| 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 | 35.8 | Very low | 46.7 | Very low | 242 Ų | 242 | 141.5 Ų | 141.5 | 100% | 1.192 | 73% | 0.732 | S | S | * | * | 0 | 91.3 | 0 | -92.4 | 166.3 | 117.7 | 0 | 0 | 107.4 | K3 | M1-K3 PolarHBondContact O-N 3.5Š| |||
| 2 | E | 38.5 | Very low | 48.7 | Very low | 179 Ų | 179 | 136.6 Ų | 136.6 | 84% | 0.836 | 70% | 0.697 | S | S | * | * | trans | -69.3 | 112.3 | 172.7 | -169.5 | 176.5 | 150.9 | 0 | 0 | 107.2 | M4 | E2-M4 VanDerWaalsContact C-N 3.32Å; E2-M4 PolarHBondContact O-N 2.99Å | ||
| 3 | K | 40.3 | Very low | 50.3 | Low | 197 Ų | 197 | 133.2 Ų | 133.2 | 86% | 0.857 | 69% | 0.687 | S | S | * | * | trans | -66.2 | 101.3 | 167.1 | -76.6 | -177.8 | 177.3 | -179.4 | 0 | 105.3 | M1 D5 | M1-K3 PolarHBondContact O-N 3.5Å; K3-D5 PolarHBondContact O-N 3.22Å | ||
| 4 | M | 41.6 | Very low | 51.1 | Low | 161 Ų | 161 | 132.3 Ų | 132.3 | 79% | 0.793 | 68% | 0.683 | S | S | * | * | trans | -58.2 | 98.6 | 162.1 | -84.6 | -174.8 | -106.5 | 0 | 0 | 106.1 | E2 V6 | E2-M4 VanDerWaalsContact C-N 3.32Å; E2-M4 PolarHBondContact O-N 2.99Å; M4-V6 VanDerWaalsContact C-N 3.27Å; M4-V6 PolarHBondContact O-N 3Å | ||
| 5 | D | 41.5 | Very low | 51.8 | Low | 138 Ų | 138 | 130.1 Ų | 130.1 | 74% | 0.738 | 67% | 0.673 | S | S | * | * | trans | -69.4 | 93.6 | 175.1 | -152 | 12.6 | 0 | 0 | 0 | 105.7 | K3 Q7 | K3-D5 PolarHBondContact O-N 3.22Å; D5-Q7 PolarHBondContact O-N 3.25Å | ||
| 6 | V | 43.5 | Very low | 52.7 | Low | 127 Ų | 127 | 124.6 Ų | 124.6 | 77% | 0.77 | 65% | 0.645 | S | S | * | * | trans | -70.7 | 85 | 179.9 | -179.2 | 0 | 0 | 0 | 0 | 106.5 | M4 P8 | M4-V6 VanDerWaalsContact C-N 3.27Å; M4-V6 PolarHBondContact O-N 3Å; V6-P8 WeakPolarHBondContact O-CD 3.43Å | ||
| 7 | Q | 46.3 | Very low | 53.6 | Low | 156 Ų | 156 | 118.1 Ų | 118.1 | 73% | 0.729 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 124 | 173.2 | -72.5 | -173.7 | 20.5 | 0 | 0 | 108.2 | D5 | D5-Q7 PolarHBondContact O-N 3.25Š|
| 8 | P | 46.9 | Very low | 54.2 | Low | 107 Ų | 107 | 116.4 Ų | 116.4 | 70% | 0.695 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 134 | 173.8 | 25 | -31.5 | 0 | 0 | 0 | 108.3 | V6 | V6-P8 WeakPolarHBondContact O-CD 3.43Š|
| 9 | P | 54.6 | Low | 54.3 | Low | 40 Ų | 40 | 116.8 Ų | 116.8 | 26% | 0.26 | 61% | 0.608 | S | S | . | * | P | Polyproline II helix | trans | -57.7 | 130.6 | 179.8 | 18.8 | -27.9 | 0 | 0 | 0 | 109.6 | I11 Q47 S48 | P9-I11 PolarHBondContact O-N 3.3Å; P9-Q47 HydrophobicContact CG-CB 4.16Å; P9-S48 PolarHBondContact O-OG 3.38Å |
| 10 | P | 65.1 | Low | 54.1 | Low | 79 Ų | 79 | 113.8 Ų | 113.8 | 51% | 0.513 | 60% | 0.597 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 138.3 | -175.8 | 24.5 | -33.5 | 0 | 0 | 0 | 110 | R12 | P10-R12 PolarHBondContact O-N 3.46Š|
| 11 | I | 59.6 | Low | 53.7 | Low | 130 Ų | 130 | 112 Ų | 112 | 67% | 0.667 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 124.6 | 176.4 | -61.9 | 173.7 | 0 | 0 | 0 | 108 | P9 | P9-I11 PolarHBondContact O-N 3.3Š|
| 12 | R | 70.9 | Confident | 54.3 | Low | 83 Ų | 83 | 102.3 Ų | 102.3 | 31% | 0.313 | 55% | 0.553 | S | S | . | * | P | Polyproline II helix | trans | -86.1 | 146.6 | 179.5 | -56 | -58.1 | 178.8 | 172.3 | -4.2 | 109.6 | P10 Y45 Y46 N49 | P10-R12 PolarHBondContact O-N 3.46Å; R12-Y45 HydrophobicContact CG-CE1 4.42Å; R12-Y46 HydrophobicContact CB-CD1 4.35Å; R12-Y46 HydrophobicContact CB-CE1 4.44Å; R12-Y46 HydrophobicContact CG-CD1 4.35Å; R12-Y46 HydrophobicContact CG-CE1 4.5Å; R12-N49 PolarHBondContact N-OD1 3.19Å; R12-N49 VanDerWaalsContact N-OD1 3.09Å; R12-N49 PolarHBondContact O-ND2 3.48Å |
| 13 | T | 69.4 | Low | 55.2 | Low | 92 Ų | 92 | 97 Ų | 97 | 56% | 0.564 | 53% | 0.528 | S | S | * | . | P | Polyproline II helix | trans | -57 | 144.2 | 179.7 | 53.3 | 0 | 0 | 0 | 0 | 110.4 | D15 D16 F17 | T13-D15 PolarHBondContact O-N 3.39Å; T13-D16 PolarHBondContact O-N 2.81Å; T13-D16 VanDerWaalsContact O-N 3.1Å; T13-D16 PolarHBondContact OG1-N 3.48Å; T13-F17 PolarHBondContact O-N 2.9Å |
| 14 | L | 61.7 | Low | 56.2 | Low | 121 Ų | 121 | 93 Ų | 93 | 63% | 0.634 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.7 | -29.1 | 176 | -69.2 | 178.7 | 0 | 0 | 0 | 111.5 | F17 V18 | L14-F17 PolarHBondContact O-N 3.32Å; L14-V18 PolarHBondContact O-N 3.44Å |
| 15 | D | 61.8 | Low | 57.2 | Low | 99 Ų | 99 | 87.1 Ų | 87.1 | 53% | 0.529 | 49% | 0.488 | S | S | . | . | I | π-helix | trans | -59.8 | -51 | 172.2 | -68.1 | -45.9 | 0 | 0 | 0 | 111.3 | T13 F17 L19 S20 | T13-D15 PolarHBondContact O-N 3.39Å; D15-F17 VanDerWaalsContact C-N 3.34Å; D15-F17 PolarHBondContact O-N 3.4Å; D15-L19 CarbonylContact O-C 3.51Å; D15-L19 WeakPolarHBondContact O-CA 3.18Å; D15-L19 PolarHBondContact O-N 3.08Å; D15-L19 WeakPolarHBondContact OD1-CD1 3.19Å; D15-S20 WeakPolarHBondContact O-CA 3.43Å; D15-S20 WeakPolarHBondContact O-CB 3.47Å; D15-S20 PolarHBondContact O-N 2.97Å |
| 16 | D | 65.9 | Low | 58.1 | Low | 42 Ų | 42 | 86.6 Ų | 86.6 | 23% | 0.225 | 49% | 0.489 | C | S | . | . | I | π-helix | trans | -61.9 | -44.6 | 174 | -173.8 | 34.7 | 0 | 0 | 0 | 110.6 | T13 V18 Y46 R143 | T13-D16 PolarHBondContact O-N 2.81Å; T13-D16 VanDerWaalsContact O-N 3.1Å; T13-D16 PolarHBondContact OG1-N 3.48Å; D16-V18 PolarHBondContact O-N 3.44Å; D16-Y46 WeakPolarHBondContact OD2-CE1 3.33Å; D16-Y46 PolarHBondContact OD2-OH 3.4Å; D16-R143 PolarHBondContact O-NH1 2.95Å; D16-R143 PolarHBondContact O-NH2 3.21Å; D16-R143 IonicContact OD1-NH2 3.14Å; D16-R143 PolarHBondContact OD1-NH2 2.99Å; D16-R143 VanDerWaalsContact OD1-NH2 3.14Å |
| 17 | F | 67.8 | Low | 59 | Low | 15 Ų | 15 | 82 Ų | 82 | 7% | 0.066 | 46% | 0.462 | C | S | . | . | I | π-helix | trans | -67.2 | -34.4 | -174.7 | -172.4 | -120.8 | 0 | 0 | 0 | 115 | T13 L14 D15 Y46 N49 Y50 H139 R143 | T13-F17 PolarHBondContact O-N 2.9Å; L14-F17 PolarHBondContact O-N 3.32Å; D15-F17 VanDerWaalsContact C-N 3.34Å; D15-F17 PolarHBondContact O-N 3.4Å; F17-Y46 AromaticContact CD2-CD1 3.58Å; F17-Y46 HydrophobicContact CD2-CD1 3.58Å; F17-Y46 HydrophobicContact CD2-CE1 4.28Å; F17-Y46 AromaticContact CD2-CG 3.87Å; F17-Y46 HydrophobicContact CD2-CG 3.87Å; F17-Y46 HydrophobicContact CE2-CD1 4.29Å; F17-Y46 HydrophobicContact CE2-CG 4.13Å; F17-N49 WeakPolarHBondContact CB-ND2 3.42Å; F17-N49 HydrophobicContact CD1-CB 4.01Å; F17-N49 HydrophobicContact CD2-CB 3.58Å; F17-N49 HydrophobicContact CE1-CB 4.04Å; F17-N49 HydrophobicContact CE2-CB 3.58Å; F17-N49 HydrophobicContact CG-CB 3.8Å; F17-N49 HydrophobicContact CZ-CB 3.83Å; F17-Y50 AromaticContact CE2-CD1 3.93Å; F17-Y50 HydrophobicContact CE2-CD1 3.93Å; F17-Y50 AromaticContact CE2-CE1 3.73Å; F17-Y50 HydrophobicContact CE2-CE1 3.73Å; F17-Y50 AromaticContact CZ-CD1 3.81Å; F17-Y50 HydrophobicContact CZ-CD1 3.81Å; F17-Y50 AromaticContact CZ-CE1 3.89Å; F17-Y50 HydrophobicContact CZ-CE1 3.89Å; F17-H139 AromaticContact CD2-CE1 3.91Å; F17-H139 AromaticContact CE2-CE1 3.58Å; F17-H139 AromaticContact CE2-ND1 3.95Å; F17-H139 PolarHBondContact O-NE2 2.83Å; F17-R143 VanDerWaalsContact C-NH1 3.26Å; F17-R143 PolarHBondContact O-NH1 3.01Å |
| 18 | V | 64 | Low | 59.9 | Low | 87 Ų | 87 | 78.1 Ų | 78.1 | 53% | 0.527 | 45% | 0.447 | S | S | . | . | I | π-helix | trans | -129 | -38.9 | -171.9 | -174.4 | 0 | 0 | 0 | 0 | 113.6 | L14 D16 | L14-V18 PolarHBondContact O-N 3.44Å; D16-V18 PolarHBondContact O-N 3.44Å |
| 19 | L | 56.7 | Low | 60.8 | Low | 124 Ų | 124 | 79.2 Ų | 79.2 | 65% | 0.649 | 45% | 0.445 | S | S | * | . | I | π-helix | trans | -106.2 | -21.9 | -163 | -63.3 | 152.8 | 0 | 0 | 0 | 115.5 | D15 S21 | D15-L19 CarbonylContact O-C 3.51Å; D15-L19 WeakPolarHBondContact O-CA 3.18Å; D15-L19 PolarHBondContact O-N 3.08Å; D15-L19 WeakPolarHBondContact OD1-CD1 3.19Å; L19-S21 PolarHBondContact O-N 2.85Å |
| 20 | S | 49.6 | Very low | 61.5 | Low | 56 Ų | 56 | 88.6 Ų | 88.6 | 39% | 0.392 | 48% | 0.476 | S | S | . | . | S | Bend | trans | -85.1 | 103.4 | -173.3 | -177.9 | 0 | 0 | 0 | 0 | 109.7 | D15 A22 | D15-S20 WeakPolarHBondContact O-CA 3.43Å; D15-S20 WeakPolarHBondContact O-CB 3.47Å; D15-S20 PolarHBondContact O-N 2.97Å; S20-A22 PolarHBondContact O-N 2.94Å |
| 21 | S | 46.1 | Very low | 62.1 | Low | 76 Ų | 76 | 88.4 Ų | 88.4 | 53% | 0.531 | 47% | 0.47 | S | S | . | . | trans | 34.6 | 51.2 | 163.3 | 59.2 | 0 | 0 | 0 | 0 | 113.3 | L19 Q23 | L19-S21 PolarHBondContact O-N 2.85Å; S21-Q23 PolarHBondContact O-N 3.35Å | ||
| 22 | A | 49.3 | Very low | 62.9 | Low | 39 Ų | 39 | 87.9 Ų | 87.9 | 32% | 0.322 | 47% | 0.468 | S | S | . | . | trans | -62.8 | 100.8 | -171.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | S20 F24 | S20-A22 PolarHBondContact O-N 2.94Å; A22-F24 HydrophobicContact CB-CD1 4.38Å; A22-F24 HydrophobicContact CB-CD2 3.49Å; A22-F24 VanDerWaalsContact CB-CD2 3.49Å; A22-F24 HydrophobicContact CB-CE1 4.05Å; A22-F24 HydrophobicContact CB-CE2 3.08Å; A22-F24 HydrophobicContact CB-CG 4.16Å; A22-F24 HydrophobicContact CB-CZ 3.4Å; A22-F24 VanDerWaalsContact CB-CZ 3.4Å; A22-F24 WeakPolarHBondContact O-CD2 3.14Å; A22-F24 PolarHBondContact O-N 3.45Å | ||
| 23 | Q | 57.7 | Low | 63.2 | Low | 69 Ų | 69 | 90.8 Ų | 90.8 | 32% | 0.322 | 49% | 0.485 | S | S | . | . | trans | -72.6 | 80.1 | 171.3 | -65.8 | -176.2 | 4 | 0 | 0 | 105.8 | S21 L144 K148 | S21-Q23 PolarHBondContact O-N 3.35Å; Q23-L144 HydrophobicContact CB-CB 4.42Å; Q23-L144 WeakPolarHBondContact O-CB 3.5Å; Q23-L144 WeakPolarHBondContact O-CD1 3.24Å; Q23-L144 PolarHBondContact O-N 3.31Å; Q23-K148 VanDerWaalsContact CD-CG 3.49Å; Q23-K148 VanDerWaalsContact OE1-CG 3.27Å | ||
| 24 | F | 59.7 | Low | 63.4 | Low | 111 Ų | 111 | 92.9 Ų | 92.9 | 49% | 0.487 | 48% | 0.483 | S | S | . | . | B | Isolated β-bridge | trans | -81.6 | 125.3 | 168.7 | -65.7 | -58.5 | 0 | 0 | 0 | 107 | A22 V142 | A22-F24 HydrophobicContact CB-CD1 4.38Å; A22-F24 HydrophobicContact CB-CD2 3.49Å; A22-F24 VanDerWaalsContact CB-CD2 3.49Å; A22-F24 HydrophobicContact CB-CE1 4.05Å; A22-F24 HydrophobicContact CB-CE2 3.08Å; A22-F24 HydrophobicContact CB-CG 4.16Å; A22-F24 HydrophobicContact CB-CZ 3.4Å; A22-F24 VanDerWaalsContact CB-CZ 3.4Å; A22-F24 WeakPolarHBondContact O-CD2 3.14Å; A22-F24 PolarHBondContact O-N 3.45Å; F24-V142 WeakPolarHBondContact CA-O 3.37Å; F24-V142 HydrophobicContact CB-CG1 3.56Å; F24-V142 HydrophobicContact CD1-CB 4.15Å; F24-V142 HydrophobicContact CD1-CG1 3.58Å; F24-V142 HydrophobicContact CG-CG1 3.94Å |
| 25 | A | 64 | Low | 64 | Low | 38 Ų | 38 | 91.7 Ų | 91.7 | 31% | 0.314 | 47% | 0.47 | S | S | . | . | trans | -139.8 | 147.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | V142 L144 | A25-V142 PolarHBondContact N-O 3.4Å; A25-L144 VanDerWaalsContact CA-CD1 3.42Å; A25-L144 HydrophobicContact CB-CD1 3.15Å; A25-L144 HydrophobicContact CB-CD2 4.11Å; A25-L144 HydrophobicContact CB-CG 4.29Å | ||
| 26 | V | 60.5 | Low | 64.8 | Low | 127 Ų | 127 | 91 Ų | 91 | 77% | 0.77 | 47% | 0.466 | S | S | * | . | trans | -59 | 131.6 | -178.1 | -176.6 | 0 | 0 | 0 | 0 | 108.7 | D28 | V26-D28 PolarHBondContact O-N 2.8Š| ||
| 27 | P | 61.7 | Low | 65.4 | Low | 30 Ų | 30 | 92.5 Ų | 92.5 | 20% | 0.195 | 47% | 0.474 | C | S | . | . | trans | -54.1 | 137.3 | 174.4 | 20.5 | -31 | 0 | 0 | 0 | 112.3 | I29 W35 R38 | P27-I29 VanDerWaalsContact C-N 3.33Å; P27-I29 PolarHBondContact O-N 2.98Å; P27-W35 HydrophobicContact CB-CG 4.28Å; P27-R38 VanDerWaalsContact CB-NH2 3.25Å | ||
| 28 | D | 64.6 | Low | 65.8 | Low | 76 Ų | 76 | 93.4 Ų | 93.4 | 41% | 0.406 | 48% | 0.477 | S | S | . | . | trans | -78.3 | 89.4 | 170.8 | -172.5 | 4.2 | 0 | 0 | 0 | 108.4 | V26 R30 N31 | V26-D28 PolarHBondContact O-N 2.8Å; D28-R30 PolarHBondContact O-N 2.72Å; D28-R30 VanDerWaalsContact O-N 3.14Å; D28-R30 WeakPolarHBondContact OD1-CB 3.35Å; D28-R30 PolarHBondContact OD1-N 3.43Å; D28-N31 PolarHBondContact O-N 3.32Å | ||
| 29 | I | 65.7 | Low | 66.4 | Low | 129 Ų | 129 | 90.1 Ų | 90.1 | 66% | 0.662 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -18.5 | -177.2 | -51.4 | 173.5 | 0 | 0 | 0 | 111 | P27 N31 L32 | P27-I29 VanDerWaalsContact C-N 3.33Å; P27-I29 PolarHBondContact O-N 2.98Å; I29-N31 VanDerWaalsContact C-N 3.3Å; I29-N31 PolarHBondContact O-N 2.69Å; I29-L32 WeakPolarHBondContact O-CD1 3.34Å |
| 30 | R | 69.3 | Low | 67.5 | Low | 238 Ų | 238 | 87.6 Ų | 87.6 | 90% | 0.898 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72 | -21.9 | 179.4 | -65.9 | 177.2 | 152 | 171.9 | -6.6 | 113.2 | D28 | D28-R30 PolarHBondContact O-N 2.72Å; D28-R30 VanDerWaalsContact O-N 3.14Å; D28-R30 WeakPolarHBondContact OD1-CB 3.35Å; D28-R30 PolarHBondContact OD1-N 3.43Å |
| 31 | N | 77.6 | Confident | 68.8 | Low | 75 Ų | 75 | 89.4 Ų | 89.4 | 40% | 0.401 | 45% | 0.448 | S | S | . | . | trans | -126.4 | 84.4 | 179.3 | -162.7 | -43.7 | 0 | 0 | 0 | 111 | D28 I29 E33 R34 W35 | D28-N31 PolarHBondContact O-N 3.32Å; I29-N31 VanDerWaalsContact C-N 3.3Å; I29-N31 PolarHBondContact O-N 2.69Å; N31-E33 VanDerWaalsContact C-N 3.27Å; N31-E33 PolarHBondContact O-N 2.95Å; N31-R34 HydrophobicContact CB-CB 4.21Å; N31-R34 PolarHBondContact O-N 3.49Å; N31-R34 PolarHBondContact OD1-N 2.93Å; N31-R34 VanDerWaalsContact OD1-N 3.16Å; N31-W35 PolarHBondContact O-N 3.3Å | ||
| 32 | L | 76.6 | Confident | 70.5 | Confident | 119 Ų | 119 | 85.9 Ų | 85.9 | 62% | 0.623 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -60.4 | -34.3 | -176.4 | -74.8 | 87.4 | 0 | 0 | 0 | 112.9 | I29 W35 N36 | I29-L32 WeakPolarHBondContact O-CD1 3.34Å; L32-W35 PolarHBondContact O-N 2.74Å; L32-N36 WeakPolarHBondContact O-CB 3.4Å; L32-N36 PolarHBondContact O-N 3.33Å |
| 33 | E | 77.4 | Confident | 72 | Confident | 143 Ų | 143 | 86.7 Ų | 86.7 | 67% | 0.668 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -65.1 | -47.5 | 178.9 | -172.6 | -175.7 | 168.9 | 0 | 0 | 111 | N31 W35 N36 N37 | N31-E33 VanDerWaalsContact C-N 3.27Å; N31-E33 PolarHBondContact O-N 2.95Å; E33-W35 VanDerWaalsContact C-N 3.29Å; E33-W35 PolarHBondContact O-N 3.05Å; E33-N36 PolarHBondContact O-N 3.47Å; E33-N37 WeakPolarHBondContact O-CB 3.24Å; E33-N37 VanDerWaalsContact O-CG 3.3Å; E33-N37 PolarHBondContact O-N 2.89Å; E33-N37 PolarHBondContact O-ND2 2.79Å |
| 34 | R | 74.5 | Confident | 73 | Confident | 137 Ų | 137 | 88.3 Ų | 88.3 | 52% | 0.517 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.1 | -39.7 | 176.1 | -167.3 | -174.5 | -136.9 | 159.5 | 17.9 | 111.7 | N31 R38 K150 | N31-R34 HydrophobicContact CB-CB 4.21Å; N31-R34 PolarHBondContact O-N 3.49Å; N31-R34 PolarHBondContact OD1-N 2.93Å; N31-R34 VanDerWaalsContact OD1-N 3.16Å; R34-R38 PolarHBondContact O-N 3.43Å; R34-K150 VanDerWaalsContact NH2-NZ 3.12Å |
| 35 | W | 74.6 | Confident | 73.5 | Confident | 95 Ų | 95 | 85.7 Ų | 85.7 | 36% | 0.36 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 177.9 | -179.5 | 51.2 | 0 | 0 | 0 | 111.9 | P27 N31 L32 E33 R38 I39 S141 | P27-W35 HydrophobicContact CB-CG 4.28Å; N31-W35 PolarHBondContact O-N 3.3Å; L32-W35 PolarHBondContact O-N 2.74Å; E33-W35 VanDerWaalsContact C-N 3.29Å; E33-W35 PolarHBondContact O-N 3.05Å; W35-R38 WeakPolarHBondContact O-CB 3.32Å; W35-R38 PolarHBondContact O-N 3.28Å; W35-I39 HydrophobicContact CD2-CD1 3.96Å; W35-I39 HydrophobicContact CE3-CD1 4.48Å; W35-I39 HydrophobicContact CG-CD1 4.41Å; W35-I39 HydrophobicContact CH2-CD1 4.29Å; W35-I39 HydrophobicContact CZ2-CD1 3.74Å; W35-I39 WeakPolarHBondContact O-CG1 3.4Å; W35-I39 PolarHBondContact O-N 2.89Å; W35-S141 PolarHBondContact NE1-OG 3.07Å |
| 36 | N | 77.6 | Confident | 74 | Confident | 84 Ų | 84 | 84.1 Ų | 84.1 | 45% | 0.449 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.2 | -46 | 175.8 | -172.9 | 32.6 | 0 | 0 | 0 | 111.7 | L32 E33 R38 I39 I40 | L32-N36 WeakPolarHBondContact O-CB 3.4Å; L32-N36 PolarHBondContact O-N 3.33Å; E33-N36 PolarHBondContact O-N 3.47Å; N36-R38 PolarHBondContact O-N 3.34Å; N36-I39 PolarHBondContact O-N 3.31Å; N36-I39 VanDerWaalsContact O-N 3.13Å; N36-I40 WeakPolarHBondContact O-CG1 3.43Å; N36-I40 PolarHBondContact O-N 2.88Å |
| 37 | N | 78.3 | Confident | 74.8 | Confident | 75 Ų | 75 | 82.9 Ų | 82.9 | 40% | 0.401 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59 | -35.4 | 175.6 | -72.6 | -21.7 | 0 | 0 | 0 | 111.8 | E33 N41 | E33-N37 WeakPolarHBondContact O-CB 3.24Å; E33-N37 VanDerWaalsContact O-CG 3.3Å; E33-N37 PolarHBondContact O-N 2.89Å; E33-N37 PolarHBondContact O-ND2 2.79Å; N37-N41 WeakPolarHBondContact O-CB 3.22Å; N37-N41 VanDerWaalsContact O-CG 3.31Å; N37-N41 PolarHBondContact O-N 3.35Å; N37-N41 VanDerWaalsContact O-N 3.11Å; N37-N41 PolarHBondContact O-ND2 3.39Å |
| 38 | R | 75.6 | Confident | 75.7 | Confident | 34 Ų | 34 | 82.5 Ų | 82.5 | 13% | 0.128 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -65.4 | -47.4 | 174.7 | -173.5 | 171.4 | 73.5 | -169.5 | 11.5 | 111.8 | P27 R34 W35 N36 N41 N42 S141 | P27-R38 VanDerWaalsContact CB-NH2 3.25Å; R34-R38 PolarHBondContact O-N 3.43Å; W35-R38 WeakPolarHBondContact O-CB 3.32Å; W35-R38 PolarHBondContact O-N 3.28Å; N36-R38 PolarHBondContact O-N 3.34Å; R38-N41 PolarHBondContact O-N 3.49Å; R38-N42 WeakPolarHBondContact O-CB 3.46Å; R38-N42 PolarHBondContact O-N 2.98Å; R38-N42 PolarHBondContact O-ND2 3.37Å; R38-S141 PolarHBondContact NE-O 3.33Å; R38-S141 PolarHBondContact NH2-O 2.87Å |
| 39 | I | 78.1 | Confident | 76.6 | Confident | 17 Ų | 17 | 79.2 Ų | 79.2 | 9% | 0.087 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -59.2 | -51.1 | 178.6 | -67.9 | 165.1 | 0 | 0 | 0 | 110.2 | W35 N36 N41 N42 L43 L137 A140 | W35-I39 HydrophobicContact CD2-CD1 3.96Å; W35-I39 HydrophobicContact CE3-CD1 4.48Å; W35-I39 HydrophobicContact CG-CD1 4.41Å; W35-I39 HydrophobicContact CH2-CD1 4.29Å; W35-I39 HydrophobicContact CZ2-CD1 3.74Å; W35-I39 WeakPolarHBondContact O-CG1 3.4Å; W35-I39 PolarHBondContact O-N 2.89Å; N36-I39 PolarHBondContact O-N 3.31Å; N36-I39 VanDerWaalsContact O-N 3.13Å; I39-N41 PolarHBondContact O-N 3.46Å; I39-N42 PolarHBondContact O-N 3.3Å; I39-L43 HydrophobicContact CG2-CD1 3.73Å; I39-L43 HydrophobicContact CG2-CG 4.15Å; I39-L43 WeakPolarHBondContact O-CB 3.34Å; I39-L43 VanDerWaalsContact O-CG 3.31Å; I39-L43 WeakPolarHBondContact O-CG 3.3Å; I39-L43 PolarHBondContact O-N 3.16Å; I39-L137 HydrophobicContact CG2-CD2 4.19Å; I39-A140 HydrophobicContact CG2-CB 4.2Å |
| 40 | I | 79.9 | Confident | 77.6 | Confident | 71 Ų | 71 | 73.7 Ų | 73.7 | 36% | 0.364 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.8 | -47.6 | -177.9 | -66 | 169.4 | 0 | 0 | 0 | 111.1 | N36 N42 L43 L44 | N36-I40 WeakPolarHBondContact O-CG1 3.43Å; N36-I40 PolarHBondContact O-N 2.88Å; I40-N42 VanDerWaalsContact C-N 3.3Å; I40-N42 PolarHBondContact O-N 2.94Å; I40-L43 PolarHBondContact O-N 3.26Å; I40-L44 HydrophobicContact CG2-CD1 3.94Å; I40-L44 HydrophobicContact CG2-CG 4.43Å; I40-L44 WeakPolarHBondContact O-CG 3.47Å; I40-L44 PolarHBondContact O-N 2.98Å |
| 41 | N | 76.5 | Confident | 78.4 | Confident | 94 Ų | 94 | 68.4 Ų | 68.4 | 50% | 0.503 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.2 | -37 | 179.7 | -77.8 | -50.9 | 0 | 0 | 0 | 112.6 | N37 R38 I39 Y45 | N37-N41 WeakPolarHBondContact O-CB 3.22Å; N37-N41 VanDerWaalsContact O-CG 3.31Å; N37-N41 PolarHBondContact O-N 3.35Å; N37-N41 VanDerWaalsContact O-N 3.11Å; N37-N41 PolarHBondContact O-ND2 3.39Å; R38-N41 PolarHBondContact O-N 3.49Å; I39-N41 PolarHBondContact O-N 3.46Å; N41-Y45 VanDerWaalsContact O-CB 3.29Å; N41-Y45 WeakPolarHBondContact O-CB 3.43Å; N41-Y45 PolarHBondContact O-N 3.05Å; N41-Y45 VanDerWaalsContact O-N 3.08Å |
| 42 | N | 81.3 | Confident | 78.8 | Confident | 3 Ų | 3 | 68.3 Ų | 68.3 | 2% | 0.016 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -71.4 | -40.4 | 176.1 | -74.8 | -23.4 | 0 | 0 | 0 | 111.8 | R38 I39 I40 Y45 Y46 Y50 A140 R143 | R38-N42 WeakPolarHBondContact O-CB 3.46Å; R38-N42 PolarHBondContact O-N 2.98Å; R38-N42 PolarHBondContact O-ND2 3.37Å; I39-N42 PolarHBondContact O-N 3.3Å; I40-N42 VanDerWaalsContact C-N 3.3Å; I40-N42 PolarHBondContact O-N 2.94Å; N42-Y45 PolarHBondContact O-N 3.29Å; N42-Y46 WeakPolarHBondContact O-CD2 3.28Å; N42-Y46 PolarHBondContact O-N 2.86Å; N42-Y50 WeakPolarHBondContact O-CE2 3.32Å; N42-A140 HydrophobicContact CB-CB 4.06Å; N42-A140 PolarHBondContact ND2-O 2.68Å; N42-R143 PolarHBondContact ND2-O 3.37Å |
| 43 | L | 81.1 | Confident | 79.2 | Confident | 55 Ų | 55 | 64.5 Ų | 64.5 | 29% | 0.288 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.6 | -47.1 | 174.8 | -75.3 | 174.7 | 0 | 0 | 0 | 111.7 | I39 I40 Q47 Y50 I136 L137 A140 | I39-L43 HydrophobicContact CG2-CD1 3.73Å; I39-L43 HydrophobicContact CG2-CG 4.15Å; I39-L43 WeakPolarHBondContact O-CB 3.34Å; I39-L43 VanDerWaalsContact O-CG 3.31Å; I39-L43 WeakPolarHBondContact O-CG 3.3Å; I39-L43 PolarHBondContact O-N 3.16Å; I40-L43 PolarHBondContact O-N 3.26Å; L43-Q47 VanDerWaalsContact O-CA 3.24Å; L43-Q47 WeakPolarHBondContact O-CA 3.19Å; L43-Q47 WeakPolarHBondContact O-CB 3.46Å; L43-Q47 PolarHBondContact O-N 3.47Å; L43-Y50 HydrophobicContact CD2-CD2 4.08Å; L43-Y50 HydrophobicContact CD2-CE2 4Å; L43-I136 HydrophobicContact CD2-CG2 3.52Å; L43-L137 HydrophobicContact CD1-CD2 4.4Å; L43-A140 HydrophobicContact CD2-CB 4.02Å; L43-A140 HydrophobicContact CG-CB 4.04Å |
| 44 | L | 78.9 | Confident | 79.7 | Confident | 103 Ų | 103 | 59.9 Ų | 59.9 | 54% | 0.539 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -66.5 | -39.3 | 178.7 | -68.6 | 173.2 | 0 | 0 | 0 | 112.1 | I40 | I40-L44 HydrophobicContact CG2-CD1 3.94Å; I40-L44 HydrophobicContact CG2-CG 4.43Å; I40-L44 WeakPolarHBondContact O-CG 3.47Å; I40-L44 PolarHBondContact O-N 2.98Å |
| 45 | Y | 69.9 | Low | 80.4 | Confident | 56 Ų | 56 | 57.1 Ų | 57.1 | 22% | 0.22 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -73.5 | -37.7 | -176.4 | -173.1 | -97 | 0 | 0 | 0 | 113.8 | R12 N41 N42 R145 | R12-Y45 HydrophobicContact CG-CE1 4.42Å; N41-Y45 VanDerWaalsContact O-CB 3.29Å; N41-Y45 WeakPolarHBondContact O-CB 3.43Å; N41-Y45 PolarHBondContact O-N 3.05Å; N41-Y45 VanDerWaalsContact O-N 3.08Å; N42-Y45 PolarHBondContact O-N 3.29Å; Y45-R145 VanDerWaalsContact CG-NH1 3.27Å |
| 46 | Y | 75.4 | Confident | 81.1 | Confident | 6 Ų | 6 | 56.3 Ų | 56.3 | 2% | 0.024 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.3 | 22.2 | 178.3 | -60.6 | -74.5 | 0 | 0 | 0 | 112.8 | R12 D16 F17 N42 S48 N49 Y50 R143 | R12-Y46 HydrophobicContact CB-CD1 4.35Å; R12-Y46 HydrophobicContact CB-CE1 4.44Å; R12-Y46 HydrophobicContact CG-CD1 4.35Å; R12-Y46 HydrophobicContact CG-CE1 4.5Å; D16-Y46 WeakPolarHBondContact OD2-CE1 3.33Å; D16-Y46 PolarHBondContact OD2-OH 3.4Å; F17-Y46 AromaticContact CD2-CD1 3.58Å; F17-Y46 HydrophobicContact CD2-CD1 3.58Å; F17-Y46 HydrophobicContact CD2-CE1 4.28Å; F17-Y46 AromaticContact CD2-CG 3.87Å; F17-Y46 HydrophobicContact CD2-CG 3.87Å; F17-Y46 HydrophobicContact CE2-CD1 4.29Å; F17-Y46 HydrophobicContact CE2-CG 4.13Å; N42-Y46 WeakPolarHBondContact O-CD2 3.28Å; N42-Y46 PolarHBondContact O-N 2.86Å; Y46-S48 VanDerWaalsContact C-N 3.29Å; Y46-S48 PolarHBondContact O-N 3.45Å; Y46-N49 PolarHBondContact O-N 2.96Å; Y46-Y50 VanDerWaalsContact O-CD2 3.24Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.49Å; Y46-Y50 PolarHBondContact O-N 3.16Å; Y46-R143 VanDerWaalsContact CE2-CD 3.47Å; Y46-R143 PolarHBondContact OH-NE 3.16Å; Y46-R143 VanDerWaalsContact OH-NE 3.08Å; Y46-R143 PolarHBondContact OH-NH2 2.69Å |
| 47 | Q | 77.4 | Confident | 81.5 | Confident | 100 Ų | 100 | 54.2 Ų | 54.2 | 47% | 0.467 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -48.9 | -49.6 | -174.5 | -179.1 | -178.2 | -32.5 | 0 | 0 | 112.4 | P9 L43 Y50 F51 | P9-Q47 HydrophobicContact CG-CB 4.16Å; L43-Q47 VanDerWaalsContact O-CA 3.24Å; L43-Q47 WeakPolarHBondContact O-CA 3.19Å; L43-Q47 WeakPolarHBondContact O-CB 3.46Å; L43-Q47 PolarHBondContact O-N 3.47Å; Q47-Y50 PolarHBondContact O-N 3.41Å; Q47-F51 WeakPolarHBondContact O-CB 3.49Å; Q47-F51 PolarHBondContact O-N 2.97Å |
| 48 | S | 79.1 | Confident | 81.9 | Confident | 23 Ų | 23 | 52.4 Ų | 52.4 | 16% | 0.161 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.6 | -39.8 | -179.8 | -53 | 0 | 0 | 0 | 0 | 112.2 | P9 Y46 F51 V52 | P9-S48 PolarHBondContact O-OG 3.38Å; Y46-S48 VanDerWaalsContact C-N 3.29Å; Y46-S48 PolarHBondContact O-N 3.45Å; S48-F51 PolarHBondContact O-N 3.21Å; S48-V52 WeakPolarHBondContact O-CG2 3.48Å; S48-V52 PolarHBondContact O-N 3.42Å |
| 49 | N | 84.7 | Confident | 82.5 | Confident | 7 Ų | 7 | 52.9 Ų | 52.9 | 4% | 0.037 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67 | -42.1 | 176.3 | -65.2 | 65.7 | 0 | 0 | 0 | 111.8 | R12 F17 Y46 F51 V52 S53 | R12-N49 PolarHBondContact N-OD1 3.19Å; R12-N49 VanDerWaalsContact N-OD1 3.09Å; R12-N49 PolarHBondContact O-ND2 3.48Å; F17-N49 WeakPolarHBondContact CB-ND2 3.42Å; F17-N49 HydrophobicContact CD1-CB 4.01Å; F17-N49 HydrophobicContact CD2-CB 3.58Å; F17-N49 HydrophobicContact CE1-CB 4.04Å; F17-N49 HydrophobicContact CE2-CB 3.58Å; F17-N49 HydrophobicContact CG-CB 3.8Å; F17-N49 HydrophobicContact CZ-CB 3.83Å; Y46-N49 PolarHBondContact O-N 2.96Å; N49-F51 VanDerWaalsContact C-N 3.32Å; N49-F51 PolarHBondContact O-N 3.35Å; N49-V52 PolarHBondContact O-N 2.88Å; N49-S53 WeakPolarHBondContact O-CB 3.26Å; N49-S53 PolarHBondContact O-N 3.42Å; N49-S53 PolarHBondContact O-OG 3.46Å; N49-S53 VanDerWaalsContact O-OG 3.06Å |
| 50 | Y | 86 | Confident | 82.9 | Confident | 12 Ų | 12 | 56.7 Ų | 56.7 | 5% | 0.047 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.6 | -38.7 | 174.3 | -69.1 | -48.3 | 0 | 0 | 0 | 112.3 | F17 N42 L43 Y46 Q47 S53 F54 I136 H139 A140 | F17-Y50 AromaticContact CE2-CD1 3.93Å; F17-Y50 HydrophobicContact CE2-CD1 3.93Å; F17-Y50 AromaticContact CE2-CE1 3.73Å; F17-Y50 HydrophobicContact CE2-CE1 3.73Å; F17-Y50 AromaticContact CZ-CD1 3.81Å; F17-Y50 HydrophobicContact CZ-CD1 3.81Å; F17-Y50 AromaticContact CZ-CE1 3.89Å; F17-Y50 HydrophobicContact CZ-CE1 3.89Å; N42-Y50 WeakPolarHBondContact O-CE2 3.32Å; L43-Y50 HydrophobicContact CD2-CD2 4.08Å; L43-Y50 HydrophobicContact CD2-CE2 4Å; Y46-Y50 VanDerWaalsContact O-CD2 3.24Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.49Å; Y46-Y50 PolarHBondContact O-N 3.16Å; Q47-Y50 PolarHBondContact O-N 3.41Å; Y50-S53 PolarHBondContact O-N 2.85Å; Y50-F54 VanDerWaalsContact O-CB 3.27Å; Y50-F54 WeakPolarHBondContact O-CB 3.17Å; Y50-F54 PolarHBondContact O-N 3.19Å; Y50-I136 HydrophobicContact CD1-CB 4.07Å; Y50-I136 HydrophobicContact CD1-CG1 3.73Å; Y50-I136 HydrophobicContact CD1-CG2 3.63Å; Y50-I136 HydrophobicContact CD2-CG2 4.11Å; Y50-I136 HydrophobicContact CE1-CB 4.43Å; Y50-I136 HydrophobicContact CE1-CG1 4.48Å; Y50-I136 HydrophobicContact CE1-CG2 3.97Å; Y50-I136 HydrophobicContact CE2-CG2 4.43Å; Y50-I136 HydrophobicContact CG-CG1 4.22Å; Y50-I136 HydrophobicContact CG-CG2 3.7Å; Y50-H139 HydrophobicContact CE1-CB 4.16Å; Y50-H139 AromaticContact CE1-ND1 3.27Å; Y50-H139 VanDerWaalsContact CE1-ND1 3.27Å; Y50-H139 WeakPolarHBondContact CE1-ND1 3.35Å; Y50-H139 AromaticContact CZ-ND1 3.44Å; Y50-H139 PolarHBondContact OH-ND1 3.31Å; Y50-A140 WeakPolarHBondContact OH-CA 3.35Å; Y50-A140 PolarHBondContact OH-N 2.92Å |
| 51 | F | 85.6 | Confident | 83.2 | Confident | 127 Ų | 127 | 54.5 Ų | 54.5 | 56% | 0.557 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -63.6 | -46.1 | 175.9 | -175.9 | -108.7 | 0 | 0 | 0 | 111.7 | Q47 S48 N49 F54 L55 | Q47-F51 WeakPolarHBondContact O-CB 3.49Å; Q47-F51 PolarHBondContact O-N 2.97Å; S48-F51 PolarHBondContact O-N 3.21Å; N49-F51 VanDerWaalsContact C-N 3.32Å; N49-F51 PolarHBondContact O-N 3.35Å; F51-F54 WeakPolarHBondContact O-CB 3.31Å; F51-F54 PolarHBondContact O-N 3.46Å; F51-L55 HydrophobicContact CD1-CD1 3.96Å; F51-L55 HydrophobicContact CE1-CD1 3.4Å; F51-L55 HydrophobicContact CE1-CG 4.17Å; F51-L55 HydrophobicContact CE2-CD1 4.41Å; F51-L55 HydrophobicContact CE2-CG 4.39Å; F51-L55 HydrophobicContact CZ-CD1 3.66Å; F51-L55 HydrophobicContact CZ-CD2 4.35Å; F51-L55 HydrophobicContact CZ-CG 4.1Å; F51-L55 WeakPolarHBondContact O-CG 3.37Å; F51-L55 PolarHBondContact O-N 3.32Å |
| 52 | V | 86.3 | Confident | 83.7 | Confident | 73 Ų | 73 | 50.5 Ų | 50.5 | 44% | 0.442 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.8 | -44.1 | 176 | 172 | 0 | 0 | 0 | 0 | 111.4 | S48 N49 F54 L55 T56 | S48-V52 WeakPolarHBondContact O-CG2 3.48Å; S48-V52 PolarHBondContact O-N 3.42Å; N49-V52 PolarHBondContact O-N 2.88Å; V52-F54 VanDerWaalsContact C-N 3.34Å; V52-F54 PolarHBondContact O-N 3.46Å; V52-L55 PolarHBondContact O-N 2.97Å; V52-T56 WeakPolarHBondContact O-CB 3.42Å; V52-T56 PolarHBondContact O-N 3.47Å; V52-T56 PolarHBondContact O-OG1 2.86Å |
| 53 | S | 85.8 | Confident | 83.9 | Confident | 40 Ų | 40 | 59.4 Ų | 59.4 | 28% | 0.28 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 175.6 | -65.3 | 0 | 0 | 0 | 0 | 112.1 | N49 Y50 T56 I57 | N49-S53 WeakPolarHBondContact O-CB 3.26Å; N49-S53 PolarHBondContact O-N 3.42Å; N49-S53 PolarHBondContact O-OG 3.46Å; N49-S53 VanDerWaalsContact O-OG 3.06Å; Y50-S53 PolarHBondContact O-N 2.85Å; S53-T56 PolarHBondContact O-N 2.85Å; S53-I57 WeakPolarHBondContact O-CG1 3.31Å; S53-I57 PolarHBondContact O-N 3.27Å |
| 54 | F | 88.3 | Confident | 84.1 | Confident | 45 Ų | 45 | 64.2 Ų | 64.2 | 20% | 0.197 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -59.7 | -51.1 | 175.6 | -177.9 | -94.2 | 0 | 0 | 0 | 111.2 | Y50 F51 V52 T56 I57 L58 P132 I133 I136 | Y50-F54 VanDerWaalsContact O-CB 3.27Å; Y50-F54 WeakPolarHBondContact O-CB 3.17Å; Y50-F54 PolarHBondContact O-N 3.19Å; F51-F54 WeakPolarHBondContact O-CB 3.31Å; F51-F54 PolarHBondContact O-N 3.46Å; V52-F54 VanDerWaalsContact C-N 3.34Å; V52-F54 PolarHBondContact O-N 3.46Å; F54-T56 VanDerWaalsContact C-N 3.29Å; F54-T56 PolarHBondContact O-N 3.35Å; F54-I57 PolarHBondContact O-N 3.06Å; F54-L58 HydrophobicContact CE1-CD2 4.13Å; F54-L58 VanDerWaalsContact O-CB 3.28Å; F54-L58 WeakPolarHBondContact O-CB 3.32Å; F54-L58 PolarHBondContact O-N 3.36Å; F54-P132 HydrophobicContact CD2-CB 3.48Å; F54-P132 VanDerWaalsContact CD2-CB 3.48Å; F54-P132 HydrophobicContact CD2-CG 4.37Å; F54-P132 HydrophobicContact CE2-CB 3.87Å; F54-P132 HydrophobicContact CE2-CG 4.45Å; F54-P132 HydrophobicContact CG-CB 4.46Å; F54-I133 HydrophobicContact CE2-CG1 4.16Å; F54-I136 HydrophobicContact CB-CD1 4.15Å; F54-I136 HydrophobicContact CD2-CD1 4.36Å |
| 55 | L | 88.8 | Confident | 84.4 | Confident | 80 Ų | 80 | 63.2 Ų | 63.2 | 42% | 0.419 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.1 | -36.6 | 178.2 | -71.8 | -177.5 | 0 | 0 | 0 | 112.7 | F51 V52 L58 G59 | F51-L55 HydrophobicContact CD1-CD1 3.96Å; F51-L55 HydrophobicContact CE1-CD1 3.4Å; F51-L55 HydrophobicContact CE1-CG 4.17Å; F51-L55 HydrophobicContact CE2-CD1 4.41Å; F51-L55 HydrophobicContact CE2-CG 4.39Å; F51-L55 HydrophobicContact CZ-CD1 3.66Å; F51-L55 HydrophobicContact CZ-CD2 4.35Å; F51-L55 HydrophobicContact CZ-CG 4.1Å; F51-L55 WeakPolarHBondContact O-CG 3.37Å; F51-L55 PolarHBondContact O-N 3.32Å; V52-L55 PolarHBondContact O-N 2.97Å; L55-L58 PolarHBondContact O-N 2.77Å; L55-G59 PolarHBondContact O-N 2.88Å |
| 56 | T | 88 | Confident | 85.1 | Confident | 77 Ų | 77 | 64 Ų | 64 | 47% | 0.472 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -63.5 | -49.8 | 177.8 | -57 | 0 | 0 | 0 | 0 | 110.6 | V52 S53 F54 G59 I60 | V52-T56 WeakPolarHBondContact O-CB 3.42Å; V52-T56 PolarHBondContact O-N 3.47Å; V52-T56 PolarHBondContact O-OG1 2.86Å; S53-T56 PolarHBondContact O-N 2.85Å; F54-T56 VanDerWaalsContact C-N 3.29Å; F54-T56 PolarHBondContact O-N 3.35Å; T56-G59 PolarHBondContact O-N 3.25Å; T56-I60 HydrophobicContact CG2-CD1 4.16Å; T56-I60 VanDerWaalsContact O-CG1 3.3Å; T56-I60 WeakPolarHBondContact O-CG1 3.4Å; T56-I60 PolarHBondContact O-N 3.01Å |
| 57 | I | 87.6 | Confident | 85.5 | Confident | 41 Ų | 41 | 71.4 Ų | 71.4 | 21% | 0.21 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 178.3 | -59.8 | 164.4 | 0 | 0 | 0 | 110.6 | S53 F54 G59 I60 V61 P132 L135 | S53-I57 WeakPolarHBondContact O-CG1 3.31Å; S53-I57 PolarHBondContact O-N 3.27Å; F54-I57 PolarHBondContact O-N 3.06Å; I57-G59 VanDerWaalsContact C-N 3.3Å; I57-G59 PolarHBondContact O-N 3.09Å; I57-I60 PolarHBondContact O-N 3.45Å; I57-V61 HydrophobicContact CG2-CG2 4.36Å; I57-V61 WeakPolarHBondContact O-CG2 3.31Å; I57-V61 PolarHBondContact O-N 2.85Å; I57-P132 HydrophobicContact CB-CG 3.85Å; I57-P132 HydrophobicContact CD1-CB 4.07Å; I57-P132 HydrophobicContact CD1-CG 4.03Å; I57-P132 HydrophobicContact CG2-CG 3.57Å; I57-L135 HydrophobicContact CD1-CD1 4.07Å |
| 58 | L | 86.5 | Confident | 85.8 | Confident | 37 Ų | 37 | 68.7 Ų | 68.7 | 19% | 0.194 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -59 | -42.6 | 176.8 | -168.5 | 73.9 | 0 | 0 | 0 | 111.5 | F54 L55 V61 G62 L69 G128 I129 | F54-L58 HydrophobicContact CE1-CD2 4.13Å; F54-L58 VanDerWaalsContact O-CB 3.28Å; F54-L58 WeakPolarHBondContact O-CB 3.32Å; F54-L58 PolarHBondContact O-N 3.36Å; L55-L58 PolarHBondContact O-N 2.77Å; L58-V61 PolarHBondContact O-N 3.4Å; L58-G62 WeakPolarHBondContact O-CA 3.39Å; L58-G62 PolarHBondContact O-N 3.48Å; L58-L69 HydrophobicContact CD1-CD1 3.55Å; L58-L69 HydrophobicContact CG-CD1 4Å; L58-G128 WeakPolarHBondContact CD1-O 3.41Å; L58-I129 HydrophobicContact CD1-CG1 4.26Å |
| 59 | G | 86.7 | Confident | 86.1 | Confident | 44 Ų | 44 | 69 Ų | 69 | 45% | 0.454 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L55 T56 I57 G62 Y63 | L55-G59 PolarHBondContact O-N 2.88Å; T56-G59 PolarHBondContact O-N 3.25Å; I57-G59 VanDerWaalsContact C-N 3.3Å; I57-G59 PolarHBondContact O-N 3.09Å; G59-G62 PolarHBondContact O-N 3.25Å; G59-Y63 WeakPolarHBondContact O-CB 3.3Å; G59-Y63 PolarHBondContact O-N 3.02Å |
| 60 | I | 87.8 | Confident | 86.2 | Confident | 97 Ų | 97 | 76 Ų | 76 | 50% | 0.497 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.9 | -50.1 | 175.3 | -67.6 | 164.9 | 0 | 0 | 0 | 110.4 | T56 I57 G62 Y63 F64 | T56-I60 HydrophobicContact CG2-CD1 4.16Å; T56-I60 VanDerWaalsContact O-CG1 3.3Å; T56-I60 WeakPolarHBondContact O-CG1 3.4Å; T56-I60 PolarHBondContact O-N 3.01Å; I57-I60 PolarHBondContact O-N 3.45Å; I60-G62 VanDerWaalsContact C-N 3.32Å; I60-G62 PolarHBondContact O-N 2.92Å; I60-Y63 WeakPolarHBondContact O-CB 3.15Å; I60-Y63 PolarHBondContact O-N 2.86Å; I60-F64 HydrophobicContact CG2-CD2 4.48Å; I60-F64 HydrophobicContact CG2-CE2 4.04Å; I60-F64 WeakPolarHBondContact O-CD2 3.44Å |
| 61 | V | 86 | Confident | 86.2 | Confident | 25 Ų | 25 | 77.9 Ų | 77.9 | 15% | 0.152 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -64.6 | -40.3 | 178.5 | 178.4 | 0 | 0 | 0 | 0 | 111 | I57 L58 Y63 F64 Q65 V124 F127 | I57-V61 HydrophobicContact CG2-CG2 4.36Å; I57-V61 WeakPolarHBondContact O-CG2 3.31Å; I57-V61 PolarHBondContact O-N 2.85Å; L58-V61 PolarHBondContact O-N 3.4Å; V61-Y63 VanDerWaalsContact C-N 3.29Å; V61-Y63 PolarHBondContact O-N 2.86Å; V61-F64 PolarHBondContact O-N 3.45Å; V61-Q65 PolarHBondContact O-N 3.2Å; V61-Q65 VanDerWaalsContact O-N 3.08Å; V61-V124 HydrophobicContact CG1-CG1 4.08Å; V61-V124 HydrophobicContact CG1-CG2 4.37Å; V61-F127 HydrophobicContact CG2-CB 4.17Å |
| 62 | G | 85.6 | Confident | 86.2 | Confident | 9 Ų | 9 | 71.9 Ų | 71.9 | 9% | 0.093 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.1 | -34.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | L58 G59 I60 F64 Q65 P66 | L58-G62 WeakPolarHBondContact O-CA 3.39Å; L58-G62 PolarHBondContact O-N 3.48Å; G59-G62 PolarHBondContact O-N 3.25Å; I60-G62 VanDerWaalsContact C-N 3.32Å; I60-G62 PolarHBondContact O-N 2.92Å; G62-F64 VanDerWaalsContact C-N 3.32Å; G62-F64 PolarHBondContact O-N 2.86Å; G62-Q65 CarbonylContact O-C 3.51Å; G62-Q65 PolarHBondContact O-N 2.91Å; G62-P66 WeakPolarHBondContact O-CA 3.45Å; G62-P66 WeakPolarHBondContact O-CB 3.27Å; G62-P66 WeakPolarHBondContact O-CD 3.46Å |
| 63 | Y | 87.4 | Confident | 86.1 | Confident | 191 Ų | 191 | 70.3 Ų | 70.3 | 75% | 0.749 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -62.2 | -40.4 | 175.2 | -179.7 | -98.9 | 0 | 0 | 0 | 111.9 | G59 I60 V61 | G59-Y63 WeakPolarHBondContact O-CB 3.3Å; G59-Y63 PolarHBondContact O-N 3.02Å; I60-Y63 WeakPolarHBondContact O-CB 3.15Å; I60-Y63 PolarHBondContact O-N 2.86Å; V61-Y63 VanDerWaalsContact C-N 3.29Å; V61-Y63 PolarHBondContact O-N 2.86Å |
| 64 | F | 84.5 | Confident | 86.2 | Confident | 155 Ų | 155 | 72 Ų | 72 | 68% | 0.68 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -78 | -33.4 | 179.4 | -67.7 | -73.7 | 0 | 0 | 0 | 113.4 | I60 V61 G62 | I60-F64 HydrophobicContact CG2-CD2 4.48Å; I60-F64 HydrophobicContact CG2-CE2 4.04Å; I60-F64 WeakPolarHBondContact O-CD2 3.44Å; V61-F64 PolarHBondContact O-N 3.45Å; G62-F64 VanDerWaalsContact C-N 3.32Å; G62-F64 PolarHBondContact O-N 2.86Å |
| 65 | Q | 84.2 | Confident | 86.2 | Confident | 82 Ų | 82 | 70.6 Ų | 70.6 | 38% | 0.383 | 37% | 0.367 | S | S | . | . | trans | -140.4 | 71.3 | -177.6 | -65.7 | -161.5 | -15.7 | 0 | 0 | 112.6 | V61 G62 F67 N68 L69 V124 | V61-Q65 PolarHBondContact O-N 3.2Å; V61-Q65 VanDerWaalsContact O-N 3.08Å; G62-Q65 CarbonylContact O-C 3.51Å; G62-Q65 PolarHBondContact O-N 2.91Å; Q65-F67 PolarHBondContact O-N 3.37Å; Q65-N68 HydrophobicContact CB-CB 4.18Å; Q65-N68 PolarHBondContact O-N 2.93Å; Q65-N68 PolarHBondContact OE1-ND2 2.62Å; Q65-L69 PolarHBondContact O-N 2.89Å; Q65-V124 HydrophobicContact CB-CG2 3.77Å | ||
| 66 | P | 85.1 | Confident | 86.1 | Confident | 73 Ų | 73 | 68.1 Ų | 68.1 | 47% | 0.474 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -66 | -40.8 | -171.7 | 23.5 | -33.4 | 0 | 0 | 0 | 113 | G62 L69 F70 | G62-P66 WeakPolarHBondContact O-CA 3.45Å; G62-P66 WeakPolarHBondContact O-CB 3.27Å; G62-P66 WeakPolarHBondContact O-CD 3.46Å; P66-L69 WeakPolarHBondContact O-CB 3.41Å; P66-L69 PolarHBondContact O-N 3.34Å; P66-F70 WeakPolarHBondContact O-CD2 3.24Å; P66-F70 PolarHBondContact O-N 3.44Å |
| 67 | F | 84.5 | Confident | 86.1 | Confident | 162 Ų | 162 | 67.7 Ų | 67.7 | 71% | 0.711 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -63.6 | -46 | 179.7 | -175.1 | -98.9 | 0 | 0 | 0 | 112.1 | Q65 L69 F70 L71 | Q65-F67 PolarHBondContact O-N 3.37Å; F67-L69 VanDerWaalsContact C-N 3.26Å; F67-L69 PolarHBondContact O-N 3.47Å; F67-F70 PolarHBondContact O-N 3.34Å; F67-L71 PolarHBondContact O-N 3.44Å |
| 68 | N | 82.9 | Confident | 86.2 | Confident | 42 Ų | 42 | 71.1 Ų | 71.1 | 23% | 0.225 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -66.3 | -30 | 176.9 | -67.9 | -19.2 | 0 | 0 | 0 | 111.8 | Q65 G72 V124 | Q65-N68 HydrophobicContact CB-CB 4.18Å; Q65-N68 PolarHBondContact O-N 2.93Å; Q65-N68 PolarHBondContact OE1-ND2 2.62Å; N68-G72 PolarHBondContact O-N 3.04Å; N68-V124 HydrophobicContact CB-CB 4.14Å; N68-V124 HydrophobicContact CB-CG2 3.43Å; N68-V124 VanDerWaalsContact CB-CG2 3.43Å |
| 69 | L | 85.8 | Confident | 86.3 | Confident | 31 Ų | 31 | 70.9 Ų | 70.9 | 16% | 0.162 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -66 | -47.7 | 172 | 177.2 | 65.2 | 0 | 0 | 0 | 111.7 | L58 Q65 P66 F67 L71 G72 A73 V124 | L58-L69 HydrophobicContact CD1-CD1 3.55Å; L58-L69 HydrophobicContact CG-CD1 4Å; Q65-L69 PolarHBondContact O-N 2.89Å; P66-L69 WeakPolarHBondContact O-CB 3.41Å; P66-L69 PolarHBondContact O-N 3.34Å; F67-L69 VanDerWaalsContact C-N 3.26Å; F67-L69 PolarHBondContact O-N 3.47Å; L69-L71 VanDerWaalsContact C-N 3.31Å; L69-L71 PolarHBondContact O-N 3.04Å; L69-G72 PolarHBondContact O-N 3.25Å; L69-A73 VanDerWaalsContact O-CB 3.24Å; L69-A73 WeakPolarHBondContact O-CB 3.45Å; L69-A73 PolarHBondContact O-N 3.24Å; L69-V124 HydrophobicContact CB-CG1 3.98Å; L69-V124 HydrophobicContact CD1-CG1 3.99Å |
| 70 | F | 86.6 | Confident | 86.4 | Confident | 153 Ų | 153 | 74 Ų | 74 | 67% | 0.671 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -60.3 | -43 | 176.3 | -81.6 | -69.9 | 0 | 0 | 0 | 111.9 | P66 F67 T74 | P66-F70 WeakPolarHBondContact O-CD2 3.24Å; P66-F70 PolarHBondContact O-N 3.44Å; F67-F70 PolarHBondContact O-N 3.34Å; F70-T74 WeakPolarHBondContact O-CB 3.39Å; F70-T74 PolarHBondContact O-N 3.44Å; F70-T74 PolarHBondContact O-OG1 2.74Å |
| 71 | L | 85.7 | Confident | 86.5 | Confident | 51 Ų | 51 | 75 Ų | 75 | 27% | 0.267 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.4 | -48.9 | 176.4 | -173.6 | 63.7 | 0 | 0 | 0 | 111.3 | F67 L69 T74 V75 L119 | F67-L71 PolarHBondContact O-N 3.44Å; L69-L71 VanDerWaalsContact C-N 3.31Å; L69-L71 PolarHBondContact O-N 3.04Å; L71-T74 PolarHBondContact O-N 2.92Å; L71-V75 WeakPolarHBondContact O-CG2 3.34Å; L71-V75 PolarHBondContact O-N 2.95Å; L71-L119 HydrophobicContact CD1-CD1 4.4Å; L71-L119 HydrophobicContact CD2-CB 4.08Å |
| 72 | G | 85.6 | Confident | 86.7 | Confident | 1 Ų | 1 | 75.6 Ų | 75.6 | 1% | 0.01 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -58.8 | -48 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | N68 L69 T74 V75 V76 | N68-G72 PolarHBondContact O-N 3.04Å; L69-G72 PolarHBondContact O-N 3.25Å; G72-T74 VanDerWaalsContact C-N 3.33Å; G72-T74 PolarHBondContact O-N 2.83Å; G72-V75 PolarHBondContact O-N 2.8Å; G72-V76 WeakPolarHBondContact O-CB 3.39Å; G72-V76 VanDerWaalsContact O-CG2 3.32Å; G72-V76 WeakPolarHBondContact O-CG2 3.3Å; G72-V76 PolarHBondContact O-N 2.87Å |
| 73 | A | 85.6 | Confident | 86.8 | Confident | 40 Ų | 40 | 76.9 Ų | 76.9 | 33% | 0.331 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.7 | -41.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L69 T77 | L69-A73 VanDerWaalsContact O-CB 3.24Å; L69-A73 WeakPolarHBondContact O-CB 3.45Å; L69-A73 PolarHBondContact O-N 3.24Å; A73-T77 VanDerWaalsContact O-CB 3.24Å; A73-T77 WeakPolarHBondContact O-CB 3.43Å; A73-T77 PolarHBondContact O-N 2.87Å; A73-T77 PolarHBondContact O-OG1 2.99Å |
| 74 | T | 87.5 | Confident | 86.8 | Confident | 77 Ų | 77 | 69.6 Ų | 69.6 | 47% | 0.472 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.4 | -49.9 | 176.8 | -57.9 | 0 | 0 | 0 | 0 | 110.9 | F70 L71 G72 V76 T77 L78 | F70-T74 WeakPolarHBondContact O-CB 3.39Å; F70-T74 PolarHBondContact O-N 3.44Å; F70-T74 PolarHBondContact O-OG1 2.74Å; L71-T74 PolarHBondContact O-N 2.92Å; G72-T74 VanDerWaalsContact C-N 3.33Å; G72-T74 PolarHBondContact O-N 2.83Å; T74-V76 PolarHBondContact O-N 3.13Å; T74-T77 PolarHBondContact O-N 2.84Å; T74-L78 HydrophobicContact CG2-CD1 4Å; T74-L78 HydrophobicContact CG2-CG 4.45Å; T74-L78 VanDerWaalsContact O-CG 3.32Å; T74-L78 WeakPolarHBondContact O-CG 3.36Å; T74-L78 PolarHBondContact O-N 3.31Å |
| 75 | V | 88.1 | Confident | 87.1 | Confident | 15 Ų | 15 | 70.1 Ų | 70.1 | 9% | 0.091 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.3 | -48.9 | 179.8 | 169.7 | 0 | 0 | 0 | 0 | 111.5 | L71 G72 T77 L78 I79 F115 L116 L119 | L71-V75 WeakPolarHBondContact O-CG2 3.34Å; L71-V75 PolarHBondContact O-N 2.95Å; G72-V75 PolarHBondContact O-N 2.8Å; V75-T77 VanDerWaalsContact C-N 3.32Å; V75-T77 PolarHBondContact O-N 2.94Å; V75-L78 PolarHBondContact O-N 3.28Å; V75-I79 HydrophobicContact CG1-CD1 3.7Å; V75-I79 WeakPolarHBondContact O-CG1 3.49Å; V75-I79 PolarHBondContact O-N 3.47Å; V75-F115 HydrophobicContact CG1-CB 3.74Å; V75-F115 HydrophobicContact CG1-CG 4.49Å; V75-L116 HydrophobicContact CB-CD2 4.09Å; V75-L116 HydrophobicContact CB-CG 4.36Å; V75-L116 HydrophobicContact CG1-CD1 4.39Å; V75-L116 HydrophobicContact CG1-CD2 4.28Å; V75-L116 HydrophobicContact CG1-CG 4.05Å; V75-L116 HydrophobicContact CG2-CD2 3.97Å; V75-L119 HydrophobicContact CG2-CD1 3.6Å |
| 76 | V | 86.3 | Confident | 87.3 | Confident | 28 Ų | 28 | 67.2 Ų | 67.2 | 17% | 0.17 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62 | -41.8 | 179.4 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | G72 T74 I79 F80 F125 I129 | G72-V76 WeakPolarHBondContact O-CB 3.39Å; G72-V76 VanDerWaalsContact O-CG2 3.32Å; G72-V76 WeakPolarHBondContact O-CG2 3.3Å; G72-V76 PolarHBondContact O-N 2.87Å; T74-V76 PolarHBondContact O-N 3.13Å; V76-I79 PolarHBondContact O-N 3.4Å; V76-F80 VanDerWaalsContact O-CB 3.26Å; V76-F80 WeakPolarHBondContact O-CB 3.4Å; V76-F80 PolarHBondContact O-N 2.88Å; V76-F125 HydrophobicContact CG2-CD2 3.92Å; V76-F125 HydrophobicContact CG2-CE2 3.75Å; V76-I129 HydrophobicContact CB-CD1 4.41Å; V76-I129 HydrophobicContact CG2-CD1 3.75Å |
| 77 | T | 87.6 | Confident | 87.3 | Confident | 68 Ų | 68 | 63.7 Ų | 63.7 | 42% | 0.417 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.6 | -45.3 | 178.4 | -58.8 | 0 | 0 | 0 | 0 | 111.4 | A73 T74 V75 F80 M81 | A73-T77 VanDerWaalsContact O-CB 3.24Å; A73-T77 WeakPolarHBondContact O-CB 3.43Å; A73-T77 PolarHBondContact O-N 2.87Å; A73-T77 PolarHBondContact O-OG1 2.99Å; T74-T77 PolarHBondContact O-N 2.84Å; V75-T77 VanDerWaalsContact C-N 3.32Å; V75-T77 PolarHBondContact O-N 2.94Å; T77-F80 PolarHBondContact O-N 3Å; T77-M81 HydrophobicContact CG2-CE 3.64Å; T77-M81 HydrophobicContact CG2-CG 4.4Å; T77-M81 HydrophobicContact CG2-SD 4.05Å; T77-M81 WeakPolarHBondContact O-CB 3.4Å; T77-M81 VanDerWaalsContact O-CG 3.31Å; T77-M81 WeakPolarHBondContact O-CG 3.27Å; T77-M81 PolarHBondContact O-N 2.85Å |
| 78 | L | 89.9 | Confident | 87.5 | Confident | 113 Ų | 113 | 62.2 Ų | 62.2 | 59% | 0.592 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -64 | -43.5 | 178.5 | -71.7 | 174.8 | 0 | 0 | 0 | 112.1 | T74 V75 M81 G82 | T74-L78 HydrophobicContact CG2-CD1 4Å; T74-L78 HydrophobicContact CG2-CG 4.45Å; T74-L78 VanDerWaalsContact O-CG 3.32Å; T74-L78 WeakPolarHBondContact O-CG 3.36Å; T74-L78 PolarHBondContact O-N 3.31Å; V75-L78 PolarHBondContact O-N 3.28Å; L78-M81 PolarHBondContact O-N 2.92Å; L78-G82 PolarHBondContact O-N 3.43Å |
| 79 | I | 90.1 | Very high | 87.6 | Confident | 32 Ų | 32 | 64.7 Ų | 64.7 | 16% | 0.164 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.3 | -43.3 | 177 | -69.6 | 170.5 | 0 | 0 | 0 | 110.4 | V75 V76 G82 F83 I108 A111 S112 F115 | V75-I79 HydrophobicContact CG1-CD1 3.7Å; V75-I79 WeakPolarHBondContact O-CG1 3.49Å; V75-I79 PolarHBondContact O-N 3.47Å; V76-I79 PolarHBondContact O-N 3.4Å; I79-G82 PolarHBondContact O-N 3.25Å; I79-F83 WeakPolarHBondContact O-CB 3.36Å; I79-F83 PolarHBondContact O-N 3.4Å; I79-I108 HydrophobicContact CG2-CG2 4.19Å; I79-A111 HydrophobicContact CD1-CB 4.38Å; I79-A111 HydrophobicContact CG2-CB 4.05Å; I79-S112 VanDerWaalsContact CD1-CA 3.46Å; I79-F115 HydrophobicContact CD1-CB 4.34Å; I79-F115 HydrophobicContact CD1-CD2 3.94Å; I79-F115 HydrophobicContact CD1-CG 4.28Å |
| 80 | F | 88.1 | Confident | 87.7 | Confident | 108 Ų | 108 | 68.1 Ų | 68.1 | 47% | 0.474 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.4 | -48.4 | 177.1 | -179.5 | -102.6 | 0 | 0 | 0 | 111.7 | V76 T77 G82 F83 V84 I108 | V76-F80 VanDerWaalsContact O-CB 3.26Å; V76-F80 WeakPolarHBondContact O-CB 3.4Å; V76-F80 PolarHBondContact O-N 2.88Å; T77-F80 PolarHBondContact O-N 3Å; F80-G82 PolarHBondContact O-N 2.95Å; F80-F83 PolarHBondContact O-N 2.95Å; F80-V84 HydrophobicContact CD1-CG2 4.23Å; F80-V84 HydrophobicContact CD2-CG2 4.5Å; F80-V84 HydrophobicContact CE1-CG2 3.8Å; F80-V84 HydrophobicContact CE2-CG2 4.1Å; F80-V84 HydrophobicContact CZ-CG2 3.73Å; F80-V84 WeakPolarHBondContact O-CG2 3.35Å; F80-V84 PolarHBondContact O-N 3.1Å; F80-I108 HydrophobicContact CD2-CD1 4.1Å |
| 81 | M | 89.6 | Confident | 87.7 | Confident | 118 Ų | 118 | 63 Ų | 63 | 58% | 0.581 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -60.2 | -45 | 176.5 | -74.8 | -180 | 177.2 | 0 | 0 | 111.5 | T77 L78 F83 V84 W85 | T77-M81 HydrophobicContact CG2-CE 3.64Å; T77-M81 HydrophobicContact CG2-CG 4.4Å; T77-M81 HydrophobicContact CG2-SD 4.05Å; T77-M81 WeakPolarHBondContact O-CB 3.4Å; T77-M81 VanDerWaalsContact O-CG 3.31Å; T77-M81 WeakPolarHBondContact O-CG 3.27Å; T77-M81 PolarHBondContact O-N 2.85Å; L78-M81 PolarHBondContact O-N 2.92Å; M81-F83 VanDerWaalsContact C-N 3.33Å; M81-F83 PolarHBondContact O-N 2.79Å; M81-V84 PolarHBondContact O-N 3.42Å; M81-W85 VanDerWaalsContact O-CB 3.31Å; M81-W85 WeakPolarHBondContact O-CB 3.27Å; M81-W85 PolarHBondContact O-N 3.1Å |
| 82 | G | 89.4 | Confident | 87.7 | Confident | 39 Ų | 39 | 64.6 Ų | 64.6 | 40% | 0.402 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.6 | -41.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | L78 I79 F80 A86 | L78-G82 PolarHBondContact O-N 3.43Å; I79-G82 PolarHBondContact O-N 3.25Å; F80-G82 PolarHBondContact O-N 2.95Å; G82-A86 WeakPolarHBondContact O-CB 3.2Å; G82-A86 PolarHBondContact O-N 3.33Å |
| 83 | F | 87.9 | Confident | 87.5 | Confident | 36 Ų | 36 | 67 Ų | 67 | 16% | 0.158 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.7 | -43 | 175.2 | -178.6 | -93.7 | 0 | 0 | 0 | 112.3 | I79 F80 M81 A86 A87 I93 R97 A104 I108 | I79-F83 WeakPolarHBondContact O-CB 3.36Å; I79-F83 PolarHBondContact O-N 3.4Å; F80-F83 PolarHBondContact O-N 2.95Å; M81-F83 VanDerWaalsContact C-N 3.33Å; M81-F83 PolarHBondContact O-N 2.79Å; F83-A86 PolarHBondContact O-N 3.26Å; F83-A87 VanDerWaalsContact O-CB 3.27Å; F83-A87 WeakPolarHBondContact O-CB 3.34Å; F83-A87 PolarHBondContact O-N 2.89Å; F83-I93 HydrophobicContact CE2-CG2 4.09Å; F83-I93 HydrophobicContact CZ-CG2 4.32Å; F83-R97 HydrophobicContact CE1-CB 4.3Å; F83-R97 HydrophobicContact CE1-CG 4.13Å; F83-R97 HydrophobicContact CZ-CB 4.24Å; F83-A104 HydrophobicContact CE1-CB 4.24Å; F83-A104 HydrophobicContact CZ-CB 3.74Å; F83-I108 HydrophobicContact CB-CD1 4.44Å; F83-I108 HydrophobicContact CB-CG1 4.19Å; F83-I108 HydrophobicContact CD1-CD1 3.72Å; F83-I108 HydrophobicContact CD1-CG1 4.2Å; F83-I108 HydrophobicContact CD2-CG1 4.28Å; F83-I108 HydrophobicContact CE1-CD1 4.1Å; F83-I108 HydrophobicContact CG-CD1 4.02Å; F83-I108 HydrophobicContact CG-CG1 3.96Å |
| 84 | V | 87.9 | Confident | 87.5 | Confident | 38 Ų | 38 | 71.4 Ų | 71.4 | 23% | 0.23 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.5 | -47.7 | 177.7 | 169.9 | 0 | 0 | 0 | 0 | 110.6 | F80 M81 A86 A87 E88 | F80-V84 HydrophobicContact CD1-CG2 4.23Å; F80-V84 HydrophobicContact CD2-CG2 4.5Å; F80-V84 HydrophobicContact CE1-CG2 3.8Å; F80-V84 HydrophobicContact CE2-CG2 4.1Å; F80-V84 HydrophobicContact CZ-CG2 3.73Å; F80-V84 WeakPolarHBondContact O-CG2 3.35Å; F80-V84 PolarHBondContact O-N 3.1Å; M81-V84 PolarHBondContact O-N 3.42Å; V84-A86 VanDerWaalsContact C-N 3.35Å; V84-A86 PolarHBondContact O-N 2.89Å; V84-A87 CarbonylContact O-C 3.46Å; V84-A87 WeakPolarHBondContact O-CB 3.48Å; V84-A87 PolarHBondContact O-N 3.2Å; V84-A87 VanDerWaalsContact O-N 3.13Å; V84-E88 PolarHBondContact O-N 2.76Å |
| 85 | W | 91.4 | Very high | 87.4 | Confident | 166 Ų | 166 | 75.9 Ų | 75.9 | 63% | 0.629 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -57.5 | -48.2 | 175 | 178.6 | 82.7 | 0 | 0 | 0 | 111.1 | M81 A87 E88 N89 | M81-W85 VanDerWaalsContact O-CB 3.31Å; M81-W85 WeakPolarHBondContact O-CB 3.27Å; M81-W85 PolarHBondContact O-N 3.1Å; W85-A87 VanDerWaalsContact C-N 3.28Å; W85-A87 PolarHBondContact O-N 3.39Å; W85-E88 PolarHBondContact O-N 3.41Å; W85-E88 VanDerWaalsContact O-N 3.1Å; W85-N89 PolarHBondContact O-N 3.45Å; W85-N89 PolarHBondContact O-OD1 3.33Å |
| 86 | A | 87.1 | Confident | 87.1 | Confident | 20 Ų | 20 | 78.9 Ų | 78.9 | 17% | 0.165 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61.4 | -37.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | G82 F83 V84 E88 Q90 I93 | G82-A86 WeakPolarHBondContact O-CB 3.2Å; G82-A86 PolarHBondContact O-N 3.33Å; F83-A86 PolarHBondContact O-N 3.26Å; V84-A86 VanDerWaalsContact C-N 3.35Å; V84-A86 PolarHBondContact O-N 2.89Å; A86-E88 VanDerWaalsContact C-N 3.34Å; A86-Q90 WeakPolarHBondContact O-CA 3.19Å; A86-Q90 WeakPolarHBondContact O-CB 3.45Å; A86-Q90 PolarHBondContact O-N 2.63Å; A86-I93 HydrophobicContact CB-CD1 3.6Å; A86-I93 HydrophobicContact CB-CG2 4.47Å |
| 87 | A | 86.9 | Confident | 86.9 | Confident | 0 Ų | 0 | 81.6 Ų | 81.6 | 0% | 0 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -71.6 | -24.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | F83 V84 W85 I93 R94 R97 | F83-A87 VanDerWaalsContact O-CB 3.27Å; F83-A87 WeakPolarHBondContact O-CB 3.34Å; F83-A87 PolarHBondContact O-N 2.89Å; V84-A87 CarbonylContact O-C 3.46Å; V84-A87 WeakPolarHBondContact O-CB 3.48Å; V84-A87 PolarHBondContact O-N 3.2Å; V84-A87 VanDerWaalsContact O-N 3.13Å; W85-A87 VanDerWaalsContact C-N 3.28Å; W85-A87 PolarHBondContact O-N 3.39Å; A87-I93 HydrophobicContact CB-CB 4.49Å; A87-I93 HydrophobicContact CB-CG2 3.74Å; A87-R94 WeakPolarHBondContact O-CB 3.2Å; A87-R94 WeakPolarHBondContact O-CG 3.49Å; A87-R97 VanDerWaalsContact CB-NH1 3.31Å |
| 88 | E | 87.2 | Confident | 86.6 | Confident | 131 Ų | 131 | 88.6 Ų | 88.6 | 61% | 0.612 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -79.3 | -43.7 | 173.1 | -75.4 | -178.9 | -177.4 | 0 | 0 | 111.2 | V84 W85 A86 | V84-E88 PolarHBondContact O-N 2.76Å; W85-E88 PolarHBondContact O-N 3.41Å; W85-E88 VanDerWaalsContact O-N 3.1Å; A86-E88 VanDerWaalsContact C-N 3.34Å |
| 89 | N | 86.5 | Confident | 86.2 | Confident | 93 Ų | 93 | 88.4 Ų | 88.4 | 50% | 0.497 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -81.4 | -26.6 | -175.7 | -71.6 | 68.5 | 0 | 0 | 0 | 113.7 | W85 | W85-N89 PolarHBondContact O-N 3.45Å; W85-N89 PolarHBondContact O-OD1 3.33Å |
| 90 | Q | 87.9 | Confident | 85.7 | Confident | 103 Ų | 103 | 91.3 Ų | 91.3 | 48% | 0.481 | 43% | 0.431 | S | S | . | . | trans | -116.3 | 114.8 | -176.1 | -58.4 | -67.3 | -23.2 | 0 | 0 | 111.5 | A86 P92 I93 R94 | A86-Q90 WeakPolarHBondContact O-CA 3.19Å; A86-Q90 WeakPolarHBondContact O-CB 3.45Å; A86-Q90 PolarHBondContact O-N 2.63Å; Q90-P92 VanDerWaalsContact C-CD 3.42Å; Q90-P92 HydrophobicContact CB-CG 4.3Å; Q90-I93 HydrophobicContact CB-CB 4.21Å; Q90-I93 HydrophobicContact CB-CD1 3.87Å; Q90-I93 HydrophobicContact CB-CG1 3.95Å; Q90-I93 HydrophobicContact CG-CD1 4.14Å; Q90-I93 PolarHBondContact O-N 2.9Å; Q90-I93 VanDerWaalsContact O-N 3.16Å; Q90-R94 PolarHBondContact O-N 3.49Å | ||
| 91 | A | 85.6 | Confident | 85.3 | Confident | 46 Ų | 46 | 89.8 Ų | 89.8 | 38% | 0.38 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -51 | -41.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | R94 R95 | A91-R94 PolarHBondContact O-N 2.9Å; A91-R95 WeakPolarHBondContact O-CG 3.45Å; A91-R95 PolarHBondContact O-N 2.92Å |
| 92 | P | 84.9 | Confident | 84.6 | Confident | 85 Ų | 85 | 88.4 Ų | 88.4 | 55% | 0.552 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -65.2 | -39.9 | 178 | 23.4 | -33.6 | 0 | 0 | 0 | 112.7 | Q90 R95 F96 | Q90-P92 VanDerWaalsContact C-CD 3.42Å; Q90-P92 HydrophobicContact CB-CG 4.3Å; P92-R95 PolarHBondContact O-N 3.29Å; P92-F96 WeakPolarHBondContact O-CB 3.47Å; P92-F96 PolarHBondContact O-N 3.05Å |
| 93 | I | 81.3 | Confident | 84.3 | Confident | 51 Ų | 51 | 91.2 Ų | 91.2 | 26% | 0.262 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -69.6 | -39 | 179.5 | -57 | 179 | 0 | 0 | 0 | 110 | F83 A86 A87 Q90 R95 F96 R97 | F83-I93 HydrophobicContact CE2-CG2 4.09Å; F83-I93 HydrophobicContact CZ-CG2 4.32Å; A86-I93 HydrophobicContact CB-CD1 3.6Å; A86-I93 HydrophobicContact CB-CG2 4.47Å; A87-I93 HydrophobicContact CB-CB 4.49Å; A87-I93 HydrophobicContact CB-CG2 3.74Å; Q90-I93 HydrophobicContact CB-CB 4.21Å; Q90-I93 HydrophobicContact CB-CD1 3.87Å; Q90-I93 HydrophobicContact CB-CG1 3.95Å; Q90-I93 HydrophobicContact CG-CD1 4.14Å; Q90-I93 PolarHBondContact O-N 2.9Å; Q90-I93 VanDerWaalsContact O-N 3.16Å; I93-R95 VanDerWaalsContact C-N 3.34Å; I93-R95 PolarHBondContact O-N 2.84Å; I93-F96 PolarHBondContact O-N 3.38Å; I93-R97 WeakPolarHBondContact O-CB 3.5Å; I93-R97 PolarHBondContact O-N 3.32Å |
| 94 | R | 85.6 | Confident | 84.1 | Confident | 133 Ų | 133 | 89.7 Ų | 89.7 | 50% | 0.502 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -57.4 | -46.2 | 172.2 | -157.1 | 173.3 | 75.5 | -139.2 | 8.1 | 112.4 | A87 Q90 A91 R98 | A87-R94 WeakPolarHBondContact O-CB 3.2Å; A87-R94 WeakPolarHBondContact O-CG 3.49Å; Q90-R94 PolarHBondContact O-N 3.49Å; A91-R94 PolarHBondContact O-N 2.9Å; R94-R98 PolarHBondContact O-N 3.47Å |
| 95 | R | 86.4 | Confident | 83.9 | Confident | 171 Ų | 171 | 93 Ų | 93 | 65% | 0.645 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -66.6 | -43.6 | 178.7 | -73 | 179.5 | -172.9 | -156.9 | 3.1 | 111.2 | A91 P92 I93 R97 R98 N99 | A91-R95 WeakPolarHBondContact O-CG 3.45Å; A91-R95 PolarHBondContact O-N 2.92Å; P92-R95 PolarHBondContact O-N 3.29Å; I93-R95 VanDerWaalsContact C-N 3.34Å; I93-R95 PolarHBondContact O-N 2.84Å; R95-R97 PolarHBondContact O-N 3.37Å; R95-R98 PolarHBondContact O-N 2.81Å; R95-N99 WeakPolarHBondContact O-CB 3.22Å; R95-N99 VanDerWaalsContact O-CG 3.28Å; R95-N99 PolarHBondContact O-N 3.05Å |
| 96 | F | 82.7 | Confident | 83.6 | Confident | 78 Ų | 78 | 87 Ų | 87 | 34% | 0.342 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -57.7 | -49.8 | 176.4 | 176.4 | -105.5 | 0 | 0 | 0 | 111.9 | P92 I93 R98 N99 H100 L103 A104 | P92-F96 WeakPolarHBondContact O-CB 3.47Å; P92-F96 PolarHBondContact O-N 3.05Å; I93-F96 PolarHBondContact O-N 3.38Å; F96-R98 VanDerWaalsContact C-N 3.25Å; F96-R98 PolarHBondContact O-N 3.48Å; F96-N99 PolarHBondContact O-N 3.08Å; F96-H100 HydrophobicContact CE2-CB 4.49Å; F96-H100 PolarHBondContact O-N 2.96Å; F96-L103 HydrophobicContact CE2-CB 4.13Å; F96-L103 HydrophobicContact CE2-CD1 4.46Å; F96-L103 HydrophobicContact CZ-CB 3.73Å; F96-A104 HydrophobicContact CD1-CB 4.33Å; F96-A104 HydrophobicContact CE1-CB 4.02Å |
| 97 | R | 81.4 | Confident | 83.5 | Confident | 84 Ų | 84 | 88.4 Ų | 88.4 | 32% | 0.317 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -56.5 | -38.4 | 176.2 | -177.7 | 178.7 | 67.3 | -172.2 | -1.3 | 112.7 | F83 A87 I93 R95 P101 | F83-R97 HydrophobicContact CE1-CB 4.3Å; F83-R97 HydrophobicContact CE1-CG 4.13Å; F83-R97 HydrophobicContact CZ-CB 4.24Å; A87-R97 VanDerWaalsContact CB-NH1 3.31Å; I93-R97 WeakPolarHBondContact O-CB 3.5Å; I93-R97 PolarHBondContact O-N 3.32Å; R95-R97 PolarHBondContact O-N 3.37Å; R97-P101 WeakPolarHBondContact O-CA 3.27Å |
| 98 | R | 80.9 | Confident | 83.5 | Confident | 216 Ų | 216 | 89.2 Ų | 89.2 | 82% | 0.815 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -78.9 | -39.5 | -177.2 | -168.3 | 174.6 | -179.8 | 160.6 | -0.5 | 112.8 | R94 R95 F96 | R94-R98 PolarHBondContact O-N 3.47Å; R95-R98 PolarHBondContact O-N 2.81Å; F96-R98 VanDerWaalsContact C-N 3.25Å; F96-R98 PolarHBondContact O-N 3.48Å |
| 99 | N | 82.1 | Confident | 83.5 | Confident | 109 Ų | 109 | 85.1 Ų | 85.1 | 58% | 0.583 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -80.9 | -32.7 | -176.8 | -67.2 | -1.4 | 0 | 0 | 0 | 112 | R95 F96 | R95-N99 WeakPolarHBondContact O-CB 3.22Å; R95-N99 VanDerWaalsContact O-CG 3.28Å; R95-N99 PolarHBondContact O-N 3.05Å; F96-N99 PolarHBondContact O-N 3.08Å |
| 100 | H | 79.4 | Confident | 83.5 | Confident | 92 Ų | 92 | 82.3 Ų | 82.3 | 43% | 0.426 | 43% | 0.43 | S | S | . | . | trans | -136.2 | 67.5 | -175.7 | -54.6 | -68.5 | 0 | 0 | 0 | 111.5 | F96 S102 L103 A104 | F96-H100 HydrophobicContact CE2-CB 4.49Å; F96-H100 PolarHBondContact O-N 2.96Å; H100-S102 PolarHBondContact O-N 3.33Å; H100-L103 HydrophobicContact CB-CB 3.86Å; H100-L103 HydrophobicContact CB-CD1 3.79Å; H100-L103 HydrophobicContact CB-CG 3.98Å; H100-L103 PolarHBondContact O-N 2.89Å; H100-L103 VanDerWaalsContact O-N 3.1Å; H100-A104 PolarHBondContact O-N 3.24Å | ||
| 101 | P | 78.4 | Confident | 83.5 | Confident | 76 Ų | 76 | 79 Ų | 79 | 49% | 0.494 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -60.3 | -32.5 | -177.6 | 24 | -34.3 | 0 | 0 | 0 | 113.1 | R97 A104 L105 | R97-P101 WeakPolarHBondContact O-CA 3.27Å; P101-A104 PolarHBondContact O-N 3.47Å; P101-L105 PolarHBondContact O-N 3Å |
| 102 | S | 76.2 | Confident | 83.5 | Confident | 89 Ų | 89 | 76.8 Ų | 76.8 | 62% | 0.622 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -67.6 | -41.4 | 174.7 | 51.6 | 0 | 0 | 0 | 0 | 112.7 | H100 A104 L105 G106 | H100-S102 PolarHBondContact O-N 3.33Å; S102-A104 VanDerWaalsContact C-N 3.35Å; S102-L105 PolarHBondContact O-N 3.09Å; S102-G106 PolarHBondContact O-N 2.83Å |
| 103 | L | 82.5 | Confident | 83.7 | Confident | 99 Ų | 99 | 77.5 Ų | 77.5 | 52% | 0.518 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -69.1 | -35.1 | 175.3 | -64.1 | -179 | 0 | 0 | 0 | 111.5 | F96 H100 G106 A107 | F96-L103 HydrophobicContact CE2-CB 4.13Å; F96-L103 HydrophobicContact CE2-CD1 4.46Å; F96-L103 HydrophobicContact CZ-CB 3.73Å; H100-L103 HydrophobicContact CB-CB 3.86Å; H100-L103 HydrophobicContact CB-CD1 3.79Å; H100-L103 HydrophobicContact CB-CG 3.98Å; H100-L103 PolarHBondContact O-N 2.89Å; H100-L103 VanDerWaalsContact O-N 3.1Å; L103-G106 PolarHBondContact O-N 2.94Å; L103-A107 WeakPolarHBondContact O-CB 3.18Å; L103-A107 PolarHBondContact O-N 3.33Å |
| 104 | A | 83.5 | Confident | 83.9 | Confident | 4 Ų | 4 | 80.4 Ų | 80.4 | 3% | 0.033 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | F83 F96 H100 P101 S102 A107 I108 | F83-A104 HydrophobicContact CE1-CB 4.24Å; F83-A104 HydrophobicContact CZ-CB 3.74Å; F96-A104 HydrophobicContact CD1-CB 4.33Å; F96-A104 HydrophobicContact CE1-CB 4.02Å; H100-A104 PolarHBondContact O-N 3.24Å; P101-A104 PolarHBondContact O-N 3.47Å; S102-A104 VanDerWaalsContact C-N 3.35Å; A104-A107 PolarHBondContact O-N 3.38Å; A104-I108 WeakPolarHBondContact O-CG1 3.44Å; A104-I108 PolarHBondContact O-N 3.44Å; A104-I108 VanDerWaalsContact O-N 3.09Å |
| 105 | L | 83.4 | Confident | 83.9 | Confident | 107 Ų | 107 | 80 Ų | 80 | 56% | 0.56 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.3 | -45.3 | 171.9 | -82.5 | 165.3 | 0 | 0 | 0 | 111.8 | P101 S102 A107 I108 L109 | P101-L105 PolarHBondContact O-N 3Å; S102-L105 PolarHBondContact O-N 3.09Å; L105-A107 VanDerWaalsContact C-N 3.3Å; L105-A107 PolarHBondContact O-N 3.3Å; L105-I108 PolarHBondContact O-N 2.87Å; L105-L109 WeakPolarHBondContact O-CG 3.49Å; L105-L109 PolarHBondContact O-N 3.43Å |
| 106 | G | 84.7 | Confident | 83.8 | Confident | 41 Ų | 41 | 71.9 Ų | 71.9 | 42% | 0.423 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -58.3 | -40.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S102 L103 L109 G110 | S102-G106 PolarHBondContact O-N 2.83Å; L103-G106 PolarHBondContact O-N 2.94Å; G106-L109 PolarHBondContact O-N 2.99Å; G106-G110 PolarHBondContact O-N 3.16Å |
| 107 | A | 86.6 | Confident | 83.8 | Confident | 49 Ų | 49 | 71.1 Ų | 71.1 | 41% | 0.405 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.5 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L103 A104 L105 G110 A111 | L103-A107 WeakPolarHBondContact O-CB 3.18Å; L103-A107 PolarHBondContact O-N 3.33Å; A104-A107 PolarHBondContact O-N 3.38Å; L105-A107 VanDerWaalsContact C-N 3.3Å; L105-A107 PolarHBondContact O-N 3.3Å; A107-G110 PolarHBondContact O-N 3.23Å; A107-A111 VanDerWaalsContact O-CB 3.27Å; A107-A111 WeakPolarHBondContact O-CB 3.31Å; A107-A111 PolarHBondContact O-N 3.14Å |
| 108 | I | 87 | Confident | 84 | Confident | 16 Ų | 16 | 73 Ų | 73 | 8% | 0.082 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -63.5 | -46.4 | 176.5 | -67.4 | 158.9 | 0 | 0 | 0 | 110.6 | I79 F80 F83 A104 L105 S112 | I79-I108 HydrophobicContact CG2-CG2 4.19Å; F80-I108 HydrophobicContact CD2-CD1 4.1Å; F83-I108 HydrophobicContact CB-CD1 4.44Å; F83-I108 HydrophobicContact CB-CG1 4.19Å; F83-I108 HydrophobicContact CD1-CD1 3.72Å; F83-I108 HydrophobicContact CD1-CG1 4.2Å; F83-I108 HydrophobicContact CD2-CG1 4.28Å; F83-I108 HydrophobicContact CE1-CD1 4.1Å; F83-I108 HydrophobicContact CG-CD1 4.02Å; F83-I108 HydrophobicContact CG-CG1 3.96Å; A104-I108 WeakPolarHBondContact O-CG1 3.44Å; A104-I108 PolarHBondContact O-N 3.44Å; A104-I108 VanDerWaalsContact O-N 3.09Å; L105-I108 PolarHBondContact O-N 2.87Å; I108-S112 WeakPolarHBondContact O-CB 3.3Å; I108-S112 PolarHBondContact O-N 2.71Å; I108-S112 PolarHBondContact O-OG 3.38Å |
| 109 | L | 86.5 | Confident | 83.9 | Confident | 45 Ų | 45 | 66.7 Ų | 66.7 | 24% | 0.236 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.7 | -42.2 | 178.4 | -68.6 | 177.4 | 0 | 0 | 0 | 111.6 | L105 G106 S112 Y113 F125 I129 I133 | L105-L109 WeakPolarHBondContact O-CG 3.49Å; L105-L109 PolarHBondContact O-N 3.43Å; G106-L109 PolarHBondContact O-N 2.99Å; L109-S112 PolarHBondContact O-N 3.45Å; L109-Y113 WeakPolarHBondContact O-CB 3.45Å; L109-Y113 PolarHBondContact O-N 3.47Å; L109-F125 HydrophobicContact CB-CZ 4.27Å; L109-F125 HydrophobicContact CD2-CE2 4.3Å; L109-F125 HydrophobicContact CD2-CZ 3.86Å; L109-F125 VanDerWaalsContact O-CZ 3.3Å; L109-F125 WeakPolarHBondContact O-CZ 3.24Å; L109-I129 HydrophobicContact CD2-CG2 4.35Å; L109-I133 HydrophobicContact CD1-CD1 4.47Å; L109-I133 HydrophobicContact CD2-CD1 4.1Å |
| 110 | G | 87.4 | Confident | 83.7 | Confident | 34 Ų | 34 | 64.3 Ų | 64.3 | 35% | 0.351 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.5 | -45.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | G106 A107 S112 Y113 L114 | G106-G110 PolarHBondContact O-N 3.16Å; A107-G110 PolarHBondContact O-N 3.23Å; G110-S112 VanDerWaalsContact C-N 3.34Å; G110-S112 PolarHBondContact O-N 2.64Å; G110-Y113 WeakPolarHBondContact O-CB 3.24Å; G110-Y113 PolarHBondContact O-N 2.8Å; G110-L114 WeakPolarHBondContact O-CG 3.45Å; G110-L114 PolarHBondContact O-N 2.97Å |
| 111 | A | 87.9 | Confident | 83.8 | Confident | 34 Ų | 34 | 60 Ų | 60 | 28% | 0.281 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | I79 A107 Y113 L114 F115 | I79-A111 HydrophobicContact CD1-CB 4.38Å; I79-A111 HydrophobicContact CG2-CB 4.05Å; A107-A111 VanDerWaalsContact O-CB 3.27Å; A107-A111 WeakPolarHBondContact O-CB 3.31Å; A107-A111 PolarHBondContact O-N 3.14Å; A111-Y113 VanDerWaalsContact C-N 3.34Å; A111-Y113 PolarHBondContact O-N 2.84Å; A111-L114 PolarHBondContact O-N 3.38Å; A111-F115 WeakPolarHBondContact O-CD2 3.24Å; A111-F115 PolarHBondContact O-N 3.39Å |
| 112 | S | 85.4 | Confident | 83.9 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62 | -41.2 | 177.9 | -57.6 | 0 | 0 | 0 | 0 | 112.3 | I79 I108 L109 G110 F115 L116 | I79-S112 VanDerWaalsContact CD1-CA 3.46Å; I108-S112 WeakPolarHBondContact O-CB 3.3Å; I108-S112 PolarHBondContact O-N 2.71Å; I108-S112 PolarHBondContact O-OG 3.38Å; L109-S112 PolarHBondContact O-N 3.45Å; G110-S112 VanDerWaalsContact C-N 3.34Å; G110-S112 PolarHBondContact O-N 2.64Å; S112-F115 PolarHBondContact O-N 3.08Å; S112-L116 WeakPolarHBondContact O-CB 3.42Å; S112-L116 VanDerWaalsContact O-CG 3.31Å; S112-L116 WeakPolarHBondContact O-CG 3.4Å; S112-L116 PolarHBondContact O-N 2.83Å |
| 113 | Y | 87.4 | Confident | 84.1 | Confident | 99 Ų | 99 | 56 Ų | 56 | 39% | 0.388 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.3 | -49.3 | 174 | 178 | -97.4 | 0 | 0 | 0 | 111.4 | L109 G110 A111 F115 L116 T117 V122 F125 L126 | L109-Y113 WeakPolarHBondContact O-CB 3.45Å; L109-Y113 PolarHBondContact O-N 3.47Å; G110-Y113 WeakPolarHBondContact O-CB 3.24Å; G110-Y113 PolarHBondContact O-N 2.8Å; A111-Y113 VanDerWaalsContact C-N 3.34Å; A111-Y113 PolarHBondContact O-N 2.84Å; Y113-F115 PolarHBondContact O-N 2.83Å; Y113-L116 PolarHBondContact O-N 2.78Å; Y113-T117 HydrophobicContact CD1-CG2 4.07Å; Y113-T117 HydrophobicContact CE1-CG2 3.66Å; Y113-T117 HydrophobicContact CE2-CG2 4.24Å; Y113-T117 WeakPolarHBondContact O-CG2 3.45Å; Y113-T117 PolarHBondContact O-N 3.25Å; Y113-V122 HydrophobicContact CD2-CG1 4.14Å; Y113-V122 HydrophobicContact CE2-CG1 3.54Å; Y113-F125 HydrophobicContact CD2-CD1 4.18Å; Y113-F125 HydrophobicContact CD2-CE1 4.38Å; Y113-L126 HydrophobicContact CD2-CD2 4.2Å; Y113-L126 HydrophobicContact CE2-CD1 4.42Å; Y113-L126 HydrophobicContact CE2-CD2 4.17Å; Y113-L126 HydrophobicContact CE2-CG 4.44Å |
| 114 | L | 87.1 | Confident | 83.9 | Confident | 112 Ų | 112 | 51.3 Ų | 51.3 | 59% | 0.586 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -58.9 | -47.2 | 178.9 | -68.6 | 174.1 | 0 | 0 | 0 | 111.8 | G110 A111 L116 T117 V118 | G110-L114 WeakPolarHBondContact O-CG 3.45Å; G110-L114 PolarHBondContact O-N 2.97Å; A111-L114 PolarHBondContact O-N 3.38Å; L114-L116 VanDerWaalsContact C-N 3.33Å; L114-L116 PolarHBondContact O-N 3.25Å; L114-T117 PolarHBondContact O-N 3.22Å; L114-T117 PolarHBondContact O-OG1 3.36Å; L114-V118 PolarHBondContact O-N 3.37Å |
| 115 | F | 84.4 | Confident | 83.8 | Confident | 125 Ų | 125 | 51.4 Ų | 51.4 | 55% | 0.548 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.6 | -41.2 | 176.3 | -89.4 | -92.1 | 0 | 0 | 0 | 112.6 | V75 I79 A111 S112 Y113 T117 V118 L119 | V75-F115 HydrophobicContact CG1-CB 3.74Å; V75-F115 HydrophobicContact CG1-CG 4.49Å; I79-F115 HydrophobicContact CD1-CB 4.34Å; I79-F115 HydrophobicContact CD1-CD2 3.94Å; I79-F115 HydrophobicContact CD1-CG 4.28Å; A111-F115 WeakPolarHBondContact O-CD2 3.24Å; A111-F115 PolarHBondContact O-N 3.39Å; S112-F115 PolarHBondContact O-N 3.08Å; Y113-F115 PolarHBondContact O-N 2.83Å; F115-T117 VanDerWaalsContact C-N 3.32Å; F115-T117 PolarHBondContact O-N 3.04Å; F115-V118 PolarHBondContact O-N 3.15Å; F115-L119 WeakPolarHBondContact O-CG 3.38Å; F115-L119 PolarHBondContact O-N 3.43Å; F115-L119 VanDerWaalsContact O-N 3.16Å |
| 116 | L | 84.9 | Confident | 83.8 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -75.5 | -20.2 | -179 | -68 | 167.3 | 0 | 0 | 0 | 113.4 | V75 S112 Y113 L114 V118 L119 G120 G121 V122 F125 | V75-L116 HydrophobicContact CB-CD2 4.09Å; V75-L116 HydrophobicContact CB-CG 4.36Å; V75-L116 HydrophobicContact CG1-CD1 4.39Å; V75-L116 HydrophobicContact CG1-CD2 4.28Å; V75-L116 HydrophobicContact CG1-CG 4.05Å; V75-L116 HydrophobicContact CG2-CD2 3.97Å; S112-L116 WeakPolarHBondContact O-CB 3.42Å; S112-L116 VanDerWaalsContact O-CG 3.31Å; S112-L116 WeakPolarHBondContact O-CG 3.4Å; S112-L116 PolarHBondContact O-N 2.83Å; Y113-L116 PolarHBondContact O-N 2.78Å; L114-L116 VanDerWaalsContact C-N 3.33Å; L114-L116 PolarHBondContact O-N 3.25Å; L116-V118 VanDerWaalsContact C-N 3.33Å; L116-L119 HydrophobicContact CD2-CD1 4.35Å; L116-L119 PolarHBondContact O-N 2.85Å; L116-G120 PolarHBondContact O-N 3.11Å; L116-G121 PolarHBondContact O-N 3.24Å; L116-V122 WeakPolarHBondContact O-CG2 3.15Å; L116-F125 HydrophobicContact CD1-CB 3.54Å; L116-F125 HydrophobicContact CD1-CD2 3.5Å; L116-F125 HydrophobicContact CD1-CE2 4.46Å; L116-F125 HydrophobicContact CD1-CG 3.69Å |
| 117 | T | 83.5 | Confident | 83.7 | Confident | 62 Ų | 62 | 53.7 Ų | 53.7 | 38% | 0.38 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.3 | -37.7 | 166.9 | 60.2 | 0 | 0 | 0 | 0 | 112.3 | Y113 L114 F115 V122 | Y113-T117 HydrophobicContact CD1-CG2 4.07Å; Y113-T117 HydrophobicContact CE1-CG2 3.66Å; Y113-T117 HydrophobicContact CE2-CG2 4.24Å; Y113-T117 WeakPolarHBondContact O-CG2 3.45Å; Y113-T117 PolarHBondContact O-N 3.25Å; L114-T117 PolarHBondContact O-N 3.22Å; L114-T117 PolarHBondContact O-OG1 3.36Å; F115-T117 VanDerWaalsContact C-N 3.32Å; F115-T117 PolarHBondContact O-N 3.04Å; T117-V122 HydrophobicContact CG2-CG2 3.61Å |
| 118 | V | 83.8 | Confident | 83.5 | Confident | 125 Ų | 125 | 51.3 Ų | 51.3 | 76% | 0.758 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -73 | -36.2 | 176.7 | -179.9 | 0 | 0 | 0 | 0 | 111.3 | L114 F115 L116 | L114-V118 PolarHBondContact O-N 3.37Å; F115-V118 PolarHBondContact O-N 3.15Å; L116-V118 VanDerWaalsContact C-N 3.33Å |
| 119 | L | 80 | Confident | 83.3 | Confident | 83 Ų | 83 | 51.4 Ų | 51.4 | 44% | 0.435 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -87.7 | -2.2 | -176.1 | -64 | 171.1 | 0 | 0 | 0 | 114.4 | L71 V75 F115 L116 G121 | L71-L119 HydrophobicContact CD1-CD1 4.4Å; L71-L119 HydrophobicContact CD2-CB 4.08Å; V75-L119 HydrophobicContact CG2-CD1 3.6Å; F115-L119 WeakPolarHBondContact O-CG 3.38Å; F115-L119 PolarHBondContact O-N 3.43Å; F115-L119 VanDerWaalsContact O-N 3.16Å; L116-L119 HydrophobicContact CD2-CD1 4.35Å; L116-L119 PolarHBondContact O-N 2.85Å; L119-G121 VanDerWaalsContact C-N 3.26Å; L119-G121 PolarHBondContact O-N 2.96Å |
| 120 | G | 78.1 | Confident | 83.2 | Confident | 58 Ų | 58 | 50 Ų | 50 | 60% | 0.598 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.9 | 11.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115 | L116 | L116-G120 PolarHBondContact O-N 3.11Š|
| 121 | G | 80.8 | Confident | 83.1 | Confident | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.01 | 29% | 0.294 | C | S | . | . | trans | -93.3 | 12 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | L116 L119 A123 V124 F125 | L116-G121 PolarHBondContact O-N 3.24Å; L119-G121 VanDerWaalsContact C-N 3.26Å; L119-G121 PolarHBondContact O-N 2.96Å; G121-A123 VanDerWaalsContact C-N 3.34Å; G121-A123 PolarHBondContact O-N 3.47Å; G121-V124 PolarHBondContact O-N 3.27Å; G121-F125 PolarHBondContact O-N 3.5Å; G121-F125 VanDerWaalsContact O-N 3.16Å | ||
| 122 | V | 81 | Confident | 83 | Confident | 32 Ų | 32 | 51.2 Ų | 51.2 | 19% | 0.194 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.2 | -42.5 | -170.1 | -175 | 0 | 0 | 0 | 0 | 112.7 | Y113 L116 T117 V124 F125 L126 | Y113-V122 HydrophobicContact CD2-CG1 4.14Å; Y113-V122 HydrophobicContact CE2-CG1 3.54Å; L116-V122 WeakPolarHBondContact O-CG2 3.15Å; T117-V122 HydrophobicContact CG2-CG2 3.61Å; V122-V124 PolarHBondContact O-N 3.19Å; V122-F125 WeakPolarHBondContact O-CB 3.45Å; V122-F125 PolarHBondContact O-N 3.38Å; V122-L126 HydrophobicContact CG1-CD1 3.69Å; V122-L126 HydrophobicContact CG1-CG 3.99Å; V122-L126 WeakPolarHBondContact O-CB 3.45Å; V122-L126 WeakPolarHBondContact O-CG 3.16Å; V122-L126 PolarHBondContact O-N 2.88Å |
| 123 | A | 79.6 | Confident | 83 | Confident | 49 Ų | 49 | 53.8 Ų | 53.8 | 41% | 0.405 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.9 | -44.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | G121 F125 L126 F127 | G121-A123 VanDerWaalsContact C-N 3.34Å; G121-A123 PolarHBondContact O-N 3.47Å; A123-F125 VanDerWaalsContact C-N 3.35Å; A123-F125 PolarHBondContact O-N 3.1Å; A123-L126 PolarHBondContact O-N 2.95Å; A123-F127 HydrophobicContact CB-CD2 4.48Å; A123-F127 WeakPolarHBondContact O-CB 3.48Å; A123-F127 WeakPolarHBondContact O-CD2 3.32Å; A123-F127 PolarHBondContact O-N 3.2Å |
| 124 | V | 78.6 | Confident | 82.9 | Confident | 2 Ų | 2 | 53.8 Ų | 53.8 | 1% | 0.012 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -69.5 | -34.7 | 179.2 | 179.6 | 0 | 0 | 0 | 0 | 111.9 | V61 Q65 N68 L69 G121 V122 G128 | V61-V124 HydrophobicContact CG1-CG1 4.08Å; V61-V124 HydrophobicContact CG1-CG2 4.37Å; Q65-V124 HydrophobicContact CB-CG2 3.77Å; N68-V124 HydrophobicContact CB-CB 4.14Å; N68-V124 HydrophobicContact CB-CG2 3.43Å; N68-V124 VanDerWaalsContact CB-CG2 3.43Å; L69-V124 HydrophobicContact CB-CG1 3.98Å; L69-V124 HydrophobicContact CD1-CG1 3.99Å; G121-V124 PolarHBondContact O-N 3.27Å; V122-V124 PolarHBondContact O-N 3.19Å; V124-G128 WeakPolarHBondContact O-CA 3.39Å; V124-G128 PolarHBondContact O-N 3.3Å |
| 125 | F | 82.4 | Confident | 82.8 | Confident | 5 Ų | 5 | 51.9 Ų | 51.9 | 2% | 0.022 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63.1 | -49.3 | 171.7 | -177.5 | -103.7 | 0 | 0 | 0 | 112.2 | V76 L109 Y113 L116 G121 V122 A123 I129 A130 | V76-F125 HydrophobicContact CG2-CD2 3.92Å; V76-F125 HydrophobicContact CG2-CE2 3.75Å; L109-F125 HydrophobicContact CB-CZ 4.27Å; L109-F125 HydrophobicContact CD2-CE2 4.3Å; L109-F125 HydrophobicContact CD2-CZ 3.86Å; L109-F125 VanDerWaalsContact O-CZ 3.3Å; L109-F125 WeakPolarHBondContact O-CZ 3.24Å; Y113-F125 HydrophobicContact CD2-CD1 4.18Å; Y113-F125 HydrophobicContact CD2-CE1 4.38Å; L116-F125 HydrophobicContact CD1-CB 3.54Å; L116-F125 HydrophobicContact CD1-CD2 3.5Å; L116-F125 HydrophobicContact CD1-CE2 4.46Å; L116-F125 HydrophobicContact CD1-CG 3.69Å; G121-F125 PolarHBondContact O-N 3.5Å; G121-F125 VanDerWaalsContact O-N 3.16Å; V122-F125 WeakPolarHBondContact O-CB 3.45Å; V122-F125 PolarHBondContact O-N 3.38Å; A123-F125 VanDerWaalsContact C-N 3.35Å; A123-F125 PolarHBondContact O-N 3.1Å; F125-I129 HydrophobicContact CD2-CB 4.29Å; F125-I129 HydrophobicContact CD2-CD1 4.12Å; F125-I129 HydrophobicContact CE2-CB 4.41Å; F125-I129 HydrophobicContact CE2-CG2 4.24Å; F125-I129 WeakPolarHBondContact O-CA 3.49Å; F125-I129 WeakPolarHBondContact O-CB 3.29Å; F125-I129 PolarHBondContact O-N 3.03Å; F125-A130 HydrophobicContact CE1-CB 4.4Å; F125-A130 PolarHBondContact O-N 2.85Å |
| 126 | L | 83.6 | Confident | 82.9 | Confident | 70 Ų | 70 | 47.1 Ų | 47.1 | 37% | 0.366 | 27% | 0.27 | S | S | . | . | I | π-helix | trans | -64.7 | -50 | -177.4 | -73.2 | 178.5 | 0 | 0 | 0 | 111.3 | Y113 V122 A123 A130 F131 | Y113-L126 HydrophobicContact CD2-CD2 4.2Å; Y113-L126 HydrophobicContact CE2-CD1 4.42Å; Y113-L126 HydrophobicContact CE2-CD2 4.17Å; Y113-L126 HydrophobicContact CE2-CG 4.44Å; V122-L126 HydrophobicContact CG1-CD1 3.69Å; V122-L126 HydrophobicContact CG1-CG 3.99Å; V122-L126 WeakPolarHBondContact O-CB 3.45Å; V122-L126 WeakPolarHBondContact O-CG 3.16Å; V122-L126 PolarHBondContact O-N 2.88Å; A123-L126 PolarHBondContact O-N 2.95Å; L126-A130 HydrophobicContact CD2-CB 4.43Å; L126-F131 WeakPolarHBondContact O-CB 3.31Å; L126-F131 PolarHBondContact O-N 2.87Å |
| 127 | F | 81.8 | Confident | 82.9 | Confident | 126 Ų | 126 | 50.7 Ų | 50.7 | 55% | 0.553 | 29% | 0.288 | S | S | * | . | I | π-helix | trans | -84.6 | -31.6 | -175.6 | -68.5 | -69.9 | 0 | 0 | 0 | 113.7 | V61 A123 P132 | V61-F127 HydrophobicContact CG2-CB 4.17Å; A123-F127 HydrophobicContact CB-CD2 4.48Å; A123-F127 WeakPolarHBondContact O-CB 3.48Å; A123-F127 WeakPolarHBondContact O-CD2 3.32Å; A123-F127 PolarHBondContact O-N 3.2Å; F127-P132 VanDerWaalsContact O-CD 3.3Å; F127-P132 WeakPolarHBondContact O-CD 3.2Å |
| 128 | G | 82.1 | Confident | 82.9 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 30% | 0.295 | C | S | . | . | I | π-helix | trans | -89.4 | -25.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L58 V124 P132 | L58-G128 WeakPolarHBondContact CD1-O 3.41Å; V124-G128 WeakPolarHBondContact O-CA 3.39Å; V124-G128 PolarHBondContact O-N 3.3Å; G128-P132 WeakPolarHBondContact O-CG 3.08Å |
| 129 | I | 82.9 | Confident | 82.9 | Confident | 17 Ų | 17 | 48.3 Ų | 48.3 | 9% | 0.087 | 27% | 0.267 | C | S | . | . | I | π-helix | trans | -124.1 | -58.2 | -174.4 | -58 | 179 | 0 | 0 | 0 | 111.3 | L58 V76 L109 F125 P132 I133 | L58-I129 HydrophobicContact CD1-CG1 4.26Å; V76-I129 HydrophobicContact CB-CD1 4.41Å; V76-I129 HydrophobicContact CG2-CD1 3.75Å; L109-I129 HydrophobicContact CD2-CG2 4.35Å; F125-I129 HydrophobicContact CD2-CB 4.29Å; F125-I129 HydrophobicContact CD2-CD1 4.12Å; F125-I129 HydrophobicContact CE2-CB 4.41Å; F125-I129 HydrophobicContact CE2-CG2 4.24Å; F125-I129 WeakPolarHBondContact O-CA 3.49Å; F125-I129 WeakPolarHBondContact O-CB 3.29Å; F125-I129 PolarHBondContact O-N 3.03Å; I129-P132 WeakPolarHBondContact O-CD 3.36Å; I129-I133 HydrophobicContact CG2-CD1 3.92Å; I129-I133 WeakPolarHBondContact O-CD1 3.42Å; I129-I133 VanDerWaalsContact O-CG1 3.24Å; I129-I133 WeakPolarHBondContact O-CG1 3.46Å; I129-I133 PolarHBondContact O-N 2.79Å |
| 130 | A | 84.3 | Confident | 82.9 | Confident | 17 Ų | 17 | 44.4 Ų | 44.4 | 14% | 0.14 | 25% | 0.246 | C | C | . | . | I | π-helix | trans | -66.2 | -45.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F125 L126 I133 L134 | F125-A130 HydrophobicContact CE1-CB 4.4Å; F125-A130 PolarHBondContact O-N 2.85Å; L126-A130 HydrophobicContact CD2-CB 4.43Å; A130-I133 PolarHBondContact O-N 3.36Å; A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.42Å; A130-L134 PolarHBondContact O-N 2.64Å |
| 131 | F | 85.4 | Confident | 82.9 | Confident | 93 Ų | 93 | 42.1 Ų | 42.1 | 41% | 0.408 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -63.3 | -47.8 | -178.2 | 176 | -103.1 | 0 | 0 | 0 | 113 | L126 I133 L134 L135 | L126-F131 WeakPolarHBondContact O-CB 3.31Å; L126-F131 PolarHBondContact O-N 2.87Å; F131-I133 VanDerWaalsContact C-N 3.33Å; F131-I133 PolarHBondContact O-N 2.8Å; F131-L134 PolarHBondContact O-N 2.99Å; F131-L135 HydrophobicContact CD1-CD1 4Å; F131-L135 HydrophobicContact CD1-CG 4.44Å; F131-L135 HydrophobicContact CE1-CD1 3.39Å; F131-L135 HydrophobicContact CE1-CG 4.07Å; F131-L135 HydrophobicContact CE2-CD1 4.31Å; F131-L135 HydrophobicContact CE2-CD2 4.24Å; F131-L135 HydrophobicContact CE2-CG 4.16Å; F131-L135 HydrophobicContact CZ-CD1 3.58Å; F131-L135 HydrophobicContact CZ-CD2 4.1Å; F131-L135 HydrophobicContact CZ-CG 3.92Å; F131-L135 WeakPolarHBondContact O-CG 3.37Å; F131-L135 PolarHBondContact O-N 3.3Å |
| 132 | P | 85.5 | Confident | 82.5 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.4 | -42.5 | 172.2 | -30.6 | 38.4 | 0 | 0 | 0 | 113.5 | F54 I57 F127 G128 I129 L134 L135 I136 | F54-P132 HydrophobicContact CD2-CB 3.48Å; F54-P132 VanDerWaalsContact CD2-CB 3.48Å; F54-P132 HydrophobicContact CD2-CG 4.37Å; F54-P132 HydrophobicContact CE2-CB 3.87Å; F54-P132 HydrophobicContact CE2-CG 4.45Å; F54-P132 HydrophobicContact CG-CB 4.46Å; I57-P132 HydrophobicContact CB-CG 3.85Å; I57-P132 HydrophobicContact CD1-CB 4.07Å; I57-P132 HydrophobicContact CD1-CG 4.03Å; I57-P132 HydrophobicContact CG2-CG 3.57Å; F127-P132 VanDerWaalsContact O-CD 3.3Å; F127-P132 WeakPolarHBondContact O-CD 3.2Å; G128-P132 WeakPolarHBondContact O-CG 3.08Å; I129-P132 WeakPolarHBondContact O-CD 3.36Å; P132-L134 VanDerWaalsContact C-N 3.34Å; P132-L134 PolarHBondContact O-N 2.87Å; P132-L135 PolarHBondContact O-N 2.77Å; P132-I136 WeakPolarHBondContact O-CB 3.35Å; P132-I136 WeakPolarHBondContact O-CD1 3.33Å; P132-I136 WeakPolarHBondContact O-CG1 3.46Å; P132-I136 PolarHBondContact O-N 2.95Å |
| 133 | I | 85.5 | Confident | 82 | Confident | 53 Ų | 53 | 43.5 Ų | 43.5 | 27% | 0.272 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.2 | -44.3 | 177 | -68.7 | 168.7 | 0 | 0 | 0 | 110.3 | F54 L109 I129 A130 F131 I136 L137 | F54-I133 HydrophobicContact CE2-CG1 4.16Å; L109-I133 HydrophobicContact CD1-CD1 4.47Å; L109-I133 HydrophobicContact CD2-CD1 4.1Å; I129-I133 HydrophobicContact CG2-CD1 3.92Å; I129-I133 WeakPolarHBondContact O-CD1 3.42Å; I129-I133 VanDerWaalsContact O-CG1 3.24Å; I129-I133 WeakPolarHBondContact O-CG1 3.46Å; I129-I133 PolarHBondContact O-N 2.79Å; A130-I133 PolarHBondContact O-N 3.36Å; F131-I133 VanDerWaalsContact C-N 3.33Å; F131-I133 PolarHBondContact O-N 2.8Å; I133-I136 PolarHBondContact O-N 3.13Å; I133-L137 HydrophobicContact CG2-CD1 4.05Å; I133-L137 HydrophobicContact CG2-CG 4.43Å; I133-L137 WeakPolarHBondContact O-CB 3.4Å; I133-L137 VanDerWaalsContact O-CG 3.31Å; I133-L137 WeakPolarHBondContact O-CG 3.46Å; I133-L137 PolarHBondContact O-N 2.78Å |
| 134 | L | 85.9 | Confident | 81.2 | Confident | 100 Ų | 100 | 42.1 Ų | 42.1 | 52% | 0.524 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -61.2 | -45.6 | 176 | -71.9 | 172.6 | 0 | 0 | 0 | 111.7 | A130 F131 P132 I136 L137 I138 | A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.42Å; A130-L134 PolarHBondContact O-N 2.64Å; F131-L134 PolarHBondContact O-N 2.99Å; P132-L134 VanDerWaalsContact C-N 3.34Å; P132-L134 PolarHBondContact O-N 2.87Å; L134-I136 VanDerWaalsContact C-N 3.34Å; L134-I136 PolarHBondContact O-N 3.04Å; L134-L137 PolarHBondContact O-N 3.48Å; L134-I138 WeakPolarHBondContact O-CB 3.19Å; L134-I138 VanDerWaalsContact O-CG1 3.24Å; L134-I138 WeakPolarHBondContact O-CG1 3.36Å; L134-I138 PolarHBondContact O-N 3.25Å |
| 135 | L | 85.5 | Confident | 80.4 | Confident | 71 Ų | 71 | 47.1 Ų | 47.1 | 37% | 0.372 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -60.5 | -43 | 176.5 | -73.6 | -176.9 | 0 | 0 | 0 | 112.1 | I57 F131 P132 I138 H139 | I57-L135 HydrophobicContact CD1-CD1 4.07Å; F131-L135 HydrophobicContact CD1-CD1 4Å; F131-L135 HydrophobicContact CD1-CG 4.44Å; F131-L135 HydrophobicContact CE1-CD1 3.39Å; F131-L135 HydrophobicContact CE1-CG 4.07Å; F131-L135 HydrophobicContact CE2-CD1 4.31Å; F131-L135 HydrophobicContact CE2-CD2 4.24Å; F131-L135 HydrophobicContact CE2-CG 4.16Å; F131-L135 HydrophobicContact CZ-CD1 3.58Å; F131-L135 HydrophobicContact CZ-CD2 4.1Å; F131-L135 HydrophobicContact CZ-CG 3.92Å; F131-L135 WeakPolarHBondContact O-CG 3.37Å; F131-L135 PolarHBondContact O-N 3.3Å; P132-L135 PolarHBondContact O-N 2.77Å; L135-I138 PolarHBondContact O-N 3.36Å; L135-H139 WeakPolarHBondContact O-CB 3.49Å; L135-H139 PolarHBondContact O-N 2.85Å |
| 136 | I | 86.6 | Confident | 79.2 | Confident | 26 Ų | 26 | 50.2 Ų | 50.2 | 13% | 0.133 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.3 | -45.5 | 176.2 | -70.9 | 164 | 0 | 0 | 0 | 110.5 | L43 Y50 F54 P132 I133 L134 H139 A140 | L43-I136 HydrophobicContact CD2-CG2 3.52Å; Y50-I136 HydrophobicContact CD1-CB 4.07Å; Y50-I136 HydrophobicContact CD1-CG1 3.73Å; Y50-I136 HydrophobicContact CD1-CG2 3.63Å; Y50-I136 HydrophobicContact CD2-CG2 4.11Å; Y50-I136 HydrophobicContact CE1-CB 4.43Å; Y50-I136 HydrophobicContact CE1-CG1 4.48Å; Y50-I136 HydrophobicContact CE1-CG2 3.97Å; Y50-I136 HydrophobicContact CE2-CG2 4.43Å; Y50-I136 HydrophobicContact CG-CG1 4.22Å; Y50-I136 HydrophobicContact CG-CG2 3.7Å; F54-I136 HydrophobicContact CB-CD1 4.15Å; F54-I136 HydrophobicContact CD2-CD1 4.36Å; P132-I136 WeakPolarHBondContact O-CB 3.35Å; P132-I136 WeakPolarHBondContact O-CD1 3.33Å; P132-I136 WeakPolarHBondContact O-CG1 3.46Å; P132-I136 PolarHBondContact O-N 2.95Å; I133-I136 PolarHBondContact O-N 3.13Å; L134-I136 VanDerWaalsContact C-N 3.34Å; L134-I136 PolarHBondContact O-N 3.04Å; I136-H139 PolarHBondContact O-N 2.94Å; I136-A140 WeakPolarHBondContact O-CB 3.41Å; I136-A140 PolarHBondContact O-N 3.08Å |
| 137 | L | 84.1 | Confident | 77.7 | Confident | 74 Ų | 74 | 49.8 Ų | 49.8 | 39% | 0.387 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -67 | -38.8 | 178.5 | -70.8 | 175.9 | 0 | 0 | 0 | 112.2 | I39 L43 I133 L134 S141 | I39-L137 HydrophobicContact CG2-CD2 4.19Å; L43-L137 HydrophobicContact CD1-CD2 4.4Å; I133-L137 HydrophobicContact CG2-CD1 4.05Å; I133-L137 HydrophobicContact CG2-CG 4.43Å; I133-L137 WeakPolarHBondContact O-CB 3.4Å; I133-L137 VanDerWaalsContact O-CG 3.31Å; I133-L137 WeakPolarHBondContact O-CG 3.46Å; I133-L137 PolarHBondContact O-N 2.78Å; L134-L137 PolarHBondContact O-N 3.48Å; L137-S141 WeakPolarHBondContact O-CA 3.12Å; L137-S141 WeakPolarHBondContact O-CB 3.5Å; L137-S141 PolarHBondContact O-N 3.02Å |
| 138 | I | 83.4 | Confident | 76.3 | Confident | 101 Ų | 101 | 47.8 Ų | 47.8 | 52% | 0.518 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.2 | -49.5 | 173.9 | -70.4 | 165.6 | 0 | 0 | 0 | 109.4 | L134 L135 A140 S141 V142 | L134-I138 WeakPolarHBondContact O-CB 3.19Å; L134-I138 VanDerWaalsContact O-CG1 3.24Å; L134-I138 WeakPolarHBondContact O-CG1 3.36Å; L134-I138 PolarHBondContact O-N 3.25Å; L135-I138 PolarHBondContact O-N 3.36Å; I138-A140 PolarHBondContact O-N 2.68Å; I138-S141 WeakPolarHBondContact O-CB 3.28Å; I138-S141 PolarHBondContact O-N 3.17Å; I138-S141 VanDerWaalsContact O-N 3.15Å; I138-V142 HydrophobicContact CG2-CG2 4.21Å; I138-V142 VanDerWaalsContact O-CG2 3.28Å; I138-V142 WeakPolarHBondContact O-CG2 3.28Å; I138-V142 PolarHBondContact O-N 2.77Å |
| 139 | H | 83.6 | Confident | 75.1 | Confident | 37 Ų | 37 | 52.1 Ų | 52.1 | 17% | 0.171 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.3 | -46.6 | 178.7 | -177.3 | -96.9 | 0 | 0 | 0 | 111.6 | F17 Y50 L135 I136 S141 V142 R143 | F17-H139 AromaticContact CD2-CE1 3.91Å; F17-H139 AromaticContact CE2-CE1 3.58Å; F17-H139 AromaticContact CE2-ND1 3.95Å; F17-H139 PolarHBondContact O-NE2 2.83Å; Y50-H139 HydrophobicContact CE1-CB 4.16Å; Y50-H139 AromaticContact CE1-ND1 3.27Å; Y50-H139 VanDerWaalsContact CE1-ND1 3.27Å; Y50-H139 WeakPolarHBondContact CE1-ND1 3.35Å; Y50-H139 AromaticContact CZ-ND1 3.44Å; Y50-H139 PolarHBondContact OH-ND1 3.31Å; L135-H139 WeakPolarHBondContact O-CB 3.49Å; L135-H139 PolarHBondContact O-N 2.85Å; I136-H139 PolarHBondContact O-N 2.94Å; H139-S141 VanDerWaalsContact C-N 3.26Å; H139-S141 PolarHBondContact O-N 2.91Å; H139-V142 PolarHBondContact O-N 3.45Å; H139-R143 WeakPolarHBondContact O-CB 3.42Å; H139-R143 PolarHBondContact O-N 3.2Å |
| 140 | A | 81.3 | Confident | 73.8 | Confident | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.9 | -31.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I39 N42 L43 Y50 I136 I138 | I39-A140 HydrophobicContact CG2-CB 4.2Å; N42-A140 HydrophobicContact CB-CB 4.06Å; N42-A140 PolarHBondContact ND2-O 2.68Å; L43-A140 HydrophobicContact CD2-CB 4.02Å; L43-A140 HydrophobicContact CG-CB 4.04Å; Y50-A140 WeakPolarHBondContact OH-CA 3.35Å; Y50-A140 PolarHBondContact OH-N 2.92Å; I136-A140 WeakPolarHBondContact O-CB 3.41Å; I136-A140 PolarHBondContact O-N 3.08Å; I138-A140 PolarHBondContact O-N 2.68Å |
| 141 | S | 77.9 | Confident | 72.5 | Confident | 10 Ų | 10 | 58.7 Ų | 58.7 | 7% | 0.07 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -69.9 | -52.9 | 174.8 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | W35 R38 L137 I138 H139 | W35-S141 PolarHBondContact NE1-OG 3.07Å; R38-S141 PolarHBondContact NE-O 3.33Å; R38-S141 PolarHBondContact NH2-O 2.87Å; L137-S141 WeakPolarHBondContact O-CA 3.12Å; L137-S141 WeakPolarHBondContact O-CB 3.5Å; L137-S141 PolarHBondContact O-N 3.02Å; I138-S141 WeakPolarHBondContact O-CB 3.28Å; I138-S141 PolarHBondContact O-N 3.17Å; I138-S141 VanDerWaalsContact O-N 3.15Å; H139-S141 VanDerWaalsContact C-N 3.26Å; H139-S141 PolarHBondContact O-N 2.91Å |
| 142 | V | 71.8 | Confident | 71.1 | Confident | 41 Ų | 41 | 59.1 Ų | 59.1 | 25% | 0.248 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -78 | -26.4 | -169.6 | -174.8 | 0 | 0 | 0 | 0 | 111.9 | F24 A25 I138 H139 L144 | F24-V142 WeakPolarHBondContact CA-O 3.37Å; F24-V142 HydrophobicContact CB-CG1 3.56Å; F24-V142 HydrophobicContact CD1-CB 4.15Å; F24-V142 HydrophobicContact CD1-CG1 3.58Å; F24-V142 HydrophobicContact CG-CG1 3.94Å; A25-V142 PolarHBondContact N-O 3.4Å; I138-V142 HydrophobicContact CG2-CG2 4.21Å; I138-V142 VanDerWaalsContact O-CG2 3.28Å; I138-V142 WeakPolarHBondContact O-CG2 3.28Å; I138-V142 PolarHBondContact O-N 2.77Å; H139-V142 PolarHBondContact O-N 3.45Å; V142-L144 WeakPolarHBondContact O-CD1 3.44Å; V142-L144 PolarHBondContact O-N 3.38Å |
| 143 | R | 70.6 | Confident | 70 | Confident | 22 Ų | 22 | 64 Ų | 64 | 8% | 0.083 | 32% | 0.323 | C | S | . | . | B | Isolated β-bridge | trans | -67.7 | 124.5 | -178.5 | -173.6 | 163.4 | -175.4 | 127.4 | 5.4 | 112.2 | D16 F17 N42 Y46 H139 | D16-R143 PolarHBondContact O-NH1 2.95Å; D16-R143 PolarHBondContact O-NH2 3.21Å; D16-R143 IonicContact OD1-NH2 3.14Å; D16-R143 PolarHBondContact OD1-NH2 2.99Å; D16-R143 VanDerWaalsContact OD1-NH2 3.14Å; F17-R143 VanDerWaalsContact C-NH1 3.26Å; F17-R143 PolarHBondContact O-NH1 3.01Å; N42-R143 PolarHBondContact ND2-O 3.37Å; Y46-R143 VanDerWaalsContact CE2-CD 3.47Å; Y46-R143 PolarHBondContact OH-NE 3.16Å; Y46-R143 VanDerWaalsContact OH-NE 3.08Å; Y46-R143 PolarHBondContact OH-NH2 2.69Å; H139-R143 WeakPolarHBondContact O-CB 3.42Å; H139-R143 PolarHBondContact O-N 3.2Å |
| 144 | L | 63.2 | Low | 68.7 | Low | 19 Ų | 19 | 67.1 Ų | 67.1 | 10% | 0.099 | 34% | 0.335 | C | S | . | . | trans | -103.3 | 114.4 | 173.2 | -67.3 | 104.1 | 0 | 0 | 0 | 112.2 | Q23 A25 V142 L147 | Q23-L144 HydrophobicContact CB-CB 4.42Å; Q23-L144 WeakPolarHBondContact O-CB 3.5Å; Q23-L144 WeakPolarHBondContact O-CD1 3.24Å; Q23-L144 PolarHBondContact O-N 3.31Å; A25-L144 VanDerWaalsContact CA-CD1 3.42Å; A25-L144 HydrophobicContact CB-CD1 3.15Å; A25-L144 HydrophobicContact CB-CD2 4.11Å; A25-L144 HydrophobicContact CB-CG 4.29Å; V142-L144 WeakPolarHBondContact O-CD1 3.44Å; V142-L144 PolarHBondContact O-N 3.38Å; L144-L147 HydrophobicContact CB-CB 4.16Å; L144-L147 HydrophobicContact CB-CG 4.42Å; L144-L147 HydrophobicContact CD2-CB 4Å; L144-L147 HydrophobicContact CD2-CD1 3.34Å; L144-L147 HydrophobicContact CD2-CG 3.32Å; L144-L147 HydrophobicContact CG-CD1 4.49Å; L144-L147 HydrophobicContact CG-CG 4.45Å | ||
| 145 | R | 60.9 | Low | 67.5 | Low | 108 Ų | 108 | 67.6 Ų | 67.6 | 41% | 0.408 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -99.5 | -34.1 | 169.3 | -168.1 | 173.9 | 177.8 | -145.4 | -6.9 | 112 | Y45 | Y45-R145 VanDerWaalsContact CG-NH1 3.27Š|
| 146 | S | 57 | Low | 66.2 | Low | 69 Ų | 69 | 70.6 Ų | 70.6 | 48% | 0.483 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -83.4 | -14.8 | -177.4 | 67.7 | 0 | 0 | 0 | 0 | 114.4 | K150 | S146-K150 WeakPolarHBondContact O-CB 3.29Å; S146-K150 PolarHBondContact O-N 3.34Å |
| 147 | L | 52.4 | Low | 64.7 | Low | 62 Ų | 62 | 72.8 Ų | 72.8 | 33% | 0.325 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -76.5 | -31.3 | 174.2 | -79.5 | -164.4 | 0 | 0 | 0 | 113 | L144 K150 L151 | L144-L147 HydrophobicContact CB-CB 4.16Å; L144-L147 HydrophobicContact CB-CG 4.42Å; L144-L147 HydrophobicContact CD2-CB 4Å; L144-L147 HydrophobicContact CD2-CD1 3.34Å; L144-L147 HydrophobicContact CD2-CG 3.32Å; L144-L147 HydrophobicContact CG-CD1 4.49Å; L144-L147 HydrophobicContact CG-CG 4.45Å; L147-K150 HydrophobicContact CD2-CB 4.4Å; L147-K150 HydrophobicContact CD2-CD 4.27Å; L147-K150 CarbonylContact O-C 3.43Å; L147-K150 PolarHBondContact O-N 3.03Å; L147-L151 WeakPolarHBondContact O-CA 3.45Å; L147-L151 WeakPolarHBondContact O-CB 3.07Å; L147-L151 VanDerWaalsContact O-CG 3.23Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 3.11Å |
| 148 | K | 52 | Low | 63.5 | Low | 83 Ų | 83 | 74.1 Ų | 74.1 | 36% | 0.361 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.7 | -54.5 | 168.4 | -89.2 | -160.6 | 177.1 | -179.7 | 0 | 110.2 | Q23 K150 L151 E152 | Q23-K148 VanDerWaalsContact CD-CG 3.49Å; Q23-K148 VanDerWaalsContact OE1-CG 3.27Å; K148-K150 PolarHBondContact O-N 2.85Å; K148-L151 CarbonylContact O-C 3.58Å; K148-L151 PolarHBondContact O-N 2.64Å; K148-L151 VanDerWaalsContact O-N 3.08Å; K148-E152 VanDerWaalsContact O-CB 3.28Å; K148-E152 WeakPolarHBondContact O-CB 3.32Å; K148-E152 WeakPolarHBondContact O-CG 3.4Å; K148-E152 PolarHBondContact O-N 3.24Å |
| 149 | N | 56.9 | Low | 61.9 | Low | 92 Ų | 92 | 70.7 Ų | 70.7 | 49% | 0.492 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.8 | -34.4 | 177.8 | -59.9 | 15.1 | 0 | 0 | 0 | 112.2 | N153 | N149-N153 WeakPolarHBondContact O-CB 3.24Å; N149-N153 PolarHBondContact O-N 3.04Å; N149-N153 PolarHBondContact O-ND2 3.35Å; N149-N153 PolarHBondContact O-OD1 3.21Å |
| 150 | K | 55.6 | Low | 60.1 | Low | 87 Ų | 87 | 75.7 Ų | 75.7 | 38% | 0.378 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -78.1 | -27.7 | 177.9 | -159 | 176.8 | -172.6 | -169.1 | 0 | 113.1 | R34 S146 L147 K148 K154 | R34-K150 VanDerWaalsContact NH2-NZ 3.12Å; S146-K150 WeakPolarHBondContact O-CB 3.29Å; S146-K150 PolarHBondContact O-N 3.34Å; L147-K150 HydrophobicContact CD2-CB 4.4Å; L147-K150 HydrophobicContact CD2-CD 4.27Å; L147-K150 CarbonylContact O-C 3.43Å; L147-K150 PolarHBondContact O-N 3.03Å; K148-K150 PolarHBondContact O-N 2.85Å; K150-K154 WeakPolarHBondContact O-CB 3.07Å; K150-K154 VanDerWaalsContact O-CG 3.24Å; K150-K154 WeakPolarHBondContact O-CG 3.23Å; K150-K154 PolarHBondContact O-N 3.14Å |
| 151 | L | 57.7 | Low | 58.5 | Low | 85 Ų | 85 | 83.7 Ų | 83.7 | 45% | 0.445 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -81.4 | -40.5 | 174.5 | -81.5 | 169.8 | 0 | 0 | 0 | 110.8 | L147 K148 K154 L155 | L147-L151 WeakPolarHBondContact O-CA 3.45Å; L147-L151 WeakPolarHBondContact O-CB 3.07Å; L147-L151 VanDerWaalsContact O-CG 3.23Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 3.11Å; K148-L151 CarbonylContact O-C 3.58Å; K148-L151 PolarHBondContact O-N 2.64Å; K148-L151 VanDerWaalsContact O-N 3.08Å; L151-K154 CarbonylContact O-C 3.53Å; L151-K154 PolarHBondContact O-N 3.16Å; L151-L155 WeakPolarHBondContact O-CA 3.19Å; L151-L155 WeakPolarHBondContact O-CB 3.15Å; L151-L155 VanDerWaalsContact O-CG 3.29Å; L151-L155 WeakPolarHBondContact O-CG 3.4Å; L151-L155 PolarHBondContact O-N 3.27Å |
| 152 | E | 56.3 | Low | 57.2 | Low | 102 Ų | 102 | 92.3 Ų | 92.3 | 48% | 0.477 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.9 | -50.6 | 169.1 | -76.9 | 171.8 | 172.7 | 0 | 0 | 108.9 | K148 K154 L155 E156 | K148-E152 VanDerWaalsContact O-CB 3.28Å; K148-E152 WeakPolarHBondContact O-CB 3.32Å; K148-E152 WeakPolarHBondContact O-CG 3.4Å; K148-E152 PolarHBondContact O-N 3.24Å; E152-K154 VanDerWaalsContact C-N 3.28Å; E152-K154 PolarHBondContact O-N 3.26Å; E152-L155 CarbonylContact O-C 3.38Å; E152-L155 PolarHBondContact O-N 3.31Å; E152-L155 VanDerWaalsContact O-N 3.11Å; E152-E156 VanDerWaalsContact O-CB 3.32Å; E152-E156 WeakPolarHBondContact O-CB 3.1Å; E152-E156 WeakPolarHBondContact O-CG 3.49Å; E152-E156 PolarHBondContact O-N 3.43Å |
| 153 | N | 61.1 | Low | 56.5 | Low | 101 Ų | 101 | 93.3 Ų | 93.3 | 54% | 0.54 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62 | -33.2 | 174.9 | -67.9 | -4.1 | 0 | 0 | 0 | 112.8 | N149 S157 | N149-N153 WeakPolarHBondContact O-CB 3.24Å; N149-N153 PolarHBondContact O-N 3.04Å; N149-N153 PolarHBondContact O-ND2 3.35Å; N149-N153 PolarHBondContact O-OD1 3.21Å; N153-S157 WeakPolarHBondContact O-CB 3.13Å; N153-S157 PolarHBondContact O-N 3Å |
| 154 | K | 59.4 | Low | 55.8 | Low | 119 Ų | 119 | 97.1 Ų | 97.1 | 52% | 0.517 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -77.8 | -32 | 174 | -84.2 | -173.1 | 172.5 | -68.8 | 0 | 113 | K150 L151 E152 S157 I158 | K150-K154 WeakPolarHBondContact O-CB 3.07Å; K150-K154 VanDerWaalsContact O-CG 3.24Å; K150-K154 WeakPolarHBondContact O-CG 3.23Å; K150-K154 PolarHBondContact O-N 3.14Å; L151-K154 CarbonylContact O-C 3.53Å; L151-K154 PolarHBondContact O-N 3.16Å; E152-K154 VanDerWaalsContact C-N 3.28Å; E152-K154 PolarHBondContact O-N 3.26Å; K154-S157 PolarHBondContact O-N 3.17Å; K154-S157 PolarHBondContact O-OG 2.99Å; K154-S157 VanDerWaalsContact O-OG 3.04Å; K154-I158 VanDerWaalsContact O-CB 3.26Å; K154-I158 WeakPolarHBondContact O-CB 3.46Å; K154-I158 WeakPolarHBondContact O-CD1 3.3Å; K154-I158 WeakPolarHBondContact O-CG1 3.26Å; K154-I158 PolarHBondContact O-N 3.27Å |
| 155 | L | 59.8 | Low | 55.4 | Low | 111 Ų | 111 | 102.7 Ų | 102.7 | 58% | 0.581 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -77.2 | -29.6 | 175.7 | -87.2 | 163.9 | 0 | 0 | 0 | 110.8 | L151 E152 G159 | L151-L155 WeakPolarHBondContact O-CA 3.19Å; L151-L155 WeakPolarHBondContact O-CB 3.15Å; L151-L155 VanDerWaalsContact O-CG 3.29Å; L151-L155 WeakPolarHBondContact O-CG 3.4Å; L151-L155 PolarHBondContact O-N 3.27Å; E152-L155 CarbonylContact O-C 3.38Å; E152-L155 PolarHBondContact O-N 3.31Å; E152-L155 VanDerWaalsContact O-N 3.11Å; L155-G159 WeakPolarHBondContact O-CA 3.33Å; L155-G159 PolarHBondContact O-N 3.33Å |
| 156 | E | 59.2 | Low | 55.2 | Low | 133 Ų | 133 | 98.6 Ų | 98.6 | 62% | 0.621 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -68.7 | -44.4 | 164.8 | -75.7 | -179.1 | 171.8 | 0 | 0 | 109.2 | E152 I158 G159 L160 | E152-E156 VanDerWaalsContact O-CB 3.32Å; E152-E156 WeakPolarHBondContact O-CB 3.1Å; E152-E156 WeakPolarHBondContact O-CG 3.49Å; E152-E156 PolarHBondContact O-N 3.43Å; E156-I158 VanDerWaalsContact C-N 3.28Å; E156-I158 PolarHBondContact O-N 3.09Å; E156-G159 PolarHBondContact O-N 2.64Å; E156-L160 WeakPolarHBondContact O-CB 3.09Å; E156-L160 PolarHBondContact O-N 3.39Å |
| 157 | S | 55.3 | Low | 55.4 | Low | 72 Ų | 72 | 99 Ų | 99 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.7 | -28.5 | 176.5 | 90.1 | 0 | 0 | 0 | 0 | 113.5 | N153 K154 | N153-S157 WeakPolarHBondContact O-CB 3.13Å; N153-S157 PolarHBondContact O-N 3Å; K154-S157 PolarHBondContact O-N 3.17Å; K154-S157 PolarHBondContact O-OG 2.99Å; K154-S157 VanDerWaalsContact O-OG 3.04Å |
| 158 | I | 57.7 | Low | 55.7 | Low | 103 Ų | 103 | 100.9 Ų | 100.9 | 53% | 0.528 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -87.2 | -34.6 | 175.5 | -68.3 | 164.5 | 0 | 0 | 0 | 110.8 | K154 E156 K161 | K154-I158 VanDerWaalsContact O-CB 3.26Å; K154-I158 WeakPolarHBondContact O-CB 3.46Å; K154-I158 WeakPolarHBondContact O-CD1 3.3Å; K154-I158 WeakPolarHBondContact O-CG1 3.26Å; K154-I158 PolarHBondContact O-N 3.27Å; E156-I158 VanDerWaalsContact C-N 3.28Å; E156-I158 PolarHBondContact O-N 3.09Å; I158-K161 WeakPolarHBondContact O-CB 3.34Å; I158-K161 PolarHBondContact O-N 2.77Å |
| 159 | G | 49.6 | Very low | 56.1 | Low | 28 Ų | 28 | 99.7 Ų | 99.7 | 29% | 0.289 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -74.6 | -25.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L155 E156 K161 R162 T163 | L155-G159 WeakPolarHBondContact O-CA 3.33Å; L155-G159 PolarHBondContact O-N 3.33Å; E156-G159 PolarHBondContact O-N 2.64Å; G159-K161 PolarHBondContact O-N 2.97Å; G159-R162 CarbonylContact O-C 3.49Å; G159-R162 PolarHBondContact O-N 3.33Å; G159-T163 VanDerWaalsContact O-CG2 3.3Å; G159-T163 WeakPolarHBondContact O-CG2 3.4Å; G159-T163 PolarHBondContact O-N 2.83Å |
| 160 | L | 46.3 | Very low | 56.5 | Low | 143 Ų | 143 | 102 Ų | 102 | 75% | 0.749 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | -28.5 | 167.2 | -146.8 | 77.5 | 0 | 0 | 0 | 111.3 | E156 | E156-L160 WeakPolarHBondContact O-CB 3.09Å; E156-L160 PolarHBondContact O-N 3.39Å |
| 161 | K | 46.8 | Very low | 56.8 | Low | 168 Ų | 168 | 102.3 Ų | 102.3 | 73% | 0.73 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | -3.7 | 173.8 | -71.6 | -168 | 172 | -165.8 | 0 | 114.3 | I158 G159 | I158-K161 WeakPolarHBondContact O-CB 3.34Å; I158-K161 PolarHBondContact O-N 2.77Å; G159-K161 PolarHBondContact O-N 2.97Å |
| 162 | R | 50.6 | Low | 57.3 | Low | 191 Ų | 191 | 104.2 Ų | 104.2 | 72% | 0.721 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -142.2 | 27.7 | -174.2 | -70 | -78.7 | -176.1 | 150.5 | -2.1 | 112.9 | G159 | G159-R162 CarbonylContact O-C 3.49Å; G159-R162 PolarHBondContact O-N 3.33Å |
| 163 | T | 58.9 | Low | 57 | Low | 61 Ų | 61 | 102.4 Ų | 102.4 | 37% | 0.374 | 55% | 0.551 | S | S | . | * | trans | -72.6 | 145.5 | 164 | 60.9 | 0 | 0 | 0 | 0 | 108.7 | G159 M165 G166 L167 | G159-T163 VanDerWaalsContact O-CG2 3.3Å; G159-T163 WeakPolarHBondContact O-CG2 3.4Å; G159-T163 PolarHBondContact O-N 2.83Å; T163-M165 PolarHBondContact O-N 3.4Å; T163-M165 VanDerWaalsContact O-N 3.09Å; T163-G166 WeakPolarHBondContact O-CA 3.38Å; T163-G166 PolarHBondContact O-N 3.04Å; T163-G166 PolarHBondContact OG1-N 2.95Å; T163-L167 PolarHBondContact O-N 2.93Å | ||
| 164 | P | 55.3 | Low | 56.9 | Low | 103 Ų | 103 | 104.2 Ų | 104.2 | 67% | 0.669 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -53.4 | -31.2 | 174.1 | -24.4 | 32.4 | 0 | 0 | 0 | 112.2 | L168 | P164-L168 WeakPolarHBondContact O-CB 3.47Å; P164-L168 WeakPolarHBondContact O-CG 3.24Å; P164-L168 PolarHBondContact O-N 2.99Å |
| 165 | M | 54.2 | Low | 56.5 | Low | 136 Ų | 136 | 107.4 Ų | 107.4 | 67% | 0.67 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -72.9 | -37.2 | 175.5 | -163.6 | 153.9 | -174.4 | 0 | 0 | 112.7 | T163 L168 L169 | T163-M165 PolarHBondContact O-N 3.4Å; T163-M165 VanDerWaalsContact O-N 3.09Å; M165-L168 PolarHBondContact O-N 3.39Å; M165-L169 HydrophobicContact CG-CD1 4.29Å; M165-L169 WeakPolarHBondContact O-CB 3.4Å; M165-L169 VanDerWaalsContact O-CG 3.24Å; M165-L169 WeakPolarHBondContact O-CG 3.38Å; M165-L169 PolarHBondContact O-N 2.85Å |
| 166 | G | 56.1 | Low | 55.9 | Low | 21 Ų | 21 | 110.3 Ų | 110.3 | 22% | 0.216 | 58% | 0.584 | C | S | . | * | H | α-helix | trans | -65.6 | -40.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T163 L169 E170 | T163-G166 WeakPolarHBondContact O-CA 3.38Å; T163-G166 PolarHBondContact O-N 3.04Å; T163-G166 PolarHBondContact OG1-N 2.95Å; G166-L169 PolarHBondContact O-N 2.94Å; G166-E170 VanDerWaalsContact O-CB 3.23Å; G166-E170 WeakPolarHBondContact O-CB 3.23Å; G166-E170 PolarHBondContact O-N 2.97Å |
| 167 | L | 61.5 | Low | 55.3 | Low | 77 Ų | 77 | 113.6 Ų | 113.6 | 40% | 0.403 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -68.6 | -34.8 | 173.8 | -72 | 168.7 | 0 | 0 | 0 | 112.3 | T163 S171 | T163-L167 PolarHBondContact O-N 2.93Å; L167-S171 VanDerWaalsContact O-CB 3.29Å; L167-S171 WeakPolarHBondContact O-CB 3.33Å; L167-S171 PolarHBondContact O-N 3.25Å; L167-S171 PolarHBondContact O-OG 3.33Å |
| 168 | L | 59.1 | Low | 54.5 | Low | 103 Ų | 103 | 113.9 Ų | 113.9 | 54% | 0.539 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.9 | -45.7 | 171.9 | -89.4 | 163.7 | 0 | 0 | 0 | 111.5 | P164 M165 S171 L172 | P164-L168 WeakPolarHBondContact O-CB 3.47Å; P164-L168 WeakPolarHBondContact O-CG 3.24Å; P164-L168 PolarHBondContact O-N 2.99Å; M165-L168 PolarHBondContact O-N 3.39Å; L168-S171 WeakPolarHBondContact CA-OG 3.33Å; L168-S171 PolarHBondContact O-N 2.88Å; L168-S171 PolarHBondContact O-OG 2.92Å; L168-L172 WeakPolarHBondContact O-CB 3.46Å; L168-L172 WeakPolarHBondContact O-CD1 3.23Å; L168-L172 VanDerWaalsContact O-CG 3.23Å; L168-L172 WeakPolarHBondContact O-CG 3.29Å; L168-L172 PolarHBondContact O-N 3.1Å |
| 169 | L | 61.2 | Low | 53.7 | Low | 58 Ų | 58 | 112.4 Ų | 112.4 | 30% | 0.304 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -68.4 | -36.5 | 178.3 | -71.6 | 167.9 | 0 | 0 | 0 | 112.6 | M165 G166 L172 G173 Q174 | M165-L169 HydrophobicContact CG-CD1 4.29Å; M165-L169 WeakPolarHBondContact O-CB 3.4Å; M165-L169 VanDerWaalsContact O-CG 3.24Å; M165-L169 WeakPolarHBondContact O-CG 3.38Å; M165-L169 PolarHBondContact O-N 2.85Å; G166-L169 PolarHBondContact O-N 2.94Å; L169-L172 CarbonylContact O-C 3.56Å; L169-L172 PolarHBondContact O-N 3.13Å; L169-G173 PolarHBondContact O-N 3.4Å; L169-G173 VanDerWaalsContact O-N 3.13Å; L169-Q174 PolarHBondContact O-N 3.24Å; L169-Q174 VanDerWaalsContact O-N 3.1Å |
| 170 | E | 65.9 | Low | 53.1 | Low | 140 Ų | 140 | 120.4 Ų | 120.4 | 65% | 0.654 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -65.4 | -40.9 | 172.1 | -172.3 | 175.5 | -174 | 0 | 0 | 111.1 | G166 L172 G173 | G166-E170 VanDerWaalsContact O-CB 3.23Å; G166-E170 WeakPolarHBondContact O-CB 3.23Å; G166-E170 PolarHBondContact O-N 2.97Å; E170-L172 VanDerWaalsContact C-N 3.27Å; E170-L172 PolarHBondContact O-N 3.29Å; E170-G173 PolarHBondContact O-N 2.73Å |
| 171 | S | 61.3 | Low | 53.4 | Low | 94 Ų | 94 | 119.3 Ų | 119.3 | 66% | 0.657 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -69.8 | -22.4 | 173.5 | 74.4 | 0 | 0 | 0 | 0 | 114 | L167 L168 | L167-S171 VanDerWaalsContact O-CB 3.29Å; L167-S171 WeakPolarHBondContact O-CB 3.33Å; L167-S171 PolarHBondContact O-N 3.25Å; L167-S171 PolarHBondContact O-OG 3.33Å; L168-S171 WeakPolarHBondContact CA-OG 3.33Å; L168-S171 PolarHBondContact O-N 2.88Å; L168-S171 PolarHBondContact O-OG 2.92Å |
| 172 | L | 67 | Low | 53.8 | Low | 125 Ų | 125 | 116.7 Ų | 116.7 | 65% | 0.654 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | 2.4 | 176.4 | -74.6 | 163.3 | 0 | 0 | 0 | 112.9 | L168 L169 E170 Q174 | L168-L172 WeakPolarHBondContact O-CB 3.46Å; L168-L172 WeakPolarHBondContact O-CD1 3.23Å; L168-L172 VanDerWaalsContact O-CG 3.23Å; L168-L172 WeakPolarHBondContact O-CG 3.29Å; L168-L172 PolarHBondContact O-N 3.1Å; L169-L172 CarbonylContact O-C 3.56Å; L169-L172 PolarHBondContact O-N 3.13Å; E170-L172 VanDerWaalsContact C-N 3.27Å; E170-L172 PolarHBondContact O-N 3.29Å; L172-Q174 VanDerWaalsContact C-N 3.31Å; L172-Q174 PolarHBondContact O-N 3.06Å |
| 173 | G | 51.8 | Low | 53.9 | Low | 63 Ų | 63 | 112.6 Ų | 112.6 | 65% | 0.649 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.4 | 18.9 | 174 | 0 | 0 | 0 | 0 | 0 | 115.1 | L169 E170 E175 | L169-G173 PolarHBondContact O-N 3.4Å; L169-G173 VanDerWaalsContact O-N 3.13Å; E170-G173 PolarHBondContact O-N 2.73Å; G173-E175 PolarHBondContact O-N 2.85Å |
| 174 | Q | 57.6 | Low | 53.7 | Low | 140 Ų | 140 | 115.6 Ų | 115.6 | 65% | 0.654 | 67% | 0.673 | S | S | * | * | trans | -92.1 | 77.3 | 172.9 | -65.9 | -157.5 | -57.1 | 0 | 0 | 109.6 | L169 L172 Q176 | L169-Q174 PolarHBondContact O-N 3.24Å; L169-Q174 VanDerWaalsContact O-N 3.1Å; L172-Q174 VanDerWaalsContact C-N 3.31Å; L172-Q174 PolarHBondContact O-N 3.06Å; Q174-Q176 PolarHBondContact O-N 3.38Å | ||
| 175 | E | 51.2 | Low | 53.6 | Low | 186 Ų | 186 | 116.4 Ų | 116.4 | 87% | 0.869 | 67% | 0.673 | S | S | * | * | trans | -62.1 | 123.3 | 162.4 | -77 | -160.7 | 155.6 | 0 | 0 | 108.9 | G173 E177 | G173-E175 PolarHBondContact O-N 2.85Å; E175-E177 PolarHBondContact O-N 3.26Å | ||
| 176 | Q | 47.5 | Very low | 53.5 | Low | 172 Ų | 172 | 115.1 Ų | 115.1 | 80% | 0.804 | 67% | 0.673 | S | S | * | * | trans | -71.1 | 100 | 170.8 | -116.2 | 162.9 | -30.8 | 0 | 0 | 108.5 | Q174 A178 | Q174-Q176 PolarHBondContact O-N 3.38Å; Q176-A178 HydrophobicContact CB-CB 4.22Å; Q176-A178 HydrophobicContact CG-CB 4.22Å; Q176-A178 PolarHBondContact O-N 3.31Å | ||
| 177 | E | 47.7 | Very low | 53.3 | Low | 202 Ų | 202 | 121.8 Ų | 121.8 | 94% | 0.944 | 71% | 0.706 | S | S | * | * | trans | -54.5 | 82.8 | 143.6 | -70.4 | -176.3 | 163.5 | 0 | 0 | 108.4 | E175 | E175-E177 PolarHBondContact O-N 3.26Š| ||
| 178 | A | 38.5 | Very low | 52.7 | Low | 78 Ų | 78 | 125.2 Ų | 125.2 | 65% | 0.645 | 73% | 0.729 | S | S | * | * | trans | -146.1 | 80.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | Q176 | Q176-A178 HydrophobicContact CB-CB 4.22Å; Q176-A178 HydrophobicContact CG-CB 4.22Å; Q176-A178 PolarHBondContact O-N 3.31Å | ||
| 179 | G | 39.4 | Very low | 52.2 | Low | 72 Ų | 72 | 127.1 Ų | 127.1 | 74% | 0.742 | 75% | 0.745 | S | S | * | * | trans | 108.1 | 81.2 | 146.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 180 | S | 37 | Very low | 51.4 | Low | 195 Ų | 195 | 133.4 Ų | 133.4 | 100% | 1.364 | 79% | 0.785 | S | S | * | * | trans | -48.1 | 0 | 133.8 | 58.2 | 0 | 0 | 0 | 0 | 112.3 |
Retrieved 180 of 180 residues in 514.1 ms
(Link to these results)