4.34Å; I386-L390 WeakPolarHBondContact O-CG 3.38Å; I386-L390 PolarHBondContact O-N 3.31Å; S387-L390 PolarHBondContact O-N 2.95Å; L390-L392 VanDerWaalsContact C-N 3.3Å; L390-L392 PolarHBondContact O-N 3.26Å; L390-I393 PolarHBondContact O-N 3.36Å; L390-Y394 HydrophobicContact CB-CD2 4.37Å; L390-Y394 HydrophobicContact CB-CE2 4.3Å; L390-Y394 HydrophobicContact CD2-CE2 4.36Å; L390-Y394 WeakPolarHBondContact O-CD2 3.25Å; L390-Y394 PolarHBondContact O-N 3.49Å |
| 391 | S | 85 | Confident | 87 | Confident | 5 Ų | 5 | 56.5 Ų | 56.5 | 4% | 0.035 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.6 | -39.3 | 177.1 | -58.4 | 0 | 0 | 0 | 0 | 111.9 | I359 S387 K388 G389 G395 | I359-S391 WeakPolarHBondContact CG2-O 3.46Å; S387-S391 WeakPolarHBondContact O-CB 3.46Å; S387-S391 PolarHBondContact O-N 2.76Å; S387-S391 PolarHBondContact O-OG 3.04Å; K388-S391 WeakPolarHBondContact O-CB 3.38Å; K388-S391 PolarHBondContact O-N 3.03Å; G389-S391 VanDerWaalsContact C-N 3.31Å; G389-S391 PolarHBondContact O-N 3.25Å; S391-G395 PolarHBondContact O-N 3.24Å |
| 392 | L | 86.4 | Confident | 87.6 | Confident | 89 Ų | 89 | 45.6 Ų | 45.6 | 47% | 0.466 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64.9 | -43.3 | 173.5 | -71.9 | 171.8 | 0 | 0 | 0 | 112.2 | T176 T180 K388 G389 L390 G395 S396 | T176-L392 HydrophobicContact CG2-CD2 3.67Å; T180-L392 HydrophobicContact CG2-CD2 3.5Å; T180-L392 VanDerWaalsContact CG2-CD2 3.5Å; T180-L392 HydrophobicContact CG2-CG 3.91Å; K388-L392 PolarHBondContact O-N 2.96Å; K388-L392 VanDerWaalsContact O-N 3.15Å; G389-L392 WeakPolarHBondContact O-CB 3.39Å; G389-L392 PolarHBondContact O-N 2.77Å; L390-L392 VanDerWaalsContact C-N 3.3Å; L390-L392 PolarHBondContact O-N 3.26Å; L392-G395 PolarHBondContact O-N 2.9Å; L392-S396 PolarHBondContact O-N 3.37Å; L392-S396 PolarHBondContact O-OG 3.36Å |
| 393 | I | 91.8 | Very high | 87.8 | Confident | 103 Ų | 103 | 40.1 Ų | 40.1 | 53% | 0.528 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63.8 | -46.5 | 178.7 | -67.4 | 166.1 | 0 | 0 | 0 | 111.1 | G389 L390 S396 A397 | G389-I393 WeakPolarHBondContact O-CG1 3.45Å; G389-I393 PolarHBondContact O-N 2.88Å; G389-I393 VanDerWaalsContact O-N 3.08Å; L390-I393 PolarHBondContact O-N 3.36Å; I393-S396 PolarHBondContact O-N 3.09Å; I393-S396 PolarHBondContact O-OG 2.96Å; I393-A397 WeakPolarHBondContact O-CB 3.33Å; I393-A397 PolarHBondContact O-N 3.48Å |
| 394 | Y | 92.2 | Very high | 88.2 | Confident | 32 Ų | 32 | 45.2 Ų | 45.2 | 13% | 0.125 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -68.8 | -35.7 | 177.4 | -73.6 | -58.5 | 0 | 0 | 0 | 112.1 | L138 M362 T366 L390 A397 C398 | L138-Y394 HydrophobicContact CD2-CE1 4.29Å; M362-Y394 HydrophobicContact CB-CD1 4.3Å; M362-Y394 HydrophobicContact CB-CD2 3.83Å; M362-Y394 HydrophobicContact CB-CE1 4.37Å; M362-Y394 HydrophobicContact CB-CE2 3.9Å; M362-Y394 HydrophobicContact CB-CG 4.06Å; M362-Y394 HydrophobicContact CE-CD1 4.14Å; M362-Y394 HydrophobicContact CE-CG 4.07Å; M362-Y394 HydrophobicContact SD-CD1 3.94Å; M362-Y394 HydrophobicContact SD-CE1 4.32Å; M362-Y394 HydrophobicContact SD-CG 4.33Å; T366-Y394 PolarHBondContact OG1-OH 2.59Å; L390-Y394 HydrophobicContact CB-CD2 4.37Å; L390-Y394 HydrophobicContact CB-CE2 4.3Å; L390-Y394 HydrophobicContact CD2-CE2 4.36Å; L390-Y394 WeakPolarHBondContact O-CD2 3.25Å; L390-Y394 PolarHBondContact O-N 3.49Å; Y394-A397 PolarHBondContact O-N 2.96Å; Y394-C398 WeakPolarHBondContact O-CB 3.19Å; Y394-C398 PolarHBondContact O-N 3.42Å; Y394-C398 PolarHBondContact O-SG 3.41Å |
| 395 | G | 90 | Very high | 88.6 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -59.2 | -47.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | S391 L392 C398 L399 | S391-G395 PolarHBondContact O-N 3.24Å; L392-G395 PolarHBondContact O-N 2.9Å; G395-C398 PolarHBondContact O-N 3.11Å; G395-L399 PolarHBondContact O-N 3.33Å |
| 396 | S | 89.8 | Confident | 88.5 | Confident | 66 Ų | 66 | 39.6 Ų | 39.6 | 46% | 0.462 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -66.6 | -39.5 | 176.4 | 65.6 | 0 | 0 | 0 | 0 | 112.4 | L392 I393 L399 T400 | L392-S396 PolarHBondContact O-N 3.37Å; L392-S396 PolarHBondContact O-OG 3.36Å; I393-S396 PolarHBondContact O-N 3.09Å; I393-S396 PolarHBondContact O-OG 2.96Å; S396-L399 WeakPolarHBondContact O-CB 3.38Å; S396-L399 PolarHBondContact O-N 3.06Å; S396-T400 PolarHBondContact O-N 3.18Å; S396-T400 PolarHBondContact O-OG1 2.8Å |
| 397 | A | 93 | Very high | 88.1 | Confident | 27 Ų | 27 | 44.9 Ų | 44.9 | 22% | 0.223 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63 | -42.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | M142 I393 Y394 L399 T400 V401 | M142-A397 HydrophobicContact CG-CB 4.41Å; M142-A397 HydrophobicContact SD-CB 3.71Å; I393-A397 WeakPolarHBondContact O-CB 3.33Å; I393-A397 PolarHBondContact O-N 3.48Å; Y394-A397 PolarHBondContact O-N 2.96Å; A397-L399 VanDerWaalsContact C-N 3.3Å; A397-L399 PolarHBondContact O-N 3.5Å; A397-T400 WeakPolarHBondContact O-CB 3.36Å; A397-T400 PolarHBondContact O-N 2.91Å; A397-V401 PolarHBondContact O-N 2.91Å |
| 398 | C | 93.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.9 | -36.3 | 175 | -65.9 | 0 | 0 | 0 | 0 | 111.6 | T145 G146 I149 Y394 G395 V401 A402 | T145-C398 HydrophobicContact CG2-CB 4.13Å; G146-C398 VanDerWaalsContact CA-O 3.3Å; G146-C398 WeakPolarHBondContact CA-O 3.33Å; I149-C398 HydrophobicContact CD1-CB 3.81Å; Y394-C398 WeakPolarHBondContact O-CB 3.19Å; Y394-C398 PolarHBondContact O-N 3.42Å; Y394-C398 PolarHBondContact O-SG 3.41Å; G395-C398 PolarHBondContact O-N 3.11Å; C398-V401 PolarHBondContact O-N 3.33Å; C398-A402 WeakPolarHBondContact O-CB 3.46Å; C398-A402 PolarHBondContact O-N 3.22Å |
| 399 | L | 91.3 | Very high | 86.9 | Confident | 35 Ų | 35 | 48.6 Ų | 48.6 | 18% | 0.183 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | 174.6 | -177.4 | 58.2 | 0 | 0 | 0 | 112 | I149 L168 L169 G395 S396 A397 V401 A402 A403 | I149-L399 HydrophobicContact CG2-CD1 4.42Å; L168-L399 WeakPolarHBondContact O-CD1 3.33Å; L169-L399 HydrophobicContact CD2-CD2 4.34Å; G395-L399 PolarHBondContact O-N 3.33Å; S396-L399 WeakPolarHBondContact O-CB 3.38Å; S396-L399 PolarHBondContact O-N 3.06Å; A397-L399 VanDerWaalsContact C-N 3.3Å; A397-L399 PolarHBondContact O-N 3.5Å; L399-V401 VanDerWaalsContact C-N 3.32Å; L399-V401 PolarHBondContact O-N 3.13Å; L399-A402 WeakPolarHBondContact O-CB 3.38Å; L399-A402 PolarHBondContact O-N 3.03Å; L399-A403 PolarHBondContact O-N 3.38Å |
| 400 | T | 91.1 | Very high | 85.9 | Confident | 91 Ų | 91 | 49.4 Ų | 49.4 | 56% | 0.558 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -60.5 | -42.7 | 172.5 | -55.9 | 0 | 0 | 0 | 0 | 111.3 | S396 A397 A402 A403 L404 | S396-T400 PolarHBondContact O-N 3.18Å; S396-T400 PolarHBondContact O-OG1 2.8Å; A397-T400 WeakPolarHBondContact O-CB 3.36Å; A397-T400 PolarHBondContact O-N 2.91Å; T400-A402 VanDerWaalsContact C-N 3.34Å; T400-A402 PolarHBondContact O-N 2.91Å; T400-A403 WeakPolarHBondContact O-CB 3.35Å; T400-A403 PolarHBondContact O-N 2.95Å; T400-L404 PolarHBondContact O-N 3.13Å; T400-L404 VanDerWaalsContact O-N 3.15Å |
| 401 | V | 92.8 | Very high | 85.5 | Confident | 17 Ų | 17 | 48.8 Ų | 48.8 | 10% | 0.103 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.1 | -36.3 | 174.9 | 177 | 0 | 0 | 0 | 0 | 111.9 | M142 L143 A397 C398 L399 A403 L404 S405 | M142-V401 HydrophobicContact CG-CG2 4.22Å; L143-V401 HydrophobicContact CD2-CG1 4.02Å; L143-V401 HydrophobicContact CD2-CG2 4.26Å; A397-V401 PolarHBondContact O-N 2.91Å; C398-V401 PolarHBondContact O-N 3.33Å; L399-V401 VanDerWaalsContact C-N 3.32Å; L399-V401 PolarHBondContact O-N 3.13Å; V401-A403 VanDerWaalsContact C-N 3.28Å; V401-A403 PolarHBondContact O-N 3.09Å; V401-L404 CarbonylContact O-C 3.3Å; V401-L404 PolarHBondContact O-N 3.47Å; V401-L404 VanDerWaalsContact O-N 3.13Å; V401-S405 WeakPolarHBondContact O-CB 3.47Å; V401-S405 PolarHBondContact O-N 3.21Å; V401-S405 PolarHBondContact O-OG 3.42Å |
| 402 | A | 91.6 | Very high | 85.6 | Confident | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.7 | -39.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | G146 I149 L168 C398 L399 T400 S405 S406 | G146-A402 VanDerWaalsContact O-CA 3.31Å; G146-A402 WeakPolarHBondContact O-CA 3.39Å; G146-A402 WeakPolarHBondContact O-CB 3.41Å; I149-A402 HydrophobicContact CB-CB 3.97Å; I149-A402 HydrophobicContact CG2-CB 3.83Å; L168-A402 HydrophobicContact CD2-CB 3.77Å; C398-A402 WeakPolarHBondContact O-CB 3.46Å; C398-A402 PolarHBondContact O-N 3.22Å; L399-A402 WeakPolarHBondContact O-CB 3.38Å; L399-A402 PolarHBondContact O-N 3.03Å; T400-A402 VanDerWaalsContact C-N 3.34Å; T400-A402 PolarHBondContact O-N 2.91Å; A402-S405 WeakPolarHBondContact O-CB 3.37Å; A402-S405 PolarHBondContact O-N 2.85Å; A402-S406 PolarHBondContact O-N 3.38Å |
| 403 | A | 89.6 | Confident | 85.7 | Confident | 20 Ų | 20 | 44.6 Ų | 44.6 | 17% | 0.165 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | W165 L168 L399 T400 V401 S405 S406 | W165-A403 HydrophobicContact CH2-CB 4.09Å; W165-A403 HydrophobicContact CZ3-CB 3.56Å; L168-A403 HydrophobicContact CD1-CB 4.44Å; L399-A403 PolarHBondContact O-N 3.38Å; T400-A403 WeakPolarHBondContact O-CB 3.35Å; T400-A403 PolarHBondContact O-N 2.95Å; V401-A403 VanDerWaalsContact C-N 3.28Å; V401-A403 PolarHBondContact O-N 3.09Å; A403-S405 VanDerWaalsContact C-N 3.26Å; A403-S405 PolarHBondContact O-N 3.04Å; A403-S406 PolarHBondContact O-N 3.43Å; A403-S406 PolarHBondContact O-OG 2.99Å |
| 404 | L | 88.4 | Confident | 85.7 | Confident | 118 Ų | 118 | 42.1 Ų | 42.1 | 62% | 0.618 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -65.5 | -32.8 | 174 | -64.7 | 173.9 | 0 | 0 | 0 | 112.1 | T400 V401 S406 M407 | T400-L404 PolarHBondContact O-N 3.13Å; T400-L404 VanDerWaalsContact O-N 3.15Å; V401-L404 CarbonylContact O-C 3.3Å; V401-L404 PolarHBondContact O-N 3.47Å; V401-L404 VanDerWaalsContact O-N 3.13Å; L404-S406 PolarHBondContact O-N 3.49Å; L404-M407 WeakPolarHBondContact O-CB 3.08Å; L404-M407 PolarHBondContact O-N 2.84Å; L404-M407 VanDerWaalsContact O-N 3.1Å |
| 405 | S | 85.6 | Confident | 85.6 | Confident | 4 Ų | 4 | 41.3 Ų | 41.3 | 3% | 0.028 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.5 | -21.9 | 179.7 | -57.5 | 0 | 0 | 0 | 0 | 112.4 | I147 V401 A402 A403 M407 L408 | I147-S405 WeakPolarHBondContact CG1-OG 3.36Å; V401-S405 WeakPolarHBondContact O-CB 3.47Å; V401-S405 PolarHBondContact O-N 3.21Å; V401-S405 PolarHBondContact O-OG 3.42Å; A402-S405 WeakPolarHBondContact O-CB 3.37Å; A402-S405 PolarHBondContact O-N 2.85Å; A403-S405 VanDerWaalsContact C-N 3.26Å; A403-S405 PolarHBondContact O-N 3.04Å; S405-M407 PolarHBondContact O-N 3.29Å; S405-M407 VanDerWaalsContact O-N 3.16Å; S405-L408 VanDerWaalsContact O-CB 3.31Å; S405-L408 WeakPolarHBondContact O-CB 3.26Å; S405-L408 PolarHBondContact O-N 3.01Å |
| 406 | S | 79.8 | Confident | 85.7 | Confident | 32 Ų | 32 | 41.5 Ų | 41.5 | 22% | 0.224 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -11.2 | 173.7 | 80.4 | 0 | 0 | 0 | 0 | 113.6 | Y150 A402 A403 L404 | Y150-S406 VanDerWaalsContact CE2-CA 3.49Å; A402-S406 PolarHBondContact O-N 3.38Å; A403-S406 PolarHBondContact O-N 3.43Å; A403-S406 PolarHBondContact O-OG 2.99Å; L404-S406 PolarHBondContact O-N 3.49Å |
| 407 | M | 78.6 | Confident | 85.8 | Confident | 161 Ų | 161 | 38.8 Ų | 38.8 | 79% | 0.793 | 25% | 0.25 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.9 | -3.9 | 175 | -53.6 | -112 | 78.1 | 0 | 0 | 112.3 | L404 S405 G409 | L404-M407 WeakPolarHBondContact O-CB 3.08Å; L404-M407 PolarHBondContact O-N 2.84Å; L404-M407 VanDerWaalsContact O-N 3.1Å; S405-M407 PolarHBondContact O-N 3.29Å; S405-M407 VanDerWaalsContact O-N 3.16Å; M407-G409 PolarHBondContact O-N 3.28Å |
| 408 | L | 71.6 | Confident | 85.7 | Confident | 89 Ų | 89 | 38.6 Ų | 38.6 | 47% | 0.466 | 25% | 0.246 | S | C | . | . | trans | -78.1 | 118.3 | 179.2 | -68.2 | 166 | 0 | 0 | 0 | 110.7 | I147 S405 | I147-L408 HydrophobicContact CD1-CD1 4.39Å; I147-L408 HydrophobicContact CG1-CD1 4.28Å; S405-L408 VanDerWaalsContact O-CB 3.31Å; S405-L408 WeakPolarHBondContact O-CB 3.26Å; S405-L408 PolarHBondContact O-N 3.01Å | ||
| 409 | G | 66 | Low | 85.7 | Confident | 78 Ų | 78 | 39.9 Ų | 39.9 | 80% | 0.804 | 25% | 0.254 | S | S | * | . | trans | -85.2 | -15.2 | 176 | 0 | 0 | 0 | 0 | 0 | 115.5 | M407 G411 | M407-G409 PolarHBondContact O-N 3.28Å; G409-G411 VanDerWaalsContact C-N 3.32Å; G409-G411 PolarHBondContact O-N 3.31Å | ||
| 410 | G | 66.3 | Low | 85.6 | Confident | 47 Ų | 47 | 38.5 Ų | 38.5 | 49% | 0.485 | 25% | 0.247 | S | C | . | . | S | Bend | trans | -82.5 | 5.8 | -170.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | Q414 | G410-Q414 WeakPolarHBondContact O-CB 3.23Å; G410-Q414 PolarHBondContact O-OE1 3.23Å |
| 411 | G | 81.5 | Confident | 85.6 | Confident | 10 Ų | 10 | 34.2 Ų | 34.2 | 10% | 0.103 | 22% | 0.22 | C | C | . | . | trans | 83 | 144.5 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | D322 G409 L413 G415 | D322-G411 WeakPolarHBondContact OD2-CA 3.17Å; G409-G411 VanDerWaalsContact C-N 3.32Å; G409-G411 PolarHBondContact O-N 3.31Å; G411-L413 VanDerWaalsContact C-N 3.28Å; G411-L413 PolarHBondContact O-N 3.3Å; G411-G415 PolarHBondContact O-N 3.23Å; G411-G415 VanDerWaalsContact O-N 3.08Å | ||
| 412 | V | 86.7 | Confident | 85.7 | Confident | 5 Ų | 5 | 33.6 Ų | 33.6 | 3% | 0.03 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64.3 | -31.9 | -173.5 | -64.1 | 0 | 0 | 0 | 0 | 113 | V71 I147 Y150 A151 D322 S416 | V71-V412 HydrophobicContact CB-CG2 4.34Å; V71-V412 HydrophobicContact CG1-CB 4.28Å; V71-V412 HydrophobicContact CG1-CG2 4Å; V71-V412 WeakPolarHBondContact CG1-O 3.18Å; V71-V412 HydrophobicContact CG2-CB 4.38Å; V71-V412 HydrophobicContact CG2-CG2 4.39Å; I147-V412 HydrophobicContact CG2-CB 4.07Å; I147-V412 HydrophobicContact CG2-CG1 4.44Å; Y150-V412 HydrophobicContact CD1-CG1 3.58Å; Y150-V412 HydrophobicContact CE1-CG1 3.76Å; A151-V412 HydrophobicContact CB-CG2 4.33Å; D322-V412 HydrophobicContact CB-CG2 4.43Å; D322-V412 PolarHBondContact OD2-N 3.41Å; V412-S416 WeakPolarHBondContact O-CB 3.46Å; V412-S416 PolarHBondContact O-N 3.31Å; V412-S416 PolarHBondContact O-OG 2.88Å |
| 413 | L | 89.9 | Confident | 85.8 | Confident | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.005 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -71.2 | -49.4 | -178.4 | -178.3 | 148.8 | 0 | 0 | 0 | 112.2 | V71 V76 E79 F87 G411 G415 S416 F417 Y523 | V71-L413 VanDerWaalsContact CG1-CA 3.41Å; V71-L413 HydrophobicContact CG1-CB 3.99Å; V76-L413 HydrophobicContact CG2-CD1 3.9Å; E79-L413 HydrophobicContact CG-CD1 4.41Å; E79-L413 HydrophobicContact CG-CD2 4.16Å; F87-L413 HydrophobicContact CE2-CD1 4.33Å; F87-L413 HydrophobicContact CE2-CD2 4.33Å; F87-L413 HydrophobicContact CZ-CD1 4.26Å; G411-L413 VanDerWaalsContact C-N 3.28Å; G411-L413 PolarHBondContact O-N 3.3Å; L413-G415 VanDerWaalsContact C-N 3.34Å; L413-G415 PolarHBondContact O-N 3.1Å; L413-S416 PolarHBondContact O-N 3.28Å; L413-F417 HydrophobicContact CD1-CE2 4.34Å; L413-F417 HydrophobicContact CD2-CD2 3.68Å; L413-F417 HydrophobicContact CD2-CE2 3.78Å; L413-F417 HydrophobicContact CG-CD2 3.98Å; L413-F417 HydrophobicContact CG-CE2 3.83Å; L413-F417 WeakPolarHBondContact O-CD2 3.29Å; L413-F417 PolarHBondContact O-N 2.82Å; L413-Y523 WeakPolarHBondContact CD2-OH 3.46Å |
| 414 | Q | 90.4 | Very high | 86 | Confident | 52 Ų | 52 | 34.1 Ų | 34.1 | 24% | 0.243 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.1 | -45.2 | 175.1 | 178.5 | 175.6 | -19.4 | 0 | 0 | 110.9 | R241 G410 S416 F417 T418 Y523 | R241-Q414 VanDerWaalsContact CZ-OE1 3.29Å; G410-Q414 WeakPolarHBondContact O-CB 3.23Å; G410-Q414 PolarHBondContact O-OE1 3.23Å; Q414-S416 VanDerWaalsContact C-N 3.32Å; Q414-S416 PolarHBondContact O-N 3.26Å; Q414-F417 PolarHBondContact O-N 3.36Å; Q414-T418 VanDerWaalsContact O-CB 3.26Å; Q414-T418 WeakPolarHBondContact O-CB 3.4Å; Q414-T418 PolarHBondContact O-N 3.02Å; Q414-T418 PolarHBondContact O-OG1 3.34Å; Q414-Y523 HydrophobicContact CG-CD1 3.81Å; Q414-Y523 HydrophobicContact CG-CD2 4.42Å; Q414-Y523 HydrophobicContact CG-CE1 4.22Å; Q414-Y523 HydrophobicContact CG-CG 3.93Å |
| 415 | G | 90.6 | Very high | 86.3 | Confident | 15 Ų | 15 | 28.5 Ų | 28.5 | 16% | 0.155 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -57.3 | -45.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G411 L413 T418 V419 | G411-G415 PolarHBondContact O-N 3.23Å; G411-G415 VanDerWaalsContact O-N 3.08Å; L413-G415 VanDerWaalsContact C-N 3.34Å; L413-G415 PolarHBondContact O-N 3.1Å; G415-T418 PolarHBondContact O-N 3.48Å; G415-V419 WeakPolarHBondContact O-CG2 3.43Å; G415-V419 PolarHBondContact O-N 2.85Å |
| 416 | S | 91.1 | Very high | 86.8 | Confident | 4 Ų | 4 | 28.3 Ų | 28.3 | 3% | 0.028 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.7 | -51.7 | 178.8 | -63.2 | 0 | 0 | 0 | 0 | 112.4 | V71 I147 V412 L413 Q414 T418 V419 M420 | V71-S416 WeakPolarHBondContact CG1-OG 3.16Å; I147-S416 WeakPolarHBondContact CG2-OG 3.3Å; V412-S416 WeakPolarHBondContact O-CB 3.46Å; V412-S416 PolarHBondContact O-N 3.31Å; V412-S416 PolarHBondContact O-OG 2.88Å; L413-S416 PolarHBondContact O-N 3.28Å; Q414-S416 VanDerWaalsContact C-N 3.32Å; Q414-S416 PolarHBondContact O-N 3.26Å; S416-T418 VanDerWaalsContact C-N 3.29Å; S416-T418 PolarHBondContact O-N 3.13Å; S416-V419 PolarHBondContact O-N 3.03Å; S416-M420 WeakPolarHBondContact O-CB 3.33Å; S416-M420 WeakPolarHBondContact O-CG 3.47Å; S416-M420 PolarHBondContact O-N 3.1Å |
| 417 | F | 91.9 | Very high | 87.6 | Confident | 9 Ų | 9 | 27 Ų | 27 | 4% | 0.039 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66.3 | -31.6 | 179.4 | -76.8 | -53.7 | 0 | 0 | 0 | 112.9 | M90 V254 W255 L413 Q414 M420 G421 Y523 L524 | M90-F417 HydrophobicContact CE-CE2 4.4Å; M90-F417 HydrophobicContact CE-CZ 4.24Å; V254-F417 HydrophobicContact CG1-CD1 3.95Å; V254-F417 HydrophobicContact CG1-CE1 4.49Å; W255-F417 HydrophobicContact CH2-CE1 4.35Å; W255-F417 AromaticContact CZ2-CE1 3.7Å; W255-F417 HydrophobicContact CZ2-CE1 3.7Å; W255-F417 AromaticContact CZ2-CZ 3.81Å; W255-F417 HydrophobicContact CZ2-CZ 3.81Å; L413-F417 HydrophobicContact CD1-CE2 4.34Å; L413-F417 HydrophobicContact CD2-CD2 3.68Å; L413-F417 HydrophobicContact CD2-CE2 3.78Å; L413-F417 HydrophobicContact CG-CD2 3.98Å; L413-F417 HydrophobicContact CG-CE2 3.83Å; L413-F417 WeakPolarHBondContact O-CD2 3.29Å; L413-F417 PolarHBondContact O-N 2.82Å; Q414-F417 PolarHBondContact O-N 3.36Å; F417-M420 HydrophobicContact CD1-SD 4.47Å; F417-G421 PolarHBondContact O-N 3.44Å; F417-Y523 HydrophobicContact CB-CD2 3.68Å; F417-Y523 HydrophobicContact CB-CE2 3.56Å; F417-Y523 AromaticContact CD2-CE2 3.84Å; F417-Y523 HydrophobicContact CD2-CE2 3.84Å; F417-Y523 HydrophobicContact CG-CE2 4.07Å; F417-L524 HydrophobicContact CB-CD2 4.46Å; F417-L524 HydrophobicContact CD2-CD2 4.49Å; F417-L524 HydrophobicContact CG-CD2 4.33Å |
| 418 | T | 92.9 | Very high | 88.5 | Confident | 23 Ų | 23 | 19.4 Ų | 19.4 | 14% | 0.141 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.9 | -52.6 | 174.4 | -61.7 | 0 | 0 | 0 | 0 | 110.7 | Q414 G415 S416 M420 G421 V422 A460 Y526 | Q414-T418 VanDerWaalsContact O-CB 3.26Å; Q414-T418 WeakPolarHBondContact O-CB 3.4Å; Q414-T418 PolarHBondContact O-N 3.02Å; Q414-T418 PolarHBondContact O-OG1 3.34Å; G415-T418 PolarHBondContact O-N 3.48Å; S416-T418 VanDerWaalsContact C-N 3.29Å; S416-T418 PolarHBondContact O-N 3.13Å; T418-M420 VanDerWaalsContact C-N 3.33Å; T418-M420 PolarHBondContact O-N 3.31Å; T418-G421 PolarHBondContact O-N 3.15Å; T418-V422 HydrophobicContact CG2-CG2 4.2Å; T418-V422 WeakPolarHBondContact O-CB 3.5Å; T418-V422 WeakPolarHBondContact O-CG2 3.34Å; T418-V422 PolarHBondContact O-N 3.23Å; T418-A460 HydrophobicContact CG2-CB 4.05Å; T418-Y526 HydrophobicContact CG2-CD2 3.97Å; T418-Y526 HydrophobicContact CG2-CE2 4.05Å |
| 419 | V | 92.1 | Very high | 89.7 | Confident | 27 Ų | 27 | 15.1 Ų | 15.1 | 16% | 0.164 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -57.6 | -47.6 | 177.7 | 167.5 | 0 | 0 | 0 | 0 | 110.9 | L143 I147 G415 S416 I423 | L143-V419 HydrophobicContact CB-CG1 3.52Å; L143-V419 HydrophobicContact CB-CG2 4.43Å; L143-V419 HydrophobicContact CD1-CG1 4.33Å; I147-V419 HydrophobicContact CD1-CG2 3.87Å; G415-V419 WeakPolarHBondContact O-CG2 3.43Å; G415-V419 PolarHBondContact O-N 2.85Å; S416-V419 PolarHBondContact O-N 3.03Å; V419-I423 HydrophobicContact CG1-CD1 4.39Å; V419-I423 PolarHBondContact O-N 3.44Å |
| 420 | M | 89.1 | Confident | 91.2 | Very high | 6 Ų | 6 | 11.4 Ų | 11.4 | 3% | 0.03 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -62.8 | -46.8 | -179.6 | -68.2 | 164.9 | 77.9 | 0 | 0 | 111.3 | F67 Y144 M258 S416 F417 T418 S424 | F67-M420 HydrophobicContact CD1-CE 4.08Å; F67-M420 HydrophobicContact CE1-CE 3.68Å; F67-M420 HydrophobicContact CZ-CE 4.48Å; Y144-M420 HydrophobicContact CD2-CG 3.8Å; Y144-M420 HydrophobicContact CD2-SD 3.41Å; Y144-M420 WeakPolarHBondContact CD2-SD 3.22Å; Y144-M420 HydrophobicContact CE2-CE 4.28Å; Y144-M420 HydrophobicContact CE2-CG 4.34Å; Y144-M420 HydrophobicContact CE2-SD 3.35Å; Y144-M420 WeakPolarHBondContact CE2-SD 3.29Å; Y144-M420 HydrophobicContact CG-CG 4.12Å; Y144-M420 HydrophobicContact CG-SD 4.15Å; M258-M420 HydrophobicContact CB-CE 4.49Å; M258-M420 HydrophobicContact CE-CB 4.29Å; M258-M420 HydrophobicContact CE-CE 4.29Å; M258-M420 HydrophobicContact CG-CE 3.26Å; M258-M420 HydrophobicContact SD-CE 3.12Å; M258-M420 WeakPolarHBondContact SD-CE 3.16Å; M258-M420 HydrophobicContact SD-CG 4.35Å; S416-M420 WeakPolarHBondContact O-CB 3.33Å; S416-M420 WeakPolarHBondContact O-CG 3.47Å; S416-M420 PolarHBondContact O-N 3.1Å; F417-M420 HydrophobicContact CD1-SD 4.47Å; T418-M420 VanDerWaalsContact C-N 3.33Å; T418-M420 PolarHBondContact O-N 3.31Å; M420-S424 WeakPolarHBondContact O-CA 3.42Å; M420-S424 WeakPolarHBondContact O-CB 3.41Å; M420-S424 PolarHBondContact O-N 3.42Å; M420-S424 PolarHBondContact O-OG 3.41Å |
| 421 | G | 91.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 9.2 Ų | 9.2 | 0% | 0 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -63.9 | -54.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F417 T418 I423 G425 G527 | F417-G421 PolarHBondContact O-N 3.44Å; T418-G421 PolarHBondContact O-N 3.15Å; G421-I423 PolarHBondContact O-N 3.44Å; G421-G425 WeakPolarHBondContact O-CA 3.33Å; G421-G425 PolarHBondContact O-N 3.16Å; G421-G527 VanDerWaalsContact O-CA 3.26Å; G421-G527 WeakPolarHBondContact O-CA 3.4Å |
| 422 | V | 94.6 | Very high | 93.3 | Very high | 5 Ų | 5 | 9.8 Ų | 9.8 | 3% | 0.03 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -58.8 | -46 | -174.9 | 170 | 0 | 0 | 0 | 0 | 111.7 | T418 P426 S456 L457 A460 Y526 | T418-V422 HydrophobicContact CG2-CG2 4.2Å; T418-V422 WeakPolarHBondContact O-CB 3.5Å; T418-V422 WeakPolarHBondContact O-CG2 3.34Å; T418-V422 PolarHBondContact O-N 3.23Å; V422-P426 WeakPolarHBondContact O-CD 3.49Å; V422-P426 WeakPolarHBondContact O-CG 3.09Å; V422-S456 PolarHBondContact O-OG 2.86Å; V422-S456 VanDerWaalsContact O-OG 3.06Å; V422-L457 HydrophobicContact CG1-CB 4.21Å; V422-L457 HydrophobicContact CG1-CD1 4.34Å; V422-A460 HydrophobicContact CG2-CB 3.57Å; V422-Y526 HydrophobicContact CG2-CD2 3.99Å; V422-Y526 HydrophobicContact CG2-CG 4.37Å |
| 423 | I | 94.1 | Very high | 93.8 | Very high | 21 Ų | 21 | 9.6 Ų | 9.6 | 11% | 0.108 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -90.9 | -36.2 | -173.5 | -52.4 | 176 | 0 | 0 | 0 | 111.3 | Q136 V139 A140 L143 V419 G421 L453 | Q136-I423 HydrophobicContact CG-CG2 3.4Å; Q136-I423 VanDerWaalsContact CG-CG2 3.4Å; Q136-I423 PolarHBondContact NE2-O 3.27Å; Q136-I423 WeakPolarHBondContact O-CG2 3.37Å; V139-I423 HydrophobicContact CG1-CD1 4.27Å; A140-I423 HydrophobicContact CB-CB 3.86Å; A140-I423 HydrophobicContact CB-CD1 4.42Å; A140-I423 HydrophobicContact CB-CG2 3.64Å; L143-I423 HydrophobicContact CD1-CD1 3.73Å; V419-I423 HydrophobicContact CG1-CD1 4.39Å; V419-I423 PolarHBondContact O-N 3.44Å; G421-I423 PolarHBondContact O-N 3.44Å; I423-L453 HydrophobicContact CG1-CD1 4.44Å |
| 424 | S | 92.6 | Very high | 94 | Very high | 9 Ų | 9 | 9.5 Ų | 9.5 | 6% | 0.063 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -87.5 | -21.3 | -175.4 | -42.2 | 0 | 0 | 0 | 0 | 113.4 | S257 M258 M420 L427 L428 | S257-S424 WeakPolarHBondContact OG-CB 3.29Å; M258-S424 WeakPolarHBondContact CE-OG 3.27Å; M420-S424 WeakPolarHBondContact O-CA 3.42Å; M420-S424 WeakPolarHBondContact O-CB 3.41Å; M420-S424 PolarHBondContact O-N 3.42Å; M420-S424 PolarHBondContact O-OG 3.41Å; S424-L427 WeakPolarHBondContact O-CB 3.45Å; S424-L427 PolarHBondContact O-N 3.07Å; S424-L428 PolarHBondContact O-N 3.05Å |
| 425 | G | 95.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 7.2 Ų | 7.2 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -58.6 | -54.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | G421 L427 L428 G429 T531 | G421-G425 WeakPolarHBondContact O-CA 3.33Å; G421-G425 PolarHBondContact O-N 3.16Å; G425-L427 PolarHBondContact O-N 3.41Å; G425-L428 WeakPolarHBondContact O-CB 3.46Å; G425-L428 PolarHBondContact O-N 2.94Å; G425-L428 VanDerWaalsContact O-N 3.1Å; G425-G429 PolarHBondContact O-N 3.11Å; G425-T531 WeakPolarHBondContact CA-OG1 3.49Å; G425-T531 WeakPolarHBondContact O-CA 3.03Å; G425-T531 PolarHBondContact O-OG1 3.03Å |
| 426 | P | 96.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 8.8 Ų | 8.8 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -57.3 | -37.8 | 176.6 | -24.9 | 34 | 0 | 0 | 0 | 112.5 | V422 G429 A430 L449 G452 L453 T534 | V422-P426 WeakPolarHBondContact O-CD 3.49Å; V422-P426 WeakPolarHBondContact O-CG 3.09Å; P426-G429 WeakPolarHBondContact O-CA 3.37Å; P426-G429 PolarHBondContact O-N 2.84Å; P426-G429 VanDerWaalsContact O-N 3.12Å; P426-A430 PolarHBondContact O-N 2.87Å; P426-L449 HydrophobicContact CB-CD2 4.19Å; P426-L449 WeakPolarHBondContact O-CD2 3.31Å; P426-G452 VanDerWaalsContact CG-C 3.47Å; P426-L453 HydrophobicContact CG-CB 4.43Å; P426-T534 WeakPolarHBondContact CA-OG1 3.39Å; P426-T534 WeakPolarHBondContact CB-OG1 3.3Å; P426-T534 WeakPolarHBondContact O-CG2 3.42Å |
| 427 | L | 96 | Very high | 94.4 | Very high | 5 Ų | 5 | 11.4 Ų | 11.4 | 3% | 0.026 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -63.3 | -44.4 | 176.6 | -173.7 | 64.7 | 0 | 0 | 0 | 111.9 | Y118 L121 S424 G425 G429 A430 F431 | Y118-L427 HydrophobicContact CE1-CD1 4Å; Y118-L427 HydrophobicContact CE1-CD2 3.73Å; Y118-L427 HydrophobicContact CE1-CG 4.36Å; L121-L427 HydrophobicContact CD1-CD1 4.39Å; S424-L427 WeakPolarHBondContact O-CB 3.45Å; S424-L427 PolarHBondContact O-N 3.07Å; G425-L427 PolarHBondContact O-N 3.41Å; L427-G429 PolarHBondContact O-N 3.36Å; L427-A430 PolarHBondContact O-N 3.43Å; L427-A430 VanDerWaalsContact O-N 3.14Å; L427-F431 HydrophobicContact CD1-CD2 4.24Å; L427-F431 HydrophobicContact CD1-CE2 3.89Å; L427-F431 HydrophobicContact CD2-CE2 4.47Å; L427-F431 HydrophobicContact CG-CD2 4.11Å; L427-F431 HydrophobicContact CG-CE2 3.94Å; L427-F431 WeakPolarHBondContact O-CD2 3.42Å; L427-F431 PolarHBondContact O-N 2.58Å; L427-F431 VanDerWaalsContact O-N 3.11Å |
| 428 | L | 96.8 | Very high | 94.3 | Very high | 1 Ų | 1 | 13.4 Ų | 13.4 | 1% | 0.005 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -56.1 | -41.7 | 171.3 | 175.5 | 65.7 | 0 | 0 | 0 | 111.2 | F105 L253 L256 V261 S424 G425 A430 F431 T432 T531 | F105-L428 HydrophobicContact CE1-CD1 4.03Å; F105-L428 HydrophobicContact CE2-CD1 4.41Å; F105-L428 HydrophobicContact CZ-CD1 3.64Å; L253-L428 HydrophobicContact CD2-CD2 4.31Å; L256-L428 HydrophobicContact CB-CD2 4.11Å; L256-L428 HydrophobicContact CD2-CD1 4.36Å; L256-L428 HydrophobicContact CD2-CD2 4.22Å; L256-L428 HydrophobicContact CG-CD1 4Å; L256-L428 HydrophobicContact CG-CD2 4.14Å; V261-L428 HydrophobicContact CG1-CD1 4.06Å; V261-L428 HydrophobicContact CG2-CB 4.34Å; V261-L428 HydrophobicContact CG2-CD1 4.4Å; S424-L428 PolarHBondContact O-N 3.05Å; G425-L428 WeakPolarHBondContact O-CB 3.46Å; G425-L428 PolarHBondContact O-N 2.94Å; G425-L428 VanDerWaalsContact O-N 3.1Å; L428-A430 PolarHBondContact O-N 3.48Å; L428-F431 PolarHBondContact O-N 3.27Å; L428-T432 WeakPolarHBondContact O-CB 3.39Å; L428-T432 PolarHBondContact O-N 3.35Å; L428-T432 PolarHBondContact O-OG1 3.25Å; L428-T531 HydrophobicContact CD2-CG2 4.14Å; L428-T531 HydrophobicContact CG-CG2 4.18Å |
| 429 | G | 97.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -57.5 | -46 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | G425 P426 L427 T432 L433 | G425-G429 PolarHBondContact O-N 3.11Å; P426-G429 WeakPolarHBondContact O-CA 3.37Å; P426-G429 PolarHBondContact O-N 2.84Å; P426-G429 VanDerWaalsContact O-N 3.12Å; L427-G429 PolarHBondContact O-N 3.36Å; G429-T432 PolarHBondContact O-N 2.9Å; G429-L433 WeakPolarHBondContact O-CG 3.43Å; G429-L433 PolarHBondContact O-N 3.48Å |
| 430 | A | 97.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -63.6 | -43.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | P426 L427 L428 T432 L433 G434 V445 L449 | P426-A430 PolarHBondContact O-N 2.87Å; L427-A430 PolarHBondContact O-N 3.43Å; L427-A430 VanDerWaalsContact O-N 3.14Å; L428-A430 PolarHBondContact O-N 3.48Å; A430-T432 VanDerWaalsContact C-N 3.34Å; A430-L433 PolarHBondContact O-N 3.01Å; A430-G434 PolarHBondContact O-N 2.82Å; A430-V445 HydrophobicContact CB-CG1 3.73Å; A430-L449 HydrophobicContact CB-CD1 4.05Å; A430-L449 HydrophobicContact CB-CD2 3.69Å; A430-L449 HydrophobicContact CB-CG 3.87Å |
| 431 | F | 96.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65 | -39.9 | 174.5 | -82.5 | -80.4 | 0 | 0 | 0 | 111.9 | F105 F109 T117 Y118 Y120 L121 V261 L427 L428 G434 M435 | F105-F431 HydrophobicContact CE1-CB 4.24Å; F109-F431 AromaticContact CE1-CE1 3.99Å; F109-F431 HydrophobicContact CE1-CE1 3.99Å; F109-F431 AromaticContact CZ-CD1 3.93Å; F109-F431 HydrophobicContact CZ-CD1 3.93Å; F109-F431 AromaticContact CZ-CE1 3.68Å; F109-F431 HydrophobicContact CZ-CE1 3.68Å; F109-F431 HydrophobicContact CZ-CZ 4.47Å; T117-F431 WeakPolarHBondContact O-CE1 3.29Å; T117-F431 WeakPolarHBondContact O-CZ 3.27Å; Y118-F431 HydrophobicContact CD1-CE2 4.24Å; Y118-F431 HydrophobicContact CD1-CZ 4.07Å; Y118-F431 HydrophobicContact CE1-CE2 4.02Å; Y118-F431 HydrophobicContact CE1-CZ 4.18Å; Y120-F431 AromaticContact CD1-CD1 3.58Å; Y120-F431 HydrophobicContact CD1-CD1 3.58Å; Y120-F431 AromaticContact CD1-CE1 3.66Å; Y120-F431 HydrophobicContact CD1-CE1 3.66Å; Y120-F431 HydrophobicContact CE1-CD1 4.02Å; Y120-F431 HydrophobicContact CG-CE1 4.35Å; L121-F431 HydrophobicContact CD1-CE1 4.42Å; L121-F431 HydrophobicContact CD1-CE2 3.92Å; L121-F431 HydrophobicContact CD1-CZ 3.87Å; L121-F431 HydrophobicContact CD2-CD1 3.9Å; L121-F431 HydrophobicContact CD2-CD2 4.4Å; L121-F431 HydrophobicContact CD2-CE1 3.93Å; L121-F431 HydrophobicContact CD2-CE2 4.41Å; L121-F431 HydrophobicContact CD2-CG 4.16Å; L121-F431 HydrophobicContact CD2-CZ 4.19Å; L121-F431 HydrophobicContact CG-CD1 4.37Å; L121-F431 HydrophobicContact CG-CE1 3.88Å; L121-F431 HydrophobicContact CG-CE2 4.26Å; L121-F431 HydrophobicContact CG-CZ 3.82Å; V261-F431 HydrophobicContact CB-CD2 3.59Å; V261-F431 HydrophobicContact CB-CE2 3.89Å; V261-F431 HydrophobicContact CB-CG 4.07Å; V261-F431 HydrophobicContact CG1-CB 3.54Å; V261-F431 HydrophobicContact CG1-CD1 4.24Å; V261-F431 HydrophobicContact CG1-CD2 3.54Å; V261-F431 HydrophobicContact CG1-CE2 4.27Å; V261-F431 HydrophobicContact CG1-CG 3.52Å; V261-F431 HydrophobicContact CG2-CD2 4.23Å; L427-F431 HydrophobicContact CD1-CD2 4.24Å; L427-F431 HydrophobicContact CD1-CE2 3.89Å; L427-F431 HydrophobicContact CD2-CE2 4.47Å; L427-F431 HydrophobicContact CG-CD2 4.11Å; L427-F431 HydrophobicContact CG-CE2 3.94Å; L427-F431 WeakPolarHBondContact O-CD2 3.42Å; L427-F431 PolarHBondContact O-N 2.58Å; L427-F431 VanDerWaalsContact O-N 3.11Å; L428-F431 PolarHBondContact O-N 3.27Å; F431-G434 PolarHBondContact O-N 2.91Å; F431-G434 VanDerWaalsContact O-N 3.16Å; F431-M435 HydrophobicContact CD1-CE 4.01Å; F431-M435 WeakPolarHBondContact O-CB 3.26Å; F431-M435 WeakPolarHBondContact O-CG 3.37Å; F431-M435 PolarHBondContact O-N 2.88Å |
| 432 | T | 96.8 | Very high | 94.8 | Very high | 23 Ų | 23 | 13.8 Ų | 13.8 | 14% | 0.141 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -63.6 | -43.1 | 177.2 | -55.8 | 0 | 0 | 0 | 0 | 111.2 | L428 G429 A430 G434 M435 L436 L535 | L428-T432 WeakPolarHBondContact O-CB 3.39Å; L428-T432 PolarHBondContact O-N 3.35Å; L428-T432 PolarHBondContact O-OG1 3.25Å; G429-T432 PolarHBondContact O-N 2.9Å; A430-T432 VanDerWaalsContact C-N 3.34Å; T432-G434 VanDerWaalsContact C-N 3.32Å; T432-G434 PolarHBondContact O-N 3.04Å; T432-M435 PolarHBondContact O-N 3.41Å; T432-L436 HydrophobicContact CG2-CD1 3.77Å; T432-L436 HydrophobicContact CG2-CG 4.36Å; T432-L436 WeakPolarHBondContact O-CB 3.43Å; T432-L436 PolarHBondContact O-N 2.71Å; T432-L535 HydrophobicContact CG2-CD2 3.86Å |
| 433 | L | 96.5 | Very high | 94.9 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -58.3 | -44.3 | 171.2 | -71.4 | 167.2 | 0 | 0 | 0 | 111.3 | G429 A430 L437 C440 V445 T534 L535 A539 | G429-L433 WeakPolarHBondContact O-CG 3.43Å; G429-L433 PolarHBondContact O-N 3.48Å; A430-L433 PolarHBondContact O-N 3.01Å; L433-L437 HydrophobicContact CD2-CD1 3.54Å; L433-L437 WeakPolarHBondContact O-CB 3.45Å; L433-L437 PolarHBondContact O-N 3Å; L433-L437 VanDerWaalsContact O-N 3.16Å; L433-C440 HydrophobicContact CB-CB 4.32Å; L433-C440 WeakPolarHBondContact CD2-SG 3.12Å; L433-V445 HydrophobicContact CB-CG2 4.21Å; L433-V445 HydrophobicContact CD1-CG2 4.07Å; L433-T534 HydrophobicContact CD1-CG2 4.15Å; L433-L535 HydrophobicContact CD2-CD2 3.95Å; L433-L535 HydrophobicContact CG-CD2 3.79Å; L433-A539 HydrophobicContact CD2-CB 4.3Å |
| 434 | G | 94.6 | Very high | 95 | Very high | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -62.1 | -49 | 179 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y120 R124 F125 A430 F431 T432 L558 | Y120-G434 PolarHBondContact OH-O 3.22Å; Y120-G434 VanDerWaalsContact OH-O 3.12Å; R124-G434 PolarHBondContact NE-O 3.31Å; F125-G434 VanDerWaalsContact CZ-CA 3.45Å; A430-G434 PolarHBondContact O-N 2.82Å; F431-G434 PolarHBondContact O-N 2.91Å; F431-G434 VanDerWaalsContact O-N 3.16Å; T432-G434 VanDerWaalsContact C-N 3.32Å; T432-G434 PolarHBondContact O-N 3.04Å; G434-L558 WeakPolarHBondContact O-CD2 3.12Å |
| 435 | M | 94.5 | Very high | 95.2 | Very high | 3 Ų | 3 | 15.2 Ų | 15.2 | 2% | 0.015 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -82 | -32.8 | -169.8 | -69.4 | 179.6 | 178.6 | 0 | 0 | 113.4 | F105 V108 F109 Y120 F431 T432 W559 | F105-M435 HydrophobicContact CD1-CE 4.09Å; F105-M435 HydrophobicContact CD1-SD 3.59Å; F105-M435 VanDerWaalsContact CD1-SD 3.59Å; F105-M435 HydrophobicContact CE1-SD 3.93Å; F105-M435 HydrophobicContact CG-SD 4.39Å; V108-M435 HydrophobicContact CB-CE 4.03Å; V108-M435 HydrophobicContact CB-SD 4.41Å; V108-M435 HydrophobicContact CG1-CE 3.87Å; V108-M435 HydrophobicContact CG2-CE 4.4Å; V108-M435 HydrophobicContact CG2-CG 4.5Å; V108-M435 HydrophobicContact CG2-SD 4.14Å; F109-M435 HydrophobicContact CD2-CE 4.42Å; F109-M435 HydrophobicContact CE1-CE 4.05Å; F109-M435 HydrophobicContact CE2-CE 3.68Å; F109-M435 HydrophobicContact CZ-CE 3.48Å; F109-M435 VanDerWaalsContact CZ-CE 3.48Å; Y120-M435 HydrophobicContact CD1-CE 4.2Å; Y120-M435 HydrophobicContact CE1-CE 4.03Å; Y120-M435 HydrophobicContact CE1-CG 3.77Å; Y120-M435 HydrophobicContact CE2-CE 4.45Å; Y120-M435 HydrophobicContact CE2-CG 4.27Å; Y120-M435 VanDerWaalsContact CZ-CG 3.47Å; Y120-M435 WeakPolarHBondContact OH-CA 3.32Å; Y120-M435 WeakPolarHBondContact OH-CG 3.44Å; Y120-M435 PolarHBondContact OH-N 2.8Å; Y120-M435 VanDerWaalsContact OH-N 3.09Å; F431-M435 HydrophobicContact CD1-CE 4.01Å; F431-M435 WeakPolarHBondContact O-CB 3.26Å; F431-M435 WeakPolarHBondContact O-CG 3.37Å; F431-M435 PolarHBondContact O-N 2.88Å; T432-M435 PolarHBondContact O-N 3.41Å; M435-W559 PolarHBondContact O-N 2.87Å |
| 436 | L | 93.3 | Very high | 95.3 | Very high | 49 Ų | 49 | 17.7 Ų | 17.7 | 26% | 0.257 | 10% | 0.104 | S | C | . | . | H | α-helix | trans | -109 | -26.5 | -171.1 | -55.4 | -174.8 | 0 | 0 | 0 | 113.6 | T432 P438 W559 | T432-L436 HydrophobicContact CG2-CD1 3.77Å; T432-L436 HydrophobicContact CG2-CG 4.36Å; T432-L436 WeakPolarHBondContact O-CB 3.43Å; T432-L436 PolarHBondContact O-N 2.71Å; L436-P438 WeakPolarHBondContact O-CD 3.25Å; L436-W559 HydrophobicContact CD2-CB 3.99Å; L436-W559 HydrophobicContact CD2-CG 4.49Å |
| 437 | L | 93.1 | Very high | 95.3 | Very high | 59 Ų | 59 | 20.1 Ų | 20.1 | 31% | 0.309 | 12% | 0.121 | S | C | . | . | trans | -111.7 | 102.8 | -173.8 | -76.5 | 153.4 | 0 | 0 | 0 | 111.6 | R124 L433 A439 C440 | R124-L437 PolarHBondContact NH2-O 3.49Å; L433-L437 HydrophobicContact CD2-CD1 3.54Å; L433-L437 WeakPolarHBondContact O-CB 3.45Å; L433-L437 PolarHBondContact O-N 3Å; L433-L437 VanDerWaalsContact O-N 3.16Å; L437-A439 VanDerWaalsContact C-N 3.28Å; L437-A439 PolarHBondContact O-N 2.94Å; L437-C440 HydrophobicContact CB-CB 4.48Å; L437-C440 VanDerWaalsContact CB-SG 3.58Å; L437-C440 PolarHBondContact O-N 3.07Å | ||
| 438 | P | 89.9 | Confident | 95.4 | Very high | 50 Ų | 50 | 19.9 Ų | 19.9 | 33% | 0.325 | 12% | 0.12 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.7 | -28.2 | -177.7 | 26.2 | -33.9 | 0 | 0 | 0 | 113.1 | R124 L436 C440 L553 L558 | R124-P438 PolarHBondContact NH2-O 3.4Å; L436-P438 WeakPolarHBondContact O-CD 3.25Å; P438-C440 VanDerWaalsContact C-N 3.26Å; P438-C440 PolarHBondContact O-N 2.89Å; P438-L553 HydrophobicContact CB-CD1 4.35Å; P438-L558 HydrophobicContact CB-CD1 3.94Å; P438-L558 HydrophobicContact CB-CD2 4.43Å |
| 439 | A | 90.3 | Very high | 95.4 | Very high | 14 Ų | 14 | 20.2 Ų | 20.2 | 12% | 0.116 | 12% | 0.121 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -16.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | L437 Y543 P547 T548 | L437-A439 VanDerWaalsContact C-N 3.28Å; L437-A439 PolarHBondContact O-N 2.94Å; A439-Y543 HydrophobicContact CB-CE1 4.09Å; A439-P547 HydrophobicContact CB-CB 3.9Å; A439-P547 WeakPolarHBondContact O-CA 3.44Å; A439-T548 PolarHBondContact O-N 3.05Å |
| 440 | C | 94.5 | Very high | 95.4 | Very high | 1 Ų | 1 | 22.5 Ų | 22.5 | 1% | 0.007 | 14% | 0.141 | C | C | . | . | trans | -69.5 | 137.5 | -174.9 | -70.1 | 0 | 0 | 0 | 0 | 112.6 | R124 F125 L433 L437 P438 V445 S542 T548 | R124-C440 PolarHBondContact NH1-O 3.24Å; R124-C440 VanDerWaalsContact NH1-O 3.09Å; R124-C440 PolarHBondContact NH2-O 2.92Å; F125-C440 HydrophobicContact CE1-CB 4.11Å; F125-C440 WeakPolarHBondContact CE1-O 3.46Å; F125-C440 HydrophobicContact CZ-CB 4.37Å; L433-C440 HydrophobicContact CB-CB 4.32Å; L433-C440 WeakPolarHBondContact CD2-SG 3.12Å; L437-C440 HydrophobicContact CB-CB 4.48Å; L437-C440 VanDerWaalsContact CB-SG 3.58Å; L437-C440 PolarHBondContact O-N 3.07Å; P438-C440 VanDerWaalsContact C-N 3.26Å; P438-C440 PolarHBondContact O-N 2.89Å; C440-V445 HydrophobicContact CB-CG2 4.49Å; C440-S542 WeakPolarHBondContact CA-OG 3.29Å; C440-T548 PolarHBondContact O-OG1 2.92Å | ||
| 441 | N | 94.7 | Very high | 95.5 | Very high | 13 Ų | 13 | 23.7 Ų | 23.7 | 7% | 0.07 | 15% | 0.151 | C | C | . | . | trans | -120.5 | 172.9 | -178.1 | 71.2 | 20.7 | 0 | 0 | 0 | 111.9 | P443 G444 V445 S542 T545 G546 T548 | N441-P443 WeakPolarHBondContact OD1-CD 3.34Å; N441-G444 PolarHBondContact O-N 2.92Å; N441-G444 PolarHBondContact OD1-N 3.46Å; N441-V445 PolarHBondContact O-N 2.91Å; N441-V445 VanDerWaalsContact O-N 3.11Å; N441-S542 PolarHBondContact N-OG 3.26Å; N441-S542 VanDerWaalsContact N-OG 3.09Å; N441-S542 PolarHBondContact ND2-O 2.94Å; N441-S542 PolarHBondContact OD1-OG 3.19Å; N441-T545 PolarHBondContact ND2-OG1 3.19Å; N441-T545 PolarHBondContact OD1-OG1 2.91Å; N441-G546 PolarHBondContact ND2-O 3.49Å; N441-T548 VanDerWaalsContact CB-OG1 3.31Å; N441-T548 WeakPolarHBondContact CB-OG1 3.18Å | ||
| 442 | T | 95.8 | Very high | 95.5 | Very high | 37 Ų | 37 | 23.7 Ų | 23.7 | 23% | 0.227 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -60 | -51.8 | -176.5 | -67.1 | 0 | 0 | 0 | 0 | 113.6 | F125 S126 V129 G444 V445 L446 | F125-T442 VanDerWaalsContact C-OG1 3.29Å; F125-T442 WeakPolarHBondContact CB-OG1 3.21Å; F125-T442 PolarHBondContact O-OG1 2.81Å; S126-T442 WeakPolarHBondContact OG-CG2 3.41Å; V129-T442 HydrophobicContact CG2-CG2 4.03Å; T442-G444 VanDerWaalsContact C-N 3.29Å; T442-G444 PolarHBondContact O-N 3.08Å; T442-V445 PolarHBondContact O-N 3.37Å; T442-L446 HydrophobicContact CG2-CD1 3.97Å; T442-L446 HydrophobicContact CG2-CG 4.49Å; T442-L446 WeakPolarHBondContact O-CG 3.47Å; T442-L446 PolarHBondContact O-N 3.16Å; T442-L446 VanDerWaalsContact O-N 3.08Å |
| 443 | P | 95.8 | Very high | 95.5 | Very high | 64 Ų | 64 | 25.6 Ų | 25.6 | 42% | 0.416 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -58.1 | -39.3 | 177.5 | -25.6 | 34.2 | 0 | 0 | 0 | 113.4 | N441 S447 | N441-P443 WeakPolarHBondContact OD1-CD 3.34Å; P443-S447 WeakPolarHBondContact O-CB 3.41Å; P443-S447 PolarHBondContact O-N 3.48Å; P443-S447 VanDerWaalsContact O-N 3.08Å; P443-S447 PolarHBondContact O-OG 2.85Å |
| 444 | G | 96.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.3 | -51.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | N441 T442 L446 S447 G448 G538 | N441-G444 PolarHBondContact O-N 2.92Å; N441-G444 PolarHBondContact OD1-N 3.46Å; T442-G444 VanDerWaalsContact C-N 3.29Å; T442-G444 PolarHBondContact O-N 3.08Å; G444-L446 PolarHBondContact O-N 3.33Å; G444-S447 PolarHBondContact O-N 3.37Å; G444-G448 PolarHBondContact O-N 3.34Å; G444-G538 VanDerWaalsContact O-CA 3.23Å; G444-G538 WeakPolarHBondContact O-CA 3.3Å |
| 445 | V | 97.2 | Very high | 95.6 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.4 | -40.5 | -178.7 | 175.4 | 0 | 0 | 0 | 0 | 112.7 | F125 V129 A430 L433 C440 N441 T442 G448 L449 | F125-V445 HydrophobicContact CD1-CG2 4.09Å; F125-V445 HydrophobicContact CD2-CG2 4.37Å; F125-V445 HydrophobicContact CE1-CG2 3.53Å; F125-V445 HydrophobicContact CE2-CG1 4.37Å; F125-V445 HydrophobicContact CE2-CG2 3.84Å; F125-V445 HydrophobicContact CG-CG2 4.48Å; F125-V445 HydrophobicContact CZ-CB 4.47Å; F125-V445 HydrophobicContact CZ-CG2 3.4Å; V129-V445 HydrophobicContact CG1-CG1 3.88Å; A430-V445 HydrophobicContact CB-CG1 3.73Å; L433-V445 HydrophobicContact CB-CG2 4.21Å; L433-V445 HydrophobicContact CD1-CG2 4.07Å; C440-V445 HydrophobicContact CB-CG2 4.49Å; N441-V445 PolarHBondContact O-N 2.91Å; N441-V445 VanDerWaalsContact O-N 3.11Å; T442-V445 PolarHBondContact O-N 3.37Å; V445-G448 PolarHBondContact O-N 3.43Å; V445-L449 HydrophobicContact CG1-CD1 4.17Å; V445-L449 HydrophobicContact CG1-CG 4.46Å; V445-L449 WeakPolarHBondContact O-CB 3.28Å; V445-L449 WeakPolarHBondContact O-CG 3.43Å; V445-L449 PolarHBondContact O-N 3.37Å |
| 446 | L | 97.6 | Very high | 95.6 | Very high | 52 Ų | 52 | 32.3 Ų | 32.3 | 27% | 0.272 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -62.8 | -45.1 | 176.8 | -71.4 | 174.8 | 0 | 0 | 0 | 111.9 | A128 V129 C132 T442 G444 G448 L449 A450 | A128-L446 HydrophobicContact CB-CD1 4.31Å; V129-L446 HydrophobicContact CB-CD2 4.47Å; V129-L446 HydrophobicContact CG2-CD2 3.89Å; V129-L446 HydrophobicContact CG2-CG 3.96Å; C132-L446 HydrophobicContact CB-CD2 4.37Å; T442-L446 HydrophobicContact CG2-CD1 3.97Å; T442-L446 HydrophobicContact CG2-CG 4.49Å; T442-L446 WeakPolarHBondContact O-CG 3.47Å; T442-L446 PolarHBondContact O-N 3.16Å; T442-L446 VanDerWaalsContact O-N 3.08Å; G444-L446 PolarHBondContact O-N 3.33Å; L446-G448 VanDerWaalsContact C-N 3.35Å; L446-L449 PolarHBondContact O-N 2.9Å; L446-A450 PolarHBondContact O-N 3.15Å |
| 447 | S | 97.1 | Very high | 95.7 | Very high | 51 Ų | 51 | 34.5 Ų | 34.5 | 36% | 0.357 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66.2 | -37.8 | 176.6 | -62.8 | 0 | 0 | 0 | 0 | 112.2 | P443 G444 A450 A451 | P443-S447 WeakPolarHBondContact O-CB 3.41Å; P443-S447 PolarHBondContact O-N 3.48Å; P443-S447 VanDerWaalsContact O-N 3.08Å; P443-S447 PolarHBondContact O-OG 2.85Å; G444-S447 PolarHBondContact O-N 3.37Å; S447-A450 PolarHBondContact O-N 3.06Å; S447-A451 VanDerWaalsContact O-CB 3.32Å; S447-A451 WeakPolarHBondContact O-CB 3.39Å; S447-A451 PolarHBondContact O-N 3.29Å |
| 448 | G | 97.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.5 | -43.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | G444 V445 L446 G452 T534 | G444-G448 PolarHBondContact O-N 3.34Å; V445-G448 PolarHBondContact O-N 3.43Å; L446-G448 VanDerWaalsContact C-N 3.35Å; G448-G452 PolarHBondContact O-N 3.08Å; G448-T534 VanDerWaalsContact O-CA 3.29Å; G448-T534 WeakPolarHBondContact O-CA 3.35Å; G448-T534 WeakPolarHBondContact O-CB 3.46Å; G448-T534 PolarHBondContact O-OG1 2.83Å |
| 449 | L | 97 | Very high | 95.9 | Very high | 8 Ų | 8 | 35.9 Ų | 35.9 | 4% | 0.042 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.4 | -47.5 | 174.7 | -81.3 | 170.7 | 0 | 0 | 0 | 111.3 | V129 P426 A430 V445 L446 G452 L453 | V129-L449 HydrophobicContact CG1-CD1 4.46Å; P426-L449 HydrophobicContact CB-CD2 4.19Å; P426-L449 WeakPolarHBondContact O-CD2 3.31Å; A430-L449 HydrophobicContact CB-CD1 4.05Å; A430-L449 HydrophobicContact CB-CD2 3.69Å; A430-L449 HydrophobicContact CB-CG 3.87Å; V445-L449 HydrophobicContact CG1-CD1 4.17Å; V445-L449 HydrophobicContact CG1-CG 4.46Å; V445-L449 WeakPolarHBondContact O-CB 3.28Å; V445-L449 WeakPolarHBondContact O-CG 3.43Å; V445-L449 PolarHBondContact O-N 3.37Å; L446-L449 PolarHBondContact O-N 2.9Å; L449-G452 PolarHBondContact O-N 3.12Å; L449-L453 WeakPolarHBondContact O-CB 3.33Å; L449-L453 PolarHBondContact O-N 3.31Å |
| 450 | A | 97.4 | Very high | 96 | Very high | 49 Ų | 49 | 35.6 Ų | 35.6 | 41% | 0.405 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -61.3 | -49.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L446 S447 G452 L453 I454 | L446-A450 PolarHBondContact O-N 3.15Å; S447-A450 PolarHBondContact O-N 3.06Å; A450-G452 PolarHBondContact O-N 3.03Å; A450-L453 PolarHBondContact O-N 3.46Å; A450-I454 WeakPolarHBondContact O-CB 3.45Å; A450-I454 WeakPolarHBondContact O-CD1 3.47Å; A450-I454 WeakPolarHBondContact O-CG1 3.39Å; A450-I454 PolarHBondContact O-N 2.97Å |
| 451 | A | 97.8 | Very high | 95.8 | Very high | 25 Ų | 25 | 38.8 Ų | 38.8 | 21% | 0.207 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.4 | -45.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112.1 | S447 L453 I454 V455 T533 C537 | S447-A451 VanDerWaalsContact O-CB 3.32Å; S447-A451 WeakPolarHBondContact O-CB 3.39Å; S447-A451 PolarHBondContact O-N 3.29Å; A451-L453 PolarHBondContact O-N 2.97Å; A451-I454 PolarHBondContact O-N 3.39Å; A451-V455 WeakPolarHBondContact O-CB 3.31Å; A451-V455 WeakPolarHBondContact O-CG2 3.38Å; A451-V455 PolarHBondContact O-N 3.16Å; A451-T533 HydrophobicContact CB-CG2 3.99Å; A451-C537 HydrophobicContact CB-CB 4.08Å |
| 452 | G | 97.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.4 | -41.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | P426 G448 L449 A450 S456 | P426-G452 VanDerWaalsContact CG-C 3.47Å; G448-G452 PolarHBondContact O-N 3.08Å; L449-G452 PolarHBondContact O-N 3.12Å; A450-G452 PolarHBondContact O-N 3.03Å; G452-S456 VanDerWaalsContact O-CB 3.32Å; G452-S456 WeakPolarHBondContact O-CB 3.49Å; G452-S456 PolarHBondContact O-N 3.09Å; G452-S456 PolarHBondContact O-OG 3.1Å |
| 453 | L | 96.3 | Very high | 95.2 | Very high | 62 Ų | 62 | 37.1 Ų | 37.1 | 33% | 0.325 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -67.1 | -43.9 | 176.8 | -173.3 | 66.7 | 0 | 0 | 0 | 111.7 | I423 P426 L449 A450 A451 S456 L457 | I423-L453 HydrophobicContact CG1-CD1 4.44Å; P426-L453 HydrophobicContact CG-CB 4.43Å; L449-L453 WeakPolarHBondContact O-CB 3.33Å; L449-L453 PolarHBondContact O-N 3.31Å; A450-L453 PolarHBondContact O-N 3.46Å; A451-L453 PolarHBondContact O-N 2.97Å; L453-S456 PolarHBondContact O-OG 3.15Å; L453-L457 WeakPolarHBondContact O-CB 3.49Å; L453-L457 PolarHBondContact O-N 3.36Å |
| 454 | I | 97 | Very high | 94.8 | Very high | 110 Ų | 110 | 38.9 Ų | 38.9 | 56% | 0.564 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -61.6 | -49.1 | 178.8 | -71 | 165.1 | 0 | 0 | 0 | 110.8 | A450 A451 W458 | A450-I454 WeakPolarHBondContact O-CB 3.45Å; A450-I454 WeakPolarHBondContact O-CD1 3.47Å; A450-I454 WeakPolarHBondContact O-CG1 3.39Å; A450-I454 PolarHBondContact O-N 2.97Å; A451-I454 PolarHBondContact O-N 3.39Å; I454-W458 VanDerWaalsContact O-CB 3.25Å; I454-W458 WeakPolarHBondContact O-CB 3.16Å; I454-W458 PolarHBondContact O-N 3.39Å |
| 455 | V | 96.5 | Very high | 94.3 | Very high | 35 Ų | 35 | 44.4 Ų | 44.4 | 21% | 0.212 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -66.4 | -46.1 | -176.9 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | A451 W458 V459 L529 T533 | A451-V455 WeakPolarHBondContact O-CB 3.31Å; A451-V455 WeakPolarHBondContact O-CG2 3.38Å; A451-V455 PolarHBondContact O-N 3.16Å; V455-W458 PolarHBondContact O-N 2.88Å; V455-V459 WeakPolarHBondContact O-CG2 3.33Å; V455-V459 PolarHBondContact O-N 3.28Å; V455-L529 HydrophobicContact CG1-CD1 4.16Å; V455-L529 HydrophobicContact CG1-CD2 3.84Å; V455-L529 HydrophobicContact CG1-CG 3.9Å; V455-T533 HydrophobicContact CB-CG2 4.32Å; V455-T533 HydrophobicContact CG2-CG2 4.05Å |
| 456 | S | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.1 | -39.5 | 179.2 | 56.8 | 0 | 0 | 0 | 0 | 112.4 | V422 G452 L453 V459 A460 | V422-S456 PolarHBondContact O-OG 2.86Å; V422-S456 VanDerWaalsContact O-OG 3.06Å; G452-S456 VanDerWaalsContact O-CB 3.32Å; G452-S456 WeakPolarHBondContact O-CB 3.49Å; G452-S456 PolarHBondContact O-N 3.09Å; G452-S456 PolarHBondContact O-OG 3.1Å; L453-S456 PolarHBondContact O-OG 3.15Å; S456-V459 PolarHBondContact O-N 3.31Å; S456-A460 WeakPolarHBondContact O-CB 3.39Å; S456-A460 PolarHBondContact O-N 3.41Å |
| 457 | L | 94.6 | Very high | 93.1 | Very high | 94 Ų | 94 | 49.2 Ų | 49.2 | 49% | 0.492 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -66.9 | -41.5 | 175.9 | -174.6 | 65.4 | 0 | 0 | 0 | 111.6 | V422 L453 V459 A460 V461 | V422-L457 HydrophobicContact CG1-CB 4.21Å; V422-L457 HydrophobicContact CG1-CD1 4.34Å; L453-L457 WeakPolarHBondContact O-CB 3.49Å; L453-L457 PolarHBondContact O-N 3.36Å; L457-V459 PolarHBondContact O-N 3.31Å; L457-A460 PolarHBondContact O-N 3.3Å; L457-V461 HydrophobicContact CD1-CG2 4.17Å; L457-V461 HydrophobicContact CG-CG2 4.31Å; L457-V461 WeakPolarHBondContact O-CB 3.43Å; L457-V461 VanDerWaalsContact O-CG2 3.28Å; L457-V461 WeakPolarHBondContact O-CG2 3.36Å; L457-V461 PolarHBondContact O-N 2.68Å |
| 458 | W | 94.6 | Very high | 92.5 | Very high | 138 Ų | 138 | 48.1 Ų | 48.1 | 52% | 0.523 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -57.8 | -49.3 | 175.9 | 174.7 | 14.3 | 0 | 0 | 0 | 111 | I454 V455 V461 G462 Y519 | I454-W458 VanDerWaalsContact O-CB 3.25Å; I454-W458 WeakPolarHBondContact O-CB 3.16Å; I454-W458 PolarHBondContact O-N 3.39Å; V455-W458 PolarHBondContact O-N 2.88Å; W458-V461 PolarHBondContact O-N 3.33Å; W458-G462 PolarHBondContact O-N 2.89Å; W458-Y519 AromaticContact NE1-CE1 3.75Å; W458-Y519 AromaticContact NE1-CZ 3.76Å; W458-Y519 PolarHBondContact NE1-OH 3.24Å |
| 459 | V | 93.3 | Very high | 91.6 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.6 | -44.8 | 178.8 | 176.5 | 0 | 0 | 0 | 0 | 111.7 | V455 S456 L457 V461 G462 A463 F518 Y526 L529 | V455-V459 WeakPolarHBondContact O-CG2 3.33Å; V455-V459 PolarHBondContact O-N 3.28Å; S456-V459 PolarHBondContact O-N 3.31Å; L457-V459 PolarHBondContact O-N 3.31Å; V459-V461 PolarHBondContact O-N 3.22Å; V459-G462 PolarHBondContact O-N 3.01Å; V459-A463 WeakPolarHBondContact O-CB 3.48Å; V459-A463 PolarHBondContact O-N 3.27Å; V459-F518 HydrophobicContact CG2-CD1 3.73Å; V459-F518 HydrophobicContact CG2-CE1 3.13Å; V459-F518 HydrophobicContact CG2-CE2 4.5Å; V459-F518 HydrophobicContact CG2-CZ 3.58Å; V459-Y526 HydrophobicContact CG1-CD1 3.98Å; V459-Y526 HydrophobicContact CG1-CE1 3.55Å; V459-L529 HydrophobicContact CB-CD2 4.18Å; V459-L529 HydrophobicContact CG2-CD2 3.66Å |
| 460 | A | 91.9 | Very high | 90.8 | Very high | 8 Ų | 8 | 55.1 Ų | 55.1 | 7% | 0.066 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | T418 V422 S456 L457 A463 T464 Y526 | T418-A460 HydrophobicContact CG2-CB 4.05Å; V422-A460 HydrophobicContact CG2-CB 3.57Å; S456-A460 WeakPolarHBondContact O-CB 3.39Å; S456-A460 PolarHBondContact O-N 3.41Å; L457-A460 PolarHBondContact O-N 3.3Å; A460-A463 PolarHBondContact O-N 2.93Å; A460-T464 WeakPolarHBondContact O-CG2 3.49Å; A460-T464 PolarHBondContact O-N 3.49Å; A460-T464 PolarHBondContact O-OG1 3.36Å; A460-Y526 HydrophobicContact CB-CD2 4.07Å; A460-Y526 HydrophobicContact CB-CE2 4Å |
| 461 | V | 91.3 | Very high | 89.8 | Confident | 68 Ų | 68 | 60.2 Ų | 60.2 | 41% | 0.412 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 175.9 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | L457 W458 V459 A463 T464 L465 | L457-V461 HydrophobicContact CD1-CG2 4.17Å; L457-V461 HydrophobicContact CG-CG2 4.31Å; L457-V461 WeakPolarHBondContact O-CB 3.43Å; L457-V461 VanDerWaalsContact O-CG2 3.28Å; L457-V461 WeakPolarHBondContact O-CG2 3.36Å; L457-V461 PolarHBondContact O-N 2.68Å; W458-V461 PolarHBondContact O-N 3.33Å; V459-V461 PolarHBondContact O-N 3.22Å; V461-A463 VanDerWaalsContact C-N 3.33Å; V461-A463 PolarHBondContact O-N 3.48Å; V461-T464 WeakPolarHBondContact CA-OG1 3.44Å; V461-T464 PolarHBondContact O-N 2.93Å; V461-T464 VanDerWaalsContact O-N 3.16Å; V461-T464 PolarHBondContact O-OG1 2.96Å; V461-L465 HydrophobicContact CG1-CD1 3.86Å; V461-L465 HydrophobicContact CG1-CG 4.32Å; V461-L465 WeakPolarHBondContact O-CG 3.11Å; V461-L465 PolarHBondContact O-N 2.94Å |
| 462 | G | 89.3 | Confident | 88.9 | Confident | 4 Ų | 4 | 61.4 Ų | 61.4 | 4% | 0.041 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -56.6 | -44.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | W458 V459 L465 Y466 | W458-G462 PolarHBondContact O-N 2.89Å; V459-G462 PolarHBondContact O-N 3.01Å; G462-L465 PolarHBondContact O-N 2.94Å; G462-Y466 PolarHBondContact O-N 3.42Å |
| 463 | A | 88 | Confident | 88 | Confident | 11 Ų | 11 | 63 Ų | 63 | 9% | 0.091 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -68.3 | -31.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | V459 A460 V461 Y466 P467 Y519 Y526 | V459-A463 WeakPolarHBondContact O-CB 3.48Å; V459-A463 PolarHBondContact O-N 3.27Å; A460-A463 PolarHBondContact O-N 2.93Å; V461-A463 VanDerWaalsContact C-N 3.33Å; V461-A463 PolarHBondContact O-N 3.48Å; A463-Y466 CarbonylContact O-C 3.5Å; A463-P467 WeakPolarHBondContact O-CA 3.3Å; A463-Y519 VanDerWaalsContact CB-O 3.23Å; A463-Y519 WeakPolarHBondContact CB-O 3.36Å; A463-Y526 WeakPolarHBondContact CB-OH 3.3Å |
| 464 | T | 86.6 | Confident | 87.1 | Confident | 102 Ų | 102 | 61.5 Ų | 61.5 | 63% | 0.626 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -73.9 | -34.6 | 174.1 | 56.6 | 0 | 0 | 0 | 0 | 113 | A460 V461 | A460-T464 WeakPolarHBondContact O-CG2 3.49Å; A460-T464 PolarHBondContact O-N 3.49Å; A460-T464 PolarHBondContact O-OG1 3.36Å; V461-T464 WeakPolarHBondContact CA-OG1 3.44Å; V461-T464 PolarHBondContact O-N 2.93Å; V461-T464 VanDerWaalsContact O-N 3.16Å; V461-T464 PolarHBondContact O-OG1 2.96Å |
| 465 | L | 86.9 | Confident | 86.4 | Confident | 116 Ų | 116 | 58.1 Ų | 58.1 | 61% | 0.607 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -78.2 | -34.7 | 178.2 | -67.6 | 175.2 | 0 | 0 | 0 | 112.2 | V461 G462 | V461-L465 HydrophobicContact CG1-CD1 3.86Å; V461-L465 HydrophobicContact CG1-CG 4.32Å; V461-L465 WeakPolarHBondContact O-CG 3.11Å; V461-L465 PolarHBondContact O-N 2.94Å; G462-L465 PolarHBondContact O-N 2.94Å |
| 466 | Y | 87.1 | Confident | 85.8 | Confident | 80 Ų | 80 | 57.9 Ų | 57.9 | 31% | 0.314 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -126.4 | 74.5 | -178.8 | -55.4 | -79.5 | 0 | 0 | 0 | 110 | G462 A463 P512 A515 Y519 | G462-Y466 PolarHBondContact O-N 3.42Å; A463-Y466 CarbonylContact O-C 3.5Å; Y466-P512 HydrophobicContact CD1-CG 4.44Å; Y466-P512 HydrophobicContact CD2-CG 4.36Å; Y466-P512 HydrophobicContact CE1-CG 3.95Å; Y466-P512 HydrophobicContact CE2-CG 3.87Å; Y466-A515 HydrophobicContact CG-CB 4.27Å; Y466-Y519 HydrophobicContact CD2-CD2 4.04Å; Y466-Y519 HydrophobicContact CD2-CE2 4.11Å |
| 467 | P | 83.4 | Confident | 85 | Confident | 73 Ų | 73 | 63.1 Ų | 63.1 | 47% | 0.474 | 35% | 0.348 | S | S | . | . | P | Polyproline II helix | trans | -63.1 | 139.8 | -177.6 | 25.4 | -33.7 | 0 | 0 | 0 | 111.1 | A463 R511 | A463-P467 WeakPolarHBondContact O-CA 3.3Å; P467-R511 PolarHBondContact O-NH2 3.38Å |
| 468 | P | 83.2 | Confident | 84.3 | Confident | 27 Ų | 27 | 61.3 Ų | 61.3 | 18% | 0.175 | 34% | 0.341 | C | S | . | . | P | Polyproline II helix | trans | -64.4 | 149.8 | 177.1 | 25.5 | -32.5 | 0 | 0 | 0 | 111.1 | I472 M473 A520 | P468-I472 HydrophobicContact CB-CB 4.25Å; P468-I472 HydrophobicContact CB-CG2 4.11Å; P468-M473 HydrophobicContact CB-CG 4.24Å; P468-M473 HydrophobicContact CG-CG 3.78Å; P468-M473 HydrophobicContact CG-SD 4.17Å; P468-M473 WeakPolarHBondContact O-CE 3.45Å; P468-A520 HydrophobicContact CB-CB 4.07Å |
| 469 | G | 79.3 | Confident | 83.6 | Confident | 35 Ų | 35 | 56.9 Ų | 56.9 | 36% | 0.361 | 33% | 0.331 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 156 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113 | Q471 I472 M473 | G469-Q471 PolarHBondContact O-N 3.48Å; G469-Q471 VanDerWaalsContact O-N 3.15Å; G469-I472 PolarHBondContact O-N 2.62Å; G469-M473 PolarHBondContact O-N 3.34Å |
| 470 | E | 79.9 | Confident | 82.9 | Confident | 120 Ų | 120 | 58.9 Ų | 58.9 | 56% | 0.561 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -57.1 | -32.4 | -178.1 | -64.5 | -171.8 | 153.9 | 0 | 0 | 113.6 | M473 G474 V475 | E470-M473 HydrophobicContact CG-CE 4.32Å; E470-M473 PolarHBondContact O-N 3.47Å; E470-G474 PolarHBondContact O-N 3.2Å; E470-V475 HydrophobicContact CB-CB 4.34Å; E470-V475 HydrophobicContact CB-CG2 4.13Å; E470-V475 HydrophobicContact CG-CG2 4.46Å; E470-V475 PolarHBondContact O-N 2.76Å; E470-V475 VanDerWaalsContact O-N 3.08Å |
| 471 | Q | 77.2 | Confident | 81.7 | Confident | 156 Ų | 156 | 62.7 Ų | 62.7 | 73% | 0.729 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -66.3 | -43.7 | 175.1 | -68.5 | -173.8 | -17.5 | 0 | 0 | 112.2 | G469 M473 G474 | G469-Q471 PolarHBondContact O-N 3.48Å; G469-Q471 VanDerWaalsContact O-N 3.15Å; Q471-M473 VanDerWaalsContact C-N 3.3Å; Q471-M473 PolarHBondContact O-N 3.08Å; Q471-G474 PolarHBondContact O-N 3.16Å; Q471-G474 VanDerWaalsContact O-N 3.1Å |
| 472 | I | 78.6 | Confident | 80.7 | Confident | 50 Ų | 50 | 63.4 Ų | 63.4 | 26% | 0.256 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.2 | -38 | 177.1 | -59.4 | 174.9 | 0 | 0 | 0 | 109.9 | R239 P468 G469 G474 A520 | R239-I472 HydrophobicContact CB-CG2 4.03Å; P468-I472 HydrophobicContact CB-CB 4.25Å; P468-I472 HydrophobicContact CB-CG2 4.11Å; G469-I472 PolarHBondContact O-N 2.62Å; I472-G474 PolarHBondContact O-N 2.97Å; I472-A520 HydrophobicContact CG2-CB 4.29Å |
| 473 | M | 78.3 | Confident | 80 | Confident | 34 Ų | 34 | 65 Ų | 65 | 17% | 0.167 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -70 | -15.5 | 174.8 | -67.7 | -166.2 | -72.6 | 0 | 0 | 113.5 | Y83 R241 P468 G469 E470 Q471 V475 | Y83-M473 HydrophobicContact CE1-CB 4.39Å; Y83-M473 VanDerWaalsContact CE1-O 3.3Å; Y83-M473 WeakPolarHBondContact CE1-O 3.36Å; R241-M473 HydrophobicContact CB-CB 4.4Å; R241-M473 VanDerWaalsContact CB-O 3.3Å; R241-M473 WeakPolarHBondContact CB-O 3.46Å; P468-M473 HydrophobicContact CB-CG 4.24Å; P468-M473 HydrophobicContact CG-CG 3.78Å; P468-M473 HydrophobicContact CG-SD 4.17Å; P468-M473 WeakPolarHBondContact O-CE 3.45Å; G469-M473 PolarHBondContact O-N 3.34Å; E470-M473 HydrophobicContact CG-CE 4.32Å; E470-M473 PolarHBondContact O-N 3.47Å; Q471-M473 VanDerWaalsContact C-N 3.3Å; Q471-M473 PolarHBondContact O-N 3.08Å; M473-V475 HydrophobicContact CB-CG2 4.18Å |
| 474 | G | 77.4 | Confident | 78.7 | Confident | 30 Ų | 30 | 71 Ų | 71 | 31% | 0.309 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.8 | 33.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y83 E470 Q471 I472 L476 | Y83-G474 WeakPolarHBondContact CD1-O 3.26Å; E470-G474 PolarHBondContact O-N 3.2Å; Q471-G474 PolarHBondContact O-N 3.16Å; Q471-G474 VanDerWaalsContact O-N 3.1Å; I472-G474 PolarHBondContact O-N 2.97Å; G474-L476 PolarHBondContact O-N 2.91Å |
| 475 | V | 81.6 | Confident | 77.1 | Confident | 39 Ų | 39 | 74 Ų | 74 | 24% | 0.236 | 45% | 0.445 | C | S | . | . | P | Polyproline II helix | trans | -64.3 | 124.8 | 175.6 | -176.1 | 0 | 0 | 0 | 0 | 108.9 | Y83 E470 M473 | Y83-V475 HydrophobicContact CE1-CB 4.21Å; Y83-V475 HydrophobicContact CE1-CG2 3.57Å; E470-V475 HydrophobicContact CB-CB 4.34Å; E470-V475 HydrophobicContact CB-CG2 4.13Å; E470-V475 HydrophobicContact CG-CG2 4.46Å; E470-V475 PolarHBondContact O-N 2.76Å; E470-V475 VanDerWaalsContact O-N 3.08Å; M473-V475 HydrophobicContact CB-CG2 4.18Å |
| 476 | L | 83.2 | Confident | 75 | Confident | 31 Ų | 31 | 71.5 Ų | 71.5 | 16% | 0.162 | 44% | 0.441 | C | S | . | . | P | Polyproline II helix | trans | -81.1 | 144.8 | 179 | -71.7 | 168.8 | 0 | 0 | 0 | 110.3 | R82 R228 G474 | R82-L476 PolarHBondContact O-N 2.96Å; R228-L476 VanDerWaalsContact NH2-C 3.27Å; R228-L476 VanDerWaalsContact NH2-CB 3.28Å; R228-L476 PolarHBondContact NH2-O 3.42Å; G474-L476 PolarHBondContact O-N 2.91Å |
| 477 | P | 80.1 | Confident | 72.8 | Confident | 109 Ų | 109 | 73.7 Ų | 73.7 | 71% | 0.708 | 47% | 0.468 | S | S | * | . | P | Polyproline II helix | trans | -64 | 143.5 | -171.5 | 25.7 | -34.6 | 0 | 0 | 0 | 113.4 | R228 | R228-P477 PolarHBondContact NH2-O 3.11Š|
| 478 | T | 80 | Confident | 70.8 | Confident | 57 Ų | 57 | 76.9 Ų | 76.9 | 35% | 0.35 | 49% | 0.486 | S | S | . | . | trans | -129 | 166.2 | 171.5 | 56.4 | 0 | 0 | 0 | 0 | 110 | F304 D311 | F304-T478 HydrophobicContact CE2-CG2 4.39Å; D311-T478 WeakPolarHBondContact OD2-CB 3.48Å; D311-T478 WeakPolarHBondContact OD2-CG2 3.24Å; D311-T478 PolarHBondContact OD2-OG1 3.33Å | ||
| 479 | S | 79.4 | Confident | 68.9 | Low | 44 Ų | 44 | 83.3 Ų | 83.3 | 31% | 0.308 | 52% | 0.518 | S | S | . | . | trans | -125.4 | 147.7 | -174.3 | -175.4 | 0 | 0 | 0 | 0 | 111.7 | D311 A481 | D311-S479 PolarHBondContact N-O 3Å; S479-A481 WeakPolarHBondContact OG-CB 3.35Å; S479-A481 PolarHBondContact OG-N 3.3Å; S479-A481 VanDerWaalsContact OG-N 3.12Å | ||
| 480 | A | 77.8 | Confident | 67 | Low | 43 Ų | 43 | 91 Ų | 91 | 36% | 0.355 | 55% | 0.547 | S | S | . | . | trans | -119.6 | 12.2 | 166.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L314 T315 S482 C483 | L314-A480 HydrophobicContact CB-CB 4.02Å; L314-A480 HydrophobicContact CD1-CB 4.29Å; T315-A480 HydrophobicContact CG2-CB 4.36Å; A480-S482 VanDerWaalsContact C-N 3.3Å; A480-S482 PolarHBondContact O-N 3.32Å; A480-C483 PolarHBondContact O-SG 2.99Å | ||
| 481 | A | 67.4 | Low | 64.7 | Low | 88 Ų | 88 | 88 Ų | 88 | 73% | 0.727 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70 | -22.2 | -166.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | S479 | S479-A481 WeakPolarHBondContact OG-CB 3.35Å; S479-A481 PolarHBondContact OG-N 3.3Å; S479-A481 VanDerWaalsContact OG-N 3.12Å |
| 482 | S | 69.3 | Low | 62.6 | Low | 82 Ų | 82 | 86.5 Ų | 86.5 | 57% | 0.573 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.2 | 21.7 | -176.3 | -57.9 | 0 | 0 | 0 | 0 | 113.4 | D309 A480 T484 | D309-S482 PolarHBondContact O-N 2.98Å; A480-S482 VanDerWaalsContact C-N 3.3Å; A480-S482 PolarHBondContact O-N 3.32Å; S482-T484 PolarHBondContact O-N 3.42Å; S482-T484 VanDerWaalsContact O-N 3.1Å |
| 483 | C | 74.8 | Confident | 60.7 | Low | 39 Ų | 39 | 90.9 Ų | 90.9 | 26% | 0.264 | 58% | 0.584 | S | S | . | * | trans | -72.3 | 102.9 | 176.6 | -62.7 | 0 | 0 | 0 | 0 | 110.8 | C310 T315 A480 N485 | C310-C483 WeakPolarHBondContact CA-SG 3.44Å; C310-C483 HydrophobicContact CB-CB 4.15Å; C310-C483 WeakPolarHBondContact CB-SG 3.3Å; C310-C483 VanDerWaalsContact SG-CA 3.6Å; C310-C483 WeakPolarHBondContact SG-CB 3.41Å; C310-C483 CovalentContact SG-SG 2.04Å; C310-C483 PolarHBondContact SG-SG 3.4Å; T315-C483 HydrophobicContact CG2-CB 4.17Å; T315-C483 WeakPolarHBondContact CG2-SG 3.4Å; A480-C483 PolarHBondContact O-SG 2.99Å; C483-N485 PolarHBondContact O-N 2.87Å | ||
| 484 | T | 60.5 | Low | 58.8 | Low | 135 Ų | 135 | 92.8 Ų | 92.8 | 83% | 0.828 | 61% | 0.612 | S | S | * | * | trans | -71 | 117.9 | 168.4 | 42.1 | 0 | 0 | 0 | 0 | 109.9 | S482 | S482-T484 PolarHBondContact O-N 3.42Å; S482-T484 VanDerWaalsContact O-N 3.1Å | ||
| 485 | N | 54.5 | Low | 56.6 | Low | 166 Ų | 166 | 95.6 Ų | 95.6 | 89% | 0.888 | 63% | 0.633 | S | S | * | * | trans | 65.7 | 80.1 | 173.5 | -65 | -14.6 | 0 | 0 | 0 | 117.5 | C483 | C483-N485 PolarHBondContact O-N 2.87Š| ||
| 486 | A | 41.5 | Very low | 54.6 | Low | 63 Ų | 63 | 98.9 Ų | 98.9 | 52% | 0.521 | 66% | 0.664 | S | S | . | * | S | Bend | trans | -123.6 | 107.8 | 132.8 | 0 | 0 | 0 | 0 | 0 | 106.2 | V488 | A486-V488 PolarHBondContact O-N 3.21Š|
| 487 | S | 41.7 | Very low | 52 | Low | 126 Ų | 126 | 104 Ų | 104 | 88% | 0.881 | 69% | 0.691 | S | S | * | * | trans | -8.7 | 79.1 | 172 | 47.6 | 0 | 0 | 0 | 0 | 116.7 | L489 | S487-L489 VanDerWaalsContact C-N 3.33Å; S487-L489 PolarHBondContact O-N 2.98Å | ||
| 488 | V | 41.8 | Very low | 50.1 | Low | 141 Ų | 141 | 103.6 Ų | 103.6 | 86% | 0.855 | 70% | 0.698 | S | S | * | * | trans | -91.6 | 79.4 | 157.9 | -178.8 | 0 | 0 | 0 | 0 | 105.8 | A486 | A486-V488 PolarHBondContact O-N 3.21Š| ||
| 489 | L | 43.1 | Very low | 47.7 | Very low | 161 Ų | 161 | 106.2 Ų | 106.2 | 84% | 0.843 | 72% | 0.718 | S | S | * | * | trans | -142.5 | 69.5 | 168.3 | -136.4 | 152.1 | 0 | 0 | 0 | 108.8 | S487 | S487-L489 VanDerWaalsContact C-N 3.33Å; S487-L489 PolarHBondContact O-N 2.98Å | ||
| 490 | M | 38.8 | Very low | 45.4 | Very low | 198 Ų | 198 | 108.3 Ų | 108.3 | 98% | 0.975 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -160.1 | 80.9 | 140.3 | -81.4 | -132.4 | -169.2 | 0 | 0 | 109.2 | ||
| 491 | G | 32.1 | Very low | 43.1 | Very low | 57 Ų | 57 | 116.6 Ų | 116.6 | 59% | 0.588 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -173.2 | 126.7 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||
| 492 | P | 33.6 | Very low | 41.4 | Very low | 123 Ų | 123 | 117.7 Ų | 117.7 | 80% | 0.799 | 75% | 0.752 | S | S | * | * | trans | -63 | 151.8 | -172.7 | 25.3 | -31.7 | 0 | 0 | 0 | 111.4 | G494 | P492-G494 PolarHBondContact O-N 3.49Š| ||
| 493 | P | 38.8 | Very low | 39.8 | Very low | 142 Ų | 142 | 117.5 Ų | 117.5 | 92% | 0.922 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -73.9 | 99.7 | -173 | 30.3 | -31.9 | 0 | 0 | 0 | 109.5 | ||
| 494 | G | 36.6 | Very low | 37.8 | Very low | 74 Ų | 74 | 120.6 Ų | 120.6 | 76% | 0.763 | 77% | 0.771 | S | S | * | * | trans | 172.7 | 62.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114 | P492 | P492-G494 PolarHBondContact O-N 3.49Š| ||
| 495 | A | 32.7 | Very low | 36.9 | Very low | 90 Ų | 90 | 120 Ų | 120 | 74% | 0.744 | 77% | 0.772 | S | S | * | * | trans | -170.9 | 68.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | N497 | A495-N497 PolarHBondContact O-N 3.32Š| ||
| 496 | A | 38.9 | Very low | 36.2 | Very low | 108 Ų | 108 | 114.3 Ų | 114.3 | 89% | 0.893 | 75% | 0.753 | S | S | * | * | trans | -71 | 77.5 | 151.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 497 | N | 29.6 | Very low | 36.4 | Very low | 137 Ų | 137 | 117.6 Ų | 117.6 | 73% | 0.733 | 77% | 0.767 | S | S | * | * | trans | -131.1 | 118.7 | 160.3 | -98.6 | -11.5 | 0 | 0 | 0 | 106.2 | A495 S499 | A495-N497 PolarHBondContact O-N 3.32Å; N497-S499 VanDerWaalsContact C-N 3.29Å; N497-S499 PolarHBondContact O-N 2.64Å | ||
| 498 | A | 38.6 | Very low | 36.8 | Very low | 102 Ų | 102 | 117.3 Ų | 117.3 | 84% | 0.843 | 75% | 0.752 | S | S | * | * | trans | -46.6 | 100.3 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108 | S500 | A498-S500 PolarHBondContact O-N 3.38Š| ||
| 499 | S | 29.6 | Very low | 37.1 | Very low | 111 Ų | 111 | 115.9 Ų | 115.9 | 78% | 0.776 | 75% | 0.754 | S | S | * | * | trans | -73 | 83.1 | 162.2 | -54.9 | 0 | 0 | 0 | 0 | 104 | N497 R501 | N497-S499 VanDerWaalsContact C-N 3.29Å; N497-S499 PolarHBondContact O-N 2.64Å; S499-R501 VanDerWaalsContact C-N 3.26Å; S499-R501 PolarHBondContact O-N 2.81Å | ||
| 500 | S | 32.3 | Very low | 38.2 | Very low | 88 Ų | 88 | 111.6 Ų | 111.6 | 62% | 0.615 | 75% | 0.75 | S | S | * | * | trans | -42.6 | 111.3 | 140.2 | 51.5 | 0 | 0 | 0 | 0 | 104.3 | A498 V502 | A498-S500 PolarHBondContact O-N 3.38Å; S500-V502 PolarHBondContact O-N 3.48Å | ||
| 501 | R | 29.9 | Very low | 40.1 | Very low | 217 Ų | 217 | 106.2 Ų | 106.2 | 82% | 0.819 | 72% | 0.718 | S | S | * | * | trans | -55.5 | 91.8 | 151.5 | -79.2 | -179.3 | -179.8 | 151.7 | -0 | 103.2 | S499 P503 | S499-R501 VanDerWaalsContact C-N 3.26Å; S499-R501 PolarHBondContact O-N 2.81Å; R501-P503 VanDerWaalsContact O-CD 3.28Å; R501-P503 WeakPolarHBondContact O-CD 3.22Å | ||
| 502 | V | 31.5 | Very low | 42.5 | Very low | 112 Ų | 112 | 105.5 Ų | 105.5 | 68% | 0.679 | 70% | 0.704 | S | S | * | * | trans | -50.6 | 115.4 | 159.1 | 175.2 | 0 | 0 | 0 | 0 | 101.6 | S500 S504 | S500-V502 PolarHBondContact O-N 3.48Å; V502-S504 VanDerWaalsContact C-N 3.33Å; V502-S504 PolarHBondContact O-N 3.29Å | ||
| 503 | P | 34.8 | Very low | 44.7 | Very low | 77 Ų | 77 | 104.2 Ų | 104.2 | 50% | 0.5 | 70% | 0.703 | S | S | . | * | trans | -57.8 | 114.9 | 171.5 | 24.1 | -28 | 0 | 0 | 0 | 103.1 | R501 S505 | R501-P503 VanDerWaalsContact O-CD 3.28Å; R501-P503 WeakPolarHBondContact O-CD 3.22Å; P503-S505 PolarHBondContact O-N 3.42Å | ||
| 504 | S | 33.8 | Very low | 46.8 | Very low | 104 Ų | 104 | 100.9 Ų | 100.9 | 73% | 0.727 | 68% | 0.677 | S | S | * | * | trans | -58.6 | 96.4 | 164 | 49.5 | 0 | 0 | 0 | 0 | 104.6 | V502 G506 | V502-S504 VanDerWaalsContact C-N 3.33Å; V502-S504 PolarHBondContact O-N 3.29Å; S504-G506 PolarHBondContact O-N 2.99Å | ||
| 505 | S | 39.7 | Very low | 49 | Very low | 122 Ų | 122 | 97.4 Ų | 97.4 | 85% | 0.853 | 64% | 0.641 | S | S | * | * | trans | -67.6 | 45.7 | 153.2 | 61.3 | 0 | 0 | 0 | 0 | 108.3 | P503 | P503-S505 PolarHBondContact O-N 3.42Š| ||
| 506 | G | 40.7 | Very low | 51.1 | Low | 47 Ų | 47 | 96.4 Ų | 96.4 | 49% | 0.485 | 62% | 0.623 | S | S | . | * | trans | -93 | 103.8 | 163.3 | 0 | 0 | 0 | 0 | 0 | 103.7 | S504 E508 | S504-G506 PolarHBondContact O-N 2.99Å; G506-E508 VanDerWaalsContact C-N 3.29Å; G506-E508 PolarHBondContact O-N 3.23Å | ||
| 507 | T | 46.4 | Very low | 53.3 | Low | 133 Ų | 133 | 94.7 Ų | 94.7 | 82% | 0.816 | 60% | 0.602 | S | S | * | * | trans | -44.8 | 101.9 | 159.2 | -39.1 | 0 | 0 | 0 | 0 | 106.5 | A509 | T507-A509 PolarHBondContact O-N 3.03Š| ||
| 508 | E | 48.9 | Very low | 55.9 | Low | 120 Ų | 120 | 91.2 Ų | 91.2 | 56% | 0.561 | 58% | 0.58 | S | S | * | * | trans | -55.5 | 111.1 | 172 | -80.6 | -177.5 | 152.9 | 0 | 0 | 105.9 | G506 G510 R511 | G506-E508 VanDerWaalsContact C-N 3.29Å; G506-E508 PolarHBondContact O-N 3.23Å; E508-G510 VanDerWaalsContact C-N 3.29Å; E508-G510 PolarHBondContact O-N 3.36Å; E508-R511 HydrophobicContact CB-CG 4.23Å; E508-R511 PolarHBondContact O-N 3.35Å; E508-R511 IonicContact OE2-CZ 2.73Å; E508-R511 IonicContact OE2-NH1 2.88Å; E508-R511 PolarHBondContact OE2-NH1 2.88Å | ||
| 509 | A | 48.3 | Very low | 58.3 | Low | 110 Ų | 110 | 87.6 Ų | 87.6 | 91% | 0.909 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | 93.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | T507 | T507-A509 PolarHBondContact O-N 3.03Š|
| 510 | G | 67.1 | Low | 61 | Low | 72 Ų | 72 | 82.4 Ų | 82.4 | 74% | 0.742 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 142 | -15.6 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | E508 P512 | E508-G510 VanDerWaalsContact C-N 3.29Å; E508-G510 PolarHBondContact O-N 3.36Å; G510-P512 WeakPolarHBondContact O-CD 3.19Å |
| 511 | R | 78 | Confident | 63.8 | Low | 84 Ų | 84 | 79.6 Ų | 79.6 | 32% | 0.317 | 49% | 0.487 | S | S | . | . | trans | -71.7 | 125.2 | 174.1 | -88.8 | -178.3 | 124.4 | 103.9 | -3.8 | 111.1 | P467 E508 | P467-R511 PolarHBondContact O-NH2 3.38Å; E508-R511 HydrophobicContact CB-CG 4.23Å; E508-R511 PolarHBondContact O-N 3.35Å; E508-R511 IonicContact OE2-CZ 2.73Å; E508-R511 IonicContact OE2-NH1 2.88Å; E508-R511 PolarHBondContact OE2-NH1 2.88Å | ||
| 512 | P | 82.1 | Confident | 66.7 | Low | 43 Ų | 43 | 69.6 Ų | 69.6 | 28% | 0.279 | 45% | 0.45 | S | S | . | . | trans | -61.7 | 146.9 | 176 | -20.8 | 30.9 | 0 | 0 | 0 | 111.9 | Y466 G510 L514 A515 | Y466-P512 HydrophobicContact CD1-CG 4.44Å; Y466-P512 HydrophobicContact CD2-CG 4.36Å; Y466-P512 HydrophobicContact CE1-CG 3.95Å; Y466-P512 HydrophobicContact CE2-CG 3.87Å; G510-P512 WeakPolarHBondContact O-CD 3.19Å; P512-L514 PolarHBondContact O-N 3.38Å; P512-A515 WeakPolarHBondContact O-CB 3.09Å; P512-A515 PolarHBondContact O-N 3.36Å | ||
| 513 | A | 80.6 | Confident | 69.6 | Low | 95 Ų | 95 | 64.4 Ų | 64.4 | 79% | 0.785 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -23.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | A515 T517 | A513-A515 VanDerWaalsContact C-N 3.3Å; A513-T517 PolarHBondContact O-OG1 2.92Å |
| 514 | L | 83.6 | Confident | 72.3 | Confident | 72 Ų | 72 | 60.7 Ų | 60.7 | 38% | 0.377 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | -17.9 | 174.5 | -67.4 | 172.2 | 0 | 0 | 0 | 113.3 | P512 T517 F518 Y519 | P512-L514 PolarHBondContact O-N 3.38Å; L514-T517 WeakPolarHBondContact CA-OG1 3.33Å; L514-T517 PolarHBondContact O-N 3.48Å; L514-F518 HydrophobicContact CD2-CB 3.97Å; L514-F518 PolarHBondContact O-N 2.9Å; L514-Y519 HydrophobicContact CB-CD2 4.23Å; L514-Y519 HydrophobicContact CB-CE1 4.42Å; L514-Y519 HydrophobicContact CB-CE2 3.96Å; L514-Y519 PolarHBondContact O-N 3.46Å |
| 515 | A | 81.3 | Confident | 75.2 | Confident | 1 Ų | 1 | 57.3 Ų | 57.3 | 1% | 0.008 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61 | -51.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112 | Y466 P512 A513 T517 A520 | Y466-A515 HydrophobicContact CG-CB 4.27Å; P512-A515 WeakPolarHBondContact O-CB 3.09Å; P512-A515 PolarHBondContact O-N 3.36Å; A513-A515 VanDerWaalsContact C-N 3.3Å; A515-T517 VanDerWaalsContact C-N 3.3Å; A515-T517 PolarHBondContact O-N 3.48Å; A515-A520 PolarHBondContact O-N 3.08Å |
| 516 | D | 77.6 | Confident | 77.8 | Confident | 70 Ų | 70 | 51.9 Ų | 51.9 | 37% | 0.374 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | 3.6 | -175.5 | -56.5 | -43 | 0 | 0 | 0 | 113.5 | R239 | R239-D516 PolarHBondContact NH1-O 3.29Š|
| 517 | T | 84.3 | Confident | 80.2 | Confident | 71 Ų | 71 | 49.6 Ų | 49.6 | 44% | 0.436 | 30% | 0.303 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -118.2 | -85.3 | 179.2 | 55 | 0 | 0 | 0 | 0 | 110.5 | A513 L514 A515 A520 | A513-T517 PolarHBondContact O-OG1 2.92Å; L514-T517 WeakPolarHBondContact CA-OG1 3.33Å; L514-T517 PolarHBondContact O-N 3.48Å; A515-T517 VanDerWaalsContact C-N 3.3Å; A515-T517 PolarHBondContact O-N 3.48Å; T517-A520 PolarHBondContact O-N 2.65Å |
| 518 | F | 85.5 | Confident | 82.5 | Confident | 65 Ų | 65 | 43.6 Ų | 43.6 | 29% | 0.285 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.8 | -35.9 | -170.8 | -163.7 | -122.8 | 0 | 0 | 0 | 113.4 | V459 L514 A520 I521 L529 | V459-F518 HydrophobicContact CG2-CD1 3.73Å; V459-F518 HydrophobicContact CG2-CE1 3.13Å; V459-F518 HydrophobicContact CG2-CE2 4.5Å; V459-F518 HydrophobicContact CG2-CZ 3.58Å; L514-F518 HydrophobicContact CD2-CB 3.97Å; L514-F518 PolarHBondContact O-N 2.9Å; F518-A520 VanDerWaalsContact C-N 3.32Å; F518-I521 HydrophobicContact CD2-CD1 3.62Å; F518-I521 HydrophobicContact CE2-CD1 3.87Å; F518-I521 HydrophobicContact CG-CD1 4.44Å; F518-I521 WeakPolarHBondContact O-CD1 3.45Å; F518-I521 VanDerWaalsContact O-CG1 3.32Å; F518-I521 WeakPolarHBondContact O-CG1 3.46Å; F518-L529 HydrophobicContact CZ-CD2 4.31Å |
| 519 | Y | 88.6 | Confident | 84.7 | Confident | 26 Ų | 26 | 39.8 Ų | 39.8 | 10% | 0.102 | 25% | 0.25 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.5 | -19.2 | 175.7 | -58.6 | -22.7 | 0 | 0 | 0 | 112.7 | W458 A463 Y466 L514 I521 | W458-Y519 AromaticContact NE1-CE1 3.75Å; W458-Y519 AromaticContact NE1-CZ 3.76Å; W458-Y519 PolarHBondContact NE1-OH 3.24Å; A463-Y519 VanDerWaalsContact CB-O 3.23Å; A463-Y519 WeakPolarHBondContact CB-O 3.36Å; Y466-Y519 HydrophobicContact CD2-CD2 4.04Å; Y466-Y519 HydrophobicContact CD2-CE2 4.11Å; L514-Y519 HydrophobicContact CB-CD2 4.23Å; L514-Y519 HydrophobicContact CB-CE1 4.42Å; L514-Y519 HydrophobicContact CB-CE2 3.96Å; L514-Y519 PolarHBondContact O-N 3.46Å; Y519-I521 PolarHBondContact O-N 3.18Å |
| 520 | A | 86.9 | Confident | 86.9 | Confident | 2 Ų | 2 | 34.5 Ų | 34.5 | 2% | 0.017 | 21% | 0.207 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -6.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | R239 P468 I472 A515 T517 F518 S522 | R239-A520 WeakPolarHBondContact CA-O 3.42Å; R239-A520 HydrophobicContact CB-CB 4.2Å; R239-A520 HydrophobicContact CG-CB 4.1Å; P468-A520 HydrophobicContact CB-CB 4.07Å; I472-A520 HydrophobicContact CG2-CB 4.29Å; A515-A520 PolarHBondContact O-N 3.08Å; T517-A520 PolarHBondContact O-N 2.65Å; F518-A520 VanDerWaalsContact C-N 3.32Å; A520-S522 PolarHBondContact O-N 3.12Å |
| 521 | I | 90.4 | Very high | 88.4 | Confident | 29 Ų | 29 | 31.3 Ų | 31.3 | 15% | 0.149 | 17% | 0.173 | C | C | . | . | S | Bend | trans | -57.2 | 134.7 | 177.3 | -67 | 173.3 | 0 | 0 | 0 | 110.1 | F518 Y519 Y523 Y525 Y526 | F518-I521 HydrophobicContact CD2-CD1 3.62Å; F518-I521 HydrophobicContact CE2-CD1 3.87Å; F518-I521 HydrophobicContact CG-CD1 4.44Å; F518-I521 WeakPolarHBondContact O-CD1 3.45Å; F518-I521 VanDerWaalsContact O-CG1 3.32Å; F518-I521 WeakPolarHBondContact O-CG1 3.46Å; Y519-I521 PolarHBondContact O-N 3.18Å; I521-Y523 PolarHBondContact O-N 3.06Å; I521-Y525 HydrophobicContact CG2-CD2 4.22Å; I521-Y525 HydrophobicContact CG2-CG 4.38Å; I521-Y526 HydrophobicContact CG2-CE1 4.37Å; I521-Y526 WeakPolarHBondContact O-CE1 3.08Å; I521-Y526 PolarHBondContact O-OH 3.15Å |
| 522 | S | 91.4 | Very high | 89.2 | Confident | 6 Ų | 6 | 31.8 Ų | 31.8 | 4% | 0.042 | 18% | 0.181 | C | C | . | . | trans | -57.9 | 138.7 | 178.7 | -178.5 | 0 | 0 | 0 | 0 | 111.9 | P238 R241 T246 A520 L524 Y525 | P238-S522 PolarHBondContact O-N 2.66Å; R241-S522 PolarHBondContact O-OG 2.97Å; T246-S522 VanDerWaalsContact CG2-OG 3.29Å; T246-S522 WeakPolarHBondContact CG2-OG 3.48Å; A520-S522 PolarHBondContact O-N 3.12Å; S522-L524 PolarHBondContact O-N 3.32Å; S522-Y525 WeakPolarHBondContact O-CB 2.98Å; S522-Y525 PolarHBondContact O-N 3.16Å | ||
| 523 | Y | 91.1 | Very high | 90 | Very high | 3 Ų | 3 | 30.9 Ų | 30.9 | 1% | 0.012 | 18% | 0.175 | C | C | . | . | G | 310 helix | trans | -57.4 | -24.3 | -178.5 | 67.1 | -90.3 | 0 | 0 | 0 | 113.7 | R241 Y242 L413 Q414 F417 I521 Y525 Y526 | R241-Y523 HydrophobicContact CG-CE1 4.13Å; R241-Y523 VanDerWaalsContact CZ-CE1 3.43Å; Y242-Y523 HydrophobicContact CE1-CE1 4.28Å; Y242-Y523 WeakPolarHBondContact CE1-OH 3.49Å; Y242-Y523 PolarHBondContact OH-OH 3Å; L413-Y523 WeakPolarHBondContact CD2-OH 3.46Å; Q414-Y523 HydrophobicContact CG-CD1 3.81Å; Q414-Y523 HydrophobicContact CG-CD2 4.42Å; Q414-Y523 HydrophobicContact CG-CE1 4.22Å; Q414-Y523 HydrophobicContact CG-CG 3.93Å; F417-Y523 HydrophobicContact CB-CD2 3.68Å; F417-Y523 HydrophobicContact CB-CE2 3.56Å; F417-Y523 AromaticContact CD2-CE2 3.84Å; F417-Y523 HydrophobicContact CD2-CE2 3.84Å; F417-Y523 HydrophobicContact CG-CE2 4.07Å; I521-Y523 PolarHBondContact O-N 3.06Å; Y523-Y525 PolarHBondContact O-N 3.02Å; Y523-Y526 PolarHBondContact O-N 3.15Å |
| 524 | L | 92.6 | Very high | 90.8 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 14% | 0.137 | C | C | . | . | G | 310 helix | trans | -67.4 | -21.7 | 175.6 | -68.6 | 175.6 | 0 | 0 | 0 | 113 | M90 Y242 T246 F247 G250 V254 F417 S522 | M90-L524 HydrophobicContact CE-CD1 4.02Å; M90-L524 HydrophobicContact CE-CD2 3.71Å; Y242-L524 HydrophobicContact CE1-CD1 4.36Å; T246-L524 HydrophobicContact CG2-CB 3.87Å; T246-L524 HydrophobicContact CG2-CD1 3.96Å; T246-L524 HydrophobicContact CG2-CG 4.44Å; F247-L524 HydrophobicContact CD1-CD1 3.69Å; F247-L524 HydrophobicContact CE1-CD1 3.65Å; F247-L524 HydrophobicContact CZ-CD1 4.46Å; G250-L524 CarbonylContact C-O 3.59Å; G250-L524 VanDerWaalsContact CA-O 3.29Å; G250-L524 WeakPolarHBondContact CA-O 3.27Å; V254-L524 WeakPolarHBondContact CG2-O 3.44Å; F417-L524 HydrophobicContact CB-CD2 4.46Å; F417-L524 HydrophobicContact CD2-CD2 4.49Å; F417-L524 HydrophobicContact CG-CD2 4.33Å; S522-L524 PolarHBondContact O-N 3.32Å |
| 525 | Y | 94.3 | Very high | 91.5 | Very high | 33 Ų | 33 | 24.9 Ų | 24.9 | 13% | 0.129 | 13% | 0.13 | C | C | . | . | G | 310 helix | trans | -86.7 | -8.7 | 175.7 | -73.5 | -64.2 | 0 | 0 | 0 | 113.9 | P238 W245 T246 V249 I521 S522 Y523 G527 A528 L529 | P238-Y525 HydrophobicContact CB-CD2 4.18Å; P238-Y525 HydrophobicContact CB-CE2 3.95Å; W245-Y525 PolarHBondContact O-OH 2.74Å; T246-Y525 WeakPolarHBondContact CA-OH 3.3Å; T246-Y525 HydrophobicContact CG2-CD2 4.06Å; T246-Y525 HydrophobicContact CG2-CE2 3.71Å; T246-Y525 PolarHBondContact N-OH 3.34Å; T246-Y525 WeakPolarHBondContact OG1-CE2 3.33Å; V249-Y525 HydrophobicContact CB-CE1 4.12Å; V249-Y525 HydrophobicContact CG1-CE1 4.13Å; I521-Y525 HydrophobicContact CG2-CD2 4.22Å; I521-Y525 HydrophobicContact CG2-CG 4.38Å; S522-Y525 WeakPolarHBondContact O-CB 2.98Å; S522-Y525 PolarHBondContact O-N 3.16Å; Y523-Y525 PolarHBondContact O-N 3.02Å; Y525-G527 VanDerWaalsContact C-N 3.28Å; Y525-G527 PolarHBondContact O-N 2.98Å; Y525-A528 HydrophobicContact CD1-CB 4.25Å; Y525-A528 WeakPolarHBondContact O-CA 3.32Å; Y525-A528 WeakPolarHBondContact O-CB 3.23Å; Y525-A528 PolarHBondContact O-N 3.47Å; Y525-L529 WeakPolarHBondContact O-CB 3.13Å; Y525-L529 PolarHBondContact O-N 3.23Å |
| 526 | Y | 93.8 | Very high | 92.2 | Very high | 7 Ų | 7 | 30.7 Ų | 30.7 | 3% | 0.027 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -63.2 | -36.8 | -178.5 | -62 | -11.2 | 0 | 0 | 0 | 112.2 | T418 V422 V459 A460 A463 I521 Y523 L529 G530 | T418-Y526 HydrophobicContact CG2-CD2 3.97Å; T418-Y526 HydrophobicContact CG2-CE2 4.05Å; V422-Y526 HydrophobicContact CG2-CD2 3.99Å; V422-Y526 HydrophobicContact CG2-CG 4.37Å; V459-Y526 HydrophobicContact CG1-CD1 3.98Å; V459-Y526 HydrophobicContact CG1-CE1 3.55Å; A460-Y526 HydrophobicContact CB-CD2 4.07Å; A460-Y526 HydrophobicContact CB-CE2 4Å; A463-Y526 WeakPolarHBondContact CB-OH 3.3Å; I521-Y526 HydrophobicContact CG2-CE1 4.37Å; I521-Y526 WeakPolarHBondContact O-CE1 3.08Å; I521-Y526 PolarHBondContact O-OH 3.15Å; Y523-Y526 PolarHBondContact O-N 3.15Å; Y526-L529 PolarHBondContact O-N 3.27Å; Y526-G530 PolarHBondContact O-N 3.35Å |
| 527 | G | 91.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.5 | -39.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G421 Y525 T531 | G421-G527 VanDerWaalsContact O-CA 3.26Å; G421-G527 WeakPolarHBondContact O-CA 3.4Å; Y525-G527 VanDerWaalsContact C-N 3.28Å; Y525-G527 PolarHBondContact O-N 2.98Å; G527-T531 VanDerWaalsContact O-CB 3.32Å; G527-T531 WeakPolarHBondContact O-CB 3.38Å; G527-T531 PolarHBondContact O-N 3.32Å; G527-T531 PolarHBondContact O-OG1 2.95Å |
| 528 | A | 94 | Very high | 93.8 | Very high | 6 Ų | 6 | 25.9 Ų | 25.9 | 5% | 0.05 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.3 | -47.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L253 Y525 T531 L532 | L253-A528 HydrophobicContact CB-CB 4.4Å; L253-A528 HydrophobicContact CD1-CB 3.51Å; Y525-A528 HydrophobicContact CD1-CB 4.25Å; Y525-A528 WeakPolarHBondContact O-CA 3.32Å; Y525-A528 WeakPolarHBondContact O-CB 3.23Å; Y525-A528 PolarHBondContact O-N 3.47Å; A528-T531 PolarHBondContact O-N 3.06Å; A528-L532 WeakPolarHBondContact O-CB 3.39Å; A528-L532 VanDerWaalsContact O-CG 3.23Å; A528-L532 WeakPolarHBondContact O-CG 3.41Å; A528-L532 PolarHBondContact O-N 2.99Å |
| 529 | L | 95.2 | Very high | 94.3 | Very high | 40 Ų | 40 | 23.7 Ų | 23.7 | 21% | 0.209 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -57.8 | -52.6 | 177 | -177.8 | 65.7 | 0 | 0 | 0 | 110.9 | V455 V459 F518 Y525 Y526 T531 L532 T533 | V455-L529 HydrophobicContact CG1-CD1 4.16Å; V455-L529 HydrophobicContact CG1-CD2 3.84Å; V455-L529 HydrophobicContact CG1-CG 3.9Å; V459-L529 HydrophobicContact CB-CD2 4.18Å; V459-L529 HydrophobicContact CG2-CD2 3.66Å; F518-L529 HydrophobicContact CZ-CD2 4.31Å; Y525-L529 WeakPolarHBondContact O-CB 3.13Å; Y525-L529 PolarHBondContact O-N 3.23Å; Y526-L529 PolarHBondContact O-N 3.27Å; L529-T531 VanDerWaalsContact C-N 3.35Å; L529-T531 PolarHBondContact O-N 3.13Å; L529-L532 PolarHBondContact O-N 2.84Å; L529-T533 WeakPolarHBondContact O-CB 3.33Å; L529-T533 PolarHBondContact O-N 3.06Å; L529-T533 PolarHBondContact O-OG1 2.88Å |
| 530 | G | 95.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59 | -43.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y526 T534 | Y526-G530 PolarHBondContact O-N 3.35Å; G530-T534 WeakPolarHBondContact O-CB 3.42Å; G530-T534 PolarHBondContact O-N 3.33Å; G530-T534 PolarHBondContact O-OG1 2.91Å; G530-T534 VanDerWaalsContact O-OG1 3.1Å |
| 531 | T | 96.7 | Very high | 95.1 | Very high | 5 Ų | 5 | 29.7 Ų | 29.7 | 3% | 0.031 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.8 | -51.5 | 177.5 | -54.9 | 0 | 0 | 0 | 0 | 111.1 | G425 L428 G527 A528 L529 T534 L535 | G425-T531 WeakPolarHBondContact CA-OG1 3.49Å; G425-T531 WeakPolarHBondContact O-CA 3.03Å; G425-T531 PolarHBondContact O-OG1 3.03Å; L428-T531 HydrophobicContact CD2-CG2 4.14Å; L428-T531 HydrophobicContact CG-CG2 4.18Å; G527-T531 VanDerWaalsContact O-CB 3.32Å; G527-T531 WeakPolarHBondContact O-CB 3.38Å; G527-T531 PolarHBondContact O-N 3.32Å; G527-T531 PolarHBondContact O-OG1 2.95Å; A528-T531 PolarHBondContact O-N 3.06Å; L529-T531 VanDerWaalsContact C-N 3.35Å; L529-T531 PolarHBondContact O-N 3.13Å; T531-T534 PolarHBondContact O-N 2.71Å; T531-L535 HydrophobicContact CG2-CD1 4.25Å; T531-L535 HydrophobicContact CG2-CG 4.46Å; T531-L535 WeakPolarHBondContact O-CG 3.42Å; T531-L535 PolarHBondContact O-N 3.06Å |
| 532 | L | 96.8 | Very high | 95.3 | Very high | 93 Ų | 93 | 28.3 Ų | 28.3 | 49% | 0.487 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -64.1 | -43.7 | -177.4 | -71.4 | 170.8 | 0 | 0 | 0 | 111.6 | A528 L529 T534 L535 L536 | A528-L532 WeakPolarHBondContact O-CB 3.39Å; A528-L532 VanDerWaalsContact O-CG 3.23Å; A528-L532 WeakPolarHBondContact O-CG 3.41Å; A528-L532 PolarHBondContact O-N 2.99Å; L529-L532 PolarHBondContact O-N 2.84Å; L532-T534 VanDerWaalsContact C-N 3.32Å; L532-T534 PolarHBondContact O-N 3.2Å; L532-L535 PolarHBondContact O-N 3.33Å; L532-L536 WeakPolarHBondContact O-CB 3.46Å; L532-L536 VanDerWaalsContact O-CG 3.28Å; L532-L536 WeakPolarHBondContact O-CG 3.42Å; L532-L536 PolarHBondContact O-N 3.08Å |
| 533 | T | 97.4 | Very high | 95.4 | Very high | 24 Ų | 24 | 34.6 Ų | 34.6 | 15% | 0.147 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.1 | -43.8 | 175 | -60.7 | 0 | 0 | 0 | 0 | 111 | A451 V455 L529 L536 C537 | A451-T533 HydrophobicContact CB-CG2 3.99Å; V455-T533 HydrophobicContact CB-CG2 4.32Å; V455-T533 HydrophobicContact CG2-CG2 4.05Å; L529-T533 WeakPolarHBondContact O-CB 3.33Å; L529-T533 PolarHBondContact O-N 3.06Å; L529-T533 PolarHBondContact O-OG1 2.88Å; T533-L536 PolarHBondContact O-N 3.45Å; T533-C537 VanDerWaalsContact O-CB 3.3Å; T533-C537 WeakPolarHBondContact O-CB 3.48Å; T533-C537 PolarHBondContact O-N 3.1Å; T533-C537 PolarHBondContact O-SG 3.32Å |
| 534 | T | 97.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.5 | -44.1 | 175.7 | -65.3 | 0 | 0 | 0 | 0 | 112.3 | P426 L433 G448 G530 T531 L532 G538 | P426-T534 WeakPolarHBondContact CA-OG1 3.39Å; P426-T534 WeakPolarHBondContact CB-OG1 3.3Å; P426-T534 WeakPolarHBondContact O-CG2 3.42Å; L433-T534 HydrophobicContact CD1-CG2 4.15Å; G448-T534 VanDerWaalsContact O-CA 3.29Å; G448-T534 WeakPolarHBondContact O-CA 3.35Å; G448-T534 WeakPolarHBondContact O-CB 3.46Å; G448-T534 PolarHBondContact O-OG1 2.83Å; G530-T534 WeakPolarHBondContact O-CB 3.42Å; G530-T534 PolarHBondContact O-N 3.33Å; G530-T534 PolarHBondContact O-OG1 2.91Å; G530-T534 VanDerWaalsContact O-OG1 3.1Å; T531-T534 PolarHBondContact O-N 2.71Å; L532-T534 VanDerWaalsContact C-N 3.32Å; L532-T534 PolarHBondContact O-N 3.2Å; T534-G538 WeakPolarHBondContact O-CA 3.37Å; T534-G538 PolarHBondContact O-N 3.33Å |
| 535 | L | 97.6 | Very high | 95.5 | Very high | 41 Ų | 41 | 44.5 Ų | 44.5 | 22% | 0.215 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.7 | -50.3 | 177.1 | -71.2 | 178.8 | 0 | 0 | 0 | 111.6 | T432 L433 T531 L532 A539 | T432-L535 HydrophobicContact CG2-CD2 3.86Å; L433-L535 HydrophobicContact CD2-CD2 3.95Å; L433-L535 HydrophobicContact CG-CD2 3.79Å; T531-L535 HydrophobicContact CG2-CD1 4.25Å; T531-L535 HydrophobicContact CG2-CG 4.46Å; T531-L535 WeakPolarHBondContact O-CG 3.42Å; T531-L535 PolarHBondContact O-N 3.06Å; L532-L535 PolarHBondContact O-N 3.33Å; L535-A539 WeakPolarHBondContact O-CB 3.26Å; L535-A539 PolarHBondContact O-N 2.78Å |
| 536 | L | 97.2 | Very high | 95.3 | Very high | 123 Ų | 123 | 44.8 Ų | 44.8 | 64% | 0.644 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -67.7 | -54.1 | -175.4 | -68.5 | 173.7 | 0 | 0 | 0 | 111.8 | L532 T533 G538 L540 | L532-L536 WeakPolarHBondContact O-CB 3.46Å; L532-L536 VanDerWaalsContact O-CG 3.28Å; L532-L536 WeakPolarHBondContact O-CG 3.42Å; L532-L536 PolarHBondContact O-N 3.08Å; T533-L536 PolarHBondContact O-N 3.45Å; L536-G538 VanDerWaalsContact C-N 3.32Å; L536-G538 PolarHBondContact O-N 3.01Å; L536-L540 VanDerWaalsContact O-CB 3.24Å; L536-L540 WeakPolarHBondContact O-CB 3.47Å; L536-L540 PolarHBondContact O-N 3.04Å |
| 537 | C | 97.4 | Very high | 95 | Very high | 40 Ų | 40 | 47.7 Ų | 47.7 | 27% | 0.27 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.5 | -40.3 | 179.2 | -66.7 | 0 | 0 | 0 | 0 | 111.1 | A451 T533 I541 | A451-C537 HydrophobicContact CB-CB 4.08Å; T533-C537 VanDerWaalsContact O-CB 3.3Å; T533-C537 WeakPolarHBondContact O-CB 3.48Å; T533-C537 PolarHBondContact O-N 3.1Å; T533-C537 PolarHBondContact O-SG 3.32Å; C537-I541 WeakPolarHBondContact O-CB 3.35Å; C537-I541 VanDerWaalsContact O-CG1 3.3Å; C537-I541 WeakPolarHBondContact O-CG1 3.37Å; C537-I541 PolarHBondContact O-N 3.45Å |
| 538 | G | 96.8 | Very high | 94.8 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -68.5 | -41.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | G444 T534 L536 S542 | G444-G538 VanDerWaalsContact O-CA 3.23Å; G444-G538 WeakPolarHBondContact O-CA 3.3Å; T534-G538 WeakPolarHBondContact O-CA 3.37Å; T534-G538 PolarHBondContact O-N 3.33Å; L536-G538 VanDerWaalsContact C-N 3.32Å; L536-G538 PolarHBondContact O-N 3.01Å; G538-S542 VanDerWaalsContact O-CB 3.3Å; G538-S542 WeakPolarHBondContact O-CB 3.32Å; G538-S542 PolarHBondContact O-N 3.45Å; G538-S542 VanDerWaalsContact O-N 3.1Å; G538-S542 PolarHBondContact O-OG 3.3Å |
| 539 | A | 95.9 | Very high | 94.3 | Very high | 20 Ų | 20 | 56.7 Ų | 56.7 | 17% | 0.165 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.8 | -51.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | L433 L535 I541 S542 Y543 | L433-A539 HydrophobicContact CD2-CB 4.3Å; L535-A539 WeakPolarHBondContact O-CB 3.26Å; L535-A539 PolarHBondContact O-N 2.78Å; A539-I541 PolarHBondContact O-N 3.2Å; A539-S542 WeakPolarHBondContact O-CB 3.13Å; A539-S542 PolarHBondContact O-N 2.88Å; A539-S542 VanDerWaalsContact O-N 3.14Å; A539-Y543 WeakPolarHBondContact O-CD2 3.44Å; A539-Y543 PolarHBondContact O-N 2.61Å |
| 540 | L | 96.4 | Very high | 93.6 | Very high | 107 Ų | 107 | 60.7 Ų | 60.7 | 56% | 0.56 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -55.4 | -51.8 | -178.6 | 179.5 | 63.8 | 0 | 0 | 0 | 111.9 | L536 S542 Y543 L544 | L536-L540 VanDerWaalsContact O-CB 3.24Å; L536-L540 WeakPolarHBondContact O-CB 3.47Å; L536-L540 PolarHBondContact O-N 3.04Å; L540-S542 VanDerWaalsContact C-N 3.3Å; L540-S542 PolarHBondContact O-N 3.44Å; L540-Y543 PolarHBondContact O-N 3Å; L540-L544 HydrophobicContact CD1-CD1 4.31Å; L540-L544 HydrophobicContact CG-CD1 4.11Å; L540-L544 WeakPolarHBondContact O-CG 3.42Å; L540-L544 PolarHBondContact O-N 3.36Å |
| 541 | I | 96.3 | Very high | 92.8 | Very high | 46 Ų | 46 | 66 Ų | 66 | 24% | 0.236 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67 | -34 | -178.9 | -66.1 | 169.7 | 0 | 0 | 0 | 111 | C537 A539 Y543 L544 T545 | C537-I541 WeakPolarHBondContact O-CB 3.35Å; C537-I541 VanDerWaalsContact O-CG1 3.3Å; C537-I541 WeakPolarHBondContact O-CG1 3.37Å; C537-I541 PolarHBondContact O-N 3.45Å; A539-I541 PolarHBondContact O-N 3.2Å; I541-Y543 VanDerWaalsContact C-N 3.32Å; I541-Y543 PolarHBondContact O-N 2.9Å; I541-L544 PolarHBondContact O-N 3.12Å; I541-T545 HydrophobicContact CG2-CG2 3.98Å; I541-T545 WeakPolarHBondContact O-CB 3.36Å; I541-T545 WeakPolarHBondContact O-CG2 3.43Å; I541-T545 PolarHBondContact O-N 3.39Å; I541-T545 PolarHBondContact O-OG1 3.37Å |
| 542 | S | 95.1 | Very high | 92 | Very high | 0 Ų | 0 | 69.8 Ų | 69.8 | 0% | 0 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.5 | -39.6 | 174.2 | -61.8 | 0 | 0 | 0 | 0 | 112.2 | C440 N441 G538 A539 L540 G546 | C440-S542 WeakPolarHBondContact CA-OG 3.29Å; N441-S542 PolarHBondContact N-OG 3.26Å; N441-S542 VanDerWaalsContact N-OG 3.09Å; N441-S542 PolarHBondContact ND2-O 2.94Å; N441-S542 PolarHBondContact OD1-OG 3.19Å; G538-S542 VanDerWaalsContact O-CB 3.3Å; G538-S542 WeakPolarHBondContact O-CB 3.32Å; G538-S542 PolarHBondContact O-N 3.45Å; G538-S542 VanDerWaalsContact O-N 3.1Å; G538-S542 PolarHBondContact O-OG 3.3Å; A539-S542 WeakPolarHBondContact O-CB 3.13Å; A539-S542 PolarHBondContact O-N 2.88Å; A539-S542 VanDerWaalsContact O-N 3.14Å; L540-S542 VanDerWaalsContact C-N 3.3Å; L540-S542 PolarHBondContact O-N 3.44Å; S542-G546 CarbonylContact O-C 3.16Å; S542-G546 VanDerWaalsContact O-C 3.3Å; S542-G546 PolarHBondContact O-N 3.33Å |
| 543 | Y | 93.8 | Very high | 91.4 | Very high | 138 Ų | 138 | 66.8 Ų | 66.8 | 54% | 0.541 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -68.3 | -39 | 175.2 | -80.1 | -72.4 | 0 | 0 | 0 | 112 | A439 A539 L540 I541 P547 | A439-Y543 HydrophobicContact CB-CE1 4.09Å; A539-Y543 WeakPolarHBondContact O-CD2 3.44Å; A539-Y543 PolarHBondContact O-N 2.61Å; L540-Y543 PolarHBondContact O-N 3Å; I541-Y543 VanDerWaalsContact C-N 3.32Å; I541-Y543 PolarHBondContact O-N 2.9Å; Y543-P547 HydrophobicContact CD1-CB 4.41Å |
| 544 | L | 94.4 | Very high | 90.4 | Very high | 133 Ų | 133 | 67.2 Ų | 67.2 | 70% | 0.696 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -71.1 | -36.6 | 179.7 | -67.5 | 174.1 | 0 | 0 | 0 | 113.4 | L540 I541 G546 | L540-L544 HydrophobicContact CD1-CD1 4.31Å; L540-L544 HydrophobicContact CG-CD1 4.11Å; L540-L544 WeakPolarHBondContact O-CG 3.42Å; L540-L544 PolarHBondContact O-N 3.36Å; I541-L544 PolarHBondContact O-N 3.12Å; L544-G546 VanDerWaalsContact C-N 3.34Å |
| 545 | T | 91.6 | Very high | 89.4 | Confident | 78 Ų | 78 | 72.6 Ų | 72.6 | 48% | 0.479 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.3 | 0.7 | -176.6 | 53.9 | 0 | 0 | 0 | 0 | 113.8 | N441 I541 | N441-T545 PolarHBondContact ND2-OG1 3.19Å; N441-T545 PolarHBondContact OD1-OG1 2.91Å; I541-T545 HydrophobicContact CG2-CG2 3.98Å; I541-T545 WeakPolarHBondContact O-CB 3.36Å; I541-T545 WeakPolarHBondContact O-CG2 3.43Å; I541-T545 PolarHBondContact O-N 3.39Å; I541-T545 PolarHBondContact O-OG1 3.37Å |
| 546 | G | 89.3 | Confident | 88.5 | Confident | 40 Ų | 40 | 70.8 Ų | 70.8 | 41% | 0.412 | 40% | 0.403 | S | S | . | . | trans | 104 | 107.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | N441 S542 L544 | N441-G546 PolarHBondContact ND2-O 3.49Å; S542-G546 CarbonylContact O-C 3.16Å; S542-G546 VanDerWaalsContact O-C 3.3Å; S542-G546 PolarHBondContact O-N 3.33Å; L544-G546 VanDerWaalsContact C-N 3.34Å | ||
| 547 | P | 87.4 | Confident | 88 | Confident | 67 Ų | 67 | 65.5 Ų | 65.5 | 44% | 0.435 | 38% | 0.375 | S | S | . | . | P | Polyproline II helix | trans | -66.7 | 142.1 | -175.4 | 26.8 | -34.3 | 0 | 0 | 0 | 111.6 | A439 Y543 K549 | A439-P547 HydrophobicContact CB-CB 3.9Å; A439-P547 WeakPolarHBondContact O-CA 3.44Å; Y543-P547 HydrophobicContact CD1-CB 4.41Å; P547-K549 PolarHBondContact O-N 2.91Å |
| 548 | T | 87.7 | Confident | 87.6 | Confident | 38 Ų | 38 | 63.8 Ų | 63.8 | 23% | 0.233 | 36% | 0.363 | C | S | . | . | P | Polyproline II helix | trans | -67.8 | 131.8 | 175.5 | -57 | 0 | 0 | 0 | 0 | 110.2 | A439 C440 N441 S552 L553 | A439-T548 PolarHBondContact O-N 3.05Å; C440-T548 PolarHBondContact O-OG1 2.92Å; N441-T548 VanDerWaalsContact CB-OG1 3.31Å; N441-T548 WeakPolarHBondContact CB-OG1 3.18Å; T548-S552 WeakPolarHBondContact CG2-OG 2.99Å; T548-L553 HydrophobicContact CG2-CD2 4.06Å; T548-L553 HydrophobicContact CG2-CG 4.44Å |
| 549 | K | 84.6 | Confident | 87.2 | Confident | 157 Ų | 157 | 66.2 Ų | 66.2 | 68% | 0.683 | 37% | 0.373 | S | S | * | . | P | Polyproline II helix | trans | -74.3 | 137.3 | 175.9 | -67.5 | -177.9 | -179.5 | 178.4 | 0 | 109.4 | P547 S551 S552 | P547-K549 PolarHBondContact O-N 2.91Å; K549-S551 PolarHBondContact O-N 3.49Å; K549-S551 VanDerWaalsContact O-N 3.16Å; K549-S552 PolarHBondContact O-N 3.27Å; K549-S552 VanDerWaalsContact O-N 3.12Å; K549-S552 PolarHBondContact O-OG 3.15Å |
| 550 | R | 80.6 | Confident | 86.5 | Confident | 124 Ų | 124 | 71.5 Ų | 71.5 | 47% | 0.468 | 39% | 0.388 | S | S | . | . | G | 310 helix | trans | -57.8 | -32.2 | 177.9 | -173.8 | 175.8 | 179.7 | -169.3 | -2.3 | 113.1 | S552 L553 L558 D561 | R550-S552 PolarHBondContact O-N 3.01Å; R550-L553 PolarHBondContact O-N 3.15Å; R550-L558 HydrophobicContact CG-CD1 4.45Å; R550-D561 IonicContact CZ-OD1 2.62Å; R550-D561 IonicContact NE-OD1 3.54Å; R550-D561 IonicContact NH2-OD1 3.79Å; R550-D561 PolarHBondContact NH2-OD1 2.04Å |
| 551 | S | 77.8 | Confident | 85.8 | Confident | 113 Ų | 113 | 67.9 Ų | 67.9 | 79% | 0.79 | 37% | 0.369 | S | S | * | . | G | 310 helix | trans | -66.2 | -17 | -179.7 | 59.7 | 0 | 0 | 0 | 0 | 114.5 | K549 | K549-S551 PolarHBondContact O-N 3.49Å; K549-S551 VanDerWaalsContact O-N 3.16Å |
| 552 | S | 80.2 | Confident | 84.9 | Confident | 84 Ų | 84 | 66 Ų | 66 | 59% | 0.587 | 36% | 0.36 | S | S | * | . | G | 310 helix | trans | -91.9 | -1.2 | 177.1 | 64.3 | 0 | 0 | 0 | 0 | 113.4 | T548 K549 R550 | T548-S552 WeakPolarHBondContact CG2-OG 2.99Å; K549-S552 PolarHBondContact O-N 3.27Å; K549-S552 VanDerWaalsContact O-N 3.12Å; K549-S552 PolarHBondContact O-OG 3.15Å; R550-S552 PolarHBondContact O-N 3.01Å |
| 553 | L | 83.8 | Confident | 83.6 | Confident | 30 Ų | 30 | 67.9 Ų | 67.9 | 16% | 0.157 | 38% | 0.375 | C | S | . | . | S | Bend | trans | -92.1 | 137.2 | -179.2 | -61.3 | 174.5 | 0 | 0 | 0 | 110.4 | P438 T548 R550 L558 | P438-L553 HydrophobicContact CB-CD1 4.35Å; T548-L553 HydrophobicContact CG2-CD2 4.06Å; T548-L553 HydrophobicContact CG2-CG 4.44Å; R550-L553 PolarHBondContact O-N 3.15Å; L553-L558 HydrophobicContact CD1-CD1 4.05Å; L553-L558 HydrophobicContact CD1-CD2 4.47Å; L553-L558 HydrophobicContact CD1-CG 4.36Å |
| 554 | G | 76.6 | Confident | 82.4 | Confident | 33 Ų | 33 | 68.2 Ų | 68.2 | 34% | 0.34 | 38% | 0.376 | S | S | . | . | P | Polyproline II helix | trans | -63.6 | 149.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 555 | P | 77.6 | Confident | 80.9 | Confident | 113 Ų | 113 | 66.4 Ų | 66.4 | 73% | 0.734 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | 140 | 179 | 27.1 | -33.9 | 0 | 0 | 0 | 111 | L557 | P555-L557 PolarHBondContact O-N 2.71Š|
| 556 | G | 78.6 | Confident | 79.3 | Confident | 3 Ų | 3 | 65.8 Ų | 65.8 | 3% | 0.031 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 82.5 | 3.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | L562 | G556-L562 WeakPolarHBondContact O-CD1 3.47Š|
| 557 | L | 85.7 | Confident | 77.3 | Confident | 12 Ų | 12 | 67.4 Ų | 67.4 | 6% | 0.063 | 37% | 0.369 | C | S | . | . | S | Bend | trans | -79.5 | -27.1 | 174.2 | -67.1 | 174.8 | 0 | 0 | 0 | 113.3 | L112 Y120 L123 P555 | L112-L557 HydrophobicContact CD1-CD2 4.45Å; Y120-L557 HydrophobicContact CD2-CD2 4.31Å; Y120-L557 HydrophobicContact CE2-CD2 4.15Å; Y120-L557 WeakPolarHBondContact CE2-O 3.33Å; Y120-L557 PolarHBondContact OH-O 3.15Å; L123-L557 HydrophobicContact CB-CD2 3.82Å; P555-L557 PolarHBondContact O-N 2.71Å |
| 558 | L | 90.2 | Very high | 75 | Confident | 4 Ų | 4 | 68.9 Ų | 68.9 | 2% | 0.021 | 38% | 0.381 | C | S | . | . | S | Bend | trans | -96 | 138.5 | 174.5 | -62.4 | 172 | 0 | 0 | 0 | 109.6 | G434 P438 R550 L553 W560 D561 L562 | G434-L558 WeakPolarHBondContact O-CD2 3.12Å; P438-L558 HydrophobicContact CB-CD1 3.94Å; P438-L558 HydrophobicContact CB-CD2 4.43Å; R550-L558 HydrophobicContact CG-CD1 4.45Å; L553-L558 HydrophobicContact CD1-CD1 4.05Å; L553-L558 HydrophobicContact CD1-CD2 4.47Å; L553-L558 HydrophobicContact CD1-CG 4.36Å; L558-W560 VanDerWaalsContact C-N 3.27Å; L558-W560 PolarHBondContact O-N 2.96Å; L558-D561 PolarHBondContact O-N 3.38Å; L558-D561 VanDerWaalsContact O-N 3.14Å; L558-L562 PolarHBondContact O-N 3.13Å |
| 559 | W | 86.8 | Confident | 72.9 | Confident | 51 Ų | 51 | 72.7 Ų | 72.7 | 19% | 0.193 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.5 | -41.8 | -179.8 | 176.5 | 77.2 | 0 | 0 | 0 | 112.4 | A103 L104 V108 M435 L436 D561 L562 A563 | A103-W559 PolarHBondContact O-NE1 3.07Å; L104-W559 HydrophobicContact CD2-CD2 4.05Å; L104-W559 HydrophobicContact CD2-CE3 4.34Å; L104-W559 HydrophobicContact CD2-CH2 4.25Å; L104-W559 HydrophobicContact CD2-CZ2 3.95Å; L104-W559 HydrophobicContact CD2-CZ3 4.41Å; V108-W559 HydrophobicContact CG2-CB 4.38Å; M435-W559 PolarHBondContact O-N 2.87Å; L436-W559 HydrophobicContact CD2-CB 3.99Å; L436-W559 HydrophobicContact CD2-CG 4.49Å; W559-D561 PolarHBondContact O-N 2.87Å; W559-L562 PolarHBondContact O-N 3.04Å; W559-A563 HydrophobicContact CZ2-CB 4.46Å; W559-A563 PolarHBondContact O-N 2.92Å |
| 560 | W | 82.5 | Confident | 70.2 | Confident | 130 Ų | 130 | 68 Ų | 68 | 49% | 0.492 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.2 | -24.6 | -178.6 | -47.4 | 94.9 | 0 | 0 | 0 | 114.1 | L558 R564 | L558-W560 VanDerWaalsContact C-N 3.27Å; L558-W560 PolarHBondContact O-N 2.96Å; W560-R564 WeakPolarHBondContact O-CG 3.05Å; W560-R564 PolarHBondContact O-N 3.12Å; W560-R564 PolarHBondContact O-NE 2.74Å |
| 561 | D | 81.8 | Confident | 67.8 | Low | 31 Ų | 31 | 67.6 Ų | 67.6 | 17% | 0.166 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -75.9 | -39.8 | 177.6 | -67 | -22.7 | 0 | 0 | 0 | 110.1 | R550 L558 W559 R564 Q565 | R550-D561 IonicContact CZ-OD1 2.62Å; R550-D561 IonicContact NE-OD1 3.54Å; R550-D561 IonicContact NH2-OD1 3.79Å; R550-D561 PolarHBondContact NH2-OD1 2.04Å; L558-D561 PolarHBondContact O-N 3.38Å; L558-D561 VanDerWaalsContact O-N 3.14Å; W559-D561 PolarHBondContact O-N 2.87Å; D561-R564 PolarHBondContact O-N 3.1Å; D561-Q565 WeakPolarHBondContact O-CG 3.37Å; D561-Q565 PolarHBondContact O-N 3Å |
| 562 | L | 76.3 | Confident | 65.8 | Low | 8 Ų | 8 | 72.5 Ų | 72.5 | 4% | 0.042 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -68.6 | -39.7 | 174.2 | -64.2 | 173.3 | 0 | 0 | 0 | 112.2 | V108 R111 G556 L558 W559 R564 Q565 T566 | V108-L562 HydrophobicContact CB-CD1 4.13Å; V108-L562 HydrophobicContact CG1-CD1 4.39Å; V108-L562 HydrophobicContact CG2-CD1 3.84Å; R111-L562 PolarHBondContact NH1-O 3.02Å; G556-L562 WeakPolarHBondContact O-CD1 3.47Å; L558-L562 PolarHBondContact O-N 3.13Å; W559-L562 PolarHBondContact O-N 3.04Å; L562-R564 VanDerWaalsContact C-N 3.31Å; L562-R564 PolarHBondContact O-N 3.29Å; L562-Q565 PolarHBondContact O-N 2.76Å; L562-T566 PolarHBondContact O-N 3.36Å; L562-T566 PolarHBondContact O-OG1 2.93Å |
| 563 | A | 69.6 | Low | 64 | Low | 38 Ų | 38 | 76.2 Ų | 76.2 | 31% | 0.314 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -59.7 | -43.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | W559 T566 A567 | W559-A563 HydrophobicContact CZ2-CB 4.46Å; W559-A563 PolarHBondContact O-N 2.92Å; A563-T566 WeakPolarHBondContact O-CB 3.25Å; A563-T566 PolarHBondContact O-N 2.89Å; A563-A567 PolarHBondContact O-N 2.69Å |
| 564 | R | 67.4 | Low | 61.6 | Low | 146 Ų | 146 | 81.1 Ų | 81.1 | 55% | 0.551 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -67 | -39.7 | 177.2 | -80.4 | -174.5 | -99.7 | -147.8 | -9.5 | 113.7 | W560 D561 L562 T566 A567 S568 | W560-R564 WeakPolarHBondContact O-CG 3.05Å; W560-R564 PolarHBondContact O-N 3.12Å; W560-R564 PolarHBondContact O-NE 2.74Å; D561-R564 PolarHBondContact O-N 3.1Å; L562-R564 VanDerWaalsContact C-N 3.31Å; L562-R564 PolarHBondContact O-N 3.29Å; R564-T566 VanDerWaalsContact C-N 3.26Å; R564-T566 PolarHBondContact O-N 3.47Å; R564-A567 PolarHBondContact O-N 2.87Å; R564-S568 PolarHBondContact O-N 2.86Å |
| 565 | Q | 63.5 | Low | 59.4 | Low | 95 Ų | 95 | 83.9 Ų | 83.9 | 44% | 0.444 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.9 | -34.2 | 173.5 | -74.9 | 175.7 | -9.6 | 0 | 0 | 112.2 | D561 L562 S568 V569 | D561-Q565 WeakPolarHBondContact O-CG 3.37Å; D561-Q565 PolarHBondContact O-N 3Å; L562-Q565 PolarHBondContact O-N 2.76Å; Q565-S568 PolarHBondContact O-OG 2.85Å; Q565-V569 VanDerWaalsContact O-CG2 3.26Å; Q565-V569 WeakPolarHBondContact O-CG2 3.28Å; Q565-V569 PolarHBondContact O-N 2.83Å |
| 566 | T | 57.6 | Low | 57.3 | Low | 65 Ų | 65 | 82.3 Ų | 82.3 | 40% | 0.399 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.2 | -41.6 | 174.5 | -39.8 | 0 | 0 | 0 | 0 | 111.4 | R111 L562 A563 R564 S568 V569 A570 | R111-T566 VanDerWaalsContact CZ-OG1 3.24Å; R111-T566 PolarHBondContact NH1-OG1 3.37Å; R111-T566 PolarHBondContact NH2-OG1 2.78Å; L562-T566 PolarHBondContact O-N 3.36Å; L562-T566 PolarHBondContact O-OG1 2.93Å; A563-T566 WeakPolarHBondContact O-CB 3.25Å; A563-T566 PolarHBondContact O-N 2.89Å; R564-T566 VanDerWaalsContact C-N 3.26Å; R564-T566 PolarHBondContact O-N 3.47Å; T566-S568 VanDerWaalsContact C-N 3.32Å; T566-S568 PolarHBondContact O-N 2.72Å; T566-V569 PolarHBondContact O-N 2.9Å; T566-A570 PolarHBondContact O-N 3.39Å; T566-A570 VanDerWaalsContact O-N 3.09Å |
| 567 | A | 46.5 | Very low | 55.1 | Low | 74 Ų | 74 | 86.8 Ų | 86.8 | 61% | 0.612 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.1 | -28.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A563 R564 | A563-A567 PolarHBondContact O-N 2.69Å; R564-A567 PolarHBondContact O-N 2.87Å |
| 568 | S | 40.2 | Very low | 52.5 | Low | 97 Ų | 97 | 93 Ų | 93 | 68% | 0.678 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -82.2 | -13.9 | 175.9 | 88 | 0 | 0 | 0 | 0 | 114 | R564 Q565 T566 | R564-S568 PolarHBondContact O-N 2.86Å; Q565-S568 PolarHBondContact O-OG 2.85Å; T566-S568 VanDerWaalsContact C-N 3.32Å; T566-S568 PolarHBondContact O-N 2.72Å |
| 569 | V | 42.3 | Very low | 49.8 | Very low | 118 Ų | 118 | 97.5 Ų | 97.5 | 72% | 0.715 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -104.3 | -9.6 | 179.3 | 178.5 | 0 | 0 | 0 | 0 | 111.7 | Q565 T566 | Q565-V569 VanDerWaalsContact O-CG2 3.26Å; Q565-V569 WeakPolarHBondContact O-CG2 3.28Å; Q565-V569 PolarHBondContact O-N 2.83Å; T566-V569 PolarHBondContact O-N 2.9Å |
| 570 | A | 28.1 | Very low | 47.2 | Very low | 59 Ų | 59 | 103.4 Ų | 103.4 | 49% | 0.488 | 58% | 0.582 | S | S | . | * | S | Bend | trans | -61.3 | 129 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | T566 K572 | T566-A570 PolarHBondContact O-N 3.39Å; T566-A570 VanDerWaalsContact O-N 3.09Å; A570-K572 PolarHBondContact O-N 2.77Å |
| 571 | P | 31 | Very low | 44.7 | Very low | 116 Ų | 116 | 105 Ų | 105 | 75% | 0.753 | 60% | 0.601 | S | S | * | * | trans | -57.5 | 130.3 | 179.8 | -17.4 | 28.5 | 0 | 0 | 0 | 109.5 | E573 | P571-E573 PolarHBondContact O-N 2.94Š| ||
| 572 | K | 36.6 | Very low | 42.2 | Very low | 215 Ų | 215 | 108 Ų | 108 | 94% | 0.935 | 62% | 0.624 | S | S | * | * | trans | -80.8 | 10.2 | 171.9 | -110.6 | -174.8 | 179.3 | -175.7 | 0 | 112.8 | A570 | A570-K572 PolarHBondContact O-N 2.77Š| ||
| 573 | E | 40.6 | Very low | 40.2 | Very low | 162 Ų | 162 | 114.6 Ų | 114.6 | 76% | 0.757 | 66% | 0.659 | S | S | * | * | trans | -111 | 107.2 | -178.9 | -76.3 | 177 | 147.7 | 0 | 0 | 108.9 | P571 | P571-E573 PolarHBondContact O-N 2.94Š| ||
| 574 | D | 34.3 | Very low | 38.3 | Very low | 134 Ų | 134 | 119.6 Ų | 119.6 | 72% | 0.717 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -177.4 | 33.6 | 142.6 | -86.4 | -20.2 | 0 | 0 | 0 | 111.2 | ||
| 575 | A | 31.3 | Very low | 36.5 | Very low | 91 Ų | 91 | 123.3 Ų | 123.3 | 75% | 0.752 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -118.8 | -4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 576 | A | 33.3 | Very low | 34.7 | Very low | 80 Ų | 80 | 121.9 Ų | 121.9 | 66% | 0.661 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -105.7 | -17.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 577 | T | 31.7 | Very low | 33.6 | Very low | 96 Ų | 96 | 124.3 Ų | 124.3 | 59% | 0.589 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | 2.5 | -177.3 | 34.7 | 0 | 0 | 0 | 0 | 114.6 | ||
| 578 | L | 30.9 | Very low | 32.8 | Very low | 142 Ų | 142 | 129.1 Ų | 129.1 | 74% | 0.743 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.1 | 7.7 | 177.7 | -72.8 | 173.2 | 0 | 0 | 0 | 114.4 | ||
| 579 | V | 34.4 | Very low | 32.1 | Very low | 100 Ų | 100 | 132.1 Ų | 132.1 | 61% | 0.606 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -111 | -24.2 | 177.7 | -178.2 | 0 | 0 | 0 | 0 | 112.8 | ||
| 580 | E | 32 | Very low | 31.4 | Very low | 175 Ų | 175 | 134.1 Ų | 134.1 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -85 | -20.8 | 179.8 | -84.1 | -179.5 | 148.1 | 0 | 0 | 114.6 | S582 | E580-S582 VanDerWaalsContact C-N 3.3Å; E580-S582 PolarHBondContact O-N 2.99Å |
| 581 | D | 29.9 | Very low | 32.5 | Very low | 163 Ų | 163 | 136.8 Ų | 136.8 | 87% | 0.872 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -86 | 7.6 | -176.7 | -111.7 | 0.7 | 0 | 0 | 0 | 114.7 | ||
| 582 | S | 28.9 | Very low | 32.2 | Very low | 94 Ų | 94 | 136.2 Ų | 136.2 | 66% | 0.657 | 77% | 0.774 | S | S | * | * | G | 310 helix | trans | -116.2 | 7 | -179.6 | 47.2 | 0 | 0 | 0 | 0 | 115 | E580 | E580-S582 VanDerWaalsContact C-N 3.3Å; E580-S582 PolarHBondContact O-N 2.99Å |
| 583 | L | 33.6 | Very low | 31.7 | Very low | 147 Ų | 147 | 130.3 Ų | 130.3 | 77% | 0.77 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -133.4 | 49.1 | -177 | -83.2 | 171.1 | 0 | 0 | 0 | 115.1 | ||
| 584 | V | 31.1 | Very low | 31 | Very low | 142 Ų | 142 | 129.5 Ų | 129.5 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | -152.9 | 103 | 144.8 | -175 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 585 | K | 29.1 | Very low | 30.6 | Very low | 224 Ų | 224 | 132.1 Ų | 132.1 | 97% | 0.974 | 78% | 0.776 | S | S | * | * | trans | -120.1 | 113.5 | 155.5 | -96.9 | -175.7 | 177 | 178 | 0 | 107.8 | ||||
| 586 | G | 26.6 | Very low | 30.4 | Very low | 66 Ų | 66 | 137.3 Ų | 137.3 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | trans | -125 | 145.9 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 587 | P | 33.9 | Very low | 30.3 | Very low | 116 Ų | 116 | 142.1 Ų | 142.1 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -96.5 | 163.7 | -166 | 38.3 | -33.4 | 0 | 0 | 0 | 114.3 | ||||
| 588 | E | 29.1 | Very low | 30.5 | Very low | 174 Ų | 174 | 143.6 Ų | 143.6 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | 75.1 | 111.2 | 156.7 | -71.7 | 174.8 | 162.5 | 0 | 0 | 120 | ||||
| 589 | D | 26.6 | Very low | 30.3 | Very low | 160 Ų | 160 | 139.9 Ų | 139.9 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | 165 | 143.6 | 104.9 | -90.2 | -28.1 | 0 | 0 | 0 | 113.3 | |||||
| 590 | I | 27.5 | Very low | 29.8 | Very low | 160 Ų | 160 | 145.1 Ų | 145.1 | 82% | 0.821 | 81% | 0.812 | S | S | * | * | trans | -121.2 | 161.1 | 169.5 | -66.3 | 175.7 | 0 | 0 | 0 | 105.8 | ||||
| 591 | P | 50.6 | Low | 29.7 | Very low | 116 Ų | 116 | 144 Ų | 144 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | cis | -130.7 | 179.1 | -11.4 | 26.9 | -5.4 | 0 | 0 | 0 | 113.9 | ||||
| 592 | A | 24.6 | Very low | 30.8 | Very low | 104 Ų | 104 | 142.1 Ų | 142.1 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | -174.6 | 145 | 128.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 593 | A | 26.5 | Very low | 30.6 | Very low | 90 Ų | 90 | 141.3 Ų | 141.3 | 74% | 0.744 | 82% | 0.815 | S | S | * | * | trans | -69.9 | 157 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 594 | T | 26 | Very low | 30.4 | Very low | 145 Ų | 145 | 142 Ų | 142 | 89% | 0.89 | 82% | 0.819 | S | S | * | * | -170.7 | 140.8 | 117.1 | 10.6 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 595 | K | 26.3 | Very low | 30.3 | Very low | 189 Ų | 189 | 144.6 Ų | 144.6 | 82% | 0.822 | 82% | 0.822 | S | S | * | * | trans | -46.1 | 148.7 | 172.3 | -63.6 | 162.6 | 170.6 | 174.2 | 0 | 116.1 | ||||
| 596 | K | 25.3 | Very low | 30.4 | Very low | 200 Ų | 200 | 137.9 Ų | 137.9 | 87% | 0.87 | 81% | 0.808 | S | S | * | * | 170.6 | 122.1 | 103.3 | -94.2 | 177.7 | 178.3 | 178.4 | 0 | 113.1 | |||||
| 597 | H | 31.4 | Very low | 30.5 | Very low | 181 Ų | 181 | 144.1 Ų | 144.1 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | trans | -83.7 | 155.9 | 142.3 | -103.8 | -54 | 0 | 0 | 0 | 108.2 | ||||
| 598 | P | 37.2 | Very low | 30.3 | Very low | 127 Ų | 127 | 147.1 Ų | 147.1 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | -143.1 | 178.1 | 75 | 31.1 | -8.7 | 0 | 0 | 0 | 111.5 | |||||
| 599 | G | 25.1 | Very low | 31 | Very low | 64 Ų | 64 | 143.7 Ų | 143.7 | 66% | 0.66 | 82% | 0.816 | S | S | * | * | cis | 152.5 | 147.3 | 8.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 600 | F | 24.9 | Very low | 31.1 | Very low | 210 Ų | 210 | 143.8 Ų | 143.8 | 92% | 0.921 | 82% | 0.815 | S | S | * | * | trans | 82.4 | 140.7 | 153.9 | -103 | -102 | 0 | 0 | 0 | 123.7 | ||||
| 601 | L | 28.9 | Very low | 31.3 | Very low | 151 Ų | 151 | 141.2 Ų | 141.2 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | trans | -87.6 | -157.4 | -169.7 | -68.7 | 159.6 | 0 | 0 | 0 | 113.4 | ||||
| 602 | P | 53 | Low | 30.8 | Very low | 124 Ų | 124 | 141.9 Ų | 141.9 | 81% | 0.805 | 82% | 0.816 | S | S | * | * | -131.4 | -173.3 | -62.1 | 35.6 | -17.3 | 0 | 0 | 0 | 113 | |||||
| 603 | G | 25.6 | Very low | 30.9 | Very low | 78 Ų | 78 | 140 Ų | 140 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | 151.4 | 138.6 | 152.1 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 604 | D | 29.4 | Very low | 31 | Very low | 162 Ų | 162 | 141.2 Ų | 141.2 | 87% | 0.866 | 81% | 0.808 | S | S | * | * | trans | -55 | 159.1 | -178.9 | -72.1 | -56.1 | 0 | 0 | 0 | 119.1 | ||||
| 605 | E | 28.7 | Very low | 31.2 | Very low | 196 Ų | 196 | 140.2 Ų | 140.2 | 92% | 0.916 | 80% | 0.798 | S | S | * | * | 172.5 | 156.5 | 106.6 | -97.3 | -168.2 | 157.6 | 0 | 0 | 114.6 | |||||
| 606 | A | 30.7 | Very low | 31.6 | Very low | 83 Ų | 83 | 137.9 Ų | 137.9 | 69% | 0.686 | 79% | 0.793 | S | S | * | * | trans | -81.9 | 167.4 | -168.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 607 | H | 29.4 | Very low | 31.9 | Very low | 197 Ų | 197 | 135.5 Ų | 135.5 | 91% | 0.912 | 79% | 0.785 | S | S | * | * | trans | -176.4 | 124.2 | 134.6 | -93.6 | -61.5 | 0 | 0 | 0 | 112.7 | ||||
| 608 | H | 30.2 | Very low | 32.1 | Very low | 178 Ų | 178 | 131.6 Ų | 131.6 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | trans | -95.9 | 173 | 154.6 | -109.5 | -46.4 | 0 | 0 | 0 | 108 | ||||
| 609 | P | 44.4 | Very low | 32.1 | Very low | 103 Ų | 103 | 132.4 Ų | 132.4 | 67% | 0.669 | 77% | 0.772 | S | S | * | * | cis | -150.5 | -176.7 | 34.3 | 33.3 | -7.5 | 0 | 0 | 0 | 117.2 | ||||
| 610 | L | 27.7 | Very low | 32.8 | Very low | 162 Ų | 162 | 141.3 Ų | 141.3 | 85% | 0.848 | 80% | 0.803 | S | S | * | * | trans | 133.5 | 114.1 | 141.8 | -72.9 | 155.4 | 0 | 0 | 0 | 115.5 | ||||
| 611 | S | 30.7 | Very low | 33.2 | Very low | 106 Ų | 106 | 137.9 Ų | 137.9 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | trans | -95.7 | 170.3 | 150.2 | 82 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 612 | P | 41.3 | Very low | 33.5 | Very low | 129 Ų | 129 | 137.2 Ų | 137.2 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | -143.9 | 176.4 | 74.5 | 31.3 | -8.9 | 0 | 0 | 0 | 112.2 | |||||
| 613 | G | 26.6 | Very low | 32.4 | Very low | 64 Ų | 64 | 137.9 Ų | 137.9 | 66% | 0.66 | 80% | 0.797 | S | S | * | * | cis | 166.9 | 169.3 | 8.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 614 | C | 29 | Very low | 32.8 | Very low | 117 Ų | 117 | 141.5 Ų | 141.5 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | trans | 65.8 | 138.9 | 159.3 | -75.8 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 615 | D | 29.3 | Very low | 33 | Very low | 124 Ų | 124 | 140.2 Ų | 140.2 | 66% | 0.663 | 79% | 0.792 | S | S | * | * | cis | -169.7 | 144.5 | 12.1 | -100.4 | -22.4 | 0 | 0 | 0 | 109.2 | ||||
| 616 | L | 34.1 | Very low | 33.3 | Very low | 139 Ų | 139 | 136.5 Ų | 136.5 | 73% | 0.728 | 78% | 0.784 | S | S | * | * | 38.9 | 146.6 | 122.7 | -92.3 | 88.1 | 0 | 0 | 0 | 119.3 | |||||
| 617 | E | 33.2 | Very low | 33.5 | Very low | 151 Ų | 151 | 140.3 Ų | 140.3 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | cis | -178.5 | 156.3 | 12.5 | -141.2 | -174.7 | 163.1 | 0 | 0 | 107.8 | ||||
| 618 | T | 35.6 | Very low | 33.8 | Very low | 99 Ų | 99 | 135.9 Ų | 135.9 | 61% | 0.607 | 78% | 0.781 | S | S | * | * | trans | 50.3 | 138.4 | 144.1 | 44.3 | 0 | 0 | 0 | 0 | 126.2 | ||||
| 619 | N | 36 | Very low | 34.1 | Very low | 144 Ų | 144 | 132.4 Ų | 132.4 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | 72.4 | 106.4 | 138 | -67.1 | -30 | 0 | 0 | 0 | 121.2 | ||||
| 620 | L | 41.1 | Very low | 33.1 | Very low | 251 Ų | 251 | 135.1 Ų | 135.1 | 100% | 1.314 | 79% | 0.788 | S | S | * | * | -167.8 | 0 | 113.4 | -109.8 | 147.9 | 0 | 0 | 0 | 111.7 |
Retrieved 620 of 620 residues in 940.3 ms
(Link to these results)