| 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 | 38.3 | Very low | 45.2 | Very low | 252 Ų | 252 | 141.3 Ų | 141.3 | 100% | 1.241 | 81% | 0.806 | S | S | * | * | 0 | 84.5 | 0 | -75.2 | -170.6 | -100 | 0 | 0 | 107.3 | |||||
| 2 | S | 36.7 | Very low | 45 | Very low | 116 Ų | 116 | 141.8 Ų | 141.8 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -101.4 | 138.1 | 175.1 | 37.8 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 3 | G | 36.6 | Very low | 45.2 | Very low | 55 Ų | 55 | 141.1 Ų | 141.1 | 57% | 0.567 | 81% | 0.811 | S | S | * | * | trans | -74.4 | 148.8 | -163.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L5 D6 | G3-L5 PolarHBondContact O-N 3.4Å; G3-D6 PolarHBondContact O-N 3.12Å | ||
| 4 | F | 55.5 | Low | 44.9 | Very low | 192 Ų | 192 | 143.3 Ų | 143.3 | 84% | 0.842 | 81% | 0.811 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.4 | -4.1 | 173.9 | 177.5 | -108 | 0 | 0 | 0 | 115.1 | ||
| 5 | L | 44.4 | Very low | 44.8 | Very low | 137 Ų | 137 | 142.3 Ų | 142.3 | 72% | 0.717 | 82% | 0.815 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.4 | 3.1 | -171.8 | -64.7 | 176.6 | 0 | 0 | 0 | 115.2 | G3 S7 | G3-L5 PolarHBondContact O-N 3.4Å; L5-S7 PolarHBondContact O-N 2.67Å |
| 6 | D | 49.2 | Very low | 44.8 | Very low | 141 Ų | 141 | 141.8 Ų | 141.8 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -0.5 | 173.3 | -88.6 | -23.8 | 0 | 0 | 0 | 113.5 | G3 | G3-D6 PolarHBondContact O-N 3.12Š|
| 7 | S | 53.5 | Low | 45 | Very low | 103 Ų | 103 | 138.1 Ų | 138.1 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | 5 | -177.8 | 53.8 | 0 | 0 | 0 | 0 | 115.2 | L5 | L5-S7 PolarHBondContact O-N 2.67Š|
| 8 | V | 48.2 | Very low | 45.8 | Very low | 117 Ų | 117 | 136 Ų | 136 | 71% | 0.709 | 78% | 0.775 | S | S | * | * | trans | -113.9 | 62.1 | 177 | -164.9 | 0 | 0 | 0 | 0 | 110.9 | C10 | V8-C10 PolarHBondContact O-N 2.97Š| ||
| 9 | R | 45.4 | Very low | 46.6 | Very low | 242 Ų | 242 | 138.3 Ų | 138.3 | 91% | 0.913 | 77% | 0.77 | S | S | * | * | trans | -87.9 | 91.8 | 155.4 | -97.5 | -179 | 152.9 | -166.9 | -7.1 | 108.3 | G11 | R9-G11 PolarHBondContact O-N 2.98Š| ||
| 10 | C | 45.2 | Very low | 47.6 | Very low | 131 Ų | 131 | 132 Ų | 132 | 89% | 0.885 | 74% | 0.737 | S | S | * | * | trans | -80.6 | 107.4 | 169.6 | -156 | 0 | 0 | 0 | 0 | 107.3 | V8 | V8-C10 PolarHBondContact O-N 2.97Š| ||
| 11 | G | 44.4 | Very low | 48.6 | Very low | 68 Ų | 68 | 131.8 Ų | 131.8 | 70% | 0.701 | 73% | 0.731 | S | S | * | * | trans | 173.6 | -24.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | R9 | R9-G11 PolarHBondContact O-N 2.98Š| ||
| 12 | D | 42.3 | Very low | 50.4 | Low | 148 Ų | 148 | 126.6 Ų | 126.6 | 79% | 0.791 | 70% | 0.697 | S | S | * | * | trans | -118.2 | 116.3 | -179.6 | -69 | -47 | 0 | 0 | 0 | 110.6 | E14 | D12-E14 PolarHBondContact O-N 3.43Š| ||
| 13 | C | 47.7 | Very low | 52.3 | Low | 132 Ų | 132 | 127.6 Ų | 127.6 | 89% | 0.892 | 68% | 0.683 | S | S | * | * | trans | -66.7 | 77.6 | 168.6 | -80.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 14 | E | 40.5 | Very low | 54.5 | Low | 172 Ų | 172 | 127 Ų | 127 | 80% | 0.804 | 67% | 0.667 | S | S | * | * | trans | -93 | 95.9 | 155.5 | -80.3 | -172.2 | 143.3 | 0 | 0 | 108.2 | D12 N16 | D12-E14 PolarHBondContact O-N 3.43Å; E14-N16 PolarHBondContact O-N 2.97Å | ||
| 15 | C | 44.1 | Very low | 55.9 | Low | 129 Ų | 129 | 121.4 Ų | 121.4 | 87% | 0.872 | 65% | 0.649 | S | S | * | * | trans | -70.2 | 45 | 168.1 | -66.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 16 | N | 44.2 | Very low | 57.9 | Low | 133 Ų | 133 | 120.1 Ų | 120.1 | 71% | 0.711 | 64% | 0.64 | S | S | * | * | trans | -110.7 | 75.1 | 166.8 | -152.7 | 23.8 | 0 | 0 | 0 | 107.3 | E14 D18 | E14-N16 PolarHBondContact O-N 2.97Å; N16-D18 PolarHBondContact O-N 3.4Å; N16-D18 VanDerWaalsContact O-N 3.08Å | ||
| 17 | V | 49.2 | Very low | 59.7 | Low | 79 Ų | 79 | 113.9 Ų | 113.9 | 48% | 0.479 | 61% | 0.609 | S | S | . | * | trans | -50.5 | 120.3 | 163.7 | 168.4 | 0 | 0 | 0 | 0 | 106.2 | W19 | V17-W19 HydrophobicContact CB-CG 4.46Å; V17-W19 HydrophobicContact CG1-CD2 3.91Å; V17-W19 HydrophobicContact CG1-CG 4.02Å; V17-W19 HydrophobicContact CG1-CZ2 4.16Å; V17-W19 PolarHBondContact O-N 3.23Å | ||
| 18 | D | 58.8 | Low | 61.4 | Low | 101 Ų | 101 | 111.3 Ų | 111.3 | 54% | 0.54 | 59% | 0.591 | S | S | . | * | trans | -67.9 | 67.6 | -177.8 | -124.4 | -35.2 | 0 | 0 | 0 | 110.9 | N16 G20 E21 R22 | N16-D18 PolarHBondContact O-N 3.4Å; N16-D18 VanDerWaalsContact O-N 3.08Å; D18-G20 PolarHBondContact O-N 3.05Å; D18-E21 HydrophobicContact CB-CB 4.2Å; D18-E21 PolarHBondContact O-N 3.43Å; D18-R22 PolarHBondContact O-N 3.43Å; D18-R22 VanDerWaalsContact O-N 3.07Å | ||
| 19 | W | 61.4 | Low | 63.4 | Low | 180 Ų | 180 | 110.8 Ų | 110.8 | 68% | 0.682 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.5 | -30 | -175.2 | -74.9 | 104.5 | 0 | 0 | 0 | 111.2 | V17 R23 | V17-W19 HydrophobicContact CB-CG 4.46Å; V17-W19 HydrophobicContact CG1-CD2 3.91Å; V17-W19 HydrophobicContact CG1-CG 4.02Å; V17-W19 HydrophobicContact CG1-CZ2 4.16Å; V17-W19 PolarHBondContact O-N 3.23Å; W19-R23 WeakPolarHBondContact O-CB 3.37Å; W19-R23 PolarHBondContact O-N 3.13Å |
| 20 | G | 66.2 | Low | 65.6 | Low | 11 Ų | 11 | 101.3 Ų | 101.3 | 11% | 0.113 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -64.8 | -49.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | D18 R23 N24 | D18-G20 PolarHBondContact O-N 3.05Å; G20-R23 PolarHBondContact O-N 3.15Å; G20-N24 WeakPolarHBondContact O-CB 3.4Å; G20-N24 PolarHBondContact O-N 2.99Å; G20-N24 PolarHBondContact O-OD1 3.44Å |
| 21 | E | 69 | Low | 67.9 | Low | 128 Ų | 128 | 95.1 Ų | 95.1 | 60% | 0.598 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -68.5 | -39.2 | -178.3 | -145.9 | 176.7 | -153 | 0 | 0 | 112 | D18 N24 T25 | D18-E21 HydrophobicContact CB-CB 4.2Å; D18-E21 PolarHBondContact O-N 3.43Å; E21-N24 PolarHBondContact O-N 3.48Å; E21-T25 PolarHBondContact O-N 2.9Å; E21-T25 PolarHBondContact O-OG1 3Å |
| 22 | R | 75.8 | Confident | 70.2 | Confident | 144 Ų | 144 | 93.8 Ų | 93.8 | 54% | 0.543 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.1 | -40 | 173.7 | -164.5 | 173.1 | -171.3 | -177.7 | 1.9 | 112.1 | D18 T25 M26 | D18-R22 PolarHBondContact O-N 3.43Å; D18-R22 VanDerWaalsContact O-N 3.07Å; R22-T25 PolarHBondContact O-N 3.13Å; R22-M26 HydrophobicContact CG-CE 3.82Å; R22-M26 HydrophobicContact CG-SD 4.41Å; R22-M26 VanDerWaalsContact O-CG 3.3Å; R22-M26 WeakPolarHBondContact O-CG 3.45Å; R22-M26 PolarHBondContact O-N 3.09Å |
| 23 | R | 76.9 | Confident | 72.7 | Confident | 137 Ų | 137 | 90.7 Ų | 90.7 | 52% | 0.517 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.4 | -42.8 | 176.1 | -179.2 | 170.8 | 70 | -170.7 | -1 | 111.8 | W19 G20 T25 M26 A27 G153 T155 | W19-R23 WeakPolarHBondContact O-CB 3.37Å; W19-R23 PolarHBondContact O-N 3.13Å; G20-R23 PolarHBondContact O-N 3.15Å; R23-T25 VanDerWaalsContact C-N 3.34Å; R23-T25 PolarHBondContact O-N 3.42Å; R23-M26 PolarHBondContact O-N 3.34Å; R23-A27 VanDerWaalsContact O-CB 3.28Å; R23-A27 WeakPolarHBondContact O-CB 3.35Å; R23-A27 PolarHBondContact O-N 3.46Å; R23-G153 WeakPolarHBondContact CG-O 3.42Å; R23-T155 VanDerWaalsContact CZ-OG1 3.24Å; R23-T155 PolarHBondContact NE-OG1 3.16Å; R23-T155 PolarHBondContact NH2-OG1 3.39Å |
| 24 | N | 82.7 | Confident | 74.9 | Confident | 43 Ų | 43 | 86.4 Ų | 86.4 | 23% | 0.23 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 177.5 | -69.6 | -5.6 | 0 | 0 | 0 | 111.5 | G20 E21 A27 S28 R154 T155 | G20-N24 WeakPolarHBondContact O-CB 3.4Å; G20-N24 PolarHBondContact O-N 2.99Å; G20-N24 PolarHBondContact O-OD1 3.44Å; E21-N24 PolarHBondContact O-N 3.48Å; N24-A27 PolarHBondContact O-N 3.05Å; N24-S28 WeakPolarHBondContact O-CB 3.43Å; N24-S28 PolarHBondContact O-N 3.48Å; N24-S28 PolarHBondContact O-OG 3.12Å; N24-R154 WeakPolarHBondContact OD1-CA 3.38Å; N24-T155 PolarHBondContact ND2-O 3.35Å; N24-T155 PolarHBondContact OD1-N 3Å; N24-T155 PolarHBondContact OD1-O 2.99Å; N24-T155 PolarHBondContact OD1-OG1 3.28Å |
| 25 | T | 84.7 | Confident | 77.5 | Confident | 74 Ų | 74 | 81.2 Ų | 81.2 | 45% | 0.454 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.2 | -50.2 | 175.9 | -56.6 | 0 | 0 | 0 | 0 | 111 | E21 R22 R23 A27 S28 I29 | E21-T25 PolarHBondContact O-N 2.9Å; E21-T25 PolarHBondContact O-OG1 3Å; R22-T25 PolarHBondContact O-N 3.13Å; R23-T25 VanDerWaalsContact C-N 3.34Å; R23-T25 PolarHBondContact O-N 3.42Å; T25-A27 PolarHBondContact O-N 3.43Å; T25-S28 PolarHBondContact O-N 3.43Å; T25-S28 PolarHBondContact O-OG 3.48Å; T25-I29 HydrophobicContact CG2-CD1 3.93Å; T25-I29 WeakPolarHBondContact O-CG1 3.3Å; T25-I29 PolarHBondContact O-N 3.49Å |
| 26 | M | 85.9 | Confident | 80 | Confident | 109 Ų | 109 | 81 Ų | 81 | 54% | 0.537 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 178.2 | -70.5 | 174.5 | 176.8 | 0 | 0 | 112.7 | R22 R23 S28 I29 A30 | R22-M26 HydrophobicContact CG-CE 3.82Å; R22-M26 HydrophobicContact CG-SD 4.41Å; R22-M26 VanDerWaalsContact O-CG 3.3Å; R22-M26 WeakPolarHBondContact O-CG 3.45Å; R22-M26 PolarHBondContact O-N 3.09Å; R23-M26 PolarHBondContact O-N 3.34Å; M26-S28 VanDerWaalsContact C-N 3.34Å; M26-S28 PolarHBondContact O-N 3.03Å; M26-I29 PolarHBondContact O-N 3.5Å; M26-A30 VanDerWaalsContact O-CB 3.31Å; M26-A30 WeakPolarHBondContact O-CB 3.2Å; M26-A30 PolarHBondContact O-N 3.08Å |
| 27 | A | 87.2 | Confident | 82.4 | Confident | 11 Ų | 11 | 76.8 Ų | 76.8 | 9% | 0.091 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -62.7 | -41.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | R23 N24 T25 A31 | R23-A27 VanDerWaalsContact O-CB 3.28Å; R23-A27 WeakPolarHBondContact O-CB 3.35Å; R23-A27 PolarHBondContact O-N 3.46Å; N24-A27 PolarHBondContact O-N 3.05Å; T25-A27 PolarHBondContact O-N 3.43Å; A27-A31 VanDerWaalsContact O-CB 3.23Å; A27-A31 WeakPolarHBondContact O-CB 3.3Å; A27-A31 PolarHBondContact O-N 3.15Å |
| 28 | S | 88.9 | Confident | 84.5 | Confident | 49 Ų | 49 | 73 Ų | 73 | 34% | 0.343 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -66.2 | -42 | 177.3 | 71.4 | 0 | 0 | 0 | 0 | 112.8 | N24 T25 M26 G32 | N24-S28 WeakPolarHBondContact O-CB 3.43Å; N24-S28 PolarHBondContact O-N 3.48Å; N24-S28 PolarHBondContact O-OG 3.12Å; T25-S28 PolarHBondContact O-N 3.43Å; T25-S28 PolarHBondContact O-OG 3.48Å; M26-S28 VanDerWaalsContact C-N 3.34Å; M26-S28 PolarHBondContact O-N 3.03Å; S28-G32 PolarHBondContact O-N 3.36Å |
| 29 | I | 91.7 | Very high | 86.2 | Confident | 105 Ų | 105 | 71.6 Ų | 71.6 | 54% | 0.538 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.8 | -49.1 | 176.2 | -66.6 | 167.5 | 0 | 0 | 0 | 110.2 | T25 M26 A31 G32 V33 | T25-I29 HydrophobicContact CG2-CD1 3.93Å; T25-I29 WeakPolarHBondContact O-CG1 3.3Å; T25-I29 PolarHBondContact O-N 3.49Å; M26-I29 PolarHBondContact O-N 3.5Å; I29-A31 VanDerWaalsContact C-N 3.35Å; I29-A31 PolarHBondContact O-N 3.39Å; I29-G32 PolarHBondContact O-N 3.41Å; I29-V33 HydrophobicContact CG2-CG2 4.43Å; I29-V33 WeakPolarHBondContact O-CG2 3.24Å; I29-V33 PolarHBondContact O-N 3.25Å |
| 30 | A | 91.7 | Very high | 87.8 | Confident | 43 Ų | 43 | 70.3 Ų | 70.3 | 36% | 0.355 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | M26 V33 L34 V149 | M26-A30 VanDerWaalsContact O-CB 3.31Å; M26-A30 WeakPolarHBondContact O-CB 3.2Å; M26-A30 PolarHBondContact O-N 3.08Å; A30-V33 PolarHBondContact O-N 3.04Å; A30-L34 VanDerWaalsContact O-CG 3.3Å; A30-L34 WeakPolarHBondContact O-CG 3.2Å; A30-L34 PolarHBondContact O-N 3.26Å; A30-V149 HydrophobicContact CB-CG1 4.04Å |
| 31 | A | 92.4 | Very high | 89.1 | Confident | 1 Ų | 1 | 71.8 Ų | 71.8 | 1% | 0.008 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -62.9 | -42.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A27 I29 L34 F35 G146 V149 F150 | A27-A31 VanDerWaalsContact O-CB 3.23Å; A27-A31 WeakPolarHBondContact O-CB 3.3Å; A27-A31 PolarHBondContact O-N 3.15Å; I29-A31 VanDerWaalsContact C-N 3.35Å; I29-A31 PolarHBondContact O-N 3.39Å; A31-L34 PolarHBondContact O-N 3.34Å; A31-F35 WeakPolarHBondContact O-CB 3.45Å; A31-F35 PolarHBondContact O-N 3.16Å; A31-G146 VanDerWaalsContact CB-O 3.28Å; A31-G146 WeakPolarHBondContact CB-O 3.4Å; A31-V149 HydrophobicContact CB-CG1 4.45Å; A31-F150 HydrophobicContact CB-CB 3.65Å; A31-F150 HydrophobicContact CB-CD2 3.88Å; A31-F150 HydrophobicContact CB-CG 4.25Å |
| 32 | G | 92.7 | Very high | 90.3 | Very high | 40 Ų | 40 | 65.9 Ų | 65.9 | 41% | 0.412 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | S28 I29 F35 F36 | S28-G32 PolarHBondContact O-N 3.36Å; I29-G32 PolarHBondContact O-N 3.41Å; G32-F35 PolarHBondContact O-N 3.34Å; G32-F36 WeakPolarHBondContact O-CB 3.42Å; G32-F36 PolarHBondContact O-N 3.2Å |
| 33 | V | 95.8 | Very high | 91 | Very high | 83 Ų | 83 | 63.3 Ų | 63.3 | 50% | 0.503 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.7 | -47.3 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | I29 A30 F35 F36 T37 | I29-V33 HydrophobicContact CG2-CG2 4.43Å; I29-V33 WeakPolarHBondContact O-CG2 3.24Å; I29-V33 PolarHBondContact O-N 3.25Å; A30-V33 PolarHBondContact O-N 3.04Å; V33-F35 PolarHBondContact O-N 2.84Å; V33-F36 PolarHBondContact O-N 3.32Å; V33-T37 HydrophobicContact CG1-CG2 4.29Å; V33-T37 VanDerWaalsContact O-CG2 3.32Å; V33-T37 WeakPolarHBondContact O-CG2 3.42Å; V33-T37 PolarHBondContact O-N 2.88Å; V33-T37 PolarHBondContact O-OG1 2.85Å; V33-T37 VanDerWaalsContact O-OG1 3.11Å |
| 34 | L | 94.1 | Very high | 91.8 | Very high | 43 Ų | 43 | 60.4 Ų | 60.4 | 23% | 0.225 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 178.4 | -72 | 168.3 | 0 | 0 | 0 | 111.9 | A30 A31 F36 T37 G38 F142 V149 | A30-L34 VanDerWaalsContact O-CG 3.3Å; A30-L34 WeakPolarHBondContact O-CG 3.2Å; A30-L34 PolarHBondContact O-N 3.26Å; A31-L34 PolarHBondContact O-N 3.34Å; L34-F36 PolarHBondContact O-N 3.27Å; L34-T37 WeakPolarHBondContact CA-OG1 3.36Å; L34-T37 PolarHBondContact O-N 3.42Å; L34-T37 PolarHBondContact O-OG1 3.46Å; L34-G38 PolarHBondContact O-N 3.29Å; L34-F142 HydrophobicContact CD2-CD1 3.77Å; L34-F142 HydrophobicContact CD2-CE1 4.32Å; L34-V149 HydrophobicContact CD1-CG2 4.19Å |
| 35 | F | 94.7 | Very high | 92.2 | Very high | 62 Ų | 62 | 58.3 Ų | 58.3 | 27% | 0.272 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.4 | -47 | 177.1 | -177.3 | -89.4 | 0 | 0 | 0 | 111.9 | A31 G32 V33 G38 W39 T67 F70 I143 | A31-F35 WeakPolarHBondContact O-CB 3.45Å; A31-F35 PolarHBondContact O-N 3.16Å; G32-F35 PolarHBondContact O-N 3.34Å; V33-F35 PolarHBondContact O-N 2.84Å; F35-G38 PolarHBondContact O-N 3.48Å; F35-W39 AromaticContact CD1-CD1 3.87Å; F35-W39 AromaticContact CE1-CD1 3.44Å; F35-W39 VanDerWaalsContact CE1-CD1 3.44Å; F35-W39 AromaticContact CE1-NE1 3.6Å; F35-W39 AromaticContact CE2-NE1 3.72Å; F35-W39 AromaticContact CZ-CD1 3.6Å; F35-W39 AromaticContact CZ-NE1 3.23Å; F35-W39 PolarHBondContact O-N 3.21Å; F35-T67 HydrophobicContact CE2-CG2 3.44Å; F35-T67 VanDerWaalsContact CE2-CG2 3.44Å; F35-T67 HydrophobicContact CZ-CG2 3.7Å; F35-F70 HydrophobicContact CD2-CD1 4.24Å; F35-F70 HydrophobicContact CD2-CD2 4.44Å; F35-F70 HydrophobicContact CD2-CE1 4.33Å; F35-F70 HydrophobicContact CD2-CG 4.33Å; F35-F70 HydrophobicContact CD2-CZ 4.48Å; F35-F70 HydrophobicContact CE2-CD1 4.15Å; F35-F70 HydrophobicContact CE2-CE1 4.49Å; F35-F70 HydrophobicContact CE2-CG 4.43Å; F35-I143 HydrophobicContact CD2-CG1 4.23Å; F35-I143 HydrophobicContact CD2-CG2 4.39Å |
| 36 | F | 95.5 | Very high | 92.4 | Very high | 124 Ų | 124 | 56.3 Ų | 56.3 | 54% | 0.544 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.9 | -45.9 | 177.1 | 177.1 | -99.7 | 0 | 0 | 0 | 111.5 | G32 V33 L34 G38 W39 W40 | G32-F36 WeakPolarHBondContact O-CB 3.42Å; G32-F36 PolarHBondContact O-N 3.2Å; V33-F36 PolarHBondContact O-N 3.32Å; L34-F36 PolarHBondContact O-N 3.27Å; F36-G38 VanDerWaalsContact C-N 3.28Å; F36-G38 PolarHBondContact O-N 3.09Å; F36-W39 PolarHBondContact O-N 3.39Å; F36-W40 HydrophobicContact CE1-CB 4.45Å; F36-W40 HydrophobicContact CE1-CE3 4.37Å; F36-W40 HydrophobicContact CE2-CE3 4.33Å; F36-W40 HydrophobicContact CZ-CD2 4.31Å; F36-W40 AromaticContact CZ-CE3 3.72Å; F36-W40 HydrophobicContact CZ-CE3 3.72Å; F36-W40 HydrophobicContact CZ-CZ3 4.3Å; F36-W40 WeakPolarHBondContact O-CB 3.34Å; F36-W40 PolarHBondContact O-N 2.98Å |
| 37 | T | 95.5 | Very high | 92.6 | Very high | 46 Ų | 46 | 56.5 Ų | 56.5 | 28% | 0.282 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.4 | -36.6 | 177.8 | 53.7 | 0 | 0 | 0 | 0 | 112.5 | V33 L34 W40 I41 | V33-T37 HydrophobicContact CG1-CG2 4.29Å; V33-T37 VanDerWaalsContact O-CG2 3.32Å; V33-T37 WeakPolarHBondContact O-CG2 3.42Å; V33-T37 PolarHBondContact O-N 2.88Å; V33-T37 PolarHBondContact O-OG1 2.85Å; V33-T37 VanDerWaalsContact O-OG1 3.11Å; L34-T37 WeakPolarHBondContact CA-OG1 3.36Å; L34-T37 PolarHBondContact O-N 3.42Å; L34-T37 PolarHBondContact O-OG1 3.46Å; T37-W40 PolarHBondContact O-N 3.24Å; T37-I41 WeakPolarHBondContact O-CD1 3.45Å; T37-I41 VanDerWaalsContact O-CG1 3.25Å; T37-I41 WeakPolarHBondContact O-CG1 3.46Å; T37-I41 PolarHBondContact O-N 2.87Å; T37-I41 VanDerWaalsContact O-N 3.09Å |
| 38 | G | 93.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.7 | -47.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L34 F35 F36 I42 Q139 | L34-G38 PolarHBondContact O-N 3.29Å; F35-G38 PolarHBondContact O-N 3.48Å; F36-G38 VanDerWaalsContact C-N 3.28Å; F36-G38 PolarHBondContact O-N 3.09Å; G38-I42 PolarHBondContact O-N 3.48Å; G38-Q139 WeakPolarHBondContact O-CB 3.29Å; G38-Q139 WeakPolarHBondContact O-CG 3.34Å |
| 39 | W | 94.4 | Very high | 92.7 | Very high | 70 Ų | 70 | 61.8 Ų | 61.8 | 27% | 0.265 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -70.1 | -34.2 | 176.7 | -79.4 | 102.2 | 0 | 0 | 0 | 113.6 | F35 F36 I41 I42 I43 V64 T67 | F35-W39 AromaticContact CD1-CD1 3.87Å; F35-W39 AromaticContact CE1-CD1 3.44Å; F35-W39 VanDerWaalsContact CE1-CD1 3.44Å; F35-W39 AromaticContact CE1-NE1 3.6Å; F35-W39 AromaticContact CE2-NE1 3.72Å; F35-W39 AromaticContact CZ-CD1 3.6Å; F35-W39 AromaticContact CZ-NE1 3.23Å; F35-W39 PolarHBondContact O-N 3.21Å; F36-W39 PolarHBondContact O-N 3.39Å; W39-I41 VanDerWaalsContact C-N 3.35Å; W39-I41 PolarHBondContact O-N 3.15Å; W39-I42 HydrophobicContact CE3-CG2 3.78Å; W39-I42 HydrophobicContact CZ3-CG2 4.3Å; W39-I42 WeakPolarHBondContact O-CG2 3.32Å; W39-I42 PolarHBondContact O-N 3.5Å; W39-I43 WeakPolarHBondContact O-CD1 3.41Å; W39-I43 VanDerWaalsContact O-CG1 3.24Å; W39-I43 WeakPolarHBondContact O-CG1 3.49Å; W39-I43 PolarHBondContact O-N 2.9Å; W39-I43 VanDerWaalsContact O-N 3.13Å; W39-V64 HydrophobicContact CH2-CG2 4.07Å; W39-T67 VanDerWaalsContact CE2-CG2 3.46Å; W39-T67 HydrophobicContact CZ2-CG2 3.31Å |
| 40 | W | 94.7 | Very high | 92.4 | Very high | 154 Ų | 154 | 60.9 Ų | 60.9 | 58% | 0.583 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -62.3 | -44.3 | 177.6 | -171.7 | -97.8 | 0 | 0 | 0 | 111.7 | F36 T37 I42 I43 D44 | F36-W40 HydrophobicContact CE1-CB 4.45Å; F36-W40 HydrophobicContact CE1-CE3 4.37Å; F36-W40 HydrophobicContact CE2-CE3 4.33Å; F36-W40 HydrophobicContact CZ-CD2 4.31Å; F36-W40 AromaticContact CZ-CE3 3.72Å; F36-W40 HydrophobicContact CZ-CE3 3.72Å; F36-W40 HydrophobicContact CZ-CZ3 4.3Å; F36-W40 WeakPolarHBondContact O-CB 3.34Å; F36-W40 PolarHBondContact O-N 2.98Å; T37-W40 PolarHBondContact O-N 3.24Å; W40-I42 PolarHBondContact O-N 3.4Å; W40-I43 PolarHBondContact O-N 3.12Å; W40-D44 PolarHBondContact O-N 3.23Å |
| 41 | I | 93.5 | Very high | 92.2 | Very high | 41 Ų | 41 | 64 Ų | 64 | 21% | 0.21 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.6 | -41 | -179.9 | -70.5 | 164.8 | 0 | 0 | 0 | 111.8 | T37 W39 A45 A135 F138 F142 | T37-I41 WeakPolarHBondContact O-CD1 3.45Å; T37-I41 VanDerWaalsContact O-CG1 3.25Å; T37-I41 WeakPolarHBondContact O-CG1 3.46Å; T37-I41 PolarHBondContact O-N 2.87Å; T37-I41 VanDerWaalsContact O-N 3.09Å; W39-I41 VanDerWaalsContact C-N 3.35Å; W39-I41 PolarHBondContact O-N 3.15Å; I41-A45 PolarHBondContact O-N 2.63Å; I41-A45 VanDerWaalsContact O-N 3.09Å; I41-A135 HydrophobicContact CG2-CB 3.71Å; I41-F138 HydrophobicContact CD1-CB 4.39Å; I41-F142 HydrophobicContact CD1-CD2 3.76Å; I41-F142 HydrophobicContact CD1-CE2 3.44Å; I41-F142 VanDerWaalsContact CD1-CE2 3.44Å |
| 42 | I | 92.7 | Very high | 91.6 | Very high | 4 Ų | 4 | 68.8 Ų | 68.8 | 2% | 0.021 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -71.8 | -33.4 | 179.5 | -164.6 | 63.5 | 0 | 0 | 0 | 112.2 | G38 W39 W40 A45 A46 F55 H60 V136 Q139 | G38-I42 PolarHBondContact O-N 3.48Å; W39-I42 HydrophobicContact CE3-CG2 3.78Å; W39-I42 HydrophobicContact CZ3-CG2 4.3Å; W39-I42 WeakPolarHBondContact O-CG2 3.32Å; W39-I42 PolarHBondContact O-N 3.5Å; W40-I42 PolarHBondContact O-N 3.4Å; I42-A45 PolarHBondContact O-N 2.94Å; I42-A46 WeakPolarHBondContact O-CB 3.4Å; I42-A46 PolarHBondContact O-N 3.05Å; I42-F55 HydrophobicContact CD1-CZ 3.97Å; I42-H60 WeakPolarHBondContact CG1-ND1 3.45Å; I42-V136 HydrophobicContact CD1-CG2 3.74Å; I42-Q139 HydrophobicContact CB-CB 4.44Å; I42-Q139 HydrophobicContact CB-CG 4.38Å; I42-Q139 VanDerWaalsContact CG1-OE1 3.25Å; I42-Q139 HydrophobicContact CG2-CG 4.44Å |
| 43 | I | 92.5 | Very high | 90.8 | Very high | 91 Ų | 91 | 70.9 Ų | 70.9 | 47% | 0.467 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66.7 | -44.2 | 176 | -68.7 | 165.6 | 0 | 0 | 0 | 109.9 | W39 W40 A45 A46 V47 | W39-I43 WeakPolarHBondContact O-CD1 3.41Å; W39-I43 VanDerWaalsContact O-CG1 3.24Å; W39-I43 WeakPolarHBondContact O-CG1 3.49Å; W39-I43 PolarHBondContact O-N 2.9Å; W39-I43 VanDerWaalsContact O-N 3.13Å; W40-I43 PolarHBondContact O-N 3.12Å; I43-A45 VanDerWaalsContact C-N 3.32Å; I43-A45 PolarHBondContact O-N 3.28Å; I43-A46 PolarHBondContact O-N 3.34Å; I43-V47 HydrophobicContact CG2-CG2 4.44Å; I43-V47 WeakPolarHBondContact O-CG2 3.46Å; I43-V47 PolarHBondContact O-N 3.09Å |
| 44 | D | 93.3 | Very high | 90 | Very high | 75 Ų | 75 | 69.1 Ų | 69.1 | 40% | 0.401 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -57.5 | -46 | 174.4 | -175.8 | 75.9 | 0 | 0 | 0 | 111.5 | W40 A46 V47 K48 Y131 | W40-D44 PolarHBondContact O-N 3.23Å; D44-A46 PolarHBondContact O-N 3.35Å; D44-V47 PolarHBondContact O-N 2.93Å; D44-K48 WeakPolarHBondContact O-CB 3.25Å; D44-K48 PolarHBondContact O-N 3.35Å; D44-Y131 PolarHBondContact OD2-OH 3.01Å |
| 45 | A | 90.4 | Very high | 89.4 | Confident | 0 Ų | 0 | 67.3 Ų | 67.3 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63 | -41.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | I41 I42 I43 K48 Y49 Y131 A135 | I41-A45 PolarHBondContact O-N 2.63Å; I41-A45 VanDerWaalsContact O-N 3.09Å; I42-A45 PolarHBondContact O-N 2.94Å; I43-A45 VanDerWaalsContact C-N 3.32Å; I43-A45 PolarHBondContact O-N 3.28Å; A45-K48 PolarHBondContact O-N 3.37Å; A45-Y49 WeakPolarHBondContact O-CD2 3.47Å; A45-Y49 PolarHBondContact O-N 3.07Å; A45-Y131 HydrophobicContact CB-CD1 4.3Å; A45-Y131 HydrophobicContact CB-CE1 3.89Å; A45-A135 HydrophobicContact CB-CB 3.57Å |
| 46 | A | 89.2 | Confident | 89 | Confident | 31 Ų | 31 | 68 Ų | 68 | 26% | 0.256 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.6 | -38.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | I42 I43 D44 Y49 | I42-A46 WeakPolarHBondContact O-CB 3.4Å; I42-A46 PolarHBondContact O-N 3.05Å; I43-A46 PolarHBondContact O-N 3.34Å; D44-A46 PolarHBondContact O-N 3.35Å; A46-Y49 CarbonylContact O-C 3.51Å |
| 47 | V | 90.7 | Very high | 88.5 | Confident | 114 Ų | 114 | 66.6 Ų | 66.6 | 69% | 0.691 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -69.4 | -37.7 | 176.8 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | I43 D44 | I43-V47 HydrophobicContact CG2-CG2 4.44Å; I43-V47 WeakPolarHBondContact O-CG2 3.46Å; I43-V47 PolarHBondContact O-N 3.09Å; D44-V47 PolarHBondContact O-N 2.93Å |
| 48 | K | 90.3 | Very high | 88.1 | Confident | 127 Ų | 127 | 67.7 Ų | 67.7 | 55% | 0.552 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -75.4 | -29.5 | -179.2 | -169.4 | 169 | -177.5 | 171.7 | 0 | 113.6 | D44 A45 | D44-K48 WeakPolarHBondContact O-CB 3.25Å; D44-K48 PolarHBondContact O-N 3.35Å; A45-K48 PolarHBondContact O-N 3.37Å |
| 49 | Y | 87.5 | Confident | 87.9 | Confident | 43 Ų | 43 | 70 Ų | 70 | 17% | 0.169 | 37% | 0.371 | C | S | . | . | trans | -129 | 74.1 | -178.1 | -54.9 | -75.6 | 0 | 0 | 0 | 110.9 | A45 A46 D51 V54 V129 Y131 P132 | A45-Y49 WeakPolarHBondContact O-CD2 3.47Å; A45-Y49 PolarHBondContact O-N 3.07Å; A46-Y49 CarbonylContact O-C 3.51Å; Y49-D51 VanDerWaalsContact C-N 3.26Å; Y49-D51 PolarHBondContact O-N 3.29Å; Y49-V54 HydrophobicContact CD1-CG1 4.15Å; Y49-V129 HydrophobicContact CD1-CG1 4.29Å; Y49-V129 HydrophobicContact CE1-CB 4.43Å; Y49-V129 HydrophobicContact CE1-CG1 3.47Å; Y49-V129 VanDerWaalsContact CE1-CG1 3.47Å; Y49-V129 HydrophobicContact CE1-CG2 4.39Å; Y49-V129 HydrophobicContact CE2-CG1 4.22Å; Y49-V129 VanDerWaalsContact CZ-CG1 3.41Å; Y49-V129 VanDerWaalsContact OH-CG1 3.3Å; Y49-V129 WeakPolarHBondContact OH-CG1 3.35Å; Y49-Y131 HydrophobicContact CD2-CD1 4.39Å; Y49-Y131 AromaticContact CE2-CD1 3.63Å; Y49-Y131 HydrophobicContact CE2-CD1 3.63Å; Y49-Y131 HydrophobicContact CE2-CE1 4.46Å; Y49-Y131 HydrophobicContact CE2-CG 4.27Å; Y49-P132 HydrophobicContact CD2-CG 3.66Å; Y49-P132 HydrophobicContact CE2-CG 4.05Å; Y49-P132 HydrophobicContact CG-CG 4Å | ||
| 50 | P | 84.5 | Confident | 87.6 | Confident | 87 Ų | 87 | 69 Ų | 69 | 57% | 0.565 | 37% | 0.368 | S | S | * | . | trans | -74.3 | -15.2 | -178.7 | 31 | -36.2 | 0 | 0 | 0 | 113.5 | ||||
| 51 | D | 86.9 | Confident | 87.5 | Confident | 109 Ų | 109 | 65.4 Ų | 65.4 | 58% | 0.583 | 36% | 0.364 | S | S | * | . | trans | -79.2 | 121.3 | -176.5 | -69.2 | -44.5 | 0 | 0 | 0 | 112.6 | Y49 A53 V54 F55 | Y49-D51 VanDerWaalsContact C-N 3.26Å; Y49-D51 PolarHBondContact O-N 3.29Å; D51-A53 PolarHBondContact O-N 3.37Å; D51-A53 VanDerWaalsContact O-N 3.12Å; D51-V54 HydrophobicContact CB-CG2 4.31Å; D51-V54 PolarHBondContact O-N 3.49Å; D51-F55 PolarHBondContact O-N 3.32Å | ||
| 52 | E | 81.5 | Confident | 87.4 | Confident | 100 Ų | 100 | 63.9 Ų | 63.9 | 47% | 0.467 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50 | -35.4 | 174.2 | -90.2 | -101.3 | -173.9 | 0 | 0 | 113.9 | V54 F55 H56 H57 | E52-V54 PolarHBondContact O-N 3.06Å; E52-F55 WeakPolarHBondContact CA-O 3.42Å; E52-F55 CarbonylContact O-C 3.46Å; E52-H56 PolarHBondContact O-ND1 3.41Å; E52-H56 IonicContact OE2-ND1 2.88Å; E52-H57 WeakPolarHBondContact CG-ND1 3.46Å; E52-H57 IonicContact OE1-CE1 3.55Å; E52-H57 IonicContact OE1-CG 3.67Å; E52-H57 IonicContact OE1-ND1 2.67Å; E52-H57 PolarHBondContact OE1-ND1 2.94Å |
| 53 | A | 75.9 | Confident | 87.4 | Confident | 84 Ų | 84 | 63.7 Ų | 63.7 | 69% | 0.694 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | -28.9 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | D51 | D51-A53 PolarHBondContact O-N 3.37Å; D51-A53 VanDerWaalsContact O-N 3.12Å |
| 54 | V | 78 | Confident | 87.5 | Confident | 47 Ų | 47 | 62.7 Ų | 62.7 | 29% | 0.285 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.7 | -42.6 | 179.4 | -175.3 | 0 | 0 | 0 | 0 | 109.7 | Y49 D51 E52 | Y49-V54 HydrophobicContact CD1-CG1 4.15Å; D51-V54 HydrophobicContact CB-CG2 4.31Å; D51-V54 PolarHBondContact O-N 3.49Å; E52-V54 PolarHBondContact O-N 3.06Å |
| 55 | F | 82.7 | Confident | 87.6 | Confident | 4 Ų | 4 | 62.3 Ų | 62.3 | 2% | 0.018 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -136.2 | 107 | -175.7 | -176.8 | -127.6 | 0 | 0 | 0 | 111.5 | I42 D51 E52 H57 Y59 H60 F122 P132 V136 | I42-F55 HydrophobicContact CD1-CZ 3.97Å; D51-F55 PolarHBondContact O-N 3.32Å; E52-F55 WeakPolarHBondContact CA-O 3.42Å; E52-F55 CarbonylContact O-C 3.46Å; F55-H57 PolarHBondContact O-N 3.39Å; F55-Y59 AromaticContact CD2-CD2 3.95Å; F55-Y59 HydrophobicContact CD2-CD2 3.95Å; F55-Y59 AromaticContact CE2-CD2 3.94Å; F55-Y59 HydrophobicContact CE2-CD2 3.94Å; F55-Y59 HydrophobicContact CE2-CG 4.44Å; F55-H60 AromaticContact CE1-CE1 3.3Å; F55-H60 WeakPolarHBondContact CE1-CE1 3.33Å; F55-H60 AromaticContact CE1-NE2 3.2Å; F55-H60 WeakPolarHBondContact CE1-NE2 3.45Å; F55-H60 AromaticContact CZ-CE1 3.58Å; F55-H60 AromaticContact CZ-NE2 3.76Å; F55-F122 HydrophobicContact CD2-CZ 4.35Å; F55-P132 HydrophobicContact CB-CB 4.39Å; F55-P132 HydrophobicContact CD2-CB 3.53Å; F55-P132 HydrophobicContact CE2-CB 4Å; F55-P132 HydrophobicContact CG-CB 4.06Å; F55-V136 HydrophobicContact CE2-CG2 3.81Å; F55-V136 HydrophobicContact CZ-CG2 4.1Å |
| 56 | H | 86 | Confident | 87.8 | Confident | 76 Ų | 76 | 62.5 Ų | 62.5 | 35% | 0.352 | 35% | 0.353 | S | S | . | . | trans | -70.6 | 129 | 178.4 | -69.7 | -66.7 | 0 | 0 | 0 | 111.2 | E52 A58 Y59 | E52-H56 PolarHBondContact O-ND1 3.41Å; E52-H56 IonicContact OE2-ND1 2.88Å; H56-A58 PolarHBondContact O-N 3.25Å; H56-Y59 HydrophobicContact CB-CD2 4.02Å; H56-Y59 HydrophobicContact CB-CE2 3.9Å; H56-Y59 HydrophobicContact CB-CG 4.45Å; H56-Y59 AromaticContact CD2-CE2 3.99Å; H56-Y59 AromaticContact CD2-CZ 4Å; H56-Y59 WeakPolarHBondContact O-CB 3.38Å; H56-Y59 PolarHBondContact O-N 3.04Å | ||
| 57 | H | 84.2 | Confident | 88.1 | Confident | 96 Ų | 96 | 62 Ų | 62 | 44% | 0.444 | 35% | 0.346 | S | S | . | . | G | 310 helix | trans | -58.4 | -24.9 | 177.4 | -67 | 107.9 | 0 | 0 | 0 | 113.2 | E52 F55 Y59 H60 | E52-H57 WeakPolarHBondContact CG-ND1 3.46Å; E52-H57 IonicContact OE1-CE1 3.55Å; E52-H57 IonicContact OE1-CG 3.67Å; E52-H57 IonicContact OE1-ND1 2.67Å; E52-H57 PolarHBondContact OE1-ND1 2.94Å; F55-H57 PolarHBondContact O-N 3.39Å; H57-Y59 PolarHBondContact O-N 3.02Å; H57-Y59 VanDerWaalsContact O-N 3.15Å; H57-H60 WeakPolarHBondContact O-CB 3.22Å; H57-H60 PolarHBondContact O-CD2 3.16Å; H57-H60 PolarHBondContact O-N 3.44Å; H57-H60 VanDerWaalsContact O-N 3.13Å |
| 58 | A | 87.8 | Confident | 88.3 | Confident | 69 Ų | 69 | 59.8 Ų | 59.8 | 57% | 0.57 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -58.4 | -25.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | H56 H60 T61 | H56-A58 PolarHBondContact O-N 3.25Å; A58-H60 PolarHBondContact O-N 3.09Å; A58-T61 VanDerWaalsContact O-CB 3.29Å; A58-T61 WeakPolarHBondContact O-CB 3.33Å; A58-T61 PolarHBondContact O-N 2.91Å; A58-T61 PolarHBondContact O-OG1 3.44Å; A58-T61 VanDerWaalsContact O-OG1 3.04Å |
| 59 | Y | 88.4 | Confident | 88.5 | Confident | 49 Ų | 49 | 53.7 Ų | 53.7 | 19% | 0.192 | 31% | 0.307 | C | S | . | . | G | 310 helix | trans | -69.7 | -21.3 | 179.3 | -61.3 | -31.1 | 0 | 0 | 0 | 113.2 | F55 H56 H57 T61 C62 I117 F122 | F55-Y59 AromaticContact CD2-CD2 3.95Å; F55-Y59 HydrophobicContact CD2-CD2 3.95Å; F55-Y59 AromaticContact CE2-CD2 3.94Å; F55-Y59 HydrophobicContact CE2-CD2 3.94Å; F55-Y59 HydrophobicContact CE2-CG 4.44Å; H56-Y59 HydrophobicContact CB-CD2 4.02Å; H56-Y59 HydrophobicContact CB-CE2 3.9Å; H56-Y59 HydrophobicContact CB-CG 4.45Å; H56-Y59 AromaticContact CD2-CE2 3.99Å; H56-Y59 AromaticContact CD2-CZ 4Å; H56-Y59 WeakPolarHBondContact O-CB 3.38Å; H56-Y59 PolarHBondContact O-N 3.04Å; H57-Y59 PolarHBondContact O-N 3.02Å; H57-Y59 VanDerWaalsContact O-N 3.15Å; Y59-T61 VanDerWaalsContact C-N 3.26Å; Y59-T61 PolarHBondContact O-N 2.74Å; Y59-C62 WeakPolarHBondContact O-CB 3.33Å; Y59-C62 PolarHBondContact O-N 3.29Å; Y59-I117 HydrophobicContact CD1-CD1 3.64Å; Y59-I117 HydrophobicContact CD1-CG1 3.84Å; Y59-I117 HydrophobicContact CD1-CG2 3.89Å; Y59-I117 HydrophobicContact CD2-CG2 4.06Å; Y59-I117 HydrophobicContact CE1-CD1 4.28Å; Y59-I117 HydrophobicContact CE1-CG1 3.99Å; Y59-I117 HydrophobicContact CE1-CG2 4.04Å; Y59-I117 HydrophobicContact CE2-CG2 4.19Å; Y59-I117 HydrophobicContact CG-CD1 4.25Å; Y59-I117 HydrophobicContact CG-CG2 3.9Å; Y59-F122 HydrophobicContact CD2-CE2 4.27Å; Y59-F122 HydrophobicContact CD2-CZ 4.36Å; Y59-F122 AromaticContact CE2-CE2 3.93Å; Y59-F122 HydrophobicContact CE2-CE2 3.93Å; Y59-F122 HydrophobicContact CE2-CZ 4.04Å |
| 60 | H | 89.2 | Confident | 88.8 | Confident | 47 Ų | 47 | 53.2 Ų | 53.2 | 22% | 0.218 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -65.9 | -29 | 173.4 | -68.4 | -62.4 | 0 | 0 | 0 | 113.3 | I42 F55 H57 A58 C62 G63 V64 | I42-H60 WeakPolarHBondContact CG1-ND1 3.45Å; F55-H60 AromaticContact CE1-CE1 3.3Å; F55-H60 WeakPolarHBondContact CE1-CE1 3.33Å; F55-H60 AromaticContact CE1-NE2 3.2Å; F55-H60 WeakPolarHBondContact CE1-NE2 3.45Å; F55-H60 AromaticContact CZ-CE1 3.58Å; F55-H60 AromaticContact CZ-NE2 3.76Å; H57-H60 WeakPolarHBondContact O-CB 3.22Å; H57-H60 PolarHBondContact O-CD2 3.16Å; H57-H60 PolarHBondContact O-N 3.44Å; H57-H60 VanDerWaalsContact O-N 3.13Å; A58-H60 PolarHBondContact O-N 3.09Å; H60-C62 PolarHBondContact O-N 3.27Å; H60-C62 VanDerWaalsContact O-N 3.15Å; H60-G63 PolarHBondContact O-N 2.83Å; H60-G63 VanDerWaalsContact O-N 3.08Å; H60-V64 PolarHBondContact O-N 3.12Å; H60-V64 VanDerWaalsContact O-N 3.16Å |
| 61 | T | 91.3 | Very high | 89.2 | Confident | 79 Ų | 79 | 54.4 Ų | 54.4 | 49% | 0.485 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -55.4 | -35 | 179.3 | -50.8 | 0 | 0 | 0 | 0 | 111.7 | A58 Y59 V64 I65 | A58-T61 VanDerWaalsContact O-CB 3.29Å; A58-T61 WeakPolarHBondContact O-CB 3.33Å; A58-T61 PolarHBondContact O-N 2.91Å; A58-T61 PolarHBondContact O-OG1 3.44Å; A58-T61 VanDerWaalsContact O-OG1 3.04Å; Y59-T61 VanDerWaalsContact C-N 3.26Å; Y59-T61 PolarHBondContact O-N 2.74Å; T61-V64 PolarHBondContact O-N 3.01Å; T61-I65 HydrophobicContact CG2-CD1 3.98Å; T61-I65 HydrophobicContact CG2-CG1 4.41Å; T61-I65 WeakPolarHBondContact O-CG1 3.34Å; T61-I65 PolarHBondContact O-N 3.31Å |
| 62 | C | 92.8 | Very high | 89.3 | Confident | 9 Ų | 9 | 50.1 Ų | 50.1 | 6% | 0.061 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60 | -48.3 | 178.2 | -172.8 | 0 | 0 | 0 | 0 | 111.8 | Y59 H60 V64 I65 A66 S110 I117 N140 | Y59-C62 WeakPolarHBondContact O-CB 3.33Å; Y59-C62 PolarHBondContact O-N 3.29Å; H60-C62 PolarHBondContact O-N 3.27Å; H60-C62 VanDerWaalsContact O-N 3.15Å; C62-V64 PolarHBondContact O-N 3.37Å; C62-I65 PolarHBondContact O-N 3.11Å; C62-A66 PolarHBondContact O-N 2.91Å; C62-S110 PolarHBondContact SG-O 2.94Å; C62-I117 HydrophobicContact CB-CD1 4.34Å; C62-N140 PolarHBondContact O-OD1 3.23Å; C62-N140 PolarHBondContact SG-ND2 2.68Å; C62-N140 VanDerWaalsContact SG-ND2 3.41Å; C62-N140 PolarHBondContact SG-OD1 3.43Å; C62-N140 VanDerWaalsContact SG-OD1 3.37Å |
| 63 | G | 92.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -65.2 | -36.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | H60 A66 T67 | H60-G63 PolarHBondContact O-N 2.83Å; H60-G63 VanDerWaalsContact O-N 3.08Å; G63-A66 WeakPolarHBondContact O-CB 3.32Å; G63-A66 PolarHBondContact O-N 2.91Å; G63-T67 PolarHBondContact O-N 3.43Å |
| 64 | V | 94.8 | Very high | 90.3 | Very high | 70 Ų | 70 | 42.4 Ų | 42.4 | 42% | 0.424 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.6 | -46.1 | 174.8 | 178.3 | 0 | 0 | 0 | 0 | 110.9 | W39 H60 T61 C62 A66 T67 V68 | W39-V64 HydrophobicContact CH2-CG2 4.07Å; H60-V64 PolarHBondContact O-N 3.12Å; H60-V64 VanDerWaalsContact O-N 3.16Å; T61-V64 PolarHBondContact O-N 3.01Å; C62-V64 PolarHBondContact O-N 3.37Å; V64-A66 VanDerWaalsContact C-N 3.28Å; V64-A66 PolarHBondContact O-N 3.46Å; V64-T67 PolarHBondContact O-N 2.75Å; V64-T67 VanDerWaalsContact O-N 3.07Å; V64-T67 PolarHBondContact O-OG1 2.82Å; V64-V68 PolarHBondContact O-N 2.87Å |
| 65 | I | 94.8 | Very high | 90.6 | Very high | 67 Ų | 67 | 43.9 Ų | 43.9 | 34% | 0.344 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -60.5 | -41.2 | 176.6 | -68.1 | 168.9 | 0 | 0 | 0 | 110.6 | T61 C62 T67 V68 A69 L106 | T61-I65 HydrophobicContact CG2-CD1 3.98Å; T61-I65 HydrophobicContact CG2-CG1 4.41Å; T61-I65 WeakPolarHBondContact O-CG1 3.34Å; T61-I65 PolarHBondContact O-N 3.31Å; C62-I65 PolarHBondContact O-N 3.11Å; I65-T67 VanDerWaalsContact C-N 3.28Å; I65-T67 PolarHBondContact O-N 2.93Å; I65-V68 PolarHBondContact O-N 3.45Å; I65-A69 WeakPolarHBondContact O-CB 3.32Å; I65-A69 PolarHBondContact O-N 3.36Å; I65-L106 HydrophobicContact CG2-CB 4.2Å; I65-L106 HydrophobicContact CG2-CD2 4.11Å |
| 66 | A | 94.9 | Very high | 90.6 | Very high | 5 Ų | 5 | 44.2 Ų | 44.2 | 4% | 0.041 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59 | -38.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | C62 G63 V64 A69 F70 S110 N140 I143 | C62-A66 PolarHBondContact O-N 2.91Å; G63-A66 WeakPolarHBondContact O-CB 3.32Å; G63-A66 PolarHBondContact O-N 2.91Å; V64-A66 VanDerWaalsContact C-N 3.28Å; V64-A66 PolarHBondContact O-N 3.46Å; A66-A69 WeakPolarHBondContact O-CB 3.41Å; A66-A69 PolarHBondContact O-N 3.46Å; A66-F70 WeakPolarHBondContact O-CB 3.4Å; A66-F70 PolarHBondContact O-N 2.92Å; A66-S110 WeakPolarHBondContact CB-OG 3.37Å; A66-N140 WeakPolarHBondContact CB-OD1 3.36Å; A66-I143 HydrophobicContact CB-CB 4.37Å; A66-I143 HydrophobicContact CB-CD1 4.42Å; A66-I143 HydrophobicContact CB-CG2 3.94Å; A66-I143 WeakPolarHBondContact O-CG2 3.19Å |
| 67 | T | 95.4 | Very high | 90 | Very high | 19 Ų | 19 | 42.2 Ų | 42.2 | 12% | 0.117 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -70.4 | -37.6 | 175.8 | 52.8 | 0 | 0 | 0 | 0 | 114.4 | F35 W39 G63 V64 I65 A69 F70 L71 I143 | F35-T67 HydrophobicContact CE2-CG2 3.44Å; F35-T67 VanDerWaalsContact CE2-CG2 3.44Å; F35-T67 HydrophobicContact CZ-CG2 3.7Å; W39-T67 VanDerWaalsContact CE2-CG2 3.46Å; W39-T67 HydrophobicContact CZ2-CG2 3.31Å; G63-T67 PolarHBondContact O-N 3.43Å; V64-T67 PolarHBondContact O-N 2.75Å; V64-T67 VanDerWaalsContact O-N 3.07Å; V64-T67 PolarHBondContact O-OG1 2.82Å; I65-T67 VanDerWaalsContact C-N 3.28Å; I65-T67 PolarHBondContact O-N 2.93Å; T67-A69 VanDerWaalsContact C-N 3.28Å; T67-A69 PolarHBondContact O-N 3.04Å; T67-F70 WeakPolarHBondContact O-CB 3.41Å; T67-F70 PolarHBondContact O-N 2.92Å; T67-L71 WeakPolarHBondContact O-CG 3.36Å; T67-L71 PolarHBondContact O-N 3.28Å; T67-I143 HydrophobicContact CG2-CD1 3.75Å; T67-I143 HydrophobicContact CG2-CG1 4.46Å; T67-I143 HydrophobicContact CG2-CG2 4.28Å |
| 68 | V | 95.3 | Very high | 89.4 | Confident | 68 Ų | 68 | 39.2 Ų | 39.2 | 41% | 0.412 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.5 | -45.2 | 173.2 | 173.9 | 0 | 0 | 0 | 0 | 109.1 | V64 I65 F70 L71 M72 | V64-V68 PolarHBondContact O-N 2.87Å; I65-V68 PolarHBondContact O-N 3.45Å; V68-F70 PolarHBondContact O-N 3.22Å; V68-L71 PolarHBondContact O-N 2.88Å; V68-M72 HydrophobicContact CG1-CG 4.3Å; V68-M72 HydrophobicContact CG1-SD 3.96Å; V68-M72 VanDerWaalsContact O-CG 3.27Å; V68-M72 WeakPolarHBondContact O-CG 3.35Å; V68-M72 PolarHBondContact O-N 2.98Å |
| 69 | A | 94.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59.7 | -44 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | I65 A66 T67 L71 M72 I73 G103 L106 A107 | I65-A69 WeakPolarHBondContact O-CB 3.32Å; I65-A69 PolarHBondContact O-N 3.36Å; A66-A69 WeakPolarHBondContact O-CB 3.41Å; A66-A69 PolarHBondContact O-N 3.46Å; T67-A69 VanDerWaalsContact C-N 3.28Å; T67-A69 PolarHBondContact O-N 3.04Å; A69-L71 PolarHBondContact O-N 3.46Å; A69-M72 PolarHBondContact O-N 3.44Å; A69-I73 WeakPolarHBondContact O-CD1 3.46Å; A69-I73 VanDerWaalsContact O-CG1 3.27Å; A69-I73 WeakPolarHBondContact O-CG1 3.42Å; A69-I73 PolarHBondContact O-N 3.29Å; A69-G103 WeakPolarHBondContact CB-O 3.03Å; A69-L106 HydrophobicContact CB-CB 3.73Å; A69-A107 HydrophobicContact CB-CB 3.83Å |
| 70 | F | 93.6 | Very high | 87.5 | Confident | 32 Ų | 32 | 38.1 Ų | 38.1 | 14% | 0.14 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.1 | -48.8 | 173.8 | 170.4 | -86.4 | 0 | 0 | 0 | 111.6 | F35 A66 T67 V68 N74 I143 G147 | F35-F70 HydrophobicContact CD2-CD1 4.24Å; F35-F70 HydrophobicContact CD2-CD2 4.44Å; F35-F70 HydrophobicContact CD2-CE1 4.33Å; F35-F70 HydrophobicContact CD2-CG 4.33Å; F35-F70 HydrophobicContact CD2-CZ 4.48Å; F35-F70 HydrophobicContact CE2-CD1 4.15Å; F35-F70 HydrophobicContact CE2-CE1 4.49Å; F35-F70 HydrophobicContact CE2-CG 4.43Å; A66-F70 WeakPolarHBondContact O-CB 3.4Å; A66-F70 PolarHBondContact O-N 2.92Å; T67-F70 WeakPolarHBondContact O-CB 3.41Å; T67-F70 PolarHBondContact O-N 2.92Å; V68-F70 PolarHBondContact O-N 3.22Å; F70-N74 WeakPolarHBondContact CD2-ND2 3.34Å; F70-N74 VanDerWaalsContact CE2-ND2 3.32Å; F70-N74 WeakPolarHBondContact CE2-ND2 3.44Å; F70-N74 VanDerWaalsContact O-CB 3.31Å; F70-N74 WeakPolarHBondContact O-CB 3.49Å; F70-N74 PolarHBondContact O-N 3.49Å; F70-N74 VanDerWaalsContact O-N 3.13Å; F70-N74 PolarHBondContact O-ND2 2.92Å; F70-I143 HydrophobicContact CB-CG2 3.96Å; F70-G147 VanDerWaalsContact CE2-CA 3.45Å |
| 71 | L | 91.8 | Very high | 86.4 | Confident | 113 Ų | 113 | 37.9 Ų | 37.9 | 59% | 0.592 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -65.3 | -43.3 | 178.7 | -69 | 175.8 | 0 | 0 | 0 | 111.5 | T67 V68 A69 I73 N74 A75 | T67-L71 WeakPolarHBondContact O-CG 3.36Å; T67-L71 PolarHBondContact O-N 3.28Å; V68-L71 PolarHBondContact O-N 2.88Å; A69-L71 PolarHBondContact O-N 3.46Å; L71-I73 PolarHBondContact O-N 3.21Å; L71-N74 PolarHBondContact O-N 3.43Å; L71-A75 WeakPolarHBondContact O-CB 3.32Å; L71-A75 PolarHBondContact O-N 3.24Å |
| 72 | M | 90.1 | Very high | 85.2 | Confident | 18 Ų | 18 | 42.9 Ų | 42.9 | 9% | 0.089 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.5 | -45.2 | 179.3 | -72.3 | 179.2 | 72.7 | 0 | 0 | 112.6 | V68 A69 W99 I102 L106 | V68-M72 HydrophobicContact CG1-CG 4.3Å; V68-M72 HydrophobicContact CG1-SD 3.96Å; V68-M72 VanDerWaalsContact O-CG 3.27Å; V68-M72 WeakPolarHBondContact O-CG 3.35Å; V68-M72 PolarHBondContact O-N 2.98Å; A69-M72 PolarHBondContact O-N 3.44Å; M72-W99 HydrophobicContact CB-CZ2 4.46Å; M72-W99 HydrophobicContact CE-CD2 3.81Å; M72-W99 HydrophobicContact CE-CE3 4.07Å; M72-W99 HydrophobicContact CE-CG 4.38Å; M72-W99 HydrophobicContact CE-CH2 4.05Å; M72-W99 HydrophobicContact CE-CZ2 3.79Å; M72-W99 HydrophobicContact CE-CZ3 4.18Å; M72-W99 HydrophobicContact CG-CZ2 3.74Å; M72-W99 PolarHBondContact O-NE1 3.44Å; M72-W99 HydrophobicContact SD-CZ2 4.4Å; M72-I102 HydrophobicContact CE-CB 4.19Å; M72-I102 HydrophobicContact CE-CG2 3.81Å; M72-L106 HydrophobicContact SD-CD1 3.79Å |
| 73 | I | 89.6 | Confident | 83.7 | Confident | 6 Ų | 6 | 43.5 Ų | 43.5 | 3% | 0.031 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.5 | -42.4 | -179 | -67.3 | 163.3 | 0 | 0 | 0 | 110.8 | A69 L71 F104 A107 K151 | A69-I73 WeakPolarHBondContact O-CD1 3.46Å; A69-I73 VanDerWaalsContact O-CG1 3.27Å; A69-I73 WeakPolarHBondContact O-CG1 3.42Å; A69-I73 PolarHBondContact O-N 3.29Å; L71-I73 PolarHBondContact O-N 3.21Å; I73-F104 HydrophobicContact CD1-CD1 3.63Å; I73-F104 HydrophobicContact CD1-CE1 3.85Å; I73-F104 HydrophobicContact CD1-CG 4.26Å; I73-F104 HydrophobicContact CG1-CD1 4.31Å; I73-F104 HydrophobicContact CG1-CE1 4.42Å; I73-F104 HydrophobicContact CG2-CE1 4.28Å; I73-F104 HydrophobicContact CG2-CZ 4.22Å; I73-A107 HydrophobicContact CD1-CB 3.98Å; I73-K151 HydrophobicContact CG2-CB 4.21Å; I73-K151 HydrophobicContact CG2-CD 4.02Å; I73-K151 HydrophobicContact CG2-CG 3.96Å; I73-K151 PolarHBondContact O-NZ 2.88Å |
| 74 | N | 87.7 | Confident | 82 | Confident | 16 Ų | 16 | 47.6 Ų | 47.6 | 9% | 0.086 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -85.5 | -18.4 | -173.4 | -68.2 | -50.5 | 0 | 0 | 0 | 114 | F70 L71 V76 G147 F150 K151 | F70-N74 WeakPolarHBondContact CD2-ND2 3.34Å; F70-N74 VanDerWaalsContact CE2-ND2 3.32Å; F70-N74 WeakPolarHBondContact CE2-ND2 3.44Å; F70-N74 VanDerWaalsContact O-CB 3.31Å; F70-N74 WeakPolarHBondContact O-CB 3.49Å; F70-N74 PolarHBondContact O-N 3.49Å; F70-N74 VanDerWaalsContact O-N 3.13Å; F70-N74 PolarHBondContact O-ND2 2.92Å; L71-N74 PolarHBondContact O-N 3.43Å; N74-V76 VanDerWaalsContact C-N 3.31Å; N74-G147 PolarHBondContact OD1-O 3.29Å; N74-F150 HydrophobicContact CB-CD1 3.67Å; N74-F150 HydrophobicContact CB-CE1 4.02Å; N74-F150 VanDerWaalsContact CG-CD1 3.47Å; N74-F150 VanDerWaalsContact OD1-CD1 3.28Å; N74-F150 WeakPolarHBondContact OD1-CD1 3.15Å; N74-K151 WeakPolarHBondContact OD1-CB 3.28Å; N74-K151 PolarHBondContact OD1-N 3Å |
| 75 | A | 85.3 | Confident | 80.1 | Confident | 78 Ų | 78 | 46.5 Ų | 46.5 | 65% | 0.645 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -71.5 | -24.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | L71 | L71-A75 WeakPolarHBondContact O-CB 3.32Å; L71-A75 PolarHBondContact O-N 3.24Å |
| 76 | V | 81.7 | Confident | 78 | Confident | 12 Ų | 12 | 54.5 Ų | 54.5 | 7% | 0.073 | 29% | 0.285 | C | S | . | . | S | Bend | trans | -85.7 | 125.9 | 178.2 | -179.3 | 0 | 0 | 0 | 0 | 109.8 | N74 Q80 V81 A96 W99 L100 K151 | N74-V76 VanDerWaalsContact C-N 3.31Å; V76-Q80 HydrophobicContact CG1-CB 4.41Å; V76-V81 HydrophobicContact CG1-CG2 3.89Å; V76-A96 HydrophobicContact CG1-CB 4.35Å; V76-W99 VanDerWaalsContact CG2-CD1 3.47Å; V76-W99 HydrophobicContact CG2-CG 4.39Å; V76-L100 HydrophobicContact CG1-CD1 4.42Å; V76-K151 PolarHBondContact O-NZ 3.45Å |
| 77 | S | 75.1 | Confident | 75.9 | Confident | 34 Ų | 34 | 59 Ų | 59 | 24% | 0.238 | 32% | 0.316 | C | S | . | . | trans | -68.1 | 146.6 | 174.1 | 151.4 | 0 | 0 | 0 | 0 | 111.1 | G79 Q80 E156 | S77-G79 VanDerWaalsContact C-N 3.27Å; S77-G79 PolarHBondContact O-N 3.09Å; S77-G79 PolarHBondContact OG-N 3.27Å; S77-G79 VanDerWaalsContact OG-N 3.13Å; S77-Q80 PolarHBondContact O-N 3.2Å; S77-E156 VanDerWaalsContact CA-OE1 3.23Å; S77-E156 WeakPolarHBondContact CA-OE1 3.47Å; S77-E156 WeakPolarHBondContact CB-OE1 3.42Å; S77-E156 VanDerWaalsContact OG-CD 3.23Å; S77-E156 PolarHBondContact OG-OE1 3.19Å; S77-E156 VanDerWaalsContact OG-OE1 3.11Å; S77-E156 PolarHBondContact OG-OE2 3.06Å | ||
| 78 | N | 71.2 | Confident | 73.8 | Confident | 32 Ų | 32 | 67.3 Ų | 67.3 | 17% | 0.171 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.1 | -33.4 | 175 | -71.4 | -36.5 | 0 | 0 | 0 | 111.5 | Q80 V81 R82 K151 E156 | N78-Q80 VanDerWaalsContact C-N 3.35Å; N78-Q80 PolarHBondContact O-N 3.48Å; N78-V81 PolarHBondContact O-N 3.33Å; N78-R82 PolarHBondContact O-N 3.05Å; N78-R82 VanDerWaalsContact O-N 3.16Å; N78-K151 PolarHBondContact ND2-O 3.5Å; N78-K151 WeakPolarHBondContact OD1-CE 3.26Å; N78-E156 WeakPolarHBondContact CA-OE2 3.49Å; N78-E156 WeakPolarHBondContact CB-OE2 3.32Å; N78-E156 VanDerWaalsContact N-CD 3.32Å; N78-E156 PolarHBondContact N-OE1 3.46Å; N78-E156 PolarHBondContact N-OE2 3.12Å |
| 79 | G | 68 | Low | 71.9 | Confident | 5 Ų | 5 | 66 Ų | 66 | 5% | 0.052 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -62.4 | -34.6 | 174 | 0 | 0 | 0 | 0 | 0 | 114.2 | S77 V81 G83 D84 E156 | S77-G79 VanDerWaalsContact C-N 3.27Å; S77-G79 PolarHBondContact O-N 3.09Å; S77-G79 PolarHBondContact OG-N 3.27Å; S77-G79 VanDerWaalsContact OG-N 3.13Å; G79-V81 VanDerWaalsContact C-N 3.27Å; G79-V81 PolarHBondContact O-N 3.48Å; G79-G83 PolarHBondContact O-N 3.45Å; G79-G83 VanDerWaalsContact O-N 3.14Å; G79-D84 PolarHBondContact O-N 3.4Å; G79-E156 PolarHBondContact N-OE2 3.45Å |
| 80 | Q | 68.5 | Low | 69.9 | Low | 90 Ų | 90 | 73.1 Ų | 73.1 | 42% | 0.421 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -68.9 | -25.7 | 175.5 | -67.5 | 179.9 | -48.4 | 0 | 0 | 112.9 | V76 S77 N78 A96 | V76-Q80 HydrophobicContact CG1-CB 4.41Å; S77-Q80 PolarHBondContact O-N 3.2Å; N78-Q80 VanDerWaalsContact C-N 3.35Å; N78-Q80 PolarHBondContact O-N 3.48Å; Q80-A96 HydrophobicContact CB-CB 4.49Å |
| 81 | V | 65.8 | Low | 68.3 | Low | 42 Ų | 42 | 77.8 Ų | 77.8 | 26% | 0.255 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -81.7 | -40.3 | 178.6 | -178.3 | 0 | 0 | 0 | 0 | 111.3 | V76 N78 G79 G83 R97 L100 | V76-V81 HydrophobicContact CG1-CG2 3.89Å; N78-V81 PolarHBondContact O-N 3.33Å; G79-V81 VanDerWaalsContact C-N 3.27Å; G79-V81 PolarHBondContact O-N 3.48Å; V81-G83 VanDerWaalsContact C-N 3.28Å; V81-G83 PolarHBondContact O-N 3.21Å; V81-R97 PolarHBondContact O-NH2 2.85Å; V81-L100 HydrophobicContact CG2-CD1 3.44Å; V81-L100 VanDerWaalsContact CG2-CD1 3.44Å |
| 82 | R | 65.5 | Low | 67.2 | Low | 184 Ų | 184 | 74.3 Ų | 74.3 | 69% | 0.694 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -68.9 | -26.4 | 177.9 | -72.7 | -178.7 | 175.1 | 164.4 | -0.7 | 113 | N78 D84 | N78-R82 PolarHBondContact O-N 3.05Å; N78-R82 VanDerWaalsContact O-N 3.16Å; R82-D84 VanDerWaalsContact CB-OD2 3.3Å; R82-D84 WeakPolarHBondContact CB-OD2 3.19Å |
| 83 | G | 61 | Low | 66.4 | Low | 22 Ų | 22 | 77.7 Ų | 77.7 | 23% | 0.227 | 44% | 0.435 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 87.7 | 14.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | G79 V81 S85 Q93 | G79-G83 PolarHBondContact O-N 3.45Å; G79-G83 VanDerWaalsContact O-N 3.14Å; V81-G83 VanDerWaalsContact C-N 3.28Å; V81-G83 PolarHBondContact O-N 3.21Å; G83-S85 PolarHBondContact O-N 2.7Å; G83-Q93 PolarHBondContact O-NE2 3.47Å; G83-Q93 VanDerWaalsContact O-NE2 3.12Å |
| 84 | D | 58.8 | Low | 65.8 | Low | 86 Ų | 86 | 82.4 Ų | 82.4 | 46% | 0.46 | 46% | 0.464 | S | S | . | . | trans | -76.4 | -7.8 | 177.6 | -56.6 | -37.5 | 0 | 0 | 0 | 112.3 | G79 R82 Y86 L158 | G79-D84 PolarHBondContact O-N 3.4Å; R82-D84 VanDerWaalsContact CB-OD2 3.3Å; R82-D84 WeakPolarHBondContact CB-OD2 3.19Å; D84-Y86 PolarHBondContact O-N 3.34Å; D84-L158 HydrophobicContact CB-CD1 4.19Å | ||
| 85 | S | 54.5 | Low | 65.4 | Low | 47 Ų | 47 | 82.5 Ų | 82.5 | 33% | 0.329 | 47% | 0.469 | S | S | . | . | trans | -82.9 | 111.6 | 175 | -64.8 | 0 | 0 | 0 | 0 | 111 | G83 S87 | G83-S85 PolarHBondContact O-N 2.7Å; S85-S87 PolarHBondContact O-N 3.44Å | ||
| 86 | Y | 49.2 | Very low | 65.2 | Low | 236 Ų | 236 | 79.6 Ų | 79.6 | 93% | 0.925 | 44% | 0.444 | S | S | * | . | trans | -67.6 | 6.7 | 170.5 | -68.8 | -83.3 | 0 | 0 | 0 | 114.3 | D84 | D84-Y86 PolarHBondContact O-N 3.34Š| ||
| 87 | S | 51.6 | Low | 65.3 | Low | 98 Ų | 98 | 85 Ų | 85 | 69% | 0.685 | 46% | 0.463 | S | S | * | . | trans | -94.1 | 102.4 | -179.4 | -173.6 | 0 | 0 | 0 | 0 | 110.6 | S85 G89 | S85-S87 PolarHBondContact O-N 3.44Å; S87-G89 PolarHBondContact O-N 3.08Å | ||
| 88 | E | 51.5 | Low | 65.9 | Low | 194 Ų | 194 | 87 Ų | 87 | 91% | 0.907 | 47% | 0.474 | S | S | * | . | trans | -67.1 | 77.1 | 163.8 | -68.6 | -179 | 156 | 0 | 0 | 110.3 | ||||
| 89 | G | 54.6 | Low | 66.7 | Low | 42 Ų | 42 | 91.5 Ų | 91.5 | 43% | 0.433 | 49% | 0.489 | S | S | . | . | trans | -67 | 155.8 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | S87 I91 G92 | S87-G89 PolarHBondContact O-N 3.08Å; G89-I91 PolarHBondContact O-N 3.32Å; G89-G92 PolarHBondContact O-N 3.43Å | ||
| 90 | C | 53.8 | Low | 67.7 | Low | 149 Ų | 149 | 92.4 Ų | 92.4 | 100% | 1.007 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.9 | -17.3 | -174.7 | -74.9 | 0 | 0 | 0 | 0 | 116.9 | ||
| 91 | I | 58.2 | Low | 68.8 | Low | 130 Ų | 130 | 94.4 Ų | 94.4 | 67% | 0.667 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.1 | -8 | -176.8 | -71.9 | 178.3 | 0 | 0 | 0 | 112.2 | G89 G95 | G89-I91 PolarHBondContact O-N 3.32Å; I91-G95 VanDerWaalsContact CG2-CA 3.41Å; I91-G95 PolarHBondContact O-N 3.43Å; I91-G95 VanDerWaalsContact O-N 3.16Å |
| 92 | G | 69.4 | Low | 70.1 | Confident | 40 Ų | 40 | 95.9 Ų | 95.9 | 41% | 0.412 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | 59.2 | -173.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | G89 T94 A96 | G89-G92 PolarHBondContact O-N 3.43Å; G92-T94 VanDerWaalsContact C-N 3.28Å; G92-T94 PolarHBondContact O-N 2.89Å; G92-A96 PolarHBondContact O-N 2.96Å |
| 93 | Q | 72.6 | Confident | 71.3 | Confident | 88 Ų | 88 | 87.1 Ų | 87.1 | 41% | 0.411 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.5 | -33.5 | 175.8 | -66 | 177.8 | 2.5 | 0 | 0 | 112.3 | G83 A96 R97 | G83-Q93 PolarHBondContact O-NE2 3.47Å; G83-Q93 VanDerWaalsContact O-NE2 3.12Å; Q93-A96 PolarHBondContact O-N 3.45Å; Q93-R97 WeakPolarHBondContact O-CG 3.47Å; Q93-R97 PolarHBondContact O-N 3.29Å |
| 94 | T | 77.1 | Confident | 72.8 | Confident | 106 Ų | 106 | 88.3 Ų | 88.3 | 65% | 0.65 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.7 | -44 | -178.6 | -53.1 | 0 | 0 | 0 | 0 | 111.6 | G92 R97 V98 | G92-T94 VanDerWaalsContact C-N 3.28Å; G92-T94 PolarHBondContact O-N 2.89Å; T94-R97 WeakPolarHBondContact O-CB 3.27Å; T94-R97 PolarHBondContact O-N 2.93Å; T94-V98 WeakPolarHBondContact O-CG2 3.12Å; T94-V98 PolarHBondContact O-N 2.92Å |
| 95 | G | 80.2 | Confident | 74.6 | Confident | 18 Ų | 18 | 89.5 Ų | 89.5 | 19% | 0.186 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -76.1 | -26.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114 | I91 R97 V98 W99 | I91-G95 VanDerWaalsContact CG2-CA 3.41Å; I91-G95 PolarHBondContact O-N 3.43Å; I91-G95 VanDerWaalsContact O-N 3.16Å; G95-R97 VanDerWaalsContact C-N 3.29Å; G95-R97 PolarHBondContact O-N 2.75Å; G95-V98 PolarHBondContact O-N 3.23Å; G95-W99 VanDerWaalsContact O-CB 3.29Å; G95-W99 WeakPolarHBondContact O-CB 3.35Å; G95-W99 PolarHBondContact O-N 3.03Å |
| 96 | A | 81.5 | Confident | 76.5 | Confident | 16 Ų | 16 | 90.2 Ų | 90.2 | 13% | 0.132 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | V76 Q80 G92 Q93 L100 | V76-A96 HydrophobicContact CG1-CB 4.35Å; Q80-A96 HydrophobicContact CB-CB 4.49Å; G92-A96 PolarHBondContact O-N 2.96Å; Q93-A96 PolarHBondContact O-N 3.45Å; A96-L100 VanDerWaalsContact O-CB 3.26Å; A96-L100 WeakPolarHBondContact O-CB 3.34Å; A96-L100 PolarHBondContact O-N 2.94Å |
| 97 | R | 84.1 | Confident | 78.7 | Confident | 125 Ų | 125 | 79.2 Ų | 79.2 | 47% | 0.472 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -67.5 | -43 | 175 | -67.9 | 174.4 | -176.2 | 174.6 | 4.2 | 112.3 | V81 Q93 T94 G95 L100 F101 | V81-R97 PolarHBondContact O-NH2 2.85Å; Q93-R97 WeakPolarHBondContact O-CG 3.47Å; Q93-R97 PolarHBondContact O-N 3.29Å; T94-R97 WeakPolarHBondContact O-CB 3.27Å; T94-R97 PolarHBondContact O-N 2.93Å; G95-R97 VanDerWaalsContact C-N 3.29Å; G95-R97 PolarHBondContact O-N 2.75Å; R97-L100 PolarHBondContact O-N 2.9Å; R97-F101 VanDerWaalsContact O-CB 3.29Å; R97-F101 WeakPolarHBondContact O-CB 3.48Å; R97-F101 PolarHBondContact O-N 3.45Å |
| 98 | V | 87.4 | Confident | 80.7 | Confident | 77 Ų | 77 | 79.5 Ų | 79.5 | 47% | 0.467 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.2 | -44.5 | 176.3 | 171.9 | 0 | 0 | 0 | 0 | 111 | T94 G95 L100 F101 I102 | T94-V98 WeakPolarHBondContact O-CG2 3.12Å; T94-V98 PolarHBondContact O-N 2.92Å; G95-V98 PolarHBondContact O-N 3.23Å; V98-L100 VanDerWaalsContact C-N 3.35Å; V98-L100 PolarHBondContact O-N 3.4Å; V98-F101 WeakPolarHBondContact O-CB 3.44Å; V98-F101 PolarHBondContact O-N 3.48Å; V98-I102 HydrophobicContact CG1-CD1 3.91Å; V98-I102 HydrophobicContact CG1-CG1 4.48Å; V98-I102 WeakPolarHBondContact O-CG1 3.46Å; V98-I102 PolarHBondContact O-N 2.97Å |
| 99 | W | 88.4 | Confident | 82.9 | Confident | 127 Ų | 127 | 72 Ų | 72 | 48% | 0.481 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -59.5 | -46.1 | 177.1 | -175.5 | -91.7 | 0 | 0 | 0 | 112 | M72 V76 G95 I102 G103 | M72-W99 HydrophobicContact CB-CZ2 4.46Å; M72-W99 HydrophobicContact CE-CD2 3.81Å; M72-W99 HydrophobicContact CE-CE3 4.07Å; M72-W99 HydrophobicContact CE-CG 4.38Å; M72-W99 HydrophobicContact CE-CH2 4.05Å; M72-W99 HydrophobicContact CE-CZ2 3.79Å; M72-W99 HydrophobicContact CE-CZ3 4.18Å; M72-W99 HydrophobicContact CG-CZ2 3.74Å; M72-W99 PolarHBondContact O-NE1 3.44Å; M72-W99 HydrophobicContact SD-CZ2 4.4Å; V76-W99 VanDerWaalsContact CG2-CD1 3.47Å; V76-W99 HydrophobicContact CG2-CG 4.39Å; G95-W99 VanDerWaalsContact O-CB 3.29Å; G95-W99 WeakPolarHBondContact O-CB 3.35Å; G95-W99 PolarHBondContact O-N 3.03Å; W99-I102 PolarHBondContact O-N 3.29Å; W99-G103 PolarHBondContact O-N 3.32Å |
| 100 | L | 88.6 | Confident | 84.8 | Confident | 24 Ų | 24 | 70.3 Ų | 70.3 | 13% | 0.126 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.4 | -39.8 | 177.6 | -170.7 | 161.9 | 0 | 0 | 0 | 111.4 | V76 V81 A96 R97 V98 G103 F104 | V76-L100 HydrophobicContact CG1-CD1 4.42Å; V81-L100 HydrophobicContact CG2-CD1 3.44Å; V81-L100 VanDerWaalsContact CG2-CD1 3.44Å; A96-L100 VanDerWaalsContact O-CB 3.26Å; A96-L100 WeakPolarHBondContact O-CB 3.34Å; A96-L100 PolarHBondContact O-N 2.94Å; R97-L100 PolarHBondContact O-N 2.9Å; V98-L100 VanDerWaalsContact C-N 3.35Å; V98-L100 PolarHBondContact O-N 3.4Å; L100-G103 PolarHBondContact O-N 2.85Å; L100-F104 HydrophobicContact CD2-CD2 3.38Å; L100-F104 HydrophobicContact CD2-CE2 3.29Å; L100-F104 HydrophobicContact CD2-CZ 4.44Å; L100-F104 HydrophobicContact CG-CE2 4.33Å; L100-F104 PolarHBondContact O-N 3.36Å |
| 101 | F | 90.7 | Very high | 86.8 | Confident | 132 Ų | 132 | 64.9 Ų | 64.9 | 58% | 0.579 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -61 | -47.1 | 174.7 | 179.7 | -105.2 | 0 | 0 | 0 | 112.1 | R97 V98 G103 F104 M105 | R97-F101 VanDerWaalsContact O-CB 3.29Å; R97-F101 WeakPolarHBondContact O-CB 3.48Å; R97-F101 PolarHBondContact O-N 3.45Å; V98-F101 WeakPolarHBondContact O-CB 3.44Å; V98-F101 PolarHBondContact O-N 3.48Å; F101-G103 VanDerWaalsContact C-N 3.3Å; F101-G103 PolarHBondContact O-N 3.19Å; F101-F104 PolarHBondContact O-N 2.86Å; F101-M105 HydrophobicContact CD1-CG 4.33Å; F101-M105 HydrophobicContact CD1-SD 3.78Å; F101-M105 HydrophobicContact CE1-CG 4Å; F101-M105 HydrophobicContact CE1-SD 3.19Å; F101-M105 WeakPolarHBondContact CE1-SD 3.42Å; F101-M105 HydrophobicContact CE2-CG 4.45Å; F101-M105 HydrophobicContact CZ-CG 4.06Å; F101-M105 HydrophobicContact CZ-SD 3.65Å; F101-M105 WeakPolarHBondContact O-CG 3.33Å; F101-M105 PolarHBondContact O-N 2.95Å |
| 102 | I | 92.7 | Very high | 88.5 | Confident | 73 Ų | 73 | 64.3 Ų | 64.3 | 37% | 0.374 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.3 | -43.1 | 174.8 | -65.7 | 166.6 | 0 | 0 | 0 | 110.3 | M72 V98 W99 F104 M105 L106 | M72-I102 HydrophobicContact CE-CB 4.19Å; M72-I102 HydrophobicContact CE-CG2 3.81Å; V98-I102 HydrophobicContact CG1-CD1 3.91Å; V98-I102 HydrophobicContact CG1-CG1 4.48Å; V98-I102 WeakPolarHBondContact O-CG1 3.46Å; V98-I102 PolarHBondContact O-N 2.97Å; W99-I102 PolarHBondContact O-N 3.29Å; I102-F104 PolarHBondContact O-N 3.41Å; I102-M105 PolarHBondContact O-N 3.48Å; I102-L106 HydrophobicContact CG2-CD1 4.07Å; I102-L106 HydrophobicContact CG2-CG 4.33Å; I102-L106 WeakPolarHBondContact O-CG 3.38Å; I102-L106 PolarHBondContact O-N 3.49Å |
| 103 | G | 92.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -55 | -48.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A69 W99 L100 F101 L106 A107 | A69-G103 WeakPolarHBondContact CB-O 3.03Å; W99-G103 PolarHBondContact O-N 3.32Å; L100-G103 PolarHBondContact O-N 2.85Å; F101-G103 VanDerWaalsContact C-N 3.3Å; F101-G103 PolarHBondContact O-N 3.19Å; G103-L106 PolarHBondContact O-N 2.85Å; G103-A107 WeakPolarHBondContact O-CB 3.36Å; G103-A107 PolarHBondContact O-N 2.88Å |
| 104 | F | 92.3 | Very high | 90.8 | Very high | 47 Ų | 47 | 60.1 Ų | 60.1 | 21% | 0.206 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.1 | -39.4 | 176.3 | -82.2 | -50.5 | 0 | 0 | 0 | 113.1 | I73 L100 F101 I102 L106 A107 F108 L148 | I73-F104 HydrophobicContact CD1-CD1 3.63Å; I73-F104 HydrophobicContact CD1-CE1 3.85Å; I73-F104 HydrophobicContact CD1-CG 4.26Å; I73-F104 HydrophobicContact CG1-CD1 4.31Å; I73-F104 HydrophobicContact CG1-CE1 4.42Å; I73-F104 HydrophobicContact CG2-CE1 4.28Å; I73-F104 HydrophobicContact CG2-CZ 4.22Å; L100-F104 HydrophobicContact CD2-CD2 3.38Å; L100-F104 HydrophobicContact CD2-CE2 3.29Å; L100-F104 HydrophobicContact CD2-CZ 4.44Å; L100-F104 HydrophobicContact CG-CE2 4.33Å; L100-F104 PolarHBondContact O-N 3.36Å; F101-F104 PolarHBondContact O-N 2.86Å; I102-F104 PolarHBondContact O-N 3.41Å; F104-L106 VanDerWaalsContact C-N 3.32Å; F104-L106 PolarHBondContact O-N 2.99Å; F104-A107 PolarHBondContact O-N 3.31Å; F104-F108 HydrophobicContact CB-CD2 4.37Å; F104-F108 HydrophobicContact CB-CE2 4.36Å; F104-F108 HydrophobicContact CD1-CE2 4.32Å; F104-F108 WeakPolarHBondContact O-CD2 3.4Å; F104-F108 PolarHBondContact O-N 3.13Å; F104-L148 HydrophobicContact CE1-CD2 3.8Å |
| 105 | M | 95.8 | Very high | 91.6 | Very high | 110 Ų | 110 | 58.9 Ų | 58.9 | 54% | 0.542 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58.9 | -44.1 | 175.2 | -73.6 | -175.5 | 73.9 | 0 | 0 | 111.8 | F101 I102 G109 | F101-M105 HydrophobicContact CD1-CG 4.33Å; F101-M105 HydrophobicContact CD1-SD 3.78Å; F101-M105 HydrophobicContact CE1-CG 4Å; F101-M105 HydrophobicContact CE1-SD 3.19Å; F101-M105 WeakPolarHBondContact CE1-SD 3.42Å; F101-M105 HydrophobicContact CE2-CG 4.45Å; F101-M105 HydrophobicContact CZ-CG 4.06Å; F101-M105 HydrophobicContact CZ-SD 3.65Å; F101-M105 WeakPolarHBondContact O-CG 3.33Å; F101-M105 PolarHBondContact O-N 2.95Å; I102-M105 PolarHBondContact O-N 3.48Å; M105-G109 WeakPolarHBondContact O-CA 3.43Å; M105-G109 PolarHBondContact O-N 3.27Å |
| 106 | L | 94.9 | Very high | 92.3 | Very high | 62 Ų | 62 | 67.2 Ų | 67.2 | 33% | 0.325 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.2 | -40.7 | 176.5 | -68.2 | 174.6 | 0 | 0 | 0 | 111.7 | I65 A69 M72 I102 G103 F104 G109 S110 | I65-L106 HydrophobicContact CG2-CB 4.2Å; I65-L106 HydrophobicContact CG2-CD2 4.11Å; A69-L106 HydrophobicContact CB-CB 3.73Å; M72-L106 HydrophobicContact SD-CD1 3.79Å; I102-L106 HydrophobicContact CG2-CD1 4.07Å; I102-L106 HydrophobicContact CG2-CG 4.33Å; I102-L106 WeakPolarHBondContact O-CG 3.38Å; I102-L106 PolarHBondContact O-N 3.49Å; G103-L106 PolarHBondContact O-N 2.85Å; F104-L106 VanDerWaalsContact C-N 3.32Å; F104-L106 PolarHBondContact O-N 2.99Å; L106-G109 PolarHBondContact O-N 3.14Å; L106-S110 WeakPolarHBondContact O-CB 3.34Å; L106-S110 PolarHBondContact O-N 2.92Å; L106-S110 PolarHBondContact O-OG 3.4Å |
| 107 | A | 94.6 | Very high | 92.8 | Very high | 5 Ų | 5 | 67.4 Ų | 67.4 | 4% | 0.041 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65.2 | -45.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A69 I73 G103 F104 S110 L111 F144 | A69-A107 HydrophobicContact CB-CB 3.83Å; I73-A107 HydrophobicContact CD1-CB 3.98Å; G103-A107 WeakPolarHBondContact O-CB 3.36Å; G103-A107 PolarHBondContact O-N 2.88Å; F104-A107 PolarHBondContact O-N 3.31Å; A107-S110 PolarHBondContact O-OG 3.43Å; A107-S110 VanDerWaalsContact O-OG 3.09Å; A107-L111 PolarHBondContact O-N 3.24Å; A107-F144 HydrophobicContact CB-CD2 3.79Å; A107-F144 HydrophobicContact CB-CE2 3.94Å |
| 108 | F | 94.8 | Very high | 93.2 | Very high | 104 Ų | 104 | 62.3 Ų | 62.3 | 46% | 0.456 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -70.2 | -39.9 | 174.7 | -75.1 | -65 | 0 | 0 | 0 | 111.7 | F104 S110 L111 I112 F144 | F104-F108 HydrophobicContact CB-CD2 4.37Å; F104-F108 HydrophobicContact CB-CE2 4.36Å; F104-F108 HydrophobicContact CD1-CE2 4.32Å; F104-F108 WeakPolarHBondContact O-CD2 3.4Å; F104-F108 PolarHBondContact O-N 3.13Å; F108-S110 VanDerWaalsContact C-N 3.35Å; F108-S110 PolarHBondContact O-N 2.96Å; F108-L111 PolarHBondContact O-N 2.95Å; F108-I112 VanDerWaalsContact O-CG1 3.29Å; F108-I112 WeakPolarHBondContact O-CG1 3.23Å; F108-I112 PolarHBondContact O-N 2.9Å; F108-F144 HydrophobicContact CD1-CE2 4Å; F108-F144 HydrophobicContact CD1-CZ 4.03Å; F108-F144 HydrophobicContact CE1-CE1 4.46Å; F108-F144 AromaticContact CE1-CE2 3.87Å; F108-F144 HydrophobicContact CE1-CE2 3.87Å; F108-F144 AromaticContact CE1-CZ 3.46Å; F108-F144 HydrophobicContact CE1-CZ 3.46Å; F108-F144 VanDerWaalsContact CE1-CZ 3.46Å; F108-F144 HydrophobicContact CG-CE2 4.41Å; F108-F144 HydrophobicContact CZ-CE2 4.15Å; F108-F144 AromaticContact CZ-CZ 3.76Å; F108-F144 HydrophobicContact CZ-CZ 3.76Å |
| 109 | G | 95.6 | Very high | 93.4 | Very high | 38 Ų | 38 | 63.6 Ų | 63.6 | 39% | 0.392 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.6 | -44.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | M105 L106 A113 | M105-G109 WeakPolarHBondContact O-CA 3.43Å; M105-G109 PolarHBondContact O-N 3.27Å; L106-G109 PolarHBondContact O-N 3.14Å; G109-A113 VanDerWaalsContact O-CB 3.23Å; G109-A113 WeakPolarHBondContact O-CB 3.46Å; G109-A113 PolarHBondContact O-N 3.32Å |
| 110 | S | 95.1 | Very high | 93.5 | Very high | 5 Ų | 5 | 58.9 Ų | 58.9 | 4% | 0.035 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.8 | -41.2 | 176.3 | 74.8 | 0 | 0 | 0 | 0 | 111.7 | C62 A66 L106 A107 F108 I112 A113 S114 N140 | C62-S110 PolarHBondContact SG-O 2.94Å; A66-S110 WeakPolarHBondContact CB-OG 3.37Å; L106-S110 WeakPolarHBondContact O-CB 3.34Å; L106-S110 PolarHBondContact O-N 2.92Å; L106-S110 PolarHBondContact O-OG 3.4Å; A107-S110 PolarHBondContact O-OG 3.43Å; A107-S110 VanDerWaalsContact O-OG 3.09Å; F108-S110 VanDerWaalsContact C-N 3.35Å; F108-S110 PolarHBondContact O-N 2.96Å; S110-I112 PolarHBondContact O-N 3.42Å; S110-A113 PolarHBondContact O-N 3.04Å; S110-S114 WeakPolarHBondContact O-CB 3.41Å; S110-S114 PolarHBondContact O-N 3.46Å; S110-S114 PolarHBondContact O-OG 2.94Å; S110-N140 WeakPolarHBondContact CB-OD1 3.48Å; S110-N140 PolarHBondContact OG-OD1 2.89Å |
| 111 | L | 95.3 | Very high | 93.3 | Very high | 36 Ų | 36 | 58.4 Ų | 58.4 | 19% | 0.188 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.8 | -46.5 | 177.1 | -170.2 | 66.2 | 0 | 0 | 0 | 112 | A107 F108 S114 M115 F137 N140 A141 F144 | A107-L111 PolarHBondContact O-N 3.24Å; F108-L111 PolarHBondContact O-N 2.95Å; L111-S114 PolarHBondContact O-N 2.93Å; L111-S114 PolarHBondContact O-OG 2.91Å; L111-M115 PolarHBondContact O-N 3.23Å; L111-F137 HydrophobicContact CD1-CE2 4.36Å; L111-N140 HydrophobicContact CD1-CB 4.26Å; L111-A141 HydrophobicContact CD1-CB 4.17Å; L111-F144 HydrophobicContact CD2-CD1 4.37Å; L111-F144 HydrophobicContact CD2-CG 4.45Å |
| 112 | I | 95.4 | Very high | 93.2 | Very high | 117 Ų | 117 | 52.1 Ų | 52.1 | 60% | 0.6 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -64.7 | -43.2 | 177.1 | -65.1 | 165.6 | 0 | 0 | 0 | 110.8 | F108 S110 S114 M115 W116 | F108-I112 VanDerWaalsContact O-CG1 3.29Å; F108-I112 WeakPolarHBondContact O-CG1 3.23Å; F108-I112 PolarHBondContact O-N 2.9Å; S110-I112 PolarHBondContact O-N 3.42Å; I112-S114 VanDerWaalsContact C-N 3.33Å; I112-S114 PolarHBondContact O-N 3.22Å; I112-M115 WeakPolarHBondContact O-CB 3.31Å; I112-M115 PolarHBondContact O-N 3Å; I112-W116 PolarHBondContact O-N 3.43Å |
| 113 | A | 95.1 | Very high | 93 | Very high | 41 Ų | 41 | 51.5 Ų | 51.5 | 34% | 0.339 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.3 | -41.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | G109 S110 M115 W116 I117 | G109-A113 VanDerWaalsContact O-CB 3.23Å; G109-A113 WeakPolarHBondContact O-CB 3.46Å; G109-A113 PolarHBondContact O-N 3.32Å; S110-A113 PolarHBondContact O-N 3.04Å; A113-M115 VanDerWaalsContact C-N 3.32Å; A113-M115 PolarHBondContact O-N 3.43Å; A113-W116 WeakPolarHBondContact O-CB 3.23Å; A113-W116 PolarHBondContact O-N 3.25Å; A113-I117 WeakPolarHBondContact O-CG1 3.28Å; A113-I117 PolarHBondContact O-N 2.91Å |
| 114 | S | 93.9 | Very high | 93 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -63.7 | -37.5 | 176.2 | 76.5 | 0 | 0 | 0 | 0 | 112.3 | S110 L111 I112 I117 L118 | S110-S114 WeakPolarHBondContact O-CB 3.41Å; S110-S114 PolarHBondContact O-N 3.46Å; S110-S114 PolarHBondContact O-OG 2.94Å; L111-S114 PolarHBondContact O-N 2.93Å; L111-S114 PolarHBondContact O-OG 2.91Å; I112-S114 VanDerWaalsContact C-N 3.33Å; I112-S114 PolarHBondContact O-N 3.22Å; S114-I117 PolarHBondContact O-N 2.92Å; S114-L118 PolarHBondContact O-N 2.82Å |
| 115 | M | 94.8 | Very high | 92.7 | Very high | 79 Ų | 79 | 58.1 Ų | 58.1 | 39% | 0.389 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.9 | -42.9 | 174.1 | -167.6 | 74.9 | 95.1 | 0 | 0 | 111.2 | L111 I112 A113 L118 F119 F137 | L111-M115 PolarHBondContact O-N 3.23Å; I112-M115 WeakPolarHBondContact O-CB 3.31Å; I112-M115 PolarHBondContact O-N 3Å; A113-M115 VanDerWaalsContact C-N 3.32Å; A113-M115 PolarHBondContact O-N 3.43Å; M115-L118 PolarHBondContact O-N 2.86Å; M115-F119 HydrophobicContact CG-CD2 4.03Å; M115-F119 HydrophobicContact CG-CE2 4.15Å; M115-F119 WeakPolarHBondContact O-CD2 3.3Å; M115-F119 PolarHBondContact O-N 3.38Å; M115-F119 VanDerWaalsContact O-N 3.08Å; M115-F119 HydrophobicContact SD-CD2 4.06Å; M115-F119 HydrophobicContact SD-CE2 3.62Å; M115-F137 HydrophobicContact CB-CD2 4.39Å; M115-F137 HydrophobicContact CB-CE2 4.4Å; M115-F137 HydrophobicContact CE-CE2 3.53Å; M115-F137 HydrophobicContact CE-CZ 3.84Å; M115-F137 HydrophobicContact SD-CD2 3.91Å; M115-F137 HydrophobicContact SD-CE2 3.48Å; M115-F137 WeakPolarHBondContact SD-CE2 3.27Å; M115-F137 HydrophobicContact SD-CZ 4.05Å |
| 116 | W | 94.4 | Very high | 92.2 | Very high | 194 Ų | 194 | 61.7 Ų | 61.7 | 74% | 0.735 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -62.6 | -43 | 174.4 | 177.7 | -95 | 0 | 0 | 0 | 112 | I112 A113 L118 F119 G120 | I112-W116 PolarHBondContact O-N 3.43Å; A113-W116 WeakPolarHBondContact O-CB 3.23Å; A113-W116 PolarHBondContact O-N 3.25Å; W116-L118 VanDerWaalsContact C-N 3.33Å; W116-L118 PolarHBondContact O-N 3.47Å; W116-F119 PolarHBondContact O-N 3.42Å; W116-G120 WeakPolarHBondContact O-CA 3.28Å; W116-G120 PolarHBondContact O-N 2.84Å |
| 117 | I | 92.1 | Very high | 91.7 | Very high | 20 Ų | 20 | 62 Ų | 62 | 10% | 0.103 | 33% | 0.327 | C | S | . | . | I | π-helix | trans | -59.6 | -45.4 | 177.1 | -69.8 | 164 | 0 | 0 | 0 | 110.5 | Y59 C62 A113 S114 G121 F122 V136 | Y59-I117 HydrophobicContact CD1-CD1 3.64Å; Y59-I117 HydrophobicContact CD1-CG1 3.84Å; Y59-I117 HydrophobicContact CD1-CG2 3.89Å; Y59-I117 HydrophobicContact CD2-CG2 4.06Å; Y59-I117 HydrophobicContact CE1-CD1 4.28Å; Y59-I117 HydrophobicContact CE1-CG1 3.99Å; Y59-I117 HydrophobicContact CE1-CG2 4.04Å; Y59-I117 HydrophobicContact CE2-CG2 4.19Å; Y59-I117 HydrophobicContact CG-CD1 4.25Å; Y59-I117 HydrophobicContact CG-CG2 3.9Å; C62-I117 HydrophobicContact CB-CD1 4.34Å; A113-I117 WeakPolarHBondContact O-CG1 3.28Å; A113-I117 PolarHBondContact O-N 2.91Å; S114-I117 PolarHBondContact O-N 2.92Å; I117-G121 VanDerWaalsContact O-CA 3.22Å; I117-G121 WeakPolarHBondContact O-CA 3.47Å; I117-G121 PolarHBondContact O-N 2.92Å; I117-F122 HydrophobicContact CG2-CD2 4.38Å; I117-F122 HydrophobicContact CG2-CE2 3.96Å; I117-F122 WeakPolarHBondContact O-CD2 3.31Å; I117-V136 HydrophobicContact CD1-CG1 4.31Å; I117-V136 HydrophobicContact CG2-CG1 4.46Å |
| 118 | L | 92.4 | Very high | 91 | Very high | 18 Ų | 18 | 67 Ų | 67 | 9% | 0.094 | 37% | 0.369 | C | S | . | . | I | π-helix | trans | -58.4 | -55.9 | 177.3 | 172.4 | 61.6 | 0 | 0 | 0 | 111.5 | S114 M115 W116 F122 V123 V130 I134 F137 | S114-L118 PolarHBondContact O-N 2.82Å; M115-L118 PolarHBondContact O-N 2.86Å; W116-L118 VanDerWaalsContact C-N 3.33Å; W116-L118 PolarHBondContact O-N 3.47Å; L118-F122 WeakPolarHBondContact O-CB 3.31Å; L118-F122 PolarHBondContact O-N 3.04Å; L118-V123 HydrophobicContact CD1-CG2 4.28Å; L118-V123 HydrophobicContact CG-CG2 4.48Å; L118-V123 WeakPolarHBondContact O-CG2 3.26Å; L118-V123 PolarHBondContact O-N 3.02Å; L118-V123 VanDerWaalsContact O-N 3.09Å; L118-V130 HydrophobicContact CD1-CG1 4.23Å; L118-I134 HydrophobicContact CD1-CB 4.48Å; L118-I134 HydrophobicContact CD1-CG1 3.68Å; L118-F137 HydrophobicContact CB-CB 4.48Å; L118-F137 HydrophobicContact CD2-CB 4.15Å; L118-F137 HydrophobicContact CD2-CD1 4.47Å; L118-F137 HydrophobicContact CD2-CG 4.2Å |
| 119 | F | 92.3 | Very high | 90.6 | Very high | 104 Ų | 104 | 64.4 Ų | 64.4 | 46% | 0.456 | 36% | 0.361 | S | S | . | . | I | π-helix | trans | -77.5 | -51.1 | -174 | -74.6 | -71.5 | 0 | 0 | 0 | 112.9 | M115 W116 V123 V124 | M115-F119 HydrophobicContact CG-CD2 4.03Å; M115-F119 HydrophobicContact CG-CE2 4.15Å; M115-F119 WeakPolarHBondContact O-CD2 3.3Å; M115-F119 PolarHBondContact O-N 3.38Å; M115-F119 VanDerWaalsContact O-N 3.08Å; M115-F119 HydrophobicContact SD-CD2 4.06Å; M115-F119 HydrophobicContact SD-CE2 3.62Å; W116-F119 PolarHBondContact O-N 3.42Å; F119-V123 HydrophobicContact CD1-CB 3.99Å; F119-V123 HydrophobicContact CD1-CG1 4.09Å; F119-V123 HydrophobicContact CD1-CG2 3.98Å; F119-V123 HydrophobicContact CE1-CG2 4.38Å; F119-V123 PolarHBondContact O-N 3.35Å; F119-V124 WeakPolarHBondContact O-CB 3.45Å; F119-V124 WeakPolarHBondContact O-CG2 3.03Å; F119-V124 PolarHBondContact O-N 2.92Å |
| 120 | G | 89.4 | Confident | 90.3 | Very high | 27 Ų | 27 | 64.7 Ų | 64.7 | 28% | 0.278 | 36% | 0.356 | S | S | . | . | I | π-helix | trans | -72.8 | -35.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | W116 P125 | W116-G120 WeakPolarHBondContact O-CA 3.28Å; W116-G120 PolarHBondContact O-N 2.84Å; G120-P125 WeakPolarHBondContact O-CD 3.5Å; G120-P125 VanDerWaalsContact O-CG 3.32Å; G120-P125 WeakPolarHBondContact O-CG 3.49Å |
| 121 | G | 86.1 | Confident | 90.1 | Very high | 14 Ų | 14 | 68.3 Ų | 68.3 | 14% | 0.144 | 37% | 0.369 | C | S | . | . | I | π-helix | trans | -87.4 | -31.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | I117 | I117-G121 VanDerWaalsContact O-CA 3.22Å; I117-G121 WeakPolarHBondContact O-CA 3.47Å; I117-G121 PolarHBondContact O-N 2.92Å |
| 122 | F | 87.7 | Confident | 89.8 | Confident | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 36% | 0.36 | C | S | . | . | I | π-helix | trans | -122.8 | -46.1 | -171.9 | -64.7 | -88.7 | 0 | 0 | 0 | 114.3 | F55 Y59 I117 L118 K127 V129 V130 P132 G133 | F55-F122 HydrophobicContact CD2-CZ 4.35Å; Y59-F122 HydrophobicContact CD2-CE2 4.27Å; Y59-F122 HydrophobicContact CD2-CZ 4.36Å; Y59-F122 AromaticContact CE2-CE2 3.93Å; Y59-F122 HydrophobicContact CE2-CE2 3.93Å; Y59-F122 HydrophobicContact CE2-CZ 4.04Å; I117-F122 HydrophobicContact CG2-CD2 4.38Å; I117-F122 HydrophobicContact CG2-CE2 3.96Å; I117-F122 WeakPolarHBondContact O-CD2 3.31Å; L118-F122 WeakPolarHBondContact O-CB 3.31Å; L118-F122 PolarHBondContact O-N 3.04Å; F122-K127 HydrophobicContact CD1-CD 3.96Å; F122-K127 HydrophobicContact CE1-CD 4.25Å; F122-K127 PolarHBondContact O-N 3.07Å; F122-V129 WeakPolarHBondContact CD1-O 3.48Å; F122-V130 HydrophobicContact CB-CG1 4.04Å; F122-P132 HydrophobicContact CE1-CB 4.02Å; F122-P132 HydrophobicContact CE1-CG 4.21Å; F122-P132 HydrophobicContact CZ-CB 3.9Å; F122-G133 VanDerWaalsContact CD2-CA 3.45Å |
| 123 | V | 89.4 | Confident | 89.6 | Confident | 60 Ų | 60 | 61 Ų | 61 | 36% | 0.364 | 33% | 0.332 | S | S | . | . | I | π-helix | trans | -77 | -51 | -173.9 | 178.8 | 0 | 0 | 0 | 0 | 112.6 | L118 F119 K126 V130 | L118-V123 HydrophobicContact CD1-CG2 4.28Å; L118-V123 HydrophobicContact CG-CG2 4.48Å; L118-V123 WeakPolarHBondContact O-CG2 3.26Å; L118-V123 PolarHBondContact O-N 3.02Å; L118-V123 VanDerWaalsContact O-N 3.09Å; F119-V123 HydrophobicContact CD1-CB 3.99Å; F119-V123 HydrophobicContact CD1-CG1 4.09Å; F119-V123 HydrophobicContact CD1-CG2 3.98Å; F119-V123 HydrophobicContact CE1-CG2 4.38Å; F119-V123 PolarHBondContact O-N 3.35Å; V123-K126 PolarHBondContact O-N 3.47Å; V123-K126 VanDerWaalsContact O-N 3.12Å; V123-V130 HydrophobicContact CG2-CG1 4.12Å |
| 124 | V | 90.9 | Very high | 89.5 | Confident | 112 Ų | 112 | 62.3 Ų | 62.3 | 68% | 0.679 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -44.3 | -178.4 | 172.7 | 0 | 0 | 0 | 0 | 112 | F119 K126 | F119-V124 WeakPolarHBondContact O-CB 3.45Å; F119-V124 WeakPolarHBondContact O-CG2 3.03Å; F119-V124 PolarHBondContact O-N 2.92Å; V124-K126 PolarHBondContact O-N 3.48Å; V124-K126 VanDerWaalsContact O-N 3.16Å |
| 125 | P | 87.6 | Confident | 89.5 | Confident | 74 Ų | 74 | 62.4 Ų | 62.4 | 48% | 0.481 | 33% | 0.333 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -2.8 | 176.1 | -17 | 33.3 | 0 | 0 | 0 | 113.7 | G120 K127 | G120-P125 WeakPolarHBondContact O-CD 3.5Å; G120-P125 VanDerWaalsContact O-CG 3.32Å; G120-P125 WeakPolarHBondContact O-CG 3.49Å; P125-K127 VanDerWaalsContact C-N 3.31Å; P125-K127 HydrophobicContact CB-CG 4.46Å; P125-K127 PolarHBondContact O-N 2.84Å |
| 126 | K | 85.4 | Confident | 89.5 | Confident | 185 Ų | 185 | 58.7 Ų | 58.7 | 80% | 0.804 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.7 | 47.5 | -176.6 | -59.3 | -178.8 | -179.6 | 178.2 | 0 | 112.5 | V123 V124 A128 | V123-K126 PolarHBondContact O-N 3.47Å; V123-K126 VanDerWaalsContact O-N 3.12Å; V124-K126 PolarHBondContact O-N 3.48Å; V124-K126 VanDerWaalsContact O-N 3.16Å; K126-A128 PolarHBondContact O-N 3.21Å |
| 127 | K | 82.9 | Confident | 89.6 | Confident | 68 Ų | 68 | 51.5 Ų | 51.5 | 30% | 0.296 | 29% | 0.288 | S | S | . | . | trans | -59.4 | 141.4 | 175.3 | -72.8 | -158.7 | 179.3 | -168.9 | 0 | 109.6 | F122 P125 V129 | F122-K127 HydrophobicContact CD1-CD 3.96Å; F122-K127 HydrophobicContact CE1-CD 4.25Å; F122-K127 PolarHBondContact O-N 3.07Å; P125-K127 VanDerWaalsContact C-N 3.31Å; P125-K127 HydrophobicContact CB-CG 4.46Å; P125-K127 PolarHBondContact O-N 2.84Å; K127-V129 PolarHBondContact O-N 3.27Å; K127-V129 VanDerWaalsContact O-N 3.12Å | ||
| 128 | A | 80.2 | Confident | 89.7 | Confident | 111 Ų | 111 | 54.8 Ų | 54.8 | 92% | 0.917 | 30% | 0.302 | S | S | * | . | S | Bend | trans | -59.2 | -25.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | K126 | K126-A128 PolarHBondContact O-N 3.21Š|
| 129 | V | 86.3 | Confident | 89.9 | Confident | 49 Ų | 49 | 54 Ų | 54 | 30% | 0.297 | 30% | 0.298 | S | S | . | . | trans | -123.8 | 112.6 | 178.8 | -174.8 | 0 | 0 | 0 | 0 | 109.6 | Y49 F122 K127 | Y49-V129 HydrophobicContact CD1-CG1 4.29Å; Y49-V129 HydrophobicContact CE1-CB 4.43Å; Y49-V129 HydrophobicContact CE1-CG1 3.47Å; Y49-V129 VanDerWaalsContact CE1-CG1 3.47Å; Y49-V129 HydrophobicContact CE1-CG2 4.39Å; Y49-V129 HydrophobicContact CE2-CG1 4.22Å; Y49-V129 VanDerWaalsContact CZ-CG1 3.41Å; Y49-V129 VanDerWaalsContact OH-CG1 3.3Å; Y49-V129 WeakPolarHBondContact OH-CG1 3.35Å; F122-V129 WeakPolarHBondContact CD1-O 3.48Å; K127-V129 PolarHBondContact O-N 3.27Å; K127-V129 VanDerWaalsContact O-N 3.12Å | ||
| 130 | V | 89.8 | Confident | 90.1 | Very high | 45 Ų | 45 | 49 Ų | 49 | 27% | 0.273 | 28% | 0.276 | S | S | . | . | trans | -100.7 | -13 | -179.3 | -176 | 0 | 0 | 0 | 0 | 112.3 | L118 F122 V123 P132 G133 I134 | L118-V130 HydrophobicContact CD1-CG1 4.23Å; F122-V130 HydrophobicContact CB-CG1 4.04Å; V123-V130 HydrophobicContact CG2-CG1 4.12Å; V130-P132 VanDerWaalsContact C-CD 3.49Å; V130-G133 PolarHBondContact O-N 2.94Å; V130-G133 VanDerWaalsContact O-N 3.09Å; V130-I134 HydrophobicContact CG1-CD1 4.13Å; V130-I134 HydrophobicContact CG1-CG1 4.19Å; V130-I134 PolarHBondContact O-N 2.88Å | ||
| 131 | Y | 89.9 | Confident | 90.4 | Very high | 81 Ų | 81 | 48.1 Ų | 48.1 | 32% | 0.318 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -51.9 | -43.9 | -174.9 | -176.9 | -89.4 | 0 | 0 | 0 | 114.8 | D44 A45 Y49 G133 I134 A135 | D44-Y131 PolarHBondContact OD2-OH 3.01Å; A45-Y131 HydrophobicContact CB-CD1 4.3Å; A45-Y131 HydrophobicContact CB-CE1 3.89Å; Y49-Y131 HydrophobicContact CD2-CD1 4.39Å; Y49-Y131 AromaticContact CE2-CD1 3.63Å; Y49-Y131 HydrophobicContact CE2-CD1 3.63Å; Y49-Y131 HydrophobicContact CE2-CE1 4.46Å; Y49-Y131 HydrophobicContact CE2-CG 4.27Å; Y131-G133 VanDerWaalsContact C-N 3.32Å; Y131-G133 PolarHBondContact O-N 2.85Å; Y131-I134 WeakPolarHBondContact O-CB 3.48Å; Y131-I134 PolarHBondContact O-N 3.46Å; Y131-I134 VanDerWaalsContact O-N 3.12Å; Y131-A135 HydrophobicContact CE1-CB 4.44Å; Y131-A135 PolarHBondContact O-N 2.89Å |
| 132 | P | 90.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.6 | -38.5 | 178.7 | -22.6 | 32.3 | 0 | 0 | 0 | 113.3 | Y49 F55 F122 V130 I134 A135 V136 | Y49-P132 HydrophobicContact CD2-CG 3.66Å; Y49-P132 HydrophobicContact CE2-CG 4.05Å; Y49-P132 HydrophobicContact CG-CG 4Å; F55-P132 HydrophobicContact CB-CB 4.39Å; F55-P132 HydrophobicContact CD2-CB 3.53Å; F55-P132 HydrophobicContact CE2-CB 4Å; F55-P132 HydrophobicContact CG-CB 4.06Å; F122-P132 HydrophobicContact CE1-CB 4.02Å; F122-P132 HydrophobicContact CE1-CG 4.21Å; F122-P132 HydrophobicContact CZ-CB 3.9Å; V130-P132 VanDerWaalsContact C-CD 3.49Å; P132-I134 VanDerWaalsContact C-N 3.33Å; P132-I134 PolarHBondContact O-N 2.77Å; P132-A135 PolarHBondContact O-N 3.4Å; P132-V136 WeakPolarHBondContact O-CG2 3.48Å; P132-V136 PolarHBondContact O-N 3.45Å |
| 133 | G | 90.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64 | -40.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F122 V130 Y131 V136 F137 | F122-G133 VanDerWaalsContact CD2-CA 3.45Å; V130-G133 PolarHBondContact O-N 2.94Å; V130-G133 VanDerWaalsContact O-N 3.09Å; Y131-G133 VanDerWaalsContact C-N 3.32Å; Y131-G133 PolarHBondContact O-N 2.85Å; G133-V136 PolarHBondContact O-N 2.93Å; G133-F137 PolarHBondContact O-N 2.77Å; G133-F137 VanDerWaalsContact O-N 3.15Å |
| 134 | I | 93.1 | Very high | 91.5 | Very high | 68 Ų | 68 | 48.4 Ų | 48.4 | 35% | 0.349 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65 | -44.1 | 176.8 | -64.7 | 171.5 | 0 | 0 | 0 | 109.9 | L118 V130 Y131 P132 V136 F137 F138 | L118-I134 HydrophobicContact CD1-CB 4.48Å; L118-I134 HydrophobicContact CD1-CG1 3.68Å; V130-I134 HydrophobicContact CG1-CD1 4.13Å; V130-I134 HydrophobicContact CG1-CG1 4.19Å; V130-I134 PolarHBondContact O-N 2.88Å; Y131-I134 WeakPolarHBondContact O-CB 3.48Å; Y131-I134 PolarHBondContact O-N 3.46Å; Y131-I134 VanDerWaalsContact O-N 3.12Å; P132-I134 VanDerWaalsContact C-N 3.33Å; P132-I134 PolarHBondContact O-N 2.77Å; I134-V136 PolarHBondContact O-N 3.35Å; I134-F137 PolarHBondContact O-N 2.64Å; I134-F138 HydrophobicContact CG2-CD2 3.48Å; I134-F138 VanDerWaalsContact CG2-CD2 3.48Å; I134-F138 HydrophobicContact CG2-CE2 3.57Å; I134-F138 WeakPolarHBondContact O-CD2 3.43Å; I134-F138 PolarHBondContact O-N 2.83Å |
| 135 | A | 94.1 | Very high | 91.6 | Very high | 2 Ų | 2 | 48.4 Ų | 48.4 | 2% | 0.017 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -59.9 | -45.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | I41 A45 Y131 P132 F137 F138 Q139 | I41-A135 HydrophobicContact CG2-CB 3.71Å; A45-A135 HydrophobicContact CB-CB 3.57Å; Y131-A135 HydrophobicContact CE1-CB 4.44Å; Y131-A135 PolarHBondContact O-N 2.89Å; P132-A135 PolarHBondContact O-N 3.4Å; A135-F137 VanDerWaalsContact C-N 3.35Å; A135-F137 PolarHBondContact O-N 2.9Å; A135-F138 PolarHBondContact O-N 3.35Å; A135-Q139 WeakPolarHBondContact O-CB 3.29Å; A135-Q139 PolarHBondContact O-N 3.11Å |
| 136 | V | 94.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62 | -41.7 | 177.2 | 172.3 | 0 | 0 | 0 | 0 | 111.5 | I42 F55 I117 P132 G133 I134 N140 | I42-V136 HydrophobicContact CD1-CG2 3.74Å; F55-V136 HydrophobicContact CE2-CG2 3.81Å; F55-V136 HydrophobicContact CZ-CG2 4.1Å; I117-V136 HydrophobicContact CD1-CG1 4.31Å; I117-V136 HydrophobicContact CG2-CG1 4.46Å; P132-V136 WeakPolarHBondContact O-CG2 3.48Å; P132-V136 PolarHBondContact O-N 3.45Å; G133-V136 PolarHBondContact O-N 2.93Å; I134-V136 PolarHBondContact O-N 3.35Å; V136-N140 PolarHBondContact O-N 3.5Å; V136-N140 PolarHBondContact O-ND2 3.4Å |
| 137 | F | 95.8 | Very high | 92.1 | Very high | 43 Ų | 43 | 36.2 Ų | 36.2 | 19% | 0.189 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.3 | -50.2 | 176.6 | 175.1 | -103.9 | 0 | 0 | 0 | 111.9 | L111 M115 L118 G133 I134 A135 Q139 N140 A141 | L111-F137 HydrophobicContact CD1-CE2 4.36Å; M115-F137 HydrophobicContact CB-CD2 4.39Å; M115-F137 HydrophobicContact CB-CE2 4.4Å; M115-F137 HydrophobicContact CE-CE2 3.53Å; M115-F137 HydrophobicContact CE-CZ 3.84Å; M115-F137 HydrophobicContact SD-CD2 3.91Å; M115-F137 HydrophobicContact SD-CE2 3.48Å; M115-F137 WeakPolarHBondContact SD-CE2 3.27Å; M115-F137 HydrophobicContact SD-CZ 4.05Å; L118-F137 HydrophobicContact CB-CB 4.48Å; L118-F137 HydrophobicContact CD2-CB 4.15Å; L118-F137 HydrophobicContact CD2-CD1 4.47Å; L118-F137 HydrophobicContact CD2-CG 4.2Å; G133-F137 PolarHBondContact O-N 2.77Å; G133-F137 VanDerWaalsContact O-N 3.15Å; I134-F137 PolarHBondContact O-N 2.64Å; A135-F137 VanDerWaalsContact C-N 3.35Å; A135-F137 PolarHBondContact O-N 2.9Å; F137-Q139 VanDerWaalsContact C-N 3.33Å; F137-Q139 PolarHBondContact O-N 3.13Å; F137-N140 PolarHBondContact O-N 3.22Å; F137-A141 WeakPolarHBondContact O-CB 3.47Å; F137-A141 PolarHBondContact O-N 3.44Å |
| 138 | F | 95.6 | Very high | 92.4 | Very high | 90 Ų | 90 | 34.9 Ų | 34.9 | 40% | 0.395 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -64.3 | -36.8 | 179.6 | -86.6 | -71.1 | 0 | 0 | 0 | 112.7 | I41 I134 A135 N140 A141 F142 | I41-F138 HydrophobicContact CD1-CB 4.39Å; I134-F138 HydrophobicContact CG2-CD2 3.48Å; I134-F138 VanDerWaalsContact CG2-CD2 3.48Å; I134-F138 HydrophobicContact CG2-CE2 3.57Å; I134-F138 WeakPolarHBondContact O-CD2 3.43Å; I134-F138 PolarHBondContact O-N 2.83Å; A135-F138 PolarHBondContact O-N 3.35Å; F138-N140 PolarHBondContact O-N 2.65Å; F138-A141 PolarHBondContact O-N 3.27Å; F138-F142 HydrophobicContact CB-CD2 4.15Å; F138-F142 HydrophobicContact CB-CE2 3.93Å; F138-F142 HydrophobicContact CD1-CD2 4.43Å; F138-F142 AromaticContact CD1-CE2 3.69Å; F138-F142 HydrophobicContact CD1-CE2 3.69Å; F138-F142 AromaticContact CD1-CZ 3.9Å; F138-F142 HydrophobicContact CD1-CZ 3.9Å; F138-F142 HydrophobicContact CE1-CZ 4.49Å; F138-F142 HydrophobicContact CG-CE2 4.18Å; F138-F142 WeakPolarHBondContact O-CB 3.16Å; F138-F142 WeakPolarHBondContact O-CD2 3.48Å; F138-F142 WeakPolarHBondContact O-CG 3.29Å; F138-F142 PolarHBondContact O-N 3.5Å |
| 139 | Q | 96 | Very high | 92.9 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -54.3 | -52.8 | 172.2 | 175.2 | -175 | 19.3 | 0 | 0 | 111 | G38 I42 A135 F137 F142 I143 | G38-Q139 WeakPolarHBondContact O-CB 3.29Å; G38-Q139 WeakPolarHBondContact O-CG 3.34Å; I42-Q139 HydrophobicContact CB-CB 4.44Å; I42-Q139 HydrophobicContact CB-CG 4.38Å; I42-Q139 VanDerWaalsContact CG1-OE1 3.25Å; I42-Q139 HydrophobicContact CG2-CG 4.44Å; A135-Q139 WeakPolarHBondContact O-CB 3.29Å; A135-Q139 PolarHBondContact O-N 3.11Å; F137-Q139 VanDerWaalsContact C-N 3.33Å; F137-Q139 PolarHBondContact O-N 3.13Å; Q139-F142 PolarHBondContact O-N 2.85Å; Q139-I143 HydrophobicContact CG-CD1 3.72Å; Q139-I143 WeakPolarHBondContact O-CD1 3.3Å; Q139-I143 VanDerWaalsContact O-CG1 3.28Å; Q139-I143 WeakPolarHBondContact O-CG1 3.33Å; Q139-I143 PolarHBondContact O-N 3.46Å |
| 140 | N | 96.1 | Very high | 93 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.2 | -41.3 | -178.6 | -81.5 | -89.8 | 0 | 0 | 0 | 111.8 | C62 A66 S110 L111 V136 F137 F138 F144 | C62-N140 PolarHBondContact O-OD1 3.23Å; C62-N140 PolarHBondContact SG-ND2 2.68Å; C62-N140 VanDerWaalsContact SG-ND2 3.41Å; C62-N140 PolarHBondContact SG-OD1 3.43Å; C62-N140 VanDerWaalsContact SG-OD1 3.37Å; A66-N140 WeakPolarHBondContact CB-OD1 3.36Å; S110-N140 WeakPolarHBondContact CB-OD1 3.48Å; S110-N140 PolarHBondContact OG-OD1 2.89Å; L111-N140 HydrophobicContact CD1-CB 4.26Å; V136-N140 PolarHBondContact O-N 3.5Å; V136-N140 PolarHBondContact O-ND2 3.4Å; F137-N140 PolarHBondContact O-N 3.22Å; F138-N140 PolarHBondContact O-N 2.65Å; N140-F144 WeakPolarHBondContact O-CB 3.41Å; N140-F144 PolarHBondContact O-N 3.31Å |
| 141 | A | 95.9 | Very high | 92.8 | Very high | 8 Ų | 8 | 30.7 Ų | 30.7 | 7% | 0.066 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.6 | -48.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | L111 F137 F138 F144 F145 | L111-A141 HydrophobicContact CD1-CB 4.17Å; F137-A141 WeakPolarHBondContact O-CB 3.47Å; F137-A141 PolarHBondContact O-N 3.44Å; F138-A141 PolarHBondContact O-N 3.27Å; A141-F144 PolarHBondContact O-N 3.27Å; A141-F145 HydrophobicContact CB-CD2 4.38Å; A141-F145 HydrophobicContact CB-CE2 4.3Å; A141-F145 WeakPolarHBondContact O-CB 3.49Å; A141-F145 WeakPolarHBondContact O-CD2 3.18Å; A141-F145 PolarHBondContact O-N 3.26Å |
| 142 | F | 96.2 | Very high | 92.4 | Very high | 56 Ų | 56 | 33.9 Ų | 33.9 | 25% | 0.246 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.6 | -39.5 | -179.5 | -71.9 | -51.3 | 0 | 0 | 0 | 112.7 | L34 I41 F138 Q139 G146 | L34-F142 HydrophobicContact CD2-CD1 3.77Å; L34-F142 HydrophobicContact CD2-CE1 4.32Å; I41-F142 HydrophobicContact CD1-CD2 3.76Å; I41-F142 HydrophobicContact CD1-CE2 3.44Å; I41-F142 VanDerWaalsContact CD1-CE2 3.44Å; F138-F142 HydrophobicContact CB-CD2 4.15Å; F138-F142 HydrophobicContact CB-CE2 3.93Å; F138-F142 HydrophobicContact CD1-CD2 4.43Å; F138-F142 AromaticContact CD1-CE2 3.69Å; F138-F142 HydrophobicContact CD1-CE2 3.69Å; F138-F142 AromaticContact CD1-CZ 3.9Å; F138-F142 HydrophobicContact CD1-CZ 3.9Å; F138-F142 HydrophobicContact CE1-CZ 4.49Å; F138-F142 HydrophobicContact CG-CE2 4.18Å; F138-F142 WeakPolarHBondContact O-CB 3.16Å; F138-F142 WeakPolarHBondContact O-CD2 3.48Å; F138-F142 WeakPolarHBondContact O-CG 3.29Å; F138-F142 PolarHBondContact O-N 3.5Å; Q139-F142 PolarHBondContact O-N 2.85Å; F142-G146 PolarHBondContact O-N 3.19Å |
| 143 | I | 95.5 | Very high | 91.7 | Very high | 1 Ų | 1 | 34.8 Ų | 34.8 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.7 | -42.8 | 174.6 | -67.8 | 164.8 | 0 | 0 | 0 | 110.6 | F35 A66 T67 F70 Q139 G147 | F35-I143 HydrophobicContact CD2-CG1 4.23Å; F35-I143 HydrophobicContact CD2-CG2 4.39Å; A66-I143 HydrophobicContact CB-CB 4.37Å; A66-I143 HydrophobicContact CB-CD1 4.42Å; A66-I143 HydrophobicContact CB-CG2 3.94Å; A66-I143 WeakPolarHBondContact O-CG2 3.19Å; T67-I143 HydrophobicContact CG2-CD1 3.75Å; T67-I143 HydrophobicContact CG2-CG1 4.46Å; T67-I143 HydrophobicContact CG2-CG2 4.28Å; F70-I143 HydrophobicContact CB-CG2 3.96Å; Q139-I143 HydrophobicContact CG-CD1 3.72Å; Q139-I143 WeakPolarHBondContact O-CD1 3.3Å; Q139-I143 VanDerWaalsContact O-CG1 3.28Å; Q139-I143 WeakPolarHBondContact O-CG1 3.33Å; Q139-I143 PolarHBondContact O-N 3.46Å; I143-G147 PolarHBondContact O-N 3.08Å |
| 144 | F | 94.9 | Very high | 91 | Very high | 23 Ų | 23 | 38.3 Ų | 38.3 | 10% | 0.101 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.4 | -53.6 | 177.6 | 179.8 | -95.4 | 0 | 0 | 0 | 111.5 | A107 F108 L111 N140 A141 G146 G147 L148 | A107-F144 HydrophobicContact CB-CD2 3.79Å; A107-F144 HydrophobicContact CB-CE2 3.94Å; F108-F144 HydrophobicContact CD1-CE2 4Å; F108-F144 HydrophobicContact CD1-CZ 4.03Å; F108-F144 HydrophobicContact CE1-CE1 4.46Å; F108-F144 AromaticContact CE1-CE2 3.87Å; F108-F144 HydrophobicContact CE1-CE2 3.87Å; F108-F144 AromaticContact CE1-CZ 3.46Å; F108-F144 HydrophobicContact CE1-CZ 3.46Å; F108-F144 VanDerWaalsContact CE1-CZ 3.46Å; F108-F144 HydrophobicContact CG-CE2 4.41Å; F108-F144 HydrophobicContact CZ-CE2 4.15Å; F108-F144 AromaticContact CZ-CZ 3.76Å; F108-F144 HydrophobicContact CZ-CZ 3.76Å; L111-F144 HydrophobicContact CD2-CD1 4.37Å; L111-F144 HydrophobicContact CD2-CG 4.45Å; N140-F144 WeakPolarHBondContact O-CB 3.41Å; N140-F144 PolarHBondContact O-N 3.31Å; A141-F144 PolarHBondContact O-N 3.27Å; F144-G146 PolarHBondContact O-N 3.35Å; F144-G147 WeakPolarHBondContact O-CA 3.37Å; F144-G147 PolarHBondContact O-N 3.25Å; F144-G147 VanDerWaalsContact O-N 3.14Å; F144-L148 HydrophobicContact CD1-CD1 4.08Å; F144-L148 HydrophobicContact CD1-CG 4.38Å; F144-L148 HydrophobicContact CE1-CD1 3.41Å; F144-L148 VanDerWaalsContact CE1-CD1 3.41Å; F144-L148 HydrophobicContact CE1-CG 4.04Å; F144-L148 HydrophobicContact CZ-CD1 3.8Å; F144-L148 HydrophobicContact CZ-CD2 4.36Å; F144-L148 HydrophobicContact CZ-CG 4.24Å; F144-L148 WeakPolarHBondContact O-CG 3.39Å; F144-L148 PolarHBondContact O-N 2.98Å |
| 145 | F | 93.8 | Very high | 89.7 | Confident | 112 Ų | 112 | 36.3 Ų | 36.3 | 49% | 0.491 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -65.5 | -39.2 | 179.2 | -71.2 | -58.9 | 0 | 0 | 0 | 112.2 | A141 G147 L148 V149 | A141-F145 HydrophobicContact CB-CD2 4.38Å; A141-F145 HydrophobicContact CB-CE2 4.3Å; A141-F145 WeakPolarHBondContact O-CB 3.49Å; A141-F145 WeakPolarHBondContact O-CD2 3.18Å; A141-F145 PolarHBondContact O-N 3.26Å; F145-G147 PolarHBondContact O-N 3.44Å; F145-L148 PolarHBondContact O-N 2.89Å; F145-V149 WeakPolarHBondContact O-CB 3.28Å; F145-V149 VanDerWaalsContact O-CG2 3.26Å; F145-V149 WeakPolarHBondContact O-CG2 3.39Å; F145-V149 PolarHBondContact O-N 3.16Å |
| 146 | G | 92.1 | Very high | 88.2 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -57.9 | -39.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A31 F142 F144 V149 F150 | A31-G146 VanDerWaalsContact CB-O 3.28Å; A31-G146 WeakPolarHBondContact CB-O 3.4Å; F142-G146 PolarHBondContact O-N 3.19Å; F144-G146 PolarHBondContact O-N 3.35Å; G146-V149 PolarHBondContact O-N 3Å; G146-F150 WeakPolarHBondContact O-CB 3.23Å; G146-F150 PolarHBondContact O-N 3.46Å |
| 147 | G | 90.9 | Very high | 86.2 | Confident | 4 Ų | 4 | 43.2 Ų | 43.2 | 4% | 0.041 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.3 | -45.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | F70 N74 I143 F144 F145 F150 K151 | F70-G147 VanDerWaalsContact CE2-CA 3.45Å; N74-G147 PolarHBondContact OD1-O 3.29Å; I143-G147 PolarHBondContact O-N 3.08Å; F144-G147 WeakPolarHBondContact O-CA 3.37Å; F144-G147 PolarHBondContact O-N 3.25Å; F144-G147 VanDerWaalsContact O-N 3.14Å; F145-G147 PolarHBondContact O-N 3.44Å; G147-F150 PolarHBondContact O-N 3.3Å; G147-K151 VanDerWaalsContact O-CB 3.31Å; G147-K151 WeakPolarHBondContact O-CB 3.36Å; G147-K151 PolarHBondContact O-N 3.12Å |
| 148 | L | 89.9 | Confident | 83.9 | Confident | 40 Ų | 40 | 45.7 Ų | 45.7 | 21% | 0.209 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.3 | -41.7 | 176.9 | -62.6 | -169.3 | 0 | 0 | 0 | 112.2 | F104 F144 F145 F150 K151 F152 | F104-L148 HydrophobicContact CE1-CD2 3.8Å; F144-L148 HydrophobicContact CD1-CD1 4.08Å; F144-L148 HydrophobicContact CD1-CG 4.38Å; F144-L148 HydrophobicContact CE1-CD1 3.41Å; F144-L148 VanDerWaalsContact CE1-CD1 3.41Å; F144-L148 HydrophobicContact CE1-CG 4.04Å; F144-L148 HydrophobicContact CZ-CD1 3.8Å; F144-L148 HydrophobicContact CZ-CD2 4.36Å; F144-L148 HydrophobicContact CZ-CG 4.24Å; F144-L148 WeakPolarHBondContact O-CG 3.39Å; F144-L148 PolarHBondContact O-N 2.98Å; F145-L148 PolarHBondContact O-N 2.89Å; L148-F150 VanDerWaalsContact C-N 3.34Å; L148-F150 PolarHBondContact O-N 2.7Å; L148-K151 PolarHBondContact O-N 2.94Å; L148-F152 HydrophobicContact CB-CD2 4.17Å; L148-F152 HydrophobicContact CB-CE2 4.43Å; L148-F152 HydrophobicContact CD2-CD2 4.47Å; L148-F152 HydrophobicContact CD2-CE2 3.92Å; L148-F152 WeakPolarHBondContact O-CB 3.4Å; L148-F152 WeakPolarHBondContact O-CD2 3.21Å; L148-F152 PolarHBondContact O-N 3.47Å |
| 149 | V | 89.7 | Confident | 81.5 | Confident | 53 Ų | 53 | 54 Ų | 54 | 32% | 0.321 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62 | -42.7 | 176.9 | 170.3 | 0 | 0 | 0 | 0 | 110.5 | A30 A31 L34 F145 G146 G153 | A30-V149 HydrophobicContact CB-CG1 4.04Å; A31-V149 HydrophobicContact CB-CG1 4.45Å; L34-V149 HydrophobicContact CD1-CG2 4.19Å; F145-V149 WeakPolarHBondContact O-CB 3.28Å; F145-V149 VanDerWaalsContact O-CG2 3.26Å; F145-V149 WeakPolarHBondContact O-CG2 3.39Å; F145-V149 PolarHBondContact O-N 3.16Å; G146-V149 PolarHBondContact O-N 3Å; V149-G153 WeakPolarHBondContact O-CA 3.29Å; V149-G153 PolarHBondContact O-N 3.37Å |
| 150 | F | 87.7 | Confident | 78.5 | Confident | 59 Ų | 59 | 66.4 Ų | 66.4 | 26% | 0.259 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -66.4 | -44.9 | 176.2 | -165.2 | -96.8 | 0 | 0 | 0 | 112.1 | A31 N74 G146 G147 L148 R154 | A31-F150 HydrophobicContact CB-CB 3.65Å; A31-F150 HydrophobicContact CB-CD2 3.88Å; A31-F150 HydrophobicContact CB-CG 4.25Å; N74-F150 HydrophobicContact CB-CD1 3.67Å; N74-F150 HydrophobicContact CB-CE1 4.02Å; N74-F150 VanDerWaalsContact CG-CD1 3.47Å; N74-F150 VanDerWaalsContact OD1-CD1 3.28Å; N74-F150 WeakPolarHBondContact OD1-CD1 3.15Å; G146-F150 WeakPolarHBondContact O-CB 3.23Å; G146-F150 PolarHBondContact O-N 3.46Å; G147-F150 PolarHBondContact O-N 3.3Å; L148-F150 VanDerWaalsContact C-N 3.34Å; L148-F150 PolarHBondContact O-N 2.7Å; F150-R154 WeakPolarHBondContact O-CB 3.14Å; F150-R154 PolarHBondContact O-N 3.14Å |
| 151 | K | 85.7 | Confident | 77.7 | Confident | 5 Ų | 5 | 69.7 Ų | 69.7 | 2% | 0.022 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.9 | -47.5 | -176.4 | -174.5 | 62.4 | 171.6 | -165.8 | 0 | 112.9 | I73 N74 V76 N78 G147 L148 | I73-K151 HydrophobicContact CG2-CB 4.21Å; I73-K151 HydrophobicContact CG2-CD 4.02Å; I73-K151 HydrophobicContact CG2-CG 3.96Å; I73-K151 PolarHBondContact O-NZ 2.88Å; N74-K151 WeakPolarHBondContact OD1-CB 3.28Å; N74-K151 PolarHBondContact OD1-N 3Å; V76-K151 PolarHBondContact O-NZ 3.45Å; N78-K151 PolarHBondContact ND2-O 3.5Å; N78-K151 WeakPolarHBondContact OD1-CE 3.26Å; G147-K151 VanDerWaalsContact O-CB 3.31Å; G147-K151 WeakPolarHBondContact O-CB 3.36Å; G147-K151 PolarHBondContact O-N 3.12Å; L148-K151 PolarHBondContact O-N 2.94Å |
| 152 | F | 82.6 | Confident | 76.7 | Confident | 147 Ų | 147 | 72.9 Ų | 72.9 | 65% | 0.645 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -94.4 | -23.9 | -174.8 | -63 | -55.3 | 0 | 0 | 0 | 113.7 | L148 R154 | L148-F152 HydrophobicContact CB-CD2 4.17Å; L148-F152 HydrophobicContact CB-CE2 4.43Å; L148-F152 HydrophobicContact CD2-CD2 4.47Å; L148-F152 HydrophobicContact CD2-CE2 3.92Å; L148-F152 WeakPolarHBondContact O-CB 3.4Å; L148-F152 WeakPolarHBondContact O-CD2 3.21Å; L148-F152 PolarHBondContact O-N 3.47Å; F152-R154 VanDerWaalsContact C-N 3.31Å |
| 153 | G | 75.7 | Confident | 75.6 | Confident | 20 Ų | 20 | 73.9 Ų | 73.9 | 21% | 0.206 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -74.5 | -23.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | R23 V149 | R23-G153 WeakPolarHBondContact CG-O 3.42Å; V149-G153 WeakPolarHBondContact O-CA 3.29Å; V149-G153 PolarHBondContact O-N 3.37Å |
| 154 | R | 74.9 | Confident | 74.5 | Confident | 74 Ų | 74 | 78.2 Ų | 78.2 | 28% | 0.279 | 37% | 0.365 | S | S | . | . | trans | -82.9 | 119.9 | 177.9 | -173.8 | 169.3 | 62.8 | 113 | 7.4 | 111.7 | N24 F150 F152 E156 | N24-R154 WeakPolarHBondContact OD1-CA 3.38Å; F150-R154 WeakPolarHBondContact O-CB 3.14Å; F150-R154 PolarHBondContact O-N 3.14Å; F152-R154 VanDerWaalsContact C-N 3.31Å; R154-E156 IonicContact CZ-OE1 3.7Å; R154-E156 IonicContact NH1-OE1 3.04Å; R154-E156 PolarHBondContact NH1-OE1 3.49Å; R154-E156 IonicContact NH2-OE1 2.65Å; R154-E156 PolarHBondContact NH2-OE1 3.41Å | ||
| 155 | T | 66.6 | Low | 73.2 | Confident | 26 Ų | 26 | 81.6 Ų | 81.6 | 16% | 0.16 | 38% | 0.381 | C | S | . | . | trans | -80.8 | 122 | 161.9 | -16.8 | 0 | 0 | 0 | 0 | 108.3 | R23 N24 D157 | R23-T155 VanDerWaalsContact CZ-OG1 3.24Å; R23-T155 PolarHBondContact NE-OG1 3.16Å; R23-T155 PolarHBondContact NH2-OG1 3.39Å; N24-T155 PolarHBondContact ND2-O 3.35Å; N24-T155 PolarHBondContact OD1-N 3Å; N24-T155 PolarHBondContact OD1-O 2.99Å; N24-T155 PolarHBondContact OD1-OG1 3.28Å; T155-D157 VanDerWaalsContact CG2-OD1 3.32Å; T155-D157 WeakPolarHBondContact CG2-OD1 3.3Å; T155-D157 PolarHBondContact O-N 2.86Å | ||
| 156 | E | 62.9 | Low | 71.8 | Confident | 42 Ų | 42 | 79.6 Ų | 79.6 | 20% | 0.196 | 37% | 0.374 | C | S | . | . | trans | -94.4 | 85.8 | 161.2 | -65.3 | -178.1 | 163.4 | 0 | 0 | 105.4 | S77 N78 G79 R154 L158 | S77-E156 VanDerWaalsContact CA-OE1 3.23Å; S77-E156 WeakPolarHBondContact CA-OE1 3.47Å; S77-E156 WeakPolarHBondContact CB-OE1 3.42Å; S77-E156 VanDerWaalsContact OG-CD 3.23Å; S77-E156 PolarHBondContact OG-OE1 3.19Å; S77-E156 VanDerWaalsContact OG-OE1 3.11Å; S77-E156 PolarHBondContact OG-OE2 3.06Å; N78-E156 WeakPolarHBondContact CA-OE2 3.49Å; N78-E156 WeakPolarHBondContact CB-OE2 3.32Å; N78-E156 VanDerWaalsContact N-CD 3.32Å; N78-E156 PolarHBondContact N-OE1 3.46Å; N78-E156 PolarHBondContact N-OE2 3.12Å; G79-E156 PolarHBondContact N-OE2 3.45Å; R154-E156 IonicContact CZ-OE1 3.7Å; R154-E156 IonicContact NH1-OE1 3.04Å; R154-E156 PolarHBondContact NH1-OE1 3.49Å; R154-E156 IonicContact NH2-OE1 2.65Å; R154-E156 PolarHBondContact NH2-OE1 3.41Å; E156-L158 PolarHBondContact O-N 2.83Å | ||
| 157 | D | 52 | Low | 70.4 | Confident | 105 Ų | 105 | 85.3 Ų | 85.3 | 56% | 0.561 | 40% | 0.401 | S | S | * | . | trans | -67 | 97.4 | 165.4 | -65.5 | -42.2 | 0 | 0 | 0 | 105.5 | T155 W159 | T155-D157 VanDerWaalsContact CG2-OD1 3.32Å; T155-D157 WeakPolarHBondContact CG2-OD1 3.3Å; T155-D157 PolarHBondContact O-N 2.86Å; D157-W159 PolarHBondContact O-N 2.67Å; D157-W159 VanDerWaalsContact O-N 3.12Å | ||
| 158 | L | 47.9 | Very low | 68.8 | Low | 94 Ų | 94 | 91.5 Ų | 91.5 | 49% | 0.492 | 43% | 0.428 | S | S | . | . | trans | -61.3 | 110.6 | 163.9 | -82.7 | 143.9 | 0 | 0 | 0 | 104.7 | D84 E156 Q160 | D84-L158 HydrophobicContact CB-CD1 4.19Å; E156-L158 PolarHBondContact O-N 2.83Å; L158-Q160 VanDerWaalsContact C-N 3.31Å; L158-Q160 PolarHBondContact O-N 2.78Å | ||
| 159 | W | 44.3 | Very low | 67 | Low | 266 Ų | 266 | 95.8 Ų | 95.8 | 100% | 1.008 | 45% | 0.447 | S | S | * | . | trans | -47 | 100.1 | 167.8 | -65.7 | 90 | 0 | 0 | 0 | 108.7 | D157 | D157-W159 PolarHBondContact O-N 2.67Å; D157-W159 VanDerWaalsContact O-N 3.12Å | ||
| 160 | Q | 34.2 | Very low | 65 | Low | 259 Ų | 259 | 99.7 Ų | 99.7 | 100% | 1.21 | 46% | 0.458 | S | S | * | . | trans | -107.4 | 0 | 163.4 | -71.2 | -160.5 | -59.3 | 0 | 0 | 107.5 | L158 | L158-Q160 VanDerWaalsContact C-N 3.31Å; L158-Q160 PolarHBondContact O-N 2.78Å |
Retrieved 160 of 160 residues in 952.5 ms
(Link to these results)