| 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 | 39.2 | Very low | 31 | Very low | 252 Ų | 252 | 149 Ų | 149 | 100% | 1.241 | 85% | 0.849 | S | S | * | * | 0 | 93.9 | 0 | -135.4 | 164.1 | -178.8 | 0 | 0 | 106.3 | |||||
| 2 | T | 30.7 | Very low | 31 | Very low | 145 Ų | 145 | 156.1 Ų | 156.1 | 89% | 0.89 | 85% | 0.852 | S | S | * | * | trans | -95 | 150.1 | -166.7 | 33.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 3 | A | 28.4 | Very low | 31.1 | Very low | 93 Ų | 93 | 159.8 Ų | 159.8 | 77% | 0.769 | 86% | 0.855 | S | S | * | * | trans | -61 | 144.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 4 | E | 31.4 | Very low | 31.3 | Very low | 199 Ų | 199 | 158.9 Ų | 158.9 | 93% | 0.93 | 85% | 0.85 | S | S | * | * | trans | -112.6 | 130.9 | 153.8 | -90.9 | -161.6 | 149.1 | 0 | 0 | 110.1 | ||||
| 5 | I | 33.8 | Very low | 31.7 | Very low | 164 Ų | 164 | 156.2 Ų | 156.2 | 84% | 0.841 | 85% | 0.845 | S | S | * | * | trans | -89.2 | 107.8 | -173.5 | -68.7 | 162.4 | 0 | 0 | 0 | 107.9 | S7 | I5-S7 PolarHBondContact O-N 3.31Š| ||
| 6 | G | 28.9 | Very low | 32.8 | Very low | 68 Ų | 68 | 152.5 Ų | 152.5 | 70% | 0.701 | 83% | 0.831 | S | S | * | * | trans | -80.9 | 108.2 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | I8 | G6-I8 PolarHBondContact O-N 3.07Š| ||
| 7 | S | 28.6 | Very low | 33.1 | Very low | 111 Ų | 111 | 152.8 Ų | 152.8 | 78% | 0.776 | 82% | 0.823 | S | S | * | * | trans | -54.9 | 112.7 | 178.2 | -174.5 | 0 | 0 | 0 | 0 | 113.1 | I5 R9 | I5-S7 PolarHBondContact O-N 3.31Å; S7-R9 PolarHBondContact O-N 3.36Å | ||
| 8 | I | 33.3 | Very low | 33.5 | Very low | 155 Ų | 155 | 151.2 Ų | 151.2 | 80% | 0.795 | 83% | 0.825 | S | S | * | * | trans | -79.4 | 103.4 | 167.2 | -63.1 | 173.7 | 0 | 0 | 0 | 107.3 | G6 C10 | G6-I8 PolarHBondContact O-N 3.07Å; I8-C10 PolarHBondContact O-N 3.28Å; I8-C10 VanDerWaalsContact O-N 3.13Å | ||
| 9 | R | 29.3 | Very low | 33.8 | Very low | 230 Ų | 230 | 147.6 Ų | 147.6 | 87% | 0.868 | 81% | 0.812 | S | S | * | * | trans | -68.8 | 105.9 | 172.2 | -161.3 | -176.3 | -86.9 | -165.9 | -4.1 | 107.8 | S7 S11 | S7-R9 PolarHBondContact O-N 3.36Å; R9-S11 PolarHBondContact O-N 3.34Å | ||
| 10 | C | 28.5 | Very low | 34.8 | Very low | 116 Ų | 116 | 142 Ų | 142 | 78% | 0.784 | 78% | 0.783 | S | S | * | * | trans | -56.2 | 103.5 | 169.7 | -81.4 | 0 | 0 | 0 | 0 | 110.1 | I8 R12 | I8-C10 PolarHBondContact O-N 3.28Å; I8-C10 VanDerWaalsContact O-N 3.13Å; C10-R12 PolarHBondContact O-N 3.38Å; C10-R12 VanDerWaalsContact O-N 3.13Å | ||
| 11 | S | 29.3 | Very low | 36.1 | Very low | 106 Ų | 106 | 136.9 Ų | 136.9 | 74% | 0.741 | 76% | 0.758 | S | S | * | * | trans | -60.4 | 111.3 | 160.3 | -63 | 0 | 0 | 0 | 0 | 107.6 | R9 F13 | R9-S11 PolarHBondContact O-N 3.34Å; S11-F13 PolarHBondContact O-N 3.38Å; S11-F13 VanDerWaalsContact O-N 3.08Å | ||
| 12 | R | 30.7 | Very low | 38 | Very low | 234 Ų | 234 | 129.6 Ų | 129.6 | 88% | 0.883 | 73% | 0.729 | S | S | * | * | trans | -55.1 | 115.2 | 173.4 | -68.7 | 178 | -168.6 | 163.2 | 2.8 | 107.9 | C10 N14 | C10-R12 PolarHBondContact O-N 3.38Å; C10-R12 VanDerWaalsContact O-N 3.13Å; R12-N14 PolarHBondContact O-N 2.94Å; R12-N14 VanDerWaalsContact O-N 3.17Å | ||
| 13 | F | 31.7 | Very low | 40.6 | Very low | 205 Ų | 205 | 129 Ų | 129 | 90% | 0.899 | 71% | 0.714 | S | S | * | * | trans | -59.4 | 115.1 | 163.7 | -87.8 | -96.1 | 0 | 0 | 0 | 107.7 | S11 | S11-F13 PolarHBondContact O-N 3.38Å; S11-F13 VanDerWaalsContact O-N 3.08Å | ||
| 14 | N | 34.8 | Very low | 43.5 | Very low | 147 Ų | 147 | 124.9 Ų | 124.9 | 79% | 0.786 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 130.5 | 164.3 | -78 | -21 | 0 | 0 | 0 | 108 | R12 | R12-N14 PolarHBondContact O-N 2.94Å; R12-N14 VanDerWaalsContact O-N 3.17Å |
| 15 | P | 37.5 | Very low | 46.3 | Very low | 118 Ų | 118 | 119.4 Ų | 119.4 | 77% | 0.766 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 142.4 | 169.4 | 28.2 | -31 | 0 | 0 | 0 | 108.9 | ||
| 16 | P | 49.4 | Very low | 49 | Very low | 97 Ų | 97 | 117.6 Ų | 117.6 | 63% | 0.63 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 152.8 | -178 | 38.7 | -35.2 | 0 | 0 | 0 | 110.2 | ||
| 17 | F | 37.2 | Very low | 52.1 | Low | 158 Ų | 158 | 116.1 Ų | 116.1 | 69% | 0.693 | 62% | 0.615 | S | S | * | * | trans | 74.5 | 88.9 | 165.7 | -48.2 | -67.1 | 0 | 0 | 0 | 116.5 | C19 | F17-C19 PolarHBondContact O-N 3.08Š| ||
| 18 | S | 40 | Very low | 55.2 | Low | 123 Ų | 123 | 112.1 Ų | 112.1 | 86% | 0.86 | 59% | 0.585 | S | S | * | * | trans | -57.8 | 112.4 | 151.8 | -179.9 | 0 | 0 | 0 | 0 | 108.5 | S20 | S18-S20 PolarHBondContact O-N 2.65Š| ||
| 19 | C | 39.2 | Very low | 58.1 | Low | 84 Ų | 84 | 109.5 Ų | 109.5 | 57% | 0.568 | 57% | 0.573 | S | S | * | * | trans | -71.8 | 117.2 | 176.4 | -74.7 | 0 | 0 | 0 | 0 | 110.4 | F17 S21 | F17-C19 PolarHBondContact O-N 3.08Å; C19-S21 PolarHBondContact O-N 2.78Å | ||
| 20 | S | 53.6 | Low | 61.2 | Low | 34 Ų | 34 | 100.4 Ų | 100.4 | 24% | 0.238 | 54% | 0.544 | C | S | . | . | S | Bend | trans | -55.5 | 113.6 | 155.2 | -62.3 | 0 | 0 | 0 | 0 | 108.7 | S18 E61 | S18-S20 PolarHBondContact O-N 2.65Å; S20-E61 WeakPolarHBondContact CB-OE2 3.29Å; S20-E61 PolarHBondContact OG-OE2 2.92Å |
| 21 | S | 63.2 | Low | 64.5 | Low | 36 Ų | 36 | 94.9 Ų | 94.9 | 25% | 0.252 | 51% | 0.507 | S | S | . | . | trans | 21.3 | 90.1 | 173.2 | -157.8 | 0 | 0 | 0 | 0 | 118.5 | C19 K23 L24 | C19-S21 PolarHBondContact O-N 2.78Å; S21-K23 PolarHBondContact O-N 3.31Å; S21-K23 WeakPolarHBondContact OG-CB 3.28Å; S21-L24 PolarHBondContact O-N 2.96Å | ||
| 22 | P | 77.7 | Confident | 67.6 | Low | 98 Ų | 98 | 91 Ų | 91 | 64% | 0.636 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -51.8 | -22.3 | 164.8 | 21.4 | -33.8 | 0 | 0 | 0 | 113.3 | H26 | P22-H26 WeakPolarHBondContact O-CB 2.9Å; P22-H26 PolarHBondContact O-N 3.5Å |
| 23 | K | 86.8 | Confident | 70.6 | Confident | 133 Ų | 133 | 85.1 Ų | 85.1 | 58% | 0.578 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -63.5 | -41.4 | 174.1 | -179.4 | -175.8 | 176.7 | -173.8 | 0 | 112.6 | S21 H26 M27 | S21-K23 PolarHBondContact O-N 3.31Å; S21-K23 WeakPolarHBondContact OG-CB 3.28Å; K23-H26 PolarHBondContact O-N 3.17Å; K23-M27 HydrophobicContact CG-SD 4.37Å; K23-M27 VanDerWaalsContact O-CG 3.29Å; K23-M27 WeakPolarHBondContact O-CG 3.39Å; K23-M27 PolarHBondContact O-N 3Å |
| 24 | L | 89.3 | Confident | 73.6 | Confident | 7 Ų | 7 | 77 Ų | 77 | 4% | 0.037 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -69.4 | -41.3 | -179.2 | -76.2 | 174.2 | 0 | 0 | 0 | 112.1 | S21 H26 M27 L28 N54 L55 L58 I67 F71 | S21-L24 PolarHBondContact O-N 2.96Å; L24-H26 VanDerWaalsContact C-N 3.35Å; L24-M27 HydrophobicContact CD2-SD 4.49Å; L24-M27 WeakPolarHBondContact O-CB 3.44Å; L24-M27 PolarHBondContact O-N 3.27Å; L24-L28 PolarHBondContact O-N 3.48Å; L24-N54 HydrophobicContact CD2-CB 3.95Å; L24-L55 HydrophobicContact CD1-CD1 3.4Å; L24-L55 VanDerWaalsContact CD1-CD1 3.4Å; L24-L58 HydrophobicContact CD1-CD1 3.38Å; L24-L58 HydrophobicContact CG-CD1 4.39Å; L24-I67 HydrophobicContact CB-CD1 4.24Å; L24-I67 HydrophobicContact CB-CG2 4.28Å; L24-F71 HydrophobicContact CD2-CE2 4.39Å |
| 25 | F | 88.9 | Confident | 76.4 | Confident | 83 Ų | 83 | 70.6 Ų | 70.6 | 36% | 0.364 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 171.9 | -80.4 | -76.7 | 0 | 0 | 0 | 111.5 | M27 L28 D29 I67 | F25-M27 VanDerWaalsContact C-N 3.28Å; F25-M27 PolarHBondContact O-N 2.93Å; F25-L28 WeakPolarHBondContact O-CB 3.49Å; F25-L28 PolarHBondContact O-N 3.35Å; F25-L28 VanDerWaalsContact O-N 3.14Å; F25-D29 PolarHBondContact O-N 3.43Å; F25-I67 HydrophobicContact CD1-CD1 4.44Å; F25-I67 HydrophobicContact CD1-CG1 4.29Å; F25-I67 HydrophobicContact CD2-CD1 3.77Å; F25-I67 HydrophobicContact CD2-CG1 4.47Å; F25-I67 HydrophobicContact CE1-CD1 4.1Å; F25-I67 HydrophobicContact CE1-CG1 3.79Å; F25-I67 HydrophobicContact CE2-CD1 3.38Å; F25-I67 HydrophobicContact CE2-CG1 4.02Å; F25-I67 HydrophobicContact CG-CD1 4.3Å; F25-I67 HydrophobicContact CZ-CD1 3.56Å; F25-I67 HydrophobicContact CZ-CG1 3.64Å |
| 26 | H | 90.8 | Very high | 78.9 | Confident | 127 Ų | 127 | 67 Ų | 67 | 59% | 0.588 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.5 | -36.8 | 176.2 | -173.5 | -74.9 | 0 | 0 | 0 | 112.5 | P22 K23 L24 S30 | P22-H26 WeakPolarHBondContact O-CB 2.9Å; P22-H26 PolarHBondContact O-N 3.5Å; K23-H26 PolarHBondContact O-N 3.17Å; L24-H26 VanDerWaalsContact C-N 3.35Å; H26-S30 PolarHBondContact CE1-OG 2.87Å; H26-S30 PolarHBondContact ND1-OG 3.07Å; H26-S30 WeakPolarHBondContact O-CB 3.14Å; H26-S30 PolarHBondContact O-N 3.12Å; H26-S30 PolarHBondContact O-OG 2.93Å |
| 27 | M | 93.8 | Very high | 80.8 | Confident | 36 Ų | 36 | 63.7 Ų | 63.7 | 18% | 0.177 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -65.9 | -41.3 | 174.6 | -74.2 | 177.2 | 68.9 | 0 | 0 | 111.8 | K23 L24 F25 S30 A31 A50 F71 | K23-M27 HydrophobicContact CG-SD 4.37Å; K23-M27 VanDerWaalsContact O-CG 3.29Å; K23-M27 WeakPolarHBondContact O-CG 3.39Å; K23-M27 PolarHBondContact O-N 3Å; L24-M27 HydrophobicContact CD2-SD 4.49Å; L24-M27 WeakPolarHBondContact O-CB 3.44Å; L24-M27 PolarHBondContact O-N 3.27Å; F25-M27 VanDerWaalsContact C-N 3.28Å; F25-M27 PolarHBondContact O-N 2.93Å; M27-S30 PolarHBondContact O-N 3.38Å; M27-A31 WeakPolarHBondContact O-CB 3.38Å; M27-A31 PolarHBondContact O-N 2.95Å; M27-A50 HydrophobicContact CE-CB 4.11Å; M27-F71 HydrophobicContact CB-CE1 4.4Å; M27-F71 HydrophobicContact CB-CZ 3.98Å |
| 28 | L | 94.9 | Very high | 83.3 | Confident | 28 Ų | 28 | 62.1 Ų | 62.1 | 15% | 0.147 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.7 | -44.6 | 175.4 | -176.1 | 65.2 | 0 | 0 | 0 | 111.4 | L24 F25 S30 A31 A32 F71 L74 | L24-L28 PolarHBondContact O-N 3.48Å; F25-L28 WeakPolarHBondContact O-CB 3.49Å; F25-L28 PolarHBondContact O-N 3.35Å; F25-L28 VanDerWaalsContact O-N 3.14Å; L28-S30 VanDerWaalsContact C-N 3.31Å; L28-S30 PolarHBondContact O-N 3.13Å; L28-A31 PolarHBondContact O-N 3.33Å; L28-A32 PolarHBondContact O-N 3.19Å; L28-F71 HydrophobicContact CB-CD1 4.42Å; L28-F71 HydrophobicContact CB-CE1 3.82Å; L28-F71 HydrophobicContact CB-CE2 4.45Å; L28-F71 HydrophobicContact CB-CZ 3.82Å; L28-F71 HydrophobicContact CD1-CB 4.47Å; L28-F71 HydrophobicContact CD1-CD1 3.5Å; L28-F71 HydrophobicContact CD1-CD2 4.47Å; L28-F71 HydrophobicContact CD1-CE1 3.78Å; L28-F71 HydrophobicContact CD1-CG 3.89Å; L28-F71 HydrophobicContact CD1-CZ 4.36Å; L28-F71 HydrophobicContact CG-CE1 4.43Å; L28-L74 HydrophobicContact CD1-CD1 3.66Å |
| 29 | D | 94.1 | Very high | 85.7 | Confident | 99 Ų | 99 | 57.6 Ų | 57.6 | 53% | 0.529 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.3 | -42.4 | 174.3 | -75.1 | -21.2 | 0 | 0 | 0 | 111.1 | F25 A31 A32 E33 | F25-D29 PolarHBondContact O-N 3.43Å; D29-A31 PolarHBondContact O-N 2.63Å; D29-A32 WeakPolarHBondContact O-CB 3.49Å; D29-A32 PolarHBondContact O-N 3.07Å; D29-E33 WeakPolarHBondContact O-CG 3.39Å; D29-E33 PolarHBondContact O-N 3.45Å |
| 30 | S | 94.6 | Very high | 88.4 | Confident | 39 Ų | 39 | 57 Ų | 57 | 27% | 0.273 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 177 | -57.8 | 0 | 0 | 0 | 0 | 111.8 | H26 M27 L28 A32 E33 L34 | H26-S30 PolarHBondContact CE1-OG 2.87Å; H26-S30 PolarHBondContact ND1-OG 3.07Å; H26-S30 WeakPolarHBondContact O-CB 3.14Å; H26-S30 PolarHBondContact O-N 3.12Å; H26-S30 PolarHBondContact O-OG 2.93Å; M27-S30 PolarHBondContact O-N 3.38Å; L28-S30 VanDerWaalsContact C-N 3.31Å; L28-S30 PolarHBondContact O-N 3.13Å; S30-A32 VanDerWaalsContact C-N 3.33Å; S30-E33 PolarHBondContact O-N 3.33Å; S30-L34 WeakPolarHBondContact O-CG 3.36Å; S30-L34 PolarHBondContact O-N 3.35Å |
| 31 | A | 96.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.4 | -40.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | M27 L28 D29 L34 M35 A47 L74 | M27-A31 WeakPolarHBondContact O-CB 3.38Å; M27-A31 PolarHBondContact O-N 2.95Å; L28-A31 PolarHBondContact O-N 3.33Å; D29-A31 PolarHBondContact O-N 2.63Å; A31-L34 PolarHBondContact O-N 3.35Å; A31-M35 PolarHBondContact O-N 3.02Å; A31-A47 HydrophobicContact CB-CB 3.88Å; A31-L74 HydrophobicContact CB-CD1 4.14Å |
| 32 | A | 94.8 | Very high | 92.1 | Very high | 25 Ų | 25 | 59.9 Ų | 59.9 | 21% | 0.207 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.9 | -41.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L28 D29 S30 M35 M36 L74 | L28-A32 PolarHBondContact O-N 3.19Å; D29-A32 WeakPolarHBondContact O-CB 3.49Å; D29-A32 PolarHBondContact O-N 3.07Å; S30-A32 VanDerWaalsContact C-N 3.33Å; A32-M35 PolarHBondContact O-N 3.06Å; A32-M36 HydrophobicContact CB-SD 4.47Å; A32-M36 WeakPolarHBondContact O-CB 3.33Å; A32-M36 WeakPolarHBondContact O-CG 3.45Å; A32-M36 PolarHBondContact O-N 2.92Å; A32-L74 HydrophobicContact CB-CD1 4.04Å |
| 33 | E | 93.1 | Very high | 93.1 | Very high | 110 Ų | 110 | 56 Ų | 56 | 51% | 0.514 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 175.5 | -75 | -172.5 | 170.8 | 0 | 0 | 112.5 | D29 S30 M35 V37 Q38 | D29-E33 WeakPolarHBondContact O-CG 3.39Å; D29-E33 PolarHBondContact O-N 3.45Å; S30-E33 PolarHBondContact O-N 3.33Å; E33-M35 VanDerWaalsContact C-N 3.33Å; E33-M35 PolarHBondContact O-N 2.79Å; E33-V37 WeakPolarHBondContact O-CA 3.39Å; E33-V37 VanDerWaalsContact O-CB 3.24Å; E33-V37 WeakPolarHBondContact O-CB 3.44Å; E33-V37 PolarHBondContact O-N 3.15Å; E33-Q38 PolarHBondContact O-N 3.11Å |
| 34 | L | 95.3 | Very high | 93.6 | Very high | 34 Ų | 34 | 49.6 Ų | 49.6 | 18% | 0.178 | 26% | 0.26 | C | S | . | . | I | π-helix | trans | -57.3 | -48.2 | 175.6 | -74.2 | 165.6 | 0 | 0 | 0 | 110.8 | S30 A31 Q38 G39 D40 A44 A47 | S30-L34 WeakPolarHBondContact O-CG 3.36Å; S30-L34 PolarHBondContact O-N 3.35Å; A31-L34 PolarHBondContact O-N 3.35Å; L34-Q38 CarbonylContact O-C 3.59Å; L34-Q38 WeakPolarHBondContact O-CB 3.46Å; L34-Q38 PolarHBondContact O-N 3.04Å; L34-G39 PolarHBondContact O-N 3Å; L34-D40 HydrophobicContact CD2-CB 4.2Å; L34-D40 PolarHBondContact O-N 3.5Å; L34-A44 HydrophobicContact CB-CB 3.96Å; L34-A47 HydrophobicContact CD1-CB 4.25Å |
| 35 | M | 93.1 | Very high | 94 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 6% | 0.064 | 26% | 0.263 | C | S | . | . | I | π-helix | trans | -66.4 | -50.4 | 179.2 | -178.2 | -177.3 | -68.5 | 0 | 0 | 112.9 | A31 A32 E33 F41 A44 L74 Q77 A78 M273 | A31-M35 PolarHBondContact O-N 3.02Å; A32-M35 PolarHBondContact O-N 3.06Å; E33-M35 VanDerWaalsContact C-N 3.33Å; E33-M35 PolarHBondContact O-N 2.79Å; M35-F41 HydrophobicContact CG-CD1 4.31Å; M35-F41 HydrophobicContact CG-CE1 4.4Å; M35-A44 HydrophobicContact CB-CB 3.87Å; M35-A44 HydrophobicContact CE-CB 4.42Å; M35-L74 HydrophobicContact CE-CB 3.93Å; M35-L74 HydrophobicContact CE-CD2 3.89Å; M35-L74 WeakPolarHBondContact CE-O 3.32Å; M35-L74 HydrophobicContact SD-CD2 3.71Å; M35-Q77 HydrophobicContact CE-CB 3.81Å; M35-Q77 HydrophobicContact SD-CB 4.03Å; M35-A78 HydrophobicContact CE-CB 3.9Å; M35-M273 WeakPolarHBondContact O-CE 3.39Å |
| 36 | M | 91.3 | Very high | 94.5 | Very high | 44 Ų | 44 | 50.1 Ų | 50.1 | 22% | 0.217 | 27% | 0.266 | C | S | . | . | I | π-helix | trans | -97.9 | -16.9 | -163 | -63.4 | 175.3 | 171 | 0 | 0 | 114.1 | A32 L74 Y272 M273 | A32-M36 HydrophobicContact CB-SD 4.47Å; A32-M36 WeakPolarHBondContact O-CB 3.33Å; A32-M36 WeakPolarHBondContact O-CG 3.45Å; A32-M36 PolarHBondContact O-N 2.92Å; M36-L74 HydrophobicContact CE-CD2 4.22Å; M36-Y272 HydrophobicContact CB-CD1 3.92Å; M36-Y272 HydrophobicContact CB-CE1 4.13Å; M36-Y272 HydrophobicContact CE-CD1 4.23Å; M36-Y272 HydrophobicContact CE-CE1 4.26Å; M36-Y272 HydrophobicContact CG-CD1 3.87Å; M36-Y272 HydrophobicContact CG-CE1 4.12Å; M36-Y272 HydrophobicContact SD-CD1 3.32Å; M36-Y272 WeakPolarHBondContact SD-CD1 3.44Å; M36-Y272 HydrophobicContact SD-CE1 3.1Å; M36-Y272 WeakPolarHBondContact SD-CE1 3.32Å; M36-Y272 HydrophobicContact SD-CG 4.37Å; M36-M273 VanDerWaalsContact O-CA 3.31Å; M36-M273 WeakPolarHBondContact O-CA 3.35Å; M36-M273 WeakPolarHBondContact O-CB 3.33Å; M36-M273 WeakPolarHBondContact O-CE 3.34Å; M36-M273 WeakPolarHBondContact O-CG 3.19Å |
| 37 | V | 88.6 | Confident | 94.8 | Very high | 27 Ų | 27 | 45.1 Ų | 45.1 | 16% | 0.164 | 25% | 0.247 | C | C | . | . | I | π-helix | trans | -109.4 | -50.7 | 177.1 | -176.6 | 0 | 0 | 0 | 0 | 110.3 | E33 V276 | E33-V37 WeakPolarHBondContact O-CA 3.39Å; E33-V37 VanDerWaalsContact O-CB 3.24Å; E33-V37 WeakPolarHBondContact O-CB 3.44Å; E33-V37 PolarHBondContact O-N 3.15Å; V37-V276 HydrophobicContact CG2-CB 4.43Å; V37-V276 HydrophobicContact CG2-CG1 3.52Å |
| 38 | Q | 89.3 | Confident | 94.9 | Very high | 125 Ų | 125 | 43.4 Ų | 43.4 | 58% | 0.584 | 24% | 0.238 | S | C | * | . | I | π-helix | trans | -86 | -26.4 | -171 | -51.6 | -174.5 | 38 | 0 | 0 | 111.6 | E33 L34 D40 | E33-Q38 PolarHBondContact O-N 3.11Å; L34-Q38 CarbonylContact O-C 3.59Å; L34-Q38 WeakPolarHBondContact O-CB 3.46Å; L34-Q38 PolarHBondContact O-N 3.04Å; Q38-D40 HydrophobicContact CB-CB 4.38Å |
| 39 | G | 91.8 | Very high | 95 | Very high | 28 Ų | 28 | 43.8 Ų | 43.8 | 29% | 0.289 | 24% | 0.24 | S | C | . | . | trans | 70.1 | 20.9 | -173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L34 F41 | L34-G39 PolarHBondContact O-N 3Å; G39-F41 PolarHBondContact O-N 3.21Å | ||
| 40 | D | 96.1 | Very high | 95 | Very high | 70 Ų | 70 | 40.8 Ų | 40.8 | 37% | 0.374 | 23% | 0.229 | S | C | . | . | trans | -88.6 | 84.8 | 176.5 | -175.6 | 2.4 | 0 | 0 | 0 | 109.1 | L34 Q38 Q42 G43 A44 | L34-D40 HydrophobicContact CD2-CB 4.2Å; L34-D40 PolarHBondContact O-N 3.5Å; Q38-D40 HydrophobicContact CB-CB 4.38Å; D40-Q42 PolarHBondContact OD1-N 2.94Å; D40-G43 PolarHBondContact OD1-N 3.41Å; D40-A44 VanDerWaalsContact O-CB 3.28Å; D40-A44 WeakPolarHBondContact O-CB 3.43Å; D40-A44 PolarHBondContact O-N 2.81Å | ||
| 41 | F | 96.6 | Very high | 95 | Very high | 54 Ų | 54 | 39 Ų | 39 | 24% | 0.237 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -70.1 | -33.2 | -177.6 | -52.2 | -60.1 | 0 | 0 | 0 | 112.5 | M35 G39 F45 A78 E81 L82 | M35-F41 HydrophobicContact CG-CD1 4.31Å; M35-F41 HydrophobicContact CG-CE1 4.4Å; G39-F41 PolarHBondContact O-N 3.21Å; F41-F45 WeakPolarHBondContact O-CB 3.38Å; F41-F45 PolarHBondContact O-N 2.93Å; F41-A78 WeakPolarHBondContact O-CB 3.49Å; F41-E81 HydrophobicContact CB-CB 4.3Å; F41-E81 HydrophobicContact CD1-CB 3.68Å; F41-E81 HydrophobicContact CD1-CG 3.92Å; F41-E81 HydrophobicContact CD2-CB 3.81Å; F41-E81 HydrophobicContact CE1-CB 3.87Å; F41-E81 HydrophobicContact CE1-CG 3.74Å; F41-E81 HydrophobicContact CE2-CB 3.99Å; F41-E81 HydrophobicContact CG-CB 3.65Å; F41-E81 HydrophobicContact CG-CG 4.41Å; F41-E81 HydrophobicContact CZ-CB 4.02Å; F41-E81 HydrophobicContact CZ-CG 4.06Å; F41-L82 HydrophobicContact CB-CD1 4.43Å; F41-L82 HydrophobicContact CB-CD2 3.91Å; F41-L82 HydrophobicContact CB-CG 3.86Å |
| 42 | Q | 98.1 | Very high | 94.9 | Very high | 77 Ų | 77 | 39.4 Ų | 39.4 | 36% | 0.36 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -69 | -49.1 | 176.5 | -173.3 | 62.2 | 54.9 | 0 | 0 | 110.1 | D40 A44 F45 D46 L82 | D40-Q42 PolarHBondContact OD1-N 2.94Å; Q42-A44 VanDerWaalsContact C-N 3.29Å; Q42-A44 PolarHBondContact O-N 3.31Å; Q42-F45 PolarHBondContact O-N 3.3Å; Q42-F45 VanDerWaalsContact O-N 3.14Å; Q42-D46 PolarHBondContact NE2-OD1 3.45Å; Q42-D46 PolarHBondContact O-N 2.84Å; Q42-L82 HydrophobicContact CB-CD2 4.46Å |
| 43 | G | 97.6 | Very high | 94.7 | Very high | 16 Ų | 16 | 44 Ų | 44 | 17% | 0.165 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.7 | -39.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | D40 A47 | D40-G43 PolarHBondContact OD1-N 3.41Å; G43-A47 VanDerWaalsContact O-CB 3.28Å; G43-A47 WeakPolarHBondContact O-CB 3.28Å; G43-A47 PolarHBondContact O-N 3.47Å |
| 44 | A | 97.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.5 | -43.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L34 M35 D40 Q42 A47 C48 | L34-A44 HydrophobicContact CB-CB 3.96Å; M35-A44 HydrophobicContact CB-CB 3.87Å; M35-A44 HydrophobicContact CE-CB 4.42Å; D40-A44 VanDerWaalsContact O-CB 3.28Å; D40-A44 WeakPolarHBondContact O-CB 3.43Å; D40-A44 PolarHBondContact O-N 2.81Å; Q42-A44 VanDerWaalsContact C-N 3.29Å; Q42-A44 PolarHBondContact O-N 3.31Å; A44-A47 PolarHBondContact O-N 3.22Å; A44-C48 PolarHBondContact O-N 3.28Å; A44-C48 PolarHBondContact O-SG 3.4Å |
| 45 | F | 98.1 | Very high | 94.3 | Very high | 22 Ų | 22 | 40 Ų | 40 | 10% | 0.096 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.8 | -45.6 | 177 | -177.6 | -112.5 | 0 | 0 | 0 | 111.9 | F41 Q42 A47 C48 N49 A78 L79 W91 | F41-F45 WeakPolarHBondContact O-CB 3.38Å; F41-F45 PolarHBondContact O-N 2.93Å; Q42-F45 PolarHBondContact O-N 3.3Å; Q42-F45 VanDerWaalsContact O-N 3.14Å; F45-A47 VanDerWaalsContact C-N 3.3Å; F45-A47 PolarHBondContact O-N 3.43Å; F45-C48 WeakPolarHBondContact O-CB 3.06Å; F45-C48 PolarHBondContact O-N 3.23Å; F45-C48 VanDerWaalsContact O-N 3.09Å; F45-N49 WeakPolarHBondContact CE1-ND2 3.35Å; F45-N49 VanDerWaalsContact CZ-ND2 3.29Å; F45-N49 WeakPolarHBondContact CZ-ND2 3.49Å; F45-N49 PolarHBondContact O-N 3.13Å; F45-A78 HydrophobicContact CB-CB 3.85Å; F45-A78 HydrophobicContact CD2-CB 4.49Å; F45-L79 HydrophobicContact CD1-CD2 4.49Å; F45-L79 HydrophobicContact CD2-CD1 4.36Å; F45-L79 HydrophobicContact CD2-CD2 4.06Å; F45-L79 HydrophobicContact CD2-CG 3.79Å; F45-L79 HydrophobicContact CE1-CD2 4.12Å; F45-L79 HydrophobicContact CE2-CD1 3.62Å; F45-L79 HydrophobicContact CE2-CD2 3.7Å; F45-L79 HydrophobicContact CE2-CG 3.5Å; F45-L79 HydrophobicContact CG-CD2 4.44Å; F45-L79 HydrophobicContact CZ-CD1 4.1Å; F45-L79 HydrophobicContact CZ-CD2 3.73Å; F45-L79 HydrophobicContact CZ-CG 4.05Å; F45-W91 HydrophobicContact CE2-CD2 4.03Å; F45-W91 AromaticContact CE2-CE2 3.61Å; F45-W91 HydrophobicContact CE2-CG 4.41Å; F45-W91 HydrophobicContact CE2-CH2 4.48Å; F45-W91 AromaticContact CE2-CZ2 3.85Å; F45-W91 HydrophobicContact CE2-CZ2 3.85Å; F45-W91 AromaticContact CE2-NE1 3.75Å; F45-W91 AromaticContact CZ-CD1 3.91Å; F45-W91 HydrophobicContact CZ-CD2 4.43Å; F45-W91 AromaticContact CZ-CE2 3.99Å; F45-W91 HydrophobicContact CZ-CG 4.37Å; F45-W91 AromaticContact CZ-NE1 3.62Å |
| 46 | D | 97.9 | Very high | 93.8 | Very high | 79 Ų | 79 | 42.6 Ų | 42.6 | 42% | 0.422 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.8 | -40.4 | 178.1 | -64 | -19.9 | 0 | 0 | 0 | 111.1 | Q42 N49 A50 | Q42-D46 PolarHBondContact NE2-OD1 3.45Å; Q42-D46 PolarHBondContact O-N 2.84Å; D46-N49 PolarHBondContact O-N 3.43Å; D46-A50 WeakPolarHBondContact O-CB 3.4Å; D46-A50 PolarHBondContact O-N 2.88Å |
| 47 | A | 96.9 | Very high | 93.4 | Very high | 22 Ų | 22 | 49.7 Ų | 49.7 | 18% | 0.182 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64 | -38.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A31 L34 G43 A44 F45 G51 | A31-A47 HydrophobicContact CB-CB 3.88Å; L34-A47 HydrophobicContact CD1-CB 4.25Å; G43-A47 VanDerWaalsContact O-CB 3.28Å; G43-A47 WeakPolarHBondContact O-CB 3.28Å; G43-A47 PolarHBondContact O-N 3.47Å; A44-A47 PolarHBondContact O-N 3.22Å; F45-A47 VanDerWaalsContact C-N 3.3Å; F45-A47 PolarHBondContact O-N 3.43Å; A47-G51 PolarHBondContact O-N 3.23Å |
| 48 | C | 97.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 175.1 | -67 | 0 | 0 | 0 | 0 | 112 | A44 F45 G51 L52 F71 L74 | A44-C48 PolarHBondContact O-N 3.28Å; A44-C48 PolarHBondContact O-SG 3.4Å; F45-C48 WeakPolarHBondContact O-CB 3.06Å; F45-C48 PolarHBondContact O-N 3.23Å; F45-C48 VanDerWaalsContact O-N 3.09Å; C48-G51 PolarHBondContact O-N 3.03Å; C48-L52 WeakPolarHBondContact O-CG 3.49Å; C48-L52 PolarHBondContact O-N 3.35Å; C48-F71 HydrophobicContact CB-CB 4.46Å; C48-F71 HydrophobicContact CB-CD1 4.17Å; C48-L74 VanDerWaalsContact SG-CB 3.58Å |
| 49 | N | 95.8 | Very high | 92 | Very high | 35 Ų | 35 | 53 Ų | 53 | 19% | 0.187 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.3 | -49.8 | 175.4 | -79 | -28.4 | 0 | 0 | 0 | 111.3 | F45 D46 G51 L52 E53 W91 | F45-N49 WeakPolarHBondContact CE1-ND2 3.35Å; F45-N49 VanDerWaalsContact CZ-ND2 3.29Å; F45-N49 WeakPolarHBondContact CZ-ND2 3.49Å; F45-N49 PolarHBondContact O-N 3.13Å; D46-N49 PolarHBondContact O-N 3.43Å; N49-G51 VanDerWaalsContact C-N 3.26Å; N49-G51 PolarHBondContact O-N 2.96Å; N49-L52 PolarHBondContact O-N 3.28Å; N49-E53 WeakPolarHBondContact O-CG 3.38Å; N49-E53 PolarHBondContact O-N 2.87Å; N49-W91 WeakPolarHBondContact OD1-CZ2 3.33Å; N49-W91 PolarHBondContact OD1-NE1 3.41Å |
| 50 | A | 94.9 | Very high | 90.8 | Very high | 37 Ų | 37 | 57.3 Ų | 57.3 | 31% | 0.306 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.8 | -38.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | M27 D46 N54 | M27-A50 HydrophobicContact CE-CB 4.11Å; D46-A50 WeakPolarHBondContact O-CB 3.4Å; D46-A50 PolarHBondContact O-N 2.88Å; A50-N54 WeakPolarHBondContact O-CB 3.5Å; A50-N54 PolarHBondContact O-N 3.06Å; A50-N54 PolarHBondContact O-ND2 3.09Å |
| 51 | G | 94.4 | Very high | 89.5 | Confident | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60 | -48.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | A47 C48 N49 N54 L55 | A47-G51 PolarHBondContact O-N 3.23Å; C48-G51 PolarHBondContact O-N 3.03Å; N49-G51 VanDerWaalsContact C-N 3.26Å; N49-G51 PolarHBondContact O-N 2.96Å; G51-N54 PolarHBondContact O-N 3.02Å; G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 3.33Å |
| 52 | L | 93.8 | Very high | 88 | Confident | 9 Ų | 9 | 62.4 Ų | 62.4 | 5% | 0.047 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -67.3 | -38.6 | 179.4 | -70.4 | 163.9 | 0 | 0 | 0 | 112.6 | C48 N49 L55 G56 K68 F71 W91 | C48-L52 WeakPolarHBondContact O-CG 3.49Å; C48-L52 PolarHBondContact O-N 3.35Å; N49-L52 PolarHBondContact O-N 3.28Å; L52-L55 WeakPolarHBondContact O-CB 3.28Å; L52-L55 PolarHBondContact O-N 3.28Å; L52-G56 PolarHBondContact O-N 3.48Å; L52-K68 HydrophobicContact CD2-CB 4.5Å; L52-K68 HydrophobicContact CD2-CG 3.68Å; L52-F71 HydrophobicContact CD1-CB 4.04Å; L52-F71 HydrophobicContact CD2-CB 3.79Å; L52-F71 HydrophobicContact CD2-CD2 4.46Å; L52-F71 HydrophobicContact CG-CB 3.67Å; L52-F71 HydrophobicContact CG-CD2 4.46Å; L52-F71 HydrophobicContact CG-CG 4.29Å; L52-W91 HydrophobicContact CD1-CH2 3.74Å; L52-W91 HydrophobicContact CD1-CZ2 3.56Å |
| 53 | E | 91.8 | Very high | 86.8 | Confident | 121 Ų | 121 | 64.2 Ų | 64.2 | 57% | 0.565 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -63.7 | -40.3 | 173.5 | -74.4 | -179.3 | -173.2 | 0 | 0 | 112.3 | N49 L55 G56 R57 | N49-E53 WeakPolarHBondContact O-CG 3.38Å; N49-E53 PolarHBondContact O-N 2.87Å; E53-L55 VanDerWaalsContact C-N 3.33Å; E53-G56 PolarHBondContact O-N 3.49Å; E53-R57 WeakPolarHBondContact O-CG 3.31Å |
| 54 | N | 90.1 | Very high | 86 | Confident | 49 Ų | 49 | 64 Ų | 64 | 26% | 0.262 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.1 | -37.2 | 175.1 | -78.4 | -64.6 | 0 | 0 | 0 | 111.4 | L24 A50 G51 R57 | L24-N54 HydrophobicContact CD2-CB 3.95Å; A50-N54 WeakPolarHBondContact O-CB 3.5Å; A50-N54 PolarHBondContact O-N 3.06Å; A50-N54 PolarHBondContact O-ND2 3.09Å; G51-N54 PolarHBondContact O-N 3.02Å; N54-R57 PolarHBondContact O-N 2.9Å |
| 55 | L | 89.1 | Confident | 85.5 | Confident | 11 Ų | 11 | 67.5 Ų | 67.5 | 6% | 0.058 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 176.7 | -160.8 | 80.2 | 0 | 0 | 0 | 111.9 | L24 G51 L52 E53 R57 L58 S64 I67 K68 | L24-L55 HydrophobicContact CD1-CD1 3.4Å; L24-L55 VanDerWaalsContact CD1-CD1 3.4Å; G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 3.33Å; L52-L55 WeakPolarHBondContact O-CB 3.28Å; L52-L55 PolarHBondContact O-N 3.28Å; E53-L55 VanDerWaalsContact C-N 3.33Å; L55-R57 PolarHBondContact O-N 2.85Å; L55-R57 VanDerWaalsContact O-N 3.09Å; L55-L58 PolarHBondContact O-N 3.3Å; L55-S64 WeakPolarHBondContact CD1-OG 3.44Å; L55-S64 WeakPolarHBondContact CD2-O 3.36Å; L55-S64 VanDerWaalsContact CG-OG 3.29Å; L55-S64 WeakPolarHBondContact CG-OG 3.34Å; L55-I67 HydrophobicContact CD1-CG2 4.35Å; L55-K68 HydrophobicContact CD2-CB 3.41Å; L55-K68 VanDerWaalsContact CD2-CB 3.41Å; L55-K68 HydrophobicContact CD2-CD 4.08Å; L55-K68 HydrophobicContact CD2-CG 3.66Å |
| 56 | G | 82.9 | Confident | 85.1 | Confident | 69 Ų | 69 | 73.3 Ų | 73.3 | 71% | 0.711 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -10 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | L52 E53 | L52-G56 PolarHBondContact O-N 3.48Å; E53-G56 PolarHBondContact O-N 3.49Å |
| 57 | R | 81.6 | Confident | 84.8 | Confident | 192 Ų | 192 | 69.7 Ų | 69.7 | 73% | 0.725 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | -6.3 | 174.4 | -63.8 | 175.1 | -174.6 | 174.9 | 4.3 | 113.3 | E53 N54 L55 | E53-R57 WeakPolarHBondContact O-CG 3.31Å; N54-R57 PolarHBondContact O-N 2.9Å; L55-R57 PolarHBondContact O-N 2.85Å; L55-R57 VanDerWaalsContact O-N 3.09Å |
| 58 | L | 79.4 | Confident | 84.6 | Confident | 75 Ų | 75 | 70.5 Ų | 70.5 | 39% | 0.393 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -100 | 156.3 | 179.9 | -62.9 | 171.3 | 0 | 0 | 0 | 110.3 | L24 L55 | L24-L58 HydrophobicContact CD1-CD1 3.38Å; L24-L58 HydrophobicContact CG-CD1 4.39Å; L55-L58 PolarHBondContact O-N 3.3Å |
| 59 | E | 69.1 | Low | 84.5 | Confident | 146 Ų | 146 | 71.9 Ų | 71.9 | 68% | 0.682 | 37% | 0.37 | S | S | * | . | trans | -66.6 | 148.4 | 174.4 | -69.5 | -64.3 | 122.1 | 0 | 0 | 110.6 | E61 | E59-E61 PolarHBondContact O-N 3.15Å; E59-E61 VanDerWaalsContact O-N 3.11Å | ||
| 60 | P | 66.3 | Low | 84.5 | Confident | 119 Ų | 119 | 71 Ų | 71 | 77% | 0.773 | 37% | 0.37 | S | S | * | . | trans | -69.9 | 110.3 | -177.9 | 26.3 | -32.1 | 0 | 0 | 0 | 110.7 | ||||
| 61 | E | 69.6 | Low | 84.6 | Confident | 76 Ų | 76 | 69.3 Ų | 69.3 | 36% | 0.355 | 36% | 0.355 | S | S | . | . | trans | -116.6 | 152.9 | 169.3 | -60 | 109.5 | -164.2 | 0 | 0 | 111.3 | S20 E59 R63 S64 | S20-E61 WeakPolarHBondContact CB-OE2 3.29Å; S20-E61 PolarHBondContact OG-OE2 2.92Å; E59-E61 PolarHBondContact O-N 3.15Å; E59-E61 VanDerWaalsContact O-N 3.11Å; E61-R63 PolarHBondContact O-N 2.83Å; E61-R63 VanDerWaalsContact O-N 3.14Å; E61-S64 WeakPolarHBondContact O-CA 3.45Å; E61-S64 WeakPolarHBondContact O-CB 3.46Å; E61-S64 PolarHBondContact O-N 2.86Å | ||
| 62 | D | 66 | Low | 84.8 | Confident | 156 Ų | 156 | 69.3 Ų | 69.3 | 83% | 0.834 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -56.2 | -36.1 | -179.1 | -66.1 | -25.4 | 0 | 0 | 0 | 113.3 | S64 E65 | D62-S64 VanDerWaalsContact C-N 3.28Å; D62-S64 PolarHBondContact O-N 2.92Å; D62-E65 PolarHBondContact O-N 3.48Å |
| 63 | R | 71.4 | Confident | 85 | Confident | 114 Ų | 114 | 71.2 Ų | 71.2 | 43% | 0.43 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -71 | -23.8 | 175.8 | -66 | -174.9 | -175.5 | 175.6 | 3 | 113 | E61 E65 I67 | E61-R63 PolarHBondContact O-N 2.83Å; E61-R63 VanDerWaalsContact O-N 3.14Å; R63-E65 VanDerWaalsContact C-N 3.31Å; R63-I67 WeakPolarHBondContact O-CD1 3.31Å; R63-I67 VanDerWaalsContact O-CG1 3.31Å; R63-I67 WeakPolarHBondContact O-CG1 3.35Å; R63-I67 PolarHBondContact O-N 3.44Å |
| 64 | S | 81.5 | Confident | 85.2 | Confident | 13 Ų | 13 | 66 Ų | 66 | 9% | 0.091 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.7 | -38.8 | 176.2 | -168.4 | 0 | 0 | 0 | 0 | 110.3 | L55 E61 D62 I67 K68 | L55-S64 WeakPolarHBondContact CD1-OG 3.44Å; L55-S64 WeakPolarHBondContact CD2-O 3.36Å; L55-S64 VanDerWaalsContact CG-OG 3.29Å; L55-S64 WeakPolarHBondContact CG-OG 3.34Å; E61-S64 WeakPolarHBondContact O-CA 3.45Å; E61-S64 WeakPolarHBondContact O-CB 3.46Å; E61-S64 PolarHBondContact O-N 2.86Å; D62-S64 VanDerWaalsContact C-N 3.28Å; D62-S64 PolarHBondContact O-N 2.92Å; S64-I67 PolarHBondContact O-N 3.03Å; S64-K68 WeakPolarHBondContact O-CB 3.48Å; S64-K68 PolarHBondContact O-N 3.43Å |
| 65 | E | 86.8 | Confident | 85.6 | Confident | 73 Ų | 73 | 63.7 Ų | 63.7 | 34% | 0.341 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -69.1 | -40 | -179.1 | -170.2 | 56.2 | -141.7 | 0 | 0 | 112.6 | D62 R63 I67 K68 I69 Y96 | D62-E65 PolarHBondContact O-N 3.48Å; R63-E65 VanDerWaalsContact C-N 3.31Å; E65-I67 VanDerWaalsContact C-N 3.32Å; E65-I67 PolarHBondContact O-N 3.24Å; E65-K68 WeakPolarHBondContact O-CB 3.31Å; E65-K68 PolarHBondContact O-N 3.28Å; E65-I69 HydrophobicContact CG-CD1 4.22Å; E65-I69 VanDerWaalsContact O-CG1 3.28Å; E65-I69 WeakPolarHBondContact O-CG1 3.3Å; E65-I69 PolarHBondContact O-N 2.94Å; E65-Y96 VanDerWaalsContact OE1-CE1 3.27Å; E65-Y96 WeakPolarHBondContact OE1-CE1 3.03Å; E65-Y96 PolarHBondContact OE1-OH 3.38Å |
| 66 | E | 89.6 | Confident | 86 | Confident | 143 Ų | 143 | 63.3 Ų | 63.3 | 67% | 0.668 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -62.9 | -40 | 175.4 | -68 | -173.3 | 161.6 | 0 | 0 | 112.1 | I69 G70 | E66-I69 PolarHBondContact O-N 3.06Å; E66-G70 PolarHBondContact O-N 3.03Å |
| 67 | I | 92 | Very high | 86.7 | Confident | 3 Ų | 3 | 62.2 Ų | 62.2 | 2% | 0.015 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.2 | -42.3 | 174.9 | -64.3 | 168.7 | 0 | 0 | 0 | 110.4 | L24 F25 L55 R63 S64 E65 I69 G70 F71 | L24-I67 HydrophobicContact CB-CD1 4.24Å; L24-I67 HydrophobicContact CB-CG2 4.28Å; F25-I67 HydrophobicContact CD1-CD1 4.44Å; F25-I67 HydrophobicContact CD1-CG1 4.29Å; F25-I67 HydrophobicContact CD2-CD1 3.77Å; F25-I67 HydrophobicContact CD2-CG1 4.47Å; F25-I67 HydrophobicContact CE1-CD1 4.1Å; F25-I67 HydrophobicContact CE1-CG1 3.79Å; F25-I67 HydrophobicContact CE2-CD1 3.38Å; F25-I67 HydrophobicContact CE2-CG1 4.02Å; F25-I67 HydrophobicContact CG-CD1 4.3Å; F25-I67 HydrophobicContact CZ-CD1 3.56Å; F25-I67 HydrophobicContact CZ-CG1 3.64Å; L55-I67 HydrophobicContact CD1-CG2 4.35Å; R63-I67 WeakPolarHBondContact O-CD1 3.31Å; R63-I67 VanDerWaalsContact O-CG1 3.31Å; R63-I67 WeakPolarHBondContact O-CG1 3.35Å; R63-I67 PolarHBondContact O-N 3.44Å; S64-I67 PolarHBondContact O-N 3.03Å; E65-I67 VanDerWaalsContact C-N 3.32Å; E65-I67 PolarHBondContact O-N 3.24Å; I67-I69 VanDerWaalsContact C-N 3.32Å; I67-I69 PolarHBondContact O-N 3.16Å; I67-G70 WeakPolarHBondContact O-CA 3.3Å; I67-G70 PolarHBondContact O-N 3.39Å; I67-G70 VanDerWaalsContact O-N 3.13Å; I67-F71 HydrophobicContact CG2-CD2 3.69Å; I67-F71 HydrophobicContact CG2-CE2 3.4Å; I67-F71 HydrophobicContact CG2-CZ 4.39Å; I67-F71 WeakPolarHBondContact O-CD2 3.18Å; I67-F71 PolarHBondContact O-N 2.79Å |
| 68 | K | 94.2 | Very high | 87.5 | Confident | 39 Ų | 39 | 53.1 Ų | 53.1 | 17% | 0.17 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -56.1 | -47.8 | 174.9 | -162 | 178.3 | 176.3 | -176.4 | 0 | 111.3 | L52 L55 S64 E65 G70 F71 C72 H95 Y96 | L52-K68 HydrophobicContact CD2-CB 4.5Å; L52-K68 HydrophobicContact CD2-CG 3.68Å; L55-K68 HydrophobicContact CD2-CB 3.41Å; L55-K68 VanDerWaalsContact CD2-CB 3.41Å; L55-K68 HydrophobicContact CD2-CD 4.08Å; L55-K68 HydrophobicContact CD2-CG 3.66Å; S64-K68 WeakPolarHBondContact O-CB 3.48Å; S64-K68 PolarHBondContact O-N 3.43Å; E65-K68 WeakPolarHBondContact O-CB 3.31Å; E65-K68 PolarHBondContact O-N 3.28Å; K68-G70 VanDerWaalsContact C-N 3.31Å; K68-G70 PolarHBondContact O-N 3.33Å; K68-F71 PolarHBondContact O-N 2.77Å; K68-C72 WeakPolarHBondContact O-CB 3.31Å; K68-C72 PolarHBondContact O-N 2.71Å; K68-C72 PolarHBondContact O-SG 3.06Å; K68-H95 WeakPolarHBondContact CE-O 3.41Å; K68-H95 PolarHBondContact NZ-O 3.11Å; K68-Y96 HydrophobicContact CD-CE1 3.97Å; K68-Y96 HydrophobicContact CD-CE2 4.46Å |
| 69 | I | 94.6 | Very high | 88.4 | Confident | 29 Ų | 29 | 49.9 Ų | 49.9 | 15% | 0.149 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.2 | -44.4 | 176.6 | -69.6 | 165.7 | 0 | 0 | 0 | 110.1 | E65 E66 I67 C72 I73 P103 I106 | E65-I69 HydrophobicContact CG-CD1 4.22Å; E65-I69 VanDerWaalsContact O-CG1 3.28Å; E65-I69 WeakPolarHBondContact O-CG1 3.3Å; E65-I69 PolarHBondContact O-N 2.94Å; E66-I69 PolarHBondContact O-N 3.06Å; I67-I69 VanDerWaalsContact C-N 3.32Å; I67-I69 PolarHBondContact O-N 3.16Å; I69-C72 PolarHBondContact O-N 2.92Å; I69-I73 HydrophobicContact CG2-CD1 3.68Å; I69-I73 HydrophobicContact CG2-CG1 4.32Å; I69-I73 VanDerWaalsContact O-CG1 3.31Å; I69-I73 WeakPolarHBondContact O-CG1 3.46Å; I69-I73 PolarHBondContact O-N 3.03Å; I69-P103 HydrophobicContact CD1-CB 3.93Å; I69-P103 HydrophobicContact CD1-CG 3.98Å; I69-P103 HydrophobicContact CG1-CB 4.08Å; I69-P103 HydrophobicContact CG1-CG 3.85Å; I69-I106 HydrophobicContact CG1-CD1 4.26Å |
| 70 | G | 95.7 | Very high | 89.7 | Confident | 18 Ų | 18 | 44.4 Ų | 44.4 | 19% | 0.186 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -56.5 | -50.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | E66 I67 K68 C72 I73 L74 | E66-G70 PolarHBondContact O-N 3.03Å; I67-G70 WeakPolarHBondContact O-CA 3.3Å; I67-G70 PolarHBondContact O-N 3.39Å; I67-G70 VanDerWaalsContact O-N 3.13Å; K68-G70 VanDerWaalsContact C-N 3.31Å; K68-G70 PolarHBondContact O-N 3.33Å; G70-C72 VanDerWaalsContact C-N 3.34Å; G70-C72 PolarHBondContact O-N 3.29Å; G70-I73 PolarHBondContact O-N 3.01Å; G70-L74 PolarHBondContact O-N 2.98Å; G70-L74 VanDerWaalsContact O-N 3.09Å |
| 71 | F | 97.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.8 | -39.4 | 176.7 | -76.3 | -56.9 | 0 | 0 | 0 | 112.4 | L24 M27 L28 C48 L52 I67 K68 G75 | L24-F71 HydrophobicContact CD2-CE2 4.39Å; M27-F71 HydrophobicContact CB-CE1 4.4Å; M27-F71 HydrophobicContact CB-CZ 3.98Å; L28-F71 HydrophobicContact CB-CD1 4.42Å; L28-F71 HydrophobicContact CB-CE1 3.82Å; L28-F71 HydrophobicContact CB-CE2 4.45Å; L28-F71 HydrophobicContact CB-CZ 3.82Å; L28-F71 HydrophobicContact CD1-CB 4.47Å; L28-F71 HydrophobicContact CD1-CD1 3.5Å; L28-F71 HydrophobicContact CD1-CD2 4.47Å; L28-F71 HydrophobicContact CD1-CE1 3.78Å; L28-F71 HydrophobicContact CD1-CG 3.89Å; L28-F71 HydrophobicContact CD1-CZ 4.36Å; L28-F71 HydrophobicContact CG-CE1 4.43Å; C48-F71 HydrophobicContact CB-CB 4.46Å; C48-F71 HydrophobicContact CB-CD1 4.17Å; L52-F71 HydrophobicContact CD1-CB 4.04Å; L52-F71 HydrophobicContact CD2-CB 3.79Å; L52-F71 HydrophobicContact CD2-CD2 4.46Å; L52-F71 HydrophobicContact CG-CB 3.67Å; L52-F71 HydrophobicContact CG-CD2 4.46Å; L52-F71 HydrophobicContact CG-CG 4.29Å; I67-F71 HydrophobicContact CG2-CD2 3.69Å; I67-F71 HydrophobicContact CG2-CE2 3.4Å; I67-F71 HydrophobicContact CG2-CZ 4.39Å; I67-F71 WeakPolarHBondContact O-CD2 3.18Å; I67-F71 PolarHBondContact O-N 2.79Å; K68-F71 PolarHBondContact O-N 2.77Å; F71-G75 PolarHBondContact O-N 3.46Å |
| 72 | C | 97.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.3 | -42.2 | 177.5 | -69.3 | 0 | 0 | 0 | 0 | 112 | K68 I69 G70 G75 I76 W91 I106 | K68-C72 WeakPolarHBondContact O-CB 3.31Å; K68-C72 PolarHBondContact O-N 2.71Å; K68-C72 PolarHBondContact O-SG 3.06Å; I69-C72 PolarHBondContact O-N 2.92Å; G70-C72 VanDerWaalsContact C-N 3.34Å; G70-C72 PolarHBondContact O-N 3.29Å; C72-G75 PolarHBondContact O-N 3.45Å; C72-I76 WeakPolarHBondContact O-CB 3.48Å; C72-I76 VanDerWaalsContact O-CD1 3.29Å; C72-I76 WeakPolarHBondContact O-CD1 3.41Å; C72-I76 WeakPolarHBondContact O-CG1 3.33Å; C72-I76 PolarHBondContact O-N 3.03Å; C72-W91 HydrophobicContact CB-CZ3 4.49Å; C72-I106 HydrophobicContact CB-CD1 3.51Å; C72-I106 HydrophobicContact CB-CG1 4.15Å |
| 73 | I | 97.4 | Very high | 93.7 | Very high | 49 Ų | 49 | 40 Ų | 40 | 25% | 0.251 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60.8 | -50.3 | 177.3 | -72.2 | 168.7 | 0 | 0 | 0 | 110.4 | I69 G70 I76 Q77 L109 | I69-I73 HydrophobicContact CG2-CD1 3.68Å; I69-I73 HydrophobicContact CG2-CG1 4.32Å; I69-I73 VanDerWaalsContact O-CG1 3.31Å; I69-I73 WeakPolarHBondContact O-CG1 3.46Å; I69-I73 PolarHBondContact O-N 3.03Å; G70-I73 PolarHBondContact O-N 3.01Å; I73-I76 PolarHBondContact O-N 3.1Å; I73-Q77 VanDerWaalsContact O-CG 3.3Å; I73-Q77 WeakPolarHBondContact O-CG 3.26Å; I73-Q77 PolarHBondContact O-N 3.39Å; I73-L109 HydrophobicContact CB-CD2 4.19Å; I73-L109 HydrophobicContact CG1-CD2 4.09Å; I73-L109 HydrophobicContact CG2-CD2 4.02Å |
| 74 | L | 97.6 | Very high | 94.9 | Very high | 13 Ų | 13 | 39.3 Ų | 39.3 | 7% | 0.068 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.3 | -42.5 | 177.8 | -68.2 | 178.5 | 0 | 0 | 0 | 111.2 | L28 A31 A32 M35 M36 C48 G70 I76 Q77 A78 | L28-L74 HydrophobicContact CD1-CD1 3.66Å; A31-L74 HydrophobicContact CB-CD1 4.14Å; A32-L74 HydrophobicContact CB-CD1 4.04Å; M35-L74 HydrophobicContact CE-CB 3.93Å; M35-L74 HydrophobicContact CE-CD2 3.89Å; M35-L74 WeakPolarHBondContact CE-O 3.32Å; M35-L74 HydrophobicContact SD-CD2 3.71Å; M36-L74 HydrophobicContact CE-CD2 4.22Å; C48-L74 VanDerWaalsContact SG-CB 3.58Å; G70-L74 PolarHBondContact O-N 2.98Å; G70-L74 VanDerWaalsContact O-N 3.09Å; L74-I76 PolarHBondContact O-N 3.07Å; L74-Q77 PolarHBondContact O-N 3.02Å; L74-A78 WeakPolarHBondContact O-CB 3.44Å; L74-A78 PolarHBondContact O-N 2.88Å |
| 75 | G | 97.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.5 | -44 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | F71 C72 Q77 A78 L79 | F71-G75 PolarHBondContact O-N 3.46Å; C72-G75 PolarHBondContact O-N 3.45Å; G75-Q77 PolarHBondContact O-N 3.23Å; G75-A78 PolarHBondContact O-N 3.12Å; G75-L79 WeakPolarHBondContact O-CG 3.37Å; G75-L79 PolarHBondContact O-N 3.01Å |
| 76 | I | 98.1 | Very high | 96 | Very high | 2 Ų | 2 | 44.8 Ų | 44.8 | 1% | 0.01 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.5 | -44.2 | 174.8 | -68 | 157.9 | 0 | 0 | 0 | 111 | C72 I73 L74 L79 A80 A88 W91 V92 I106 L109 L113 | C72-I76 WeakPolarHBondContact O-CB 3.48Å; C72-I76 VanDerWaalsContact O-CD1 3.29Å; C72-I76 WeakPolarHBondContact O-CD1 3.41Å; C72-I76 WeakPolarHBondContact O-CG1 3.33Å; C72-I76 PolarHBondContact O-N 3.03Å; I73-I76 PolarHBondContact O-N 3.1Å; L74-I76 PolarHBondContact O-N 3.07Å; I76-L79 PolarHBondContact O-N 3.49Å; I76-A80 WeakPolarHBondContact O-CB 3.43Å; I76-A80 PolarHBondContact O-N 3.5Å; I76-A88 HydrophobicContact CG2-CB 4.49Å; I76-W91 HydrophobicContact CG1-CE3 4.34Å; I76-W91 HydrophobicContact CG1-CZ3 4.08Å; I76-V92 HydrophobicContact CD1-CG2 3.59Å; I76-V92 HydrophobicContact CG1-CG2 3.79Å; I76-I106 HydrophobicContact CD1-CG2 3.83Å; I76-L109 HydrophobicContact CB-CD2 3.97Å; I76-L109 HydrophobicContact CD1-CD2 3.91Å; I76-L109 HydrophobicContact CD1-CG 4.5Å; I76-L109 HydrophobicContact CG2-CD2 3.88Å; I76-L109 HydrophobicContact CG2-CG 3.97Å; I76-L113 HydrophobicContact CG2-CD2 3.88Å |
| 77 | Q | 96.9 | Very high | 96.3 | Very high | 47 Ų | 47 | 39.4 Ų | 39.4 | 22% | 0.22 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.5 | -44.5 | 177.6 | -74.1 | 174.5 | -32.7 | 0 | 0 | 111.4 | M35 I73 L74 G75 A80 E81 | M35-Q77 HydrophobicContact CE-CB 3.81Å; M35-Q77 HydrophobicContact SD-CB 4.03Å; I73-Q77 VanDerWaalsContact O-CG 3.3Å; I73-Q77 WeakPolarHBondContact O-CG 3.26Å; I73-Q77 PolarHBondContact O-N 3.39Å; L74-Q77 PolarHBondContact O-N 3.02Å; G75-Q77 PolarHBondContact O-N 3.23Å; Q77-A80 WeakPolarHBondContact O-CB 3.14Å; Q77-A80 PolarHBondContact O-N 3.4Å; Q77-E81 WeakPolarHBondContact O-CG 3.42Å; Q77-E81 PolarHBondContact O-N 3.13Å |
| 78 | A | 97.7 | Very high | 96.5 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.4 | -45.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | M35 F41 F45 L74 G75 A80 E81 L82 | M35-A78 HydrophobicContact CE-CB 3.9Å; F41-A78 WeakPolarHBondContact O-CB 3.49Å; F45-A78 HydrophobicContact CB-CB 3.85Å; F45-A78 HydrophobicContact CD2-CB 4.49Å; L74-A78 WeakPolarHBondContact O-CB 3.44Å; L74-A78 PolarHBondContact O-N 2.88Å; G75-A78 PolarHBondContact O-N 3.12Å; A78-A80 VanDerWaalsContact C-N 3.27Å; A78-A80 PolarHBondContact O-N 3.14Å; A78-E81 PolarHBondContact O-N 2.85Å; A78-L82 WeakPolarHBondContact O-CB 3.22Å; A78-L82 VanDerWaalsContact O-CG 3.27Å; A78-L82 WeakPolarHBondContact O-CG 3.25Å; A78-L82 PolarHBondContact O-N 3.34Å |
| 79 | L | 97.9 | Very high | 96.7 | Very high | 7 Ų | 7 | 38.1 Ų | 38.1 | 4% | 0.037 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -60.1 | -37.2 | 174.5 | -73.2 | 173.4 | 0 | 0 | 0 | 112.3 | F45 G75 I76 N83 Q84 W85 A88 W91 | F45-L79 HydrophobicContact CD1-CD2 4.49Å; F45-L79 HydrophobicContact CD2-CD1 4.36Å; F45-L79 HydrophobicContact CD2-CD2 4.06Å; F45-L79 HydrophobicContact CD2-CG 3.79Å; F45-L79 HydrophobicContact CE1-CD2 4.12Å; F45-L79 HydrophobicContact CE2-CD1 3.62Å; F45-L79 HydrophobicContact CE2-CD2 3.7Å; F45-L79 HydrophobicContact CE2-CG 3.5Å; F45-L79 HydrophobicContact CG-CD2 4.44Å; F45-L79 HydrophobicContact CZ-CD1 4.1Å; F45-L79 HydrophobicContact CZ-CD2 3.73Å; F45-L79 HydrophobicContact CZ-CG 4.05Å; G75-L79 WeakPolarHBondContact O-CG 3.37Å; G75-L79 PolarHBondContact O-N 3.01Å; I76-L79 PolarHBondContact O-N 3.49Å; L79-N83 PolarHBondContact O-N 2.96Å; L79-Q84 HydrophobicContact CD2-CB 3.88Å; L79-Q84 CarbonylContact O-C 3.56Å; L79-Q84 WeakPolarHBondContact O-CA 3.45Å; L79-Q84 PolarHBondContact O-N 3.5Å; L79-W85 PolarHBondContact O-N 2.68Å; L79-A88 HydrophobicContact CD1-CB 4.22Å; L79-W91 HydrophobicContact CD1-CB 4.21Å; L79-W91 HydrophobicContact CD1-CD2 4.11Å; L79-W91 HydrophobicContact CD1-CE3 4.11Å; L79-W91 HydrophobicContact CD1-CG 4.17Å |
| 80 | A | 96.3 | Very high | 96.8 | Very high | 32 Ų | 32 | 39.8 Ų | 39.8 | 26% | 0.264 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -64.9 | -45.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I76 Q77 A78 L82 N83 L113 | I76-A80 WeakPolarHBondContact O-CB 3.43Å; I76-A80 PolarHBondContact O-N 3.5Å; Q77-A80 WeakPolarHBondContact O-CB 3.14Å; Q77-A80 PolarHBondContact O-N 3.4Å; A78-A80 VanDerWaalsContact C-N 3.27Å; A78-A80 PolarHBondContact O-N 3.14Å; A80-L82 VanDerWaalsContact C-N 3.33Å; A80-L82 PolarHBondContact O-N 2.87Å; A80-N83 PolarHBondContact O-N 3.27Å; A80-N83 VanDerWaalsContact O-N 3.1Å; A80-L113 HydrophobicContact CB-CD1 3.57Å; A80-L113 HydrophobicContact CB-CD2 4.36Å |
| 81 | E | 95.8 | Very high | 96.9 | Very high | 99 Ų | 99 | 39.6 Ų | 39.6 | 46% | 0.463 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -67.5 | -31.6 | 177.9 | -65 | -61.3 | 151.1 | 0 | 0 | 112.5 | F41 Q77 A78 N83 | F41-E81 HydrophobicContact CB-CB 4.3Å; F41-E81 HydrophobicContact CD1-CB 3.68Å; F41-E81 HydrophobicContact CD1-CG 3.92Å; F41-E81 HydrophobicContact CD2-CB 3.81Å; F41-E81 HydrophobicContact CE1-CB 3.87Å; F41-E81 HydrophobicContact CE1-CG 3.74Å; F41-E81 HydrophobicContact CE2-CB 3.99Å; F41-E81 HydrophobicContact CG-CB 3.65Å; F41-E81 HydrophobicContact CG-CG 4.41Å; F41-E81 HydrophobicContact CZ-CB 4.02Å; F41-E81 HydrophobicContact CZ-CG 4.06Å; Q77-E81 WeakPolarHBondContact O-CG 3.42Å; Q77-E81 PolarHBondContact O-N 3.13Å; A78-E81 PolarHBondContact O-N 2.85Å; E81-N83 PolarHBondContact O-N 2.91Å |
| 82 | L | 95.9 | Very high | 96.9 | Very high | 50 Ų | 50 | 39.6 Ų | 39.6 | 26% | 0.262 | 20% | 0.203 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | 2 | 172.5 | -67.4 | 169.9 | 0 | 0 | 0 | 113.6 | F41 Q42 A78 A80 Q84 | F41-L82 HydrophobicContact CB-CD1 4.43Å; F41-L82 HydrophobicContact CB-CD2 3.91Å; F41-L82 HydrophobicContact CB-CG 3.86Å; Q42-L82 HydrophobicContact CB-CD2 4.46Å; A78-L82 WeakPolarHBondContact O-CB 3.22Å; A78-L82 VanDerWaalsContact O-CG 3.27Å; A78-L82 WeakPolarHBondContact O-CG 3.25Å; A78-L82 PolarHBondContact O-N 3.34Å; A80-L82 VanDerWaalsContact C-N 3.33Å; A80-L82 PolarHBondContact O-N 2.87Å; L82-Q84 HydrophobicContact CB-CG 4.16Å; L82-Q84 PolarHBondContact O-N 2.62Å |
| 83 | N | 94.5 | Very high | 96.8 | Very high | 110 Ų | 110 | 41.8 Ų | 41.8 | 59% | 0.588 | 21% | 0.214 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56.7 | 25.4 | -173.6 | -165.9 | 38.2 | 0 | 0 | 0 | 113.7 | L79 A80 E81 W85 | L79-N83 PolarHBondContact O-N 2.96Å; A80-N83 PolarHBondContact O-N 3.27Å; A80-N83 VanDerWaalsContact O-N 3.1Å; E81-N83 PolarHBondContact O-N 2.91Å; N83-W85 VanDerWaalsContact C-N 3.34Å; N83-W85 PolarHBondContact OD1-NE1 3.11Å |
| 84 | Q | 96.8 | Very high | 96.7 | Very high | 99 Ų | 99 | 46.4 Ų | 46.4 | 46% | 0.463 | 23% | 0.234 | S | C | . | . | trans | -98.8 | 24.2 | 175.4 | -64.6 | -174.6 | -2.5 | 0 | 0 | 112 | L79 L82 R86 G87 | L79-Q84 HydrophobicContact CD2-CB 3.88Å; L79-Q84 CarbonylContact O-C 3.56Å; L79-Q84 WeakPolarHBondContact O-CA 3.45Å; L79-Q84 PolarHBondContact O-N 3.5Å; L82-Q84 HydrophobicContact CB-CG 4.16Å; L82-Q84 PolarHBondContact O-N 2.62Å; Q84-R86 PolarHBondContact O-N 3.14Å; Q84-G87 PolarHBondContact O-N 3.16Å; Q84-G87 VanDerWaalsContact O-N 3.12Å | ||
| 85 | W | 95.4 | Very high | 96.5 | Very high | 27 Ų | 27 | 48 Ų | 48 | 10% | 0.102 | 24% | 0.241 | C | C | . | . | G | 310 helix | trans | -53.5 | -28.9 | -177.2 | 58.4 | -97.4 | 0 | 0 | 0 | 114.1 | L79 N83 G87 A88 L113 Y114 V117 Q119 | L79-W85 PolarHBondContact O-N 2.68Å; N83-W85 VanDerWaalsContact C-N 3.34Å; N83-W85 PolarHBondContact OD1-NE1 3.11Å; W85-G87 PolarHBondContact O-N 2.9Å; W85-A88 VanDerWaalsContact O-CB 3.31Å; W85-A88 WeakPolarHBondContact O-CB 3.32Å; W85-A88 PolarHBondContact O-N 3.33Å; W85-A88 VanDerWaalsContact O-N 3.1Å; W85-L113 HydrophobicContact CB-CD1 4.13Å; W85-L113 HydrophobicContact CB-CD2 4.15Å; W85-L113 HydrophobicContact CB-CG 4.31Å; W85-Y114 HydrophobicContact CE3-CD1 4.16Å; W85-Y114 AromaticContact CE3-CE1 3.84Å; W85-Y114 HydrophobicContact CE3-CE1 3.84Å; W85-Y114 HydrophobicContact CZ3-CD1 4.23Å; W85-Y114 HydrophobicContact CZ3-CE1 4.01Å; W85-Y114 PolarHBondContact O-OH 3.45Å; W85-Y114 VanDerWaalsContact O-OH 3.07Å; W85-V117 HydrophobicContact CD2-CB 4.28Å; W85-V117 HydrophobicContact CD2-CG1 4.16Å; W85-V117 HydrophobicContact CD2-CG2 3.91Å; W85-V117 HydrophobicContact CE3-CG2 3.73Å; W85-V117 HydrophobicContact CG-CG1 4.01Å; W85-V117 HydrophobicContact CH2-CG2 4.36Å; W85-V117 HydrophobicContact CZ3-CG2 3.97Å; W85-Q119 HydrophobicContact CH2-CB 4.37Å; W85-Q119 HydrophobicContact CH2-CG 3.88Å; W85-Q119 HydrophobicContact CZ3-CB 4.23Å; W85-Q119 HydrophobicContact CZ3-CG 4.25Å |
| 86 | R | 96.5 | Very high | 96.3 | Very high | 174 Ų | 174 | 48.9 Ų | 48.9 | 66% | 0.657 | 25% | 0.245 | S | C | * | . | G | 310 helix | trans | -56.3 | -37.5 | 179.6 | -71.1 | -177.7 | -178.9 | 91 | -1.6 | 112.4 | Q84 Y114 | Q84-R86 PolarHBondContact O-N 3.14Å; R86-Y114 PolarHBondContact O-OH 3.43Å |
| 87 | G | 94.7 | Very high | 96 | Very high | 29 Ų | 29 | 51.4 Ų | 51.4 | 30% | 0.299 | 27% | 0.271 | S | S | . | . | G | 310 helix | trans | -90 | -1.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q84 W85 F89 S90 W91 | Q84-G87 PolarHBondContact O-N 3.16Å; Q84-G87 VanDerWaalsContact O-N 3.12Å; W85-G87 PolarHBondContact O-N 2.9Å; G87-F89 PolarHBondContact O-N 3.35Å; G87-S90 WeakPolarHBondContact CA-OG 3.47Å; G87-S90 PolarHBondContact O-N 3.32Å; G87-S90 PolarHBondContact O-OG 2.87Å; G87-W91 VanDerWaalsContact O-CB 3.27Å; G87-W91 WeakPolarHBondContact O-CB 3.2Å; G87-W91 PolarHBondContact O-N 3.12Å |
| 88 | A | 97.2 | Very high | 95.8 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.5 | -49 | -170.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I76 L79 W85 W91 V92 L113 | I76-A88 HydrophobicContact CG2-CB 4.49Å; L79-A88 HydrophobicContact CD1-CB 4.22Å; W85-A88 VanDerWaalsContact O-CB 3.31Å; W85-A88 WeakPolarHBondContact O-CB 3.32Å; W85-A88 PolarHBondContact O-N 3.33Å; W85-A88 VanDerWaalsContact O-N 3.1Å; A88-W91 PolarHBondContact O-N 3.46Å; A88-V92 WeakPolarHBondContact O-CG2 3.22Å; A88-V92 PolarHBondContact O-N 3.43Å; A88-V92 VanDerWaalsContact O-N 3.1Å; A88-L113 HydrophobicContact CB-CD2 3.77Å |
| 89 | F | 97.4 | Very high | 95.7 | Very high | 15 Ų | 15 | 57.3 Ų | 57.3 | 7% | 0.066 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -70.7 | -39.2 | 179.6 | -169.6 | -117.1 | 0 | 0 | 0 | 112.3 | G87 W91 V92 L93 Q99 M107 C110 Y114 M123 A126 | G87-F89 PolarHBondContact O-N 3.35Å; F89-W91 PolarHBondContact O-N 3.02Å; F89-V92 WeakPolarHBondContact O-CB 3.49Å; F89-V92 PolarHBondContact O-N 2.94Å; F89-L93 HydrophobicContact CD1-CD1 4.03Å; F89-L93 HydrophobicContact CD1-CG 4.31Å; F89-L93 HydrophobicContact CE1-CD1 3.77Å; F89-L93 HydrophobicContact CE1-CD2 4.14Å; F89-L93 HydrophobicContact CE1-CG 4.03Å; F89-L93 HydrophobicContact CZ-CD1 4.41Å; F89-L93 HydrophobicContact CZ-CD2 3.95Å; F89-L93 HydrophobicContact CZ-CG 4.23Å; F89-L93 WeakPolarHBondContact O-CG 3.47Å; F89-L93 PolarHBondContact O-N 3.32Å; F89-Q99 HydrophobicContact CE1-CB 4.41Å; F89-Q99 HydrophobicContact CZ-CB 3.95Å; F89-M107 HydrophobicContact CE2-CE 4.06Å; F89-M107 HydrophobicContact CE2-SD 4.42Å; F89-M107 HydrophobicContact CZ-CE 4.06Å; F89-C110 HydrophobicContact CD2-CB 4.11Å; F89-Y114 HydrophobicContact CB-CE2 3.97Å; F89-Y114 PolarHBondContact N-OH 3.48Å; F89-M123 HydrophobicContact CB-SD 3.99Å; F89-M123 HydrophobicContact CD1-CE 4.49Å; F89-M123 HydrophobicContact CD1-SD 3.98Å; F89-M123 HydrophobicContact CD2-CE 3.92Å; F89-M123 HydrophobicContact CD2-SD 3.93Å; F89-M123 HydrophobicContact CE1-CE 4.46Å; F89-M123 HydrophobicContact CE1-SD 4.46Å; F89-M123 HydrophobicContact CE2-CE 3.87Å; F89-M123 HydrophobicContact CE2-SD 4.41Å; F89-M123 HydrophobicContact CG-CE 4.24Å; F89-M123 HydrophobicContact CG-SD 3.69Å; F89-M123 HydrophobicContact CZ-CE 4.15Å; F89-A126 HydrophobicContact CD1-CB 4.34Å; F89-A126 HydrophobicContact CE1-CB 3.39Å; F89-A126 HydrophobicContact CZ-CB 3.67Å |
| 90 | S | 97 | Very high | 95.6 | Very high | 64 Ų | 64 | 59 Ų | 59 | 45% | 0.448 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.3 | -34 | 175 | 54 | 0 | 0 | 0 | 0 | 112.6 | G87 L93 Q94 | G87-S90 WeakPolarHBondContact CA-OG 3.47Å; G87-S90 PolarHBondContact O-N 3.32Å; G87-S90 PolarHBondContact O-OG 2.87Å; S90-L93 PolarHBondContact O-N 3.16Å; S90-Q94 WeakPolarHBondContact O-CG 3.42Å; S90-Q94 PolarHBondContact O-N 2.78Å |
| 91 | W | 97.6 | Very high | 95.5 | Very high | 15 Ų | 15 | 61.4 Ų | 61.4 | 6% | 0.057 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -68 | -44.3 | 174.6 | 172.5 | 77 | 0 | 0 | 0 | 111.6 | F45 N49 L52 C72 I76 L79 G87 A88 F89 L93 Q94 H95 | F45-W91 HydrophobicContact CE2-CD2 4.03Å; F45-W91 AromaticContact CE2-CE2 3.61Å; F45-W91 HydrophobicContact CE2-CG 4.41Å; F45-W91 HydrophobicContact CE2-CH2 4.48Å; F45-W91 AromaticContact CE2-CZ2 3.85Å; F45-W91 HydrophobicContact CE2-CZ2 3.85Å; F45-W91 AromaticContact CE2-NE1 3.75Å; F45-W91 AromaticContact CZ-CD1 3.91Å; F45-W91 HydrophobicContact CZ-CD2 4.43Å; F45-W91 AromaticContact CZ-CE2 3.99Å; F45-W91 HydrophobicContact CZ-CG 4.37Å; F45-W91 AromaticContact CZ-NE1 3.62Å; N49-W91 WeakPolarHBondContact OD1-CZ2 3.33Å; N49-W91 PolarHBondContact OD1-NE1 3.41Å; L52-W91 HydrophobicContact CD1-CH2 3.74Å; L52-W91 HydrophobicContact CD1-CZ2 3.56Å; C72-W91 HydrophobicContact CB-CZ3 4.49Å; I76-W91 HydrophobicContact CG1-CE3 4.34Å; I76-W91 HydrophobicContact CG1-CZ3 4.08Å; L79-W91 HydrophobicContact CD1-CB 4.21Å; L79-W91 HydrophobicContact CD1-CD2 4.11Å; L79-W91 HydrophobicContact CD1-CE3 4.11Å; L79-W91 HydrophobicContact CD1-CG 4.17Å; G87-W91 VanDerWaalsContact O-CB 3.27Å; G87-W91 WeakPolarHBondContact O-CB 3.2Å; G87-W91 PolarHBondContact O-N 3.12Å; A88-W91 PolarHBondContact O-N 3.46Å; F89-W91 PolarHBondContact O-N 3.02Å; W91-L93 VanDerWaalsContact C-N 3.27Å; W91-L93 PolarHBondContact O-N 3.33Å; W91-Q94 VanDerWaalsContact O-CB 3.31Å; W91-Q94 WeakPolarHBondContact O-CB 3.31Å; W91-Q94 PolarHBondContact O-N 3.13Å; W91-H95 AromaticContact CE2-NE2 3.53Å; W91-H95 AromaticContact CZ2-NE2 3.73Å; W91-H95 AromaticContact NE1-NE2 3.46Å; W91-H95 PolarHBondContact NE1-NE2 3.02Å; W91-H95 PolarHBondContact O-CD2 3.43Å |
| 92 | V | 97.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -55.8 | -43.6 | 172.6 | 171 | 0 | 0 | 0 | 0 | 111.6 | I76 A88 F89 Q94 H95 Y96 V102 I106 | I76-V92 HydrophobicContact CD1-CG2 3.59Å; I76-V92 HydrophobicContact CG1-CG2 3.79Å; A88-V92 WeakPolarHBondContact O-CG2 3.22Å; A88-V92 PolarHBondContact O-N 3.43Å; A88-V92 VanDerWaalsContact O-N 3.1Å; F89-V92 WeakPolarHBondContact O-CB 3.49Å; F89-V92 PolarHBondContact O-N 2.94Å; V92-Q94 PolarHBondContact O-N 3.25Å; V92-H95 PolarHBondContact O-N 3.25Å; V92-Y96 HydrophobicContact CG1-CD2 3.9Å; V92-Y96 HydrophobicContact CG1-CE2 4.44Å; V92-Y96 PolarHBondContact O-N 3.09Å; V92-V102 HydrophobicContact CG1-CG1 4.06Å; V92-V102 HydrophobicContact CG1-CG2 4.02Å; V92-I106 HydrophobicContact CB-CG2 4.49Å; V92-I106 HydrophobicContact CG1-CG2 3.65Å; V92-I106 HydrophobicContact CG2-CG2 4Å |
| 93 | L | 96.6 | Very high | 95.6 | Very high | 46 Ų | 46 | 55.6 Ų | 55.6 | 24% | 0.241 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63 | -26 | 179.6 | -68.3 | 179.6 | 0 | 0 | 0 | 112.9 | F89 S90 W91 H95 Y96 G97 Q99 V102 | F89-L93 HydrophobicContact CD1-CD1 4.03Å; F89-L93 HydrophobicContact CD1-CG 4.31Å; F89-L93 HydrophobicContact CE1-CD1 3.77Å; F89-L93 HydrophobicContact CE1-CD2 4.14Å; F89-L93 HydrophobicContact CE1-CG 4.03Å; F89-L93 HydrophobicContact CZ-CD1 4.41Å; F89-L93 HydrophobicContact CZ-CD2 3.95Å; F89-L93 HydrophobicContact CZ-CG 4.23Å; F89-L93 WeakPolarHBondContact O-CG 3.47Å; F89-L93 PolarHBondContact O-N 3.32Å; S90-L93 PolarHBondContact O-N 3.16Å; W91-L93 VanDerWaalsContact C-N 3.27Å; W91-L93 PolarHBondContact O-N 3.33Å; L93-H95 PolarHBondContact O-N 3Å; L93-Y96 PolarHBondContact O-N 2.94Å; L93-G97 WeakPolarHBondContact O-CA 3.49Å; L93-G97 PolarHBondContact O-N 3.26Å; L93-Q99 HydrophobicContact CD2-CB 4.03Å; L93-V102 HydrophobicContact CD2-CG2 4.11Å |
| 94 | Q | 95.2 | Very high | 95.7 | Very high | 145 Ų | 145 | 50.7 Ų | 50.7 | 68% | 0.678 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -62.4 | -26.6 | 173.3 | -64.2 | 168.5 | 15.2 | 0 | 0 | 112 | S90 W91 V92 | S90-Q94 WeakPolarHBondContact O-CG 3.42Å; S90-Q94 PolarHBondContact O-N 2.78Å; W91-Q94 VanDerWaalsContact O-CB 3.31Å; W91-Q94 WeakPolarHBondContact O-CB 3.31Å; W91-Q94 PolarHBondContact O-N 3.13Å; V92-Q94 PolarHBondContact O-N 3.25Å |
| 95 | H | 93.4 | Very high | 95.7 | Very high | 47 Ų | 47 | 52.6 Ų | 52.6 | 22% | 0.218 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -97.4 | -22.8 | -177.8 | -58.9 | -62 | 0 | 0 | 0 | 114.2 | K68 W91 V92 L93 | K68-H95 WeakPolarHBondContact CE-O 3.41Å; K68-H95 PolarHBondContact NZ-O 3.11Å; W91-H95 AromaticContact CE2-NE2 3.53Å; W91-H95 AromaticContact CZ2-NE2 3.73Å; W91-H95 AromaticContact NE1-NE2 3.46Å; W91-H95 PolarHBondContact NE1-NE2 3.02Å; W91-H95 PolarHBondContact O-CD2 3.43Å; V92-H95 PolarHBondContact O-N 3.25Å; L93-H95 PolarHBondContact O-N 3Å |
| 96 | Y | 93.1 | Very high | 95.8 | Very high | 19 Ų | 19 | 51.3 Ų | 51.3 | 8% | 0.075 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -112.2 | -9.1 | -178.7 | -72 | -80 | 0 | 0 | 0 | 113.6 | E65 K68 V92 L93 Q98 N101 V102 P103 I106 | E65-Y96 VanDerWaalsContact OE1-CE1 3.27Å; E65-Y96 WeakPolarHBondContact OE1-CE1 3.03Å; E65-Y96 PolarHBondContact OE1-OH 3.38Å; K68-Y96 HydrophobicContact CD-CE1 3.97Å; K68-Y96 HydrophobicContact CD-CE2 4.46Å; V92-Y96 HydrophobicContact CG1-CD2 3.9Å; V92-Y96 HydrophobicContact CG1-CE2 4.44Å; V92-Y96 PolarHBondContact O-N 3.09Å; L93-Y96 PolarHBondContact O-N 2.94Å; Y96-Q98 VanDerWaalsContact C-N 3.29Å; Y96-Q98 PolarHBondContact O-N 3.35Å; Y96-N101 WeakPolarHBondContact CD1-O 3.48Å; Y96-N101 WeakPolarHBondContact O-CB 3.31Å; Y96-N101 PolarHBondContact O-ND2 3Å; Y96-V102 HydrophobicContact CG-CG2 4.33Å; Y96-P103 HydrophobicContact CE1-CG 3.69Å; Y96-P103 VanDerWaalsContact CZ-CD 3.44Å; Y96-I106 HydrophobicContact CE2-CD1 3.65Å |
| 97 | G | 92.3 | Very high | 95.9 | Very high | 54 Ų | 54 | 43 Ų | 43 | 56% | 0.557 | 23% | 0.234 | S | C | * | . | S | Bend | trans | 73.8 | -78.4 | -177 | 0 | 0 | 0 | 0 | 0 | 111.4 | L93 | L93-G97 WeakPolarHBondContact O-CA 3.49Å; L93-G97 PolarHBondContact O-N 3.26Å |
| 98 | Q | 93.3 | Very high | 96.1 | Very high | 127 Ų | 127 | 43 Ų | 43 | 59% | 0.593 | 23% | 0.226 | S | C | * | . | S | Bend | trans | -103.1 | 149.3 | -176.8 | -64.8 | -174.7 | -25.4 | 0 | 0 | 111.2 | Y96 E100 N101 | Y96-Q98 VanDerWaalsContact C-N 3.29Å; Y96-Q98 PolarHBondContact O-N 3.35Å; Q98-E100 VanDerWaalsContact CB-OE2 3.31Å; Q98-E100 WeakPolarHBondContact CB-OE2 3.45Å; Q98-E100 PolarHBondContact O-N 3.25Å; Q98-N101 PolarHBondContact O-N 3.46Å; Q98-N101 VanDerWaalsContact O-N 3.13Å |
| 99 | Q | 95 | Very high | 96.1 | Very high | 45 Ų | 45 | 45 Ų | 45 | 21% | 0.21 | 24% | 0.237 | C | C | . | . | G | 310 helix | trans | -60.2 | -32.3 | -179.6 | 64.4 | -153.2 | -7.7 | 0 | 0 | 111.7 | F89 L93 N101 V102 A126 A129 W130 | F89-Q99 HydrophobicContact CE1-CB 4.41Å; F89-Q99 HydrophobicContact CZ-CB 3.95Å; L93-Q99 HydrophobicContact CD2-CB 4.03Å; Q99-N101 PolarHBondContact O-N 3Å; Q99-V102 VanDerWaalsContact O-CB 3.31Å; Q99-V102 WeakPolarHBondContact O-CB 3.27Å; Q99-V102 WeakPolarHBondContact O-CG2 3.49Å; Q99-V102 PolarHBondContact O-N 3.06Å; Q99-V102 VanDerWaalsContact O-N 3.11Å; Q99-A126 HydrophobicContact CB-CB 4.36Å; Q99-A126 VanDerWaalsContact OE1-CB 3.29Å; Q99-A129 HydrophobicContact CG-CB 4.15Å; Q99-W130 VanDerWaalsContact O-CD1 3.28Å |
| 100 | E | 95.3 | Very high | 96.1 | Very high | 43 Ų | 43 | 44.3 Ų | 44.3 | 20% | 0.201 | 23% | 0.234 | C | C | . | . | G | 310 helix | trans | -63.4 | -25.8 | 179.7 | -65.5 | 77.9 | -161.3 | 0 | 0 | 113.1 | Q98 A129 N133 N136 | Q98-E100 VanDerWaalsContact CB-OE2 3.31Å; Q98-E100 WeakPolarHBondContact CB-OE2 3.45Å; Q98-E100 PolarHBondContact O-N 3.25Å; E100-A129 WeakPolarHBondContact OE1-CB 3.43Å; E100-N133 HydrophobicContact CB-CB 4.28Å; E100-N133 WeakPolarHBondContact CB-ND2 3.42Å; E100-N133 HydrophobicContact CG-CB 4.11Å; E100-N136 PolarHBondContact O-ND2 3.22Å; E100-N136 PolarHBondContact O-OD1 3.45Å |
| 101 | N | 95.2 | Very high | 96.2 | Very high | 82 Ų | 82 | 41.4 Ų | 41.4 | 44% | 0.439 | 21% | 0.213 | S | C | . | . | G | 310 helix | trans | -87.2 | -7.1 | 179.3 | -62 | -27.8 | 0 | 0 | 0 | 113 | Y96 Q98 Q99 P103 | Y96-N101 WeakPolarHBondContact CD1-O 3.48Å; Y96-N101 WeakPolarHBondContact O-CB 3.31Å; Y96-N101 PolarHBondContact O-ND2 3Å; Q98-N101 PolarHBondContact O-N 3.46Å; Q98-N101 VanDerWaalsContact O-N 3.13Å; Q99-N101 PolarHBondContact O-N 3Å; N101-P103 WeakPolarHBondContact O-CD 3.37Å |
| 102 | V | 96.8 | Very high | 96.2 | Very high | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.006 | 23% | 0.23 | C | C | . | . | S | Bend | trans | -71.4 | 127.9 | -177.2 | 177.1 | 0 | 0 | 0 | 0 | 109.5 | V92 L93 Y96 Q99 I106 M107 W130 | V92-V102 HydrophobicContact CG1-CG1 4.06Å; V92-V102 HydrophobicContact CG1-CG2 4.02Å; L93-V102 HydrophobicContact CD2-CG2 4.11Å; Y96-V102 HydrophobicContact CG-CG2 4.33Å; Q99-V102 VanDerWaalsContact O-CB 3.31Å; Q99-V102 WeakPolarHBondContact O-CB 3.27Å; Q99-V102 WeakPolarHBondContact O-CG2 3.49Å; Q99-V102 PolarHBondContact O-N 3.06Å; Q99-V102 VanDerWaalsContact O-N 3.11Å; V102-I106 HydrophobicContact CG1-CB 3.71Å; V102-I106 HydrophobicContact CG1-CG2 3.56Å; V102-M107 HydrophobicContact CB-CE 4.27Å; V102-M107 HydrophobicContact CG1-CE 4.4Å; V102-W130 PolarHBondContact O-NE1 3.47Å |
| 103 | P | 96.4 | Very high | 96.2 | Very high | 25 Ų | 25 | 45.3 Ų | 45.3 | 16% | 0.162 | 23% | 0.234 | C | C | . | . | trans | -57.6 | 143 | 175.9 | -28.8 | 35.1 | 0 | 0 | 0 | 113 | I69 Y96 N101 K105 I106 M107 | I69-P103 HydrophobicContact CD1-CB 3.93Å; I69-P103 HydrophobicContact CD1-CG 3.98Å; I69-P103 HydrophobicContact CG1-CB 4.08Å; I69-P103 HydrophobicContact CG1-CG 3.85Å; Y96-P103 HydrophobicContact CE1-CG 3.69Å; Y96-P103 VanDerWaalsContact CZ-CD 3.44Å; N101-P103 WeakPolarHBondContact O-CD 3.37Å; P103-K105 PolarHBondContact O-N 3.32Å; P103-K105 VanDerWaalsContact O-N 3.11Å; P103-I106 HydrophobicContact CB-CD1 4.39Å; P103-I106 HydrophobicContact CG-CD1 4.14Å; P103-I106 PolarHBondContact O-N 3.23Å; P103-M107 PolarHBondContact O-N 2.91Å; P103-M107 VanDerWaalsContact O-N 3.09Å | ||
| 104 | A | 96.8 | Very high | 96.2 | Very high | 7 Ų | 7 | 43.3 Ų | 43.3 | 6% | 0.058 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -51.8 | -40.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | I106 M107 Q108 W130 V145 | A104-I106 VanDerWaalsContact C-N 3.31Å; A104-I106 PolarHBondContact O-N 3Å; A104-M107 PolarHBondContact O-N 3.41Å; A104-Q108 WeakPolarHBondContact O-CG 3.49Å; A104-Q108 PolarHBondContact O-N 3.11Å; A104-W130 HydrophobicContact CB-CH2 3.85Å; A104-W130 HydrophobicContact CB-CZ2 3.73Å; A104-V145 HydrophobicContact CB-CG2 4.17Å |
| 105 | K | 96.7 | Very high | 96.2 | Very high | 139 Ų | 139 | 37.8 Ų | 37.8 | 60% | 0.604 | 20% | 0.201 | S | C | * | . | H | α-helix | trans | -59.5 | -39.3 | 177.3 | -68.8 | -179.4 | -179 | 175.2 | 0 | 112.9 | P103 L109 | P103-K105 PolarHBondContact O-N 3.32Å; P103-K105 VanDerWaalsContact O-N 3.11Å; K105-L109 PolarHBondContact O-N 3.17Å; K105-L109 VanDerWaalsContact O-N 3.12Å |
| 106 | I | 98 | Very high | 96.3 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -72.8 | -42.6 | 178.7 | -67.7 | 169.3 | 0 | 0 | 0 | 109.8 | I69 C72 I76 V92 Y96 V102 P103 A104 Q108 L109 C110 | I69-I106 HydrophobicContact CG1-CD1 4.26Å; C72-I106 HydrophobicContact CB-CD1 3.51Å; C72-I106 HydrophobicContact CB-CG1 4.15Å; I76-I106 HydrophobicContact CD1-CG2 3.83Å; V92-I106 HydrophobicContact CB-CG2 4.49Å; V92-I106 HydrophobicContact CG1-CG2 3.65Å; V92-I106 HydrophobicContact CG2-CG2 4Å; Y96-I106 HydrophobicContact CE2-CD1 3.65Å; V102-I106 HydrophobicContact CG1-CB 3.71Å; V102-I106 HydrophobicContact CG1-CG2 3.56Å; P103-I106 HydrophobicContact CB-CD1 4.39Å; P103-I106 HydrophobicContact CG-CD1 4.14Å; P103-I106 PolarHBondContact O-N 3.23Å; A104-I106 VanDerWaalsContact C-N 3.31Å; A104-I106 PolarHBondContact O-N 3Å; I106-Q108 VanDerWaalsContact C-N 3.33Å; I106-Q108 PolarHBondContact O-N 2.75Å; I106-L109 PolarHBondContact O-N 3.36Å; I106-C110 PolarHBondContact O-N 3.4Å; I106-C110 PolarHBondContact O-SG 3.3Å |
| 107 | M | 98.3 | Very high | 96.3 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57 | -47.1 | 175 | -171.8 | 58.6 | 68.3 | 0 | 0 | 111.4 | F89 V102 P103 A104 L109 C110 I111 M123 W130 V145 | F89-M107 HydrophobicContact CE2-CE 4.06Å; F89-M107 HydrophobicContact CE2-SD 4.42Å; F89-M107 HydrophobicContact CZ-CE 4.06Å; V102-M107 HydrophobicContact CB-CE 4.27Å; V102-M107 HydrophobicContact CG1-CE 4.4Å; P103-M107 PolarHBondContact O-N 2.91Å; P103-M107 VanDerWaalsContact O-N 3.09Å; A104-M107 PolarHBondContact O-N 3.41Å; M107-L109 PolarHBondContact O-N 3.26Å; M107-C110 PolarHBondContact O-N 3.49Å; M107-I111 HydrophobicContact CG-CD1 4.06Å; M107-I111 VanDerWaalsContact O-CG1 3.28Å; M107-I111 WeakPolarHBondContact O-CG1 3.43Å; M107-I111 PolarHBondContact O-N 3.1Å; M107-M123 HydrophobicContact SD-CE 3.44Å; M107-M123 WeakPolarHBondContact SD-CE 3.38Å; M107-W130 HydrophobicContact CE-CB 3.85Å; M107-W130 HydrophobicContact CE-CG 3.84Å; M107-W130 HydrophobicContact CG-CG 4.41Å; M107-V145 HydrophobicContact CB-CG2 4.3Å; M107-V145 HydrophobicContact CG-CG1 3.83Å; M107-V145 HydrophobicContact CG-CG2 4.31Å |
| 108 | Q | 98.2 | Very high | 96.4 | Very high | 30 Ų | 30 | 50.2 Ų | 50.2 | 14% | 0.14 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -56.4 | -48.3 | 175.3 | -67.7 | 160.8 | 18.9 | 0 | 0 | 111.8 | A104 I106 C110 I111 L112 G141 L144 V145 L148 | A104-Q108 WeakPolarHBondContact O-CG 3.49Å; A104-Q108 PolarHBondContact O-N 3.11Å; I106-Q108 VanDerWaalsContact C-N 3.33Å; I106-Q108 PolarHBondContact O-N 2.75Å; Q108-C110 PolarHBondContact O-N 3.49Å; Q108-I111 PolarHBondContact O-N 3.03Å; Q108-L112 VanDerWaalsContact O-CG 3.3Å; Q108-L112 WeakPolarHBondContact O-CG 3.3Å; Q108-L112 PolarHBondContact O-N 3.1Å; Q108-G141 PolarHBondContact NE2-O 3.08Å; Q108-L144 HydrophobicContact CG-CD2 4.31Å; Q108-L144 HydrophobicContact CG-CG 4.2Å; Q108-V145 HydrophobicContact CG-CG2 3.79Å; Q108-L148 HydrophobicContact CB-CD1 3.61Å; Q108-L148 HydrophobicContact CG-CD1 3.62Å |
| 109 | L | 98.3 | Very high | 96.5 | Very high | 42 Ų | 42 | 48.6 Ų | 48.6 | 22% | 0.22 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62 | -42.2 | 179.6 | -178.8 | 61.1 | 0 | 0 | 0 | 112.1 | I73 I76 K105 I106 M107 L112 L113 | I73-L109 HydrophobicContact CB-CD2 4.19Å; I73-L109 HydrophobicContact CG1-CD2 4.09Å; I73-L109 HydrophobicContact CG2-CD2 4.02Å; I76-L109 HydrophobicContact CB-CD2 3.97Å; I76-L109 HydrophobicContact CD1-CD2 3.91Å; I76-L109 HydrophobicContact CD1-CG 4.5Å; I76-L109 HydrophobicContact CG2-CD2 3.88Å; I76-L109 HydrophobicContact CG2-CG 3.97Å; K105-L109 PolarHBondContact O-N 3.17Å; K105-L109 VanDerWaalsContact O-N 3.12Å; I106-L109 PolarHBondContact O-N 3.36Å; M107-L109 PolarHBondContact O-N 3.26Å; L109-L112 PolarHBondContact O-N 2.89Å; L109-L113 WeakPolarHBondContact O-CB 3.28Å; L109-L113 PolarHBondContact O-N 3.3Å |
| 110 | C | 98.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.9 | -47.4 | 176.1 | -69.8 | 0 | 0 | 0 | 0 | 111.4 | F89 I106 M107 Q108 L112 L113 Y114 M123 | F89-C110 HydrophobicContact CD2-CB 4.11Å; I106-C110 PolarHBondContact O-N 3.4Å; I106-C110 PolarHBondContact O-SG 3.3Å; M107-C110 PolarHBondContact O-N 3.49Å; Q108-C110 PolarHBondContact O-N 3.49Å; C110-L112 VanDerWaalsContact C-N 3.28Å; C110-L112 PolarHBondContact O-N 3.06Å; C110-L113 PolarHBondContact O-N 3.42Å; C110-L113 VanDerWaalsContact O-N 3.15Å; C110-Y114 VanDerWaalsContact O-CD2 3.26Å; C110-Y114 WeakPolarHBondContact O-CD2 3.42Å; C110-Y114 PolarHBondContact O-N 3.1Å; C110-M123 HydrophobicContact CB-CE 3.75Å; C110-M123 HydrophobicContact CB-SD 3.96Å |
| 111 | I | 98.2 | Very high | 96.6 | Very high | 2 Ų | 2 | 47.6 Ų | 47.6 | 1% | 0.01 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -55.5 | -46.8 | 176.6 | -64.2 | 163.8 | 0 | 0 | 0 | 110.6 | M107 Q108 L113 Y114 S115 M123 T127 V145 L148 H152 I153 | M107-I111 HydrophobicContact CG-CD1 4.06Å; M107-I111 VanDerWaalsContact O-CG1 3.28Å; M107-I111 WeakPolarHBondContact O-CG1 3.43Å; M107-I111 PolarHBondContact O-N 3.1Å; Q108-I111 PolarHBondContact O-N 3.03Å; I111-L113 PolarHBondContact O-N 3.43Å; I111-Y114 PolarHBondContact O-N 2.96Å; I111-S115 WeakPolarHBondContact O-CB 3.29Å; I111-S115 PolarHBondContact O-N 3.29Å; I111-M123 HydrophobicContact CG1-CE 4.34Å; I111-T127 HydrophobicContact CD1-CG2 3.66Å; I111-T127 HydrophobicContact CG1-CG2 4.46Å; I111-V145 HydrophobicContact CD1-CG1 4.1Å; I111-L148 HydrophobicContact CD1-CB 4.1Å; I111-L148 HydrophobicContact CG2-CB 3.94Å; I111-H152 HydrophobicContact CG2-CB 3.88Å; I111-I153 HydrophobicContact CG1-CD1 4.21Å; I111-I153 HydrophobicContact CG2-CD1 4.14Å; I111-I153 HydrophobicContact CG2-CG1 4.08Å |
| 112 | L | 97.8 | Very high | 96.7 | Very high | 80 Ų | 80 | 47.2 Ų | 47.2 | 42% | 0.419 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -64 | -40.1 | 178.8 | -69.6 | 172.8 | 0 | 0 | 0 | 112.6 | Q108 L109 C110 K116 L148 | Q108-L112 VanDerWaalsContact O-CG 3.3Å; Q108-L112 WeakPolarHBondContact O-CG 3.3Å; Q108-L112 PolarHBondContact O-N 3.1Å; L109-L112 PolarHBondContact O-N 2.89Å; C110-L112 VanDerWaalsContact C-N 3.28Å; C110-L112 PolarHBondContact O-N 3.06Å; L112-K116 VanDerWaalsContact O-CB 3.31Å; L112-K116 WeakPolarHBondContact O-CB 3.24Å; L112-K116 PolarHBondContact O-N 3.35Å; L112-L148 HydrophobicContact CD2-CD2 3.9Å; L112-L148 HydrophobicContact CG-CD1 4.45Å; L112-L148 HydrophobicContact CG-CD2 4.41Å |
| 113 | L | 97.2 | Very high | 96.7 | Very high | 18 Ų | 18 | 47.2 Ų | 47.2 | 9% | 0.094 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.1 | -53.3 | 175.5 | 173.7 | 60.4 | 0 | 0 | 0 | 111.4 | I76 A80 W85 A88 L109 C110 I111 S115 K116 V117 | I76-L113 HydrophobicContact CG2-CD2 3.88Å; A80-L113 HydrophobicContact CB-CD1 3.57Å; A80-L113 HydrophobicContact CB-CD2 4.36Å; W85-L113 HydrophobicContact CB-CD1 4.13Å; W85-L113 HydrophobicContact CB-CD2 4.15Å; W85-L113 HydrophobicContact CB-CG 4.31Å; A88-L113 HydrophobicContact CB-CD2 3.77Å; L109-L113 WeakPolarHBondContact O-CB 3.28Å; L109-L113 PolarHBondContact O-N 3.3Å; C110-L113 PolarHBondContact O-N 3.42Å; C110-L113 VanDerWaalsContact O-N 3.15Å; I111-L113 PolarHBondContact O-N 3.43Å; L113-S115 VanDerWaalsContact C-N 3.3Å; L113-S115 PolarHBondContact O-N 2.95Å; L113-K116 WeakPolarHBondContact O-CB 3.49Å; L113-K116 PolarHBondContact O-N 3.15Å; L113-K116 VanDerWaalsContact O-N 3.14Å; L113-V117 WeakPolarHBondContact O-CG2 3.43Å; L113-V117 PolarHBondContact O-N 3.32Å; L113-V117 VanDerWaalsContact O-N 3.11Å |
| 114 | Y | 97.5 | Very high | 96.8 | Very high | 3 Ų | 3 | 47.7 Ų | 47.7 | 1% | 0.012 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67.2 | -33 | -177.4 | -79.2 | -84.6 | 0 | 0 | 0 | 112.1 | W85 R86 F89 C110 I111 V117 K118 Q119 V122 M123 | W85-Y114 HydrophobicContact CE3-CD1 4.16Å; W85-Y114 AromaticContact CE3-CE1 3.84Å; W85-Y114 HydrophobicContact CE3-CE1 3.84Å; W85-Y114 HydrophobicContact CZ3-CD1 4.23Å; W85-Y114 HydrophobicContact CZ3-CE1 4.01Å; W85-Y114 PolarHBondContact O-OH 3.45Å; W85-Y114 VanDerWaalsContact O-OH 3.07Å; R86-Y114 PolarHBondContact O-OH 3.43Å; F89-Y114 HydrophobicContact CB-CE2 3.97Å; F89-Y114 PolarHBondContact N-OH 3.48Å; C110-Y114 VanDerWaalsContact O-CD2 3.26Å; C110-Y114 WeakPolarHBondContact O-CD2 3.42Å; C110-Y114 PolarHBondContact O-N 3.1Å; I111-Y114 PolarHBondContact O-N 2.96Å; Y114-V117 WeakPolarHBondContact O-CG2 3.42Å; Y114-K118 PolarHBondContact O-N 3.46Å; Y114-Q119 CarbonylContact O-C 3.6Å; Y114-Q119 PolarHBondContact O-N 3.44Å; Y114-V122 HydrophobicContact CD1-CB 3.66Å; Y114-V122 HydrophobicContact CD1-CG1 3.93Å; Y114-V122 HydrophobicContact CD1-CG2 4.04Å; Y114-V122 HydrophobicContact CE1-CB 3.75Å; Y114-V122 HydrophobicContact CE1-CG1 3.48Å; Y114-V122 VanDerWaalsContact CE1-CG1 3.48Å; Y114-V122 HydrophobicContact CE1-CG2 4.09Å; Y114-V122 HydrophobicContact CG-CB 4.4Å; Y114-M123 HydrophobicContact CD2-CG 3.41Å; Y114-M123 VanDerWaalsContact CD2-CG 3.41Å; Y114-M123 HydrophobicContact CD2-SD 3.82Å; Y114-M123 HydrophobicContact CE2-CG 4.13Å; Y114-M123 HydrophobicContact CE2-SD 3.96Å; Y114-M123 HydrophobicContact CG-CG 3.71Å |
| 115 | S | 94.9 | Very high | 96.8 | Very high | 30 Ų | 30 | 53.7 Ų | 53.7 | 21% | 0.21 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.3 | -46.9 | 169 | -179.6 | 0 | 0 | 0 | 0 | 112 | I111 L113 V117 K118 H152 | I111-S115 WeakPolarHBondContact O-CB 3.29Å; I111-S115 PolarHBondContact O-N 3.29Å; L113-S115 VanDerWaalsContact C-N 3.3Å; L113-S115 PolarHBondContact O-N 2.95Å; S115-V117 VanDerWaalsContact C-N 3.31Å; S115-V117 PolarHBondContact O-N 2.92Å; S115-K118 WeakPolarHBondContact O-CA 3.4Å; S115-K118 PolarHBondContact O-N 3.43Å; S115-H152 PolarHBondContact OG-ND1 2.93Å; S115-H152 VanDerWaalsContact OG-ND1 3.16Å |
| 116 | K | 94.2 | Very high | 96.9 | Very high | 153 Ų | 153 | 47.3 Ų | 47.3 | 67% | 0.665 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -60.1 | -37.6 | 179.1 | -177.4 | -178.8 | 177.9 | -174.5 | 0 | 112.8 | L112 L113 K118 | L112-K116 VanDerWaalsContact O-CB 3.31Å; L112-K116 WeakPolarHBondContact O-CB 3.24Å; L112-K116 PolarHBondContact O-N 3.35Å; L113-K116 WeakPolarHBondContact O-CB 3.49Å; L113-K116 PolarHBondContact O-N 3.15Å; L113-K116 VanDerWaalsContact O-N 3.14Å; K116-K118 PolarHBondContact O-N 3.01Å |
| 117 | V | 94.1 | Very high | 96.9 | Very high | 45 Ų | 45 | 47.3 Ų | 47.3 | 27% | 0.273 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | 10.5 | 176.3 | -57.4 | 0 | 0 | 0 | 0 | 113.3 | W85 L113 Y114 S115 Q119 | W85-V117 HydrophobicContact CD2-CB 4.28Å; W85-V117 HydrophobicContact CD2-CG1 4.16Å; W85-V117 HydrophobicContact CD2-CG2 3.91Å; W85-V117 HydrophobicContact CE3-CG2 3.73Å; W85-V117 HydrophobicContact CG-CG1 4.01Å; W85-V117 HydrophobicContact CH2-CG2 4.36Å; W85-V117 HydrophobicContact CZ3-CG2 3.97Å; L113-V117 WeakPolarHBondContact O-CG2 3.43Å; L113-V117 PolarHBondContact O-N 3.32Å; L113-V117 VanDerWaalsContact O-N 3.11Å; Y114-V117 WeakPolarHBondContact O-CG2 3.42Å; S115-V117 VanDerWaalsContact C-N 3.31Å; S115-V117 PolarHBondContact O-N 2.92Å; V117-Q119 HydrophobicContact CG2-CB 4.15Å; V117-Q119 PolarHBondContact O-N 3.37Å |
| 118 | K | 93.9 | Very high | 96.8 | Very high | 182 Ų | 182 | 49.2 Ų | 49.2 | 79% | 0.791 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.8 | 33 | 179.4 | -54.4 | -177 | 178.4 | -175.6 | 0 | 113.6 | Y114 S115 K116 | Y114-K118 PolarHBondContact O-N 3.46Å; S115-K118 WeakPolarHBondContact O-CA 3.4Å; S115-K118 PolarHBondContact O-N 3.43Å; K116-K118 PolarHBondContact O-N 3.01Å |
| 119 | Q | 96.4 | Very high | 96.7 | Very high | 94 Ų | 94 | 48.6 Ų | 48.6 | 44% | 0.439 | 25% | 0.252 | S | S | . | . | trans | -126.2 | 53.9 | 175.9 | -66.5 | -73.9 | 4.3 | 0 | 0 | 111.4 | W85 Y114 V117 A121 V122 | W85-Q119 HydrophobicContact CH2-CB 4.37Å; W85-Q119 HydrophobicContact CH2-CG 3.88Å; W85-Q119 HydrophobicContact CZ3-CB 4.23Å; W85-Q119 HydrophobicContact CZ3-CG 4.25Å; Y114-Q119 CarbonylContact O-C 3.6Å; Y114-Q119 PolarHBondContact O-N 3.44Å; V117-Q119 HydrophobicContact CG2-CB 4.15Å; V117-Q119 PolarHBondContact O-N 3.37Å; Q119-A121 PolarHBondContact O-N 2.9Å; Q119-V122 HydrophobicContact CB-CG2 4.36Å; Q119-V122 PolarHBondContact O-N 3.31Å | ||
| 120 | P | 95.1 | Very high | 96.7 | Very high | 15 Ų | 15 | 46.7 Ų | 46.7 | 10% | 0.097 | 24% | 0.242 | C | C | . | . | G | 310 helix | trans | -67.1 | -23.3 | -175.8 | 29.1 | -36 | 0 | 0 | 0 | 113.7 | V122 M123 H152 I153 P156 L157 | P120-V122 PolarHBondContact O-N 2.86Å; P120-V122 VanDerWaalsContact O-N 3.13Å; P120-M123 PolarHBondContact O-N 3.46Å; P120-H152 WeakPolarHBondContact CB-O 3.45Å; P120-I153 HydrophobicContact CB-CG1 4.38Å; P120-P156 HydrophobicContact CG-CB 4.2Å; P120-L157 HydrophobicContact CG-CD2 4.08Å; P120-L157 HydrophobicContact CG-CG 4.27Å |
| 121 | A | 96.9 | Very high | 96.7 | Very high | 51 Ų | 51 | 46.8 Ų | 46.8 | 42% | 0.421 | 24% | 0.242 | S | C | . | . | G | 310 helix | trans | -53.9 | -33.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q119 M123 Q124 L157 | Q119-A121 PolarHBondContact O-N 2.9Å; A121-M123 PolarHBondContact O-N 3.05Å; A121-Q124 PolarHBondContact O-N 2.95Å; A121-L157 HydrophobicContact CB-CD1 4.46Å; A121-L157 HydrophobicContact CB-CD2 3.94Å |
| 122 | V | 96.3 | Very high | 96.5 | Very high | 75 Ų | 75 | 52.5 Ų | 52.5 | 46% | 0.455 | 27% | 0.269 | S | S | . | . | G | 310 helix | trans | -61.1 | -31.4 | -179.8 | -177.9 | 0 | 0 | 0 | 0 | 111.9 | Y114 Q119 P120 | Y114-V122 HydrophobicContact CD1-CB 3.66Å; Y114-V122 HydrophobicContact CD1-CG1 3.93Å; Y114-V122 HydrophobicContact CD1-CG2 4.04Å; Y114-V122 HydrophobicContact CE1-CB 3.75Å; Y114-V122 HydrophobicContact CE1-CG1 3.48Å; Y114-V122 VanDerWaalsContact CE1-CG1 3.48Å; Y114-V122 HydrophobicContact CE1-CG2 4.09Å; Y114-V122 HydrophobicContact CG-CB 4.4Å; Q119-V122 HydrophobicContact CB-CG2 4.36Å; Q119-V122 PolarHBondContact O-N 3.31Å; P120-V122 PolarHBondContact O-N 2.86Å; P120-V122 VanDerWaalsContact O-N 3.13Å |
| 123 | M | 98 | Very high | 96.4 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 26% | 0.256 | C | S | . | . | G | 310 helix | trans | -94.2 | -5.5 | -177.5 | -73.7 | -58.8 | -55.9 | 0 | 0 | 113.6 | F89 M107 C110 I111 Y114 P120 A121 A126 T127 I153 | F89-M123 HydrophobicContact CB-SD 3.99Å; F89-M123 HydrophobicContact CD1-CE 4.49Å; F89-M123 HydrophobicContact CD1-SD 3.98Å; F89-M123 HydrophobicContact CD2-CE 3.92Å; F89-M123 HydrophobicContact CD2-SD 3.93Å; F89-M123 HydrophobicContact CE1-CE 4.46Å; F89-M123 HydrophobicContact CE1-SD 4.46Å; F89-M123 HydrophobicContact CE2-CE 3.87Å; F89-M123 HydrophobicContact CE2-SD 4.41Å; F89-M123 HydrophobicContact CG-CE 4.24Å; F89-M123 HydrophobicContact CG-SD 3.69Å; F89-M123 HydrophobicContact CZ-CE 4.15Å; M107-M123 HydrophobicContact SD-CE 3.44Å; M107-M123 WeakPolarHBondContact SD-CE 3.38Å; C110-M123 HydrophobicContact CB-CE 3.75Å; C110-M123 HydrophobicContact CB-SD 3.96Å; I111-M123 HydrophobicContact CG1-CE 4.34Å; Y114-M123 HydrophobicContact CD2-CG 3.41Å; Y114-M123 VanDerWaalsContact CD2-CG 3.41Å; Y114-M123 HydrophobicContact CD2-SD 3.82Å; Y114-M123 HydrophobicContact CE2-CG 4.13Å; Y114-M123 HydrophobicContact CE2-SD 3.96Å; Y114-M123 HydrophobicContact CG-CG 3.71Å; P120-M123 PolarHBondContact O-N 3.46Å; A121-M123 PolarHBondContact O-N 3.05Å; M123-A126 HydrophobicContact CE-CB 4.32Å; M123-A126 PolarHBondContact O-N 3.1Å; M123-T127 VanDerWaalsContact O-CB 3.3Å; M123-T127 WeakPolarHBondContact O-CB 3.31Å; M123-T127 PolarHBondContact O-N 3.28Å; M123-T127 PolarHBondContact O-OG1 3.28Å; M123-I153 HydrophobicContact CB-CD1 3.71Å |
| 124 | Q | 97.6 | Very high | 96.2 | Very high | 35 Ų | 35 | 54.1 Ų | 54.1 | 16% | 0.164 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.1 | -59.7 | -171.9 | -177.9 | 172.2 | 12.3 | 0 | 0 | 112 | A121 A126 T127 L128 Y149 I153 Q159 | A121-Q124 PolarHBondContact O-N 2.95Å; Q124-A126 VanDerWaalsContact C-N 3.27Å; Q124-A126 PolarHBondContact O-N 3.47Å; Q124-T127 PolarHBondContact O-N 3.08Å; Q124-L128 WeakPolarHBondContact O-CB 3.46Å; Q124-L128 PolarHBondContact O-N 3.18Å; Q124-Y149 HydrophobicContact CG-CE2 4.11Å; Q124-I153 HydrophobicContact CB-CG2 3.72Å; Q124-I153 HydrophobicContact CG-CG2 3.98Å; Q124-Q159 VanDerWaalsContact NE2-NE2 3.19Å |
| 125 | Q | 97.3 | Very high | 96 | Very high | 133 Ų | 133 | 61 Ų | 61 | 62% | 0.621 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -61.1 | -39 | -177.1 | -173 | 60.4 | 25.7 | 0 | 0 | 112 | L128 A129 | Q125-L128 PolarHBondContact O-N 2.82Å; Q125-A129 WeakPolarHBondContact O-CB 3.45Å; Q125-A129 PolarHBondContact O-N 3.29Å |
| 126 | A | 97.6 | Very high | 96 | Very high | 6 Ų | 6 | 60.5 Ų | 60.5 | 5% | 0.05 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -69.2 | -41.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F89 Q99 M123 Q124 W130 | F89-A126 HydrophobicContact CD1-CB 4.34Å; F89-A126 HydrophobicContact CE1-CB 3.39Å; F89-A126 HydrophobicContact CZ-CB 3.67Å; Q99-A126 HydrophobicContact CB-CB 4.36Å; Q99-A126 VanDerWaalsContact OE1-CB 3.29Å; M123-A126 HydrophobicContact CE-CB 4.32Å; M123-A126 PolarHBondContact O-N 3.1Å; Q124-A126 VanDerWaalsContact C-N 3.27Å; Q124-A126 PolarHBondContact O-N 3.47Å; A126-W130 WeakPolarHBondContact O-CB 3.35Å; A126-W130 PolarHBondContact O-N 3.33Å |
| 127 | T | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -68 | -42.1 | 176.7 | -52.3 | 0 | 0 | 0 | 0 | 110.5 | I111 M123 Q124 W130 L131 V145 Y149 | I111-T127 HydrophobicContact CD1-CG2 3.66Å; I111-T127 HydrophobicContact CG1-CG2 4.46Å; M123-T127 VanDerWaalsContact O-CB 3.3Å; M123-T127 WeakPolarHBondContact O-CB 3.31Å; M123-T127 PolarHBondContact O-N 3.28Å; M123-T127 PolarHBondContact O-OG1 3.28Å; Q124-T127 PolarHBondContact O-N 3.08Å; T127-W130 WeakPolarHBondContact O-CB 3.37Å; T127-W130 PolarHBondContact O-N 3.35Å; T127-L131 HydrophobicContact CG2-CD1 4.08Å; T127-L131 HydrophobicContact CG2-CG 4.42Å; T127-L131 VanDerWaalsContact O-CG 3.31Å; T127-L131 WeakPolarHBondContact O-CG 3.3Å; T127-L131 PolarHBondContact O-N 3.49Å; T127-V145 HydrophobicContact CG2-CG1 3.82Å; T127-Y149 HydrophobicContact CG2-CD2 3.47Å; T127-Y149 VanDerWaalsContact CG2-CD2 3.47Å; T127-Y149 HydrophobicContact CG2-CE2 4.38Å; T127-Y149 HydrophobicContact CG2-CG 3.97Å |
| 128 | L | 96.8 | Very high | 95.6 | Very high | 39 Ų | 39 | 66.3 Ų | 66.3 | 20% | 0.204 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.2 | -49.3 | 178.4 | -172.3 | 67.3 | 0 | 0 | 0 | 111.2 | Q124 Q125 W130 L131 H132 Y149 | Q124-L128 WeakPolarHBondContact O-CB 3.46Å; Q124-L128 PolarHBondContact O-N 3.18Å; Q125-L128 PolarHBondContact O-N 2.82Å; L128-W130 VanDerWaalsContact C-N 3.32Å; L128-W130 PolarHBondContact O-N 2.91Å; L128-L131 PolarHBondContact O-N 3.11Å; L128-H132 WeakPolarHBondContact CD1-CE1 3.4Å; L128-H132 PolarHBondContact O-N 3.44Å; L128-H132 PolarHBondContact O-ND1 3.18Å; L128-Y149 HydrophobicContact CB-CE2 4.41Å; L128-Y149 HydrophobicContact CD1-CE1 4.11Å |
| 129 | A | 96.8 | Very high | 95.5 | Very high | 18 Ų | 18 | 59.3 Ų | 59.3 | 15% | 0.149 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.1 | -38.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q99 E100 Q125 L131 H132 N133 | Q99-A129 HydrophobicContact CG-CB 4.15Å; E100-A129 WeakPolarHBondContact OE1-CB 3.43Å; Q125-A129 WeakPolarHBondContact O-CB 3.45Å; Q125-A129 PolarHBondContact O-N 3.29Å; A129-L131 PolarHBondContact O-N 3.49Å; A129-H132 PolarHBondContact O-N 2.94Å; A129-N133 PolarHBondContact O-N 3.36Å |
| 130 | W | 98.1 | Very high | 95.1 | Very high | 1 Ų | 1 | 59.6 Ų | 59.6 | 0% | 0.004 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60.7 | -43.3 | 174.3 | -171.5 | 94.1 | 0 | 0 | 0 | 112.6 | Q99 V102 A104 M107 A126 T127 L128 H132 N133 N136 F142 V145 | Q99-W130 VanDerWaalsContact O-CD1 3.28Å; V102-W130 PolarHBondContact O-NE1 3.47Å; A104-W130 HydrophobicContact CB-CH2 3.85Å; A104-W130 HydrophobicContact CB-CZ2 3.73Å; M107-W130 HydrophobicContact CE-CB 3.85Å; M107-W130 HydrophobicContact CE-CG 3.84Å; M107-W130 HydrophobicContact CG-CG 4.41Å; A126-W130 WeakPolarHBondContact O-CB 3.35Å; A126-W130 PolarHBondContact O-N 3.33Å; T127-W130 WeakPolarHBondContact O-CB 3.37Å; T127-W130 PolarHBondContact O-N 3.35Å; L128-W130 VanDerWaalsContact C-N 3.32Å; L128-W130 PolarHBondContact O-N 2.91Å; W130-H132 VanDerWaalsContact C-N 3.33Å; W130-N133 PolarHBondContact O-N 3.18Å; W130-N136 VanDerWaalsContact CD1-ND2 3.32Å; W130-N136 HydrophobicContact CD2-CB 4.15Å; W130-N136 HydrophobicContact CE3-CB 4.25Å; W130-N136 HydrophobicContact CH2-CB 3.9Å; W130-N136 HydrophobicContact CZ2-CB 3.79Å; W130-N136 HydrophobicContact CZ3-CB 4.14Å; W130-N136 PolarHBondContact NE1-ND2 2.97Å; W130-N136 PolarHBondContact O-ND2 3.33Å; W130-F142 HydrophobicContact CE3-CD2 4.29Å; W130-F142 HydrophobicContact CE3-CE2 4.5Å; W130-F142 HydrophobicContact CH2-CB 4.28Å; W130-F142 AromaticContact CH2-CD2 3.77Å; W130-F142 HydrophobicContact CH2-CD2 3.77Å; W130-F142 HydrophobicContact CH2-CG 4.47Å; W130-F142 HydrophobicContact CZ3-CB 4.43Å; W130-F142 AromaticContact CZ3-CD2 3.37Å; W130-F142 HydrophobicContact CZ3-CD2 3.37Å; W130-F142 AromaticContact CZ3-CE2 3.96Å; W130-F142 HydrophobicContact CZ3-CE2 3.96Å; W130-F142 HydrophobicContact CZ3-CG 4.21Å; W130-V145 HydrophobicContact CD2-CG1 4.41Å; W130-V145 HydrophobicContact CE3-CB 4.05Å; W130-V145 HydrophobicContact CE3-CG1 3.62Å; W130-V145 HydrophobicContact CE3-CG2 4.26Å; W130-V145 HydrophobicContact CH2-CB 4.3Å; W130-V145 HydrophobicContact CH2-CG2 3.91Å; W130-V145 HydrophobicContact CZ3-CB 3.64Å; W130-V145 HydrophobicContact CZ3-CG1 3.78Å; W130-V145 HydrophobicContact CZ3-CG2 3.74Å |
| 131 | L | 97.3 | Very high | 95 | Very high | 2 Ų | 2 | 60.3 Ų | 60.3 | 1% | 0.01 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -68.5 | -30.4 | 179.1 | -71.9 | 171.7 | 0 | 0 | 0 | 113 | T127 L128 A129 F142 V145 A146 Y149 F166 F171 | T127-L131 HydrophobicContact CG2-CD1 4.08Å; T127-L131 HydrophobicContact CG2-CG 4.42Å; T127-L131 VanDerWaalsContact O-CG 3.31Å; T127-L131 WeakPolarHBondContact O-CG 3.3Å; T127-L131 PolarHBondContact O-N 3.49Å; L128-L131 PolarHBondContact O-N 3.11Å; A129-L131 PolarHBondContact O-N 3.49Å; L131-F142 HydrophobicContact CD2-CD2 4.4Å; L131-F142 HydrophobicContact CD2-CE2 3.95Å; L131-F142 HydrophobicContact CD2-CZ 4.1Å; L131-V145 HydrophobicContact CD2-CB 4.22Å; L131-V145 HydrophobicContact CD2-CG1 3.91Å; L131-V145 HydrophobicContact CG-CG1 4.26Å; L131-A146 HydrophobicContact CD2-CB 3.93Å; L131-Y149 HydrophobicContact CD1-CD1 4.02Å; L131-Y149 HydrophobicContact CD1-CG 3.9Å; L131-F166 HydrophobicContact CD1-CE2 4.04Å; L131-F166 HydrophobicContact CD1-CZ 3.96Å; L131-F171 HydrophobicContact CB-CE2 4.32Å; L131-F171 HydrophobicContact CB-CZ 4.29Å; L131-F171 HydrophobicContact CD2-CZ 4.13Å |
| 132 | H | 95.3 | Very high | 95 | Very high | 123 Ų | 123 | 58.4 Ų | 58.4 | 57% | 0.569 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -81.1 | -12.7 | 178.2 | -76 | 82.6 | 0 | 0 | 0 | 113.7 | L128 A129 W130 P134 | L128-H132 WeakPolarHBondContact CD1-CE1 3.4Å; L128-H132 PolarHBondContact O-N 3.44Å; L128-H132 PolarHBondContact O-ND1 3.18Å; A129-H132 PolarHBondContact O-N 2.94Å; W130-H132 VanDerWaalsContact C-N 3.33Å; H132-P134 VanDerWaalsContact O-CD 3.29Å; H132-P134 WeakPolarHBondContact O-CD 3.4Å |
| 133 | N | 95.4 | Very high | 94.9 | Very high | 27 Ų | 27 | 60.5 Ų | 60.5 | 14% | 0.144 | 32% | 0.319 | C | S | . | . | trans | -72.6 | 119.7 | 177.4 | -178.9 | 6 | 0 | 0 | 0 | 111 | E100 A129 W130 Q135 N136 | E100-N133 HydrophobicContact CB-CB 4.28Å; E100-N133 WeakPolarHBondContact CB-ND2 3.42Å; E100-N133 HydrophobicContact CG-CB 4.11Å; A129-N133 PolarHBondContact O-N 3.36Å; W130-N133 PolarHBondContact O-N 3.18Å; N133-Q135 PolarHBondContact O-N 3.47Å; N133-Q135 VanDerWaalsContact O-N 3.09Å; N133-Q135 PolarHBondContact OD1-N 2.79Å; N133-Q135 VanDerWaalsContact OD1-N 3.11Å; N133-N136 HydrophobicContact CB-CB 4.46Å; N133-N136 PolarHBondContact O-N 3.18Å | ||
| 134 | P | 93 | Very high | 94.8 | Very high | 105 Ų | 105 | 63.9 Ų | 63.9 | 68% | 0.682 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.8 | -26.5 | 179.3 | -25.4 | 35.2 | 0 | 0 | 0 | 114.6 | H132 N136 | H132-P134 VanDerWaalsContact O-CD 3.29Å; H132-P134 WeakPolarHBondContact O-CD 3.4Å; P134-N136 VanDerWaalsContact C-N 3.29Å; P134-N136 PolarHBondContact O-N 3.46Å |
| 135 | Q | 92.6 | Very high | 94.9 | Very high | 147 Ų | 147 | 62.2 Ų | 62.2 | 69% | 0.687 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | -30.8 | 178.3 | -61.5 | -175.3 | -6.8 | 0 | 0 | 112.2 | N133 | N133-Q135 PolarHBondContact O-N 3.47Å; N133-Q135 VanDerWaalsContact O-N 3.09Å; N133-Q135 PolarHBondContact OD1-N 2.79Å; N133-Q135 VanDerWaalsContact OD1-N 3.11Å |
| 136 | N | 94.9 | Very high | 94.9 | Very high | 19 Ų | 19 | 55.9 Ų | 55.9 | 10% | 0.102 | 30% | 0.3 | C | S | . | . | G | 310 helix | trans | -81.2 | -21.9 | -175.3 | -70.2 | -25.3 | 0 | 0 | 0 | 113 | E100 W130 N133 P134 R138 A139 F142 | E100-N136 PolarHBondContact O-ND2 3.22Å; E100-N136 PolarHBondContact O-OD1 3.45Å; W130-N136 VanDerWaalsContact CD1-ND2 3.32Å; W130-N136 HydrophobicContact CD2-CB 4.15Å; W130-N136 HydrophobicContact CE3-CB 4.25Å; W130-N136 HydrophobicContact CH2-CB 3.9Å; W130-N136 HydrophobicContact CZ2-CB 3.79Å; W130-N136 HydrophobicContact CZ3-CB 4.14Å; W130-N136 PolarHBondContact NE1-ND2 2.97Å; W130-N136 PolarHBondContact O-ND2 3.33Å; N133-N136 HydrophobicContact CB-CB 4.46Å; N133-N136 PolarHBondContact O-N 3.18Å; P134-N136 VanDerWaalsContact C-N 3.29Å; P134-N136 PolarHBondContact O-N 3.46Å; N136-R138 PolarHBondContact O-N 3.23Å; N136-R138 VanDerWaalsContact O-N 3.08Å; N136-A139 WeakPolarHBondContact O-CB 3.45Å; N136-A139 PolarHBondContact O-N 3.12Å; N136-F142 HydrophobicContact CB-CD2 4.14Å; N136-F142 HydrophobicContact CB-CE2 4.32Å; N136-F142 WeakPolarHBondContact O-CB 3.17Å; N136-F142 WeakPolarHBondContact O-CD2 3.05Å; N136-F142 WeakPolarHBondContact O-CG 3.29Å |
| 137 | V | 91.9 | Very high | 94.8 | Very high | 82 Ų | 82 | 58.5 Ų | 58.5 | 50% | 0.497 | 31% | 0.311 | S | S | . | . | G | 310 helix | trans | -55.3 | -31.8 | 179.5 | -179.8 | 0 | 0 | 0 | 0 | 112.3 | F142 | V137-F142 HydrophobicContact CB-CE2 4.45Å; V137-F142 HydrophobicContact CB-CZ 4.44Å; V137-F142 HydrophobicContact CG2-CE2 4.06Å; V137-F142 HydrophobicContact CG2-CZ 3.95Å |
| 138 | R | 89.4 | Confident | 94.8 | Very high | 238 Ų | 238 | 59.2 Ų | 59.2 | 90% | 0.898 | 32% | 0.315 | S | S | * | . | G | 310 helix | trans | -89.8 | -5.5 | 179.1 | -61.4 | -178.5 | -175.6 | 153.4 | 2.1 | 113.7 | N136 | N136-R138 PolarHBondContact O-N 3.23Å; N136-R138 VanDerWaalsContact O-N 3.08Å |
| 139 | A | 90.4 | Very high | 94.9 | Very high | 36 Ų | 36 | 57.4 Ų | 57.4 | 30% | 0.298 | 31% | 0.305 | S | S | . | . | S | Bend | trans | -70.1 | 138.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | N136 G141 F142 | N136-A139 WeakPolarHBondContact O-CB 3.45Å; N136-A139 PolarHBondContact O-N 3.12Å; A139-G141 PolarHBondContact O-N 3.06Å; A139-G141 VanDerWaalsContact O-N 3.12Å; A139-F142 WeakPolarHBondContact O-CB 3.41Å; A139-F142 PolarHBondContact O-N 2.86Å |
| 140 | A | 89.6 | Confident | 94.9 | Very high | 100 Ų | 100 | 56.8 Ų | 56.8 | 83% | 0.826 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | 117.6 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||
| 141 | G | 92.5 | Very high | 94.8 | Very high | 29 Ų | 29 | 60.3 Ų | 60.3 | 30% | 0.299 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 98.1 | 3.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | Q108 A139 R143 L144 V145 | Q108-G141 PolarHBondContact NE2-O 3.08Å; A139-G141 PolarHBondContact O-N 3.06Å; A139-G141 VanDerWaalsContact O-N 3.12Å; G141-R143 PolarHBondContact O-N 3.38Å; G141-L144 PolarHBondContact O-N 2.78Å; G141-L144 VanDerWaalsContact O-N 3.16Å; G141-V145 PolarHBondContact O-N 3.09Å |
| 142 | F | 95.9 | Very high | 94.7 | Very high | 12 Ų | 12 | 62.9 Ų | 62.9 | 5% | 0.053 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -53.4 | -50.9 | 173.8 | 179.9 | -96.6 | 0 | 0 | 0 | 112.5 | W130 L131 N136 V137 A139 L144 V145 A146 F171 T175 | W130-F142 HydrophobicContact CE3-CD2 4.29Å; W130-F142 HydrophobicContact CE3-CE2 4.5Å; W130-F142 HydrophobicContact CH2-CB 4.28Å; W130-F142 AromaticContact CH2-CD2 3.77Å; W130-F142 HydrophobicContact CH2-CD2 3.77Å; W130-F142 HydrophobicContact CH2-CG 4.47Å; W130-F142 HydrophobicContact CZ3-CB 4.43Å; W130-F142 AromaticContact CZ3-CD2 3.37Å; W130-F142 HydrophobicContact CZ3-CD2 3.37Å; W130-F142 AromaticContact CZ3-CE2 3.96Å; W130-F142 HydrophobicContact CZ3-CE2 3.96Å; W130-F142 HydrophobicContact CZ3-CG 4.21Å; L131-F142 HydrophobicContact CD2-CD2 4.4Å; L131-F142 HydrophobicContact CD2-CE2 3.95Å; L131-F142 HydrophobicContact CD2-CZ 4.1Å; N136-F142 HydrophobicContact CB-CD2 4.14Å; N136-F142 HydrophobicContact CB-CE2 4.32Å; N136-F142 WeakPolarHBondContact O-CB 3.17Å; N136-F142 WeakPolarHBondContact O-CD2 3.05Å; N136-F142 WeakPolarHBondContact O-CG 3.29Å; V137-F142 HydrophobicContact CB-CE2 4.45Å; V137-F142 HydrophobicContact CB-CZ 4.44Å; V137-F142 HydrophobicContact CG2-CE2 4.06Å; V137-F142 HydrophobicContact CG2-CZ 3.95Å; A139-F142 WeakPolarHBondContact O-CB 3.41Å; A139-F142 PolarHBondContact O-N 2.86Å; F142-L144 VanDerWaalsContact C-N 3.27Å; F142-L144 PolarHBondContact O-N 3.26Å; F142-V145 WeakPolarHBondContact O-CB 3.41Å; F142-V145 PolarHBondContact O-N 2.91Å; F142-V145 VanDerWaalsContact O-N 3.1Å; F142-A146 PolarHBondContact O-N 2.9Å; F142-F171 HydrophobicContact CE1-CE2 4.21Å; F142-F171 HydrophobicContact CE1-CZ 4.01Å; F142-F171 AromaticContact CZ-CE2 3.79Å; F142-F171 HydrophobicContact CZ-CE2 3.79Å; F142-F171 AromaticContact CZ-CZ 3.88Å; F142-F171 HydrophobicContact CZ-CZ 3.88Å; F142-T175 HydrophobicContact CD1-CG2 4.03Å; F142-T175 HydrophobicContact CE1-CG2 3.81Å |
| 143 | R | 95.1 | Very high | 94.8 | Very high | 118 Ų | 118 | 57.1 Ų | 57.1 | 45% | 0.445 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -56.6 | -42.4 | 176.9 | -174.7 | -176.3 | -61.7 | 137.6 | 2.2 | 112 | G141 V145 A146 E147 T175 F176 | G141-R143 PolarHBondContact O-N 3.38Å; R143-V145 VanDerWaalsContact C-N 3.34Å; R143-V145 PolarHBondContact O-N 3.11Å; R143-A146 CarbonylContact O-C 3.48Å; R143-A146 WeakPolarHBondContact O-CA 3.36Å; R143-A146 WeakPolarHBondContact O-CB 3.29Å; R143-A146 PolarHBondContact O-N 3.45Å; R143-A146 VanDerWaalsContact O-N 3.1Å; R143-E147 HydrophobicContact CG-CG 4.42Å; R143-E147 WeakPolarHBondContact O-CG 3.16Å; R143-E147 PolarHBondContact O-N 3.05Å; R143-T175 HydrophobicContact CB-CG2 4.48Å; R143-T175 HydrophobicContact CG-CG2 4.4Å; R143-T175 PolarHBondContact NE-O 3.47Å; R143-F176 HydrophobicContact CG-CD1 3.95Å; R143-F176 HydrophobicContact CG-CE1 3.97Å |
| 144 | L | 96.5 | Very high | 94.9 | Very high | 72 Ų | 72 | 55.8 Ų | 55.8 | 38% | 0.377 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.9 | -38.5 | 179.4 | -179.3 | 57.3 | 0 | 0 | 0 | 111.4 | Q108 G141 F142 A146 E147 L148 | Q108-L144 HydrophobicContact CG-CD2 4.31Å; Q108-L144 HydrophobicContact CG-CG 4.2Å; G141-L144 PolarHBondContact O-N 2.78Å; G141-L144 VanDerWaalsContact O-N 3.16Å; F142-L144 VanDerWaalsContact C-N 3.27Å; F142-L144 PolarHBondContact O-N 3.26Å; L144-A146 VanDerWaalsContact C-N 3.28Å; L144-A146 PolarHBondContact O-N 3.16Å; L144-E147 PolarHBondContact O-N 3.25Å; L144-L148 HydrophobicContact CD1-CG 4.24Å; L144-L148 HydrophobicContact CG-CD1 4.4Å; L144-L148 HydrophobicContact CG-CG 4.46Å; L144-L148 WeakPolarHBondContact O-CB 3.27Å; L144-L148 VanDerWaalsContact O-CG 3.24Å; L144-L148 WeakPolarHBondContact O-CG 3.37Å; L144-L148 PolarHBondContact O-N 3.45Å |
| 145 | V | 97.9 | Very high | 95 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.7 | -40.6 | 172.3 | 178.8 | 0 | 0 | 0 | 0 | 110.8 | A104 M107 Q108 I111 T127 W130 L131 G141 F142 R143 L148 Y149 | A104-V145 HydrophobicContact CB-CG2 4.17Å; M107-V145 HydrophobicContact CB-CG2 4.3Å; M107-V145 HydrophobicContact CG-CG1 3.83Å; M107-V145 HydrophobicContact CG-CG2 4.31Å; Q108-V145 HydrophobicContact CG-CG2 3.79Å; I111-V145 HydrophobicContact CD1-CG1 4.1Å; T127-V145 HydrophobicContact CG2-CG1 3.82Å; W130-V145 HydrophobicContact CD2-CG1 4.41Å; W130-V145 HydrophobicContact CE3-CB 4.05Å; W130-V145 HydrophobicContact CE3-CG1 3.62Å; W130-V145 HydrophobicContact CE3-CG2 4.26Å; W130-V145 HydrophobicContact CH2-CB 4.3Å; W130-V145 HydrophobicContact CH2-CG2 3.91Å; W130-V145 HydrophobicContact CZ3-CB 3.64Å; W130-V145 HydrophobicContact CZ3-CG1 3.78Å; W130-V145 HydrophobicContact CZ3-CG2 3.74Å; L131-V145 HydrophobicContact CD2-CB 4.22Å; L131-V145 HydrophobicContact CD2-CG1 3.91Å; L131-V145 HydrophobicContact CG-CG1 4.26Å; G141-V145 PolarHBondContact O-N 3.09Å; F142-V145 WeakPolarHBondContact O-CB 3.41Å; F142-V145 PolarHBondContact O-N 2.91Å; F142-V145 VanDerWaalsContact O-N 3.1Å; R143-V145 VanDerWaalsContact C-N 3.34Å; R143-V145 PolarHBondContact O-N 3.11Å; V145-L148 PolarHBondContact O-N 2.91Å; V145-Y149 WeakPolarHBondContact O-CB 3.23Å; V145-Y149 PolarHBondContact O-N 3.38Å |
| 146 | A | 97.7 | Very high | 95 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.4 | -41.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L131 F142 R143 L144 Y149 L150 F166 F171 T175 F176 | L131-A146 HydrophobicContact CD2-CB 3.93Å; F142-A146 PolarHBondContact O-N 2.9Å; R143-A146 CarbonylContact O-C 3.48Å; R143-A146 WeakPolarHBondContact O-CA 3.36Å; R143-A146 WeakPolarHBondContact O-CB 3.29Å; R143-A146 PolarHBondContact O-N 3.45Å; R143-A146 VanDerWaalsContact O-N 3.1Å; L144-A146 VanDerWaalsContact C-N 3.28Å; L144-A146 PolarHBondContact O-N 3.16Å; A146-Y149 PolarHBondContact O-N 3.2Å; A146-L150 PolarHBondContact O-N 3.41Å; A146-L150 VanDerWaalsContact O-N 3.14Å; A146-F166 HydrophobicContact CB-CE1 4.33Å; A146-F166 HydrophobicContact CB-CZ 3.93Å; A146-F166 WeakPolarHBondContact O-CE1 3.42Å; A146-F171 HydrophobicContact CB-CE1 4.09Å; A146-F171 HydrophobicContact CB-CZ 4.19Å; A146-T175 HydrophobicContact CB-CG2 3.98Å; A146-F176 HydrophobicContact CB-CE1 4.02Å; A146-F176 HydrophobicContact CB-CZ 3.6Å |
| 147 | E | 96.6 | Very high | 95 | Very high | 61 Ų | 61 | 49.8 Ų | 49.8 | 29% | 0.285 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 173.8 | -68.1 | 176.6 | -170.9 | 0 | 0 | 111.1 | R143 L144 L150 L151 F176 Q180 | R143-E147 HydrophobicContact CG-CG 4.42Å; R143-E147 WeakPolarHBondContact O-CG 3.16Å; R143-E147 PolarHBondContact O-N 3.05Å; L144-E147 PolarHBondContact O-N 3.25Å; E147-L150 PolarHBondContact O-N 2.89Å; E147-L151 WeakPolarHBondContact O-CB 3.18Å; E147-L151 WeakPolarHBondContact O-CG 3.45Å; E147-L151 PolarHBondContact O-N 2.91Å; E147-F176 HydrophobicContact CG-CD1 4.46Å; E147-F176 HydrophobicContact CG-CE1 3.71Å; E147-Q180 PolarHBondContact OE1-NE2 3.41Å |
| 148 | L | 97.7 | Very high | 95 | Very high | 15 Ų | 15 | 47.7 Ų | 47.7 | 8% | 0.079 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -67.3 | -36.5 | 177.2 | -65.5 | 176.5 | 0 | 0 | 0 | 112.3 | Q108 I111 L112 L144 V145 L150 L151 H152 | Q108-L148 HydrophobicContact CB-CD1 3.61Å; Q108-L148 HydrophobicContact CG-CD1 3.62Å; I111-L148 HydrophobicContact CD1-CB 4.1Å; I111-L148 HydrophobicContact CG2-CB 3.94Å; L112-L148 HydrophobicContact CD2-CD2 3.9Å; L112-L148 HydrophobicContact CG-CD1 4.45Å; L112-L148 HydrophobicContact CG-CD2 4.41Å; L144-L148 HydrophobicContact CD1-CG 4.24Å; L144-L148 HydrophobicContact CG-CD1 4.4Å; L144-L148 HydrophobicContact CG-CG 4.46Å; L144-L148 WeakPolarHBondContact O-CB 3.27Å; L144-L148 VanDerWaalsContact O-CG 3.24Å; L144-L148 WeakPolarHBondContact O-CG 3.37Å; L144-L148 PolarHBondContact O-N 3.45Å; V145-L148 PolarHBondContact O-N 2.91Å; L148-L150 VanDerWaalsContact C-N 3.34Å; L148-L150 PolarHBondContact O-N 2.92Å; L148-L151 PolarHBondContact O-N 3.33Å; L148-H152 WeakPolarHBondContact CD2-CD2 3.49Å; L148-H152 WeakPolarHBondContact O-CA 3.5Å; L148-H152 WeakPolarHBondContact O-CB 3.42Å; L148-H152 PolarHBondContact O-N 3.48Å |
| 149 | Y | 98.2 | Very high | 95.2 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.5 | -47.8 | 174.5 | -175.2 | -114.9 | 0 | 0 | 0 | 111 | Q124 T127 L128 L131 V145 A146 I153 L154 E162 F166 | Q124-Y149 HydrophobicContact CG-CE2 4.11Å; T127-Y149 HydrophobicContact CG2-CD2 3.47Å; T127-Y149 VanDerWaalsContact CG2-CD2 3.47Å; T127-Y149 HydrophobicContact CG2-CE2 4.38Å; T127-Y149 HydrophobicContact CG2-CG 3.97Å; L128-Y149 HydrophobicContact CB-CE2 4.41Å; L128-Y149 HydrophobicContact CD1-CE1 4.11Å; L131-Y149 HydrophobicContact CD1-CD1 4.02Å; L131-Y149 HydrophobicContact CD1-CG 3.9Å; V145-Y149 WeakPolarHBondContact O-CB 3.23Å; V145-Y149 PolarHBondContact O-N 3.38Å; A146-Y149 PolarHBondContact O-N 3.2Å; Y149-I153 HydrophobicContact CD2-CB 4.1Å; Y149-I153 HydrophobicContact CD2-CD1 4Å; Y149-I153 HydrophobicContact CD2-CG1 4.44Å; Y149-I153 HydrophobicContact CD2-CG2 4.33Å; Y149-I153 HydrophobicContact CE2-CB 4.35Å; Y149-I153 HydrophobicContact CE2-CD1 4.47Å; Y149-I153 HydrophobicContact CE2-CG2 4.09Å; Y149-I153 WeakPolarHBondContact O-CA 3.31Å; Y149-I153 VanDerWaalsContact O-CB 3.28Å; Y149-I153 WeakPolarHBondContact O-CB 3.26Å; Y149-I153 PolarHBondContact O-N 3.12Å; Y149-I153 VanDerWaalsContact O-N 3.13Å; Y149-L154 HydrophobicContact CD1-CD1 3.87Å; Y149-L154 HydrophobicContact CD1-CG 4.02Å; Y149-L154 HydrophobicContact CE1-CD1 3.57Å; Y149-L154 HydrophobicContact CE1-CD2 3.81Å; Y149-L154 HydrophobicContact CE1-CG 3.67Å; Y149-L154 PolarHBondContact O-N 3.21Å; Y149-E162 PolarHBondContact OH-OE1 3.27Å; Y149-F166 HydrophobicContact CD1-CD2 4.08Å; Y149-F166 HydrophobicContact CD1-CE1 4.19Å; Y149-F166 AromaticContact CD1-CE2 3.67Å; Y149-F166 HydrophobicContact CD1-CE2 3.67Å; Y149-F166 AromaticContact CD1-CZ 3.72Å; Y149-F166 HydrophobicContact CD1-CZ 3.72Å; Y149-F166 HydrophobicContact CE1-CD2 4.18Å; Y149-F166 HydrophobicContact CE1-CE2 4.1Å |
| 150 | L | 96.8 | Very high | 95.4 | Very high | 5 Ų | 5 | 38.7 Ų | 38.7 | 3% | 0.026 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -61.8 | -56.4 | 176.3 | 178.7 | 64.8 | 0 | 0 | 0 | 111.6 | A146 E147 L148 L154 L155 A163 F166 V167 A184 V188 | A146-L150 PolarHBondContact O-N 3.41Å; A146-L150 VanDerWaalsContact O-N 3.14Å; E147-L150 PolarHBondContact O-N 2.89Å; L148-L150 VanDerWaalsContact C-N 3.34Å; L148-L150 PolarHBondContact O-N 2.92Å; L150-L154 HydrophobicContact CD1-CD1 4.43Å; L150-L155 HydrophobicContact CD1-CG 4.36Å; L150-L155 WeakPolarHBondContact O-CG 3.42Å; L150-L155 PolarHBondContact O-N 2.97Å; L150-A163 HydrophobicContact CD1-CB 3.64Å; L150-F166 HydrophobicContact CB-CD1 4.37Å; L150-F166 HydrophobicContact CB-CE1 4.3Å; L150-V167 HydrophobicContact CD1-CG2 4.18Å; L150-V167 HydrophobicContact CD2-CG2 3.72Å; L150-A184 HydrophobicContact CD2-CB 3.75Å; L150-V188 HydrophobicContact CD1-CG2 4.1Å |
| 151 | L | 95.8 | Very high | 95.6 | Very high | 76 Ų | 76 | 40.6 Ų | 40.6 | 40% | 0.398 | 22% | 0.22 | S | C | . | . | I | π-helix | trans | -77 | -32.2 | -167.6 | -66.1 | 176.8 | 0 | 0 | 0 | 114.2 | E147 L148 L155 P156 V187 | E147-L151 WeakPolarHBondContact O-CB 3.18Å; E147-L151 WeakPolarHBondContact O-CG 3.45Å; E147-L151 PolarHBondContact O-N 2.91Å; L148-L151 PolarHBondContact O-N 3.33Å; L151-L155 HydrophobicContact CD2-CD1 4.04Å; L151-P156 WeakPolarHBondContact O-CD 3.43Å; L151-P156 WeakPolarHBondContact O-CG 3.37Å; L151-V187 HydrophobicContact CD2-CG1 4.07Å |
| 152 | H | 96 | Very high | 95.8 | Very high | 56 Ų | 56 | 42.8 Ų | 42.8 | 26% | 0.259 | 22% | 0.222 | S | C | . | . | I | π-helix | trans | -113.7 | -6.8 | -172.5 | -65.7 | -64.6 | 0 | 0 | 0 | 114 | I111 S115 P120 L148 | I111-H152 HydrophobicContact CG2-CB 3.88Å; S115-H152 PolarHBondContact OG-ND1 2.93Å; S115-H152 VanDerWaalsContact OG-ND1 3.16Å; P120-H152 WeakPolarHBondContact CB-O 3.45Å; L148-H152 WeakPolarHBondContact CD2-CD2 3.49Å; L148-H152 WeakPolarHBondContact O-CA 3.5Å; L148-H152 WeakPolarHBondContact O-CB 3.42Å; L148-H152 PolarHBondContact O-N 3.48Å |
| 153 | I | 97.7 | Very high | 95.8 | Very high | 1 Ų | 1 | 42.2 Ų | 42.2 | 1% | 0.005 | 22% | 0.22 | C | C | . | . | I | π-helix | trans | -119.6 | -67.5 | 175.5 | -53.8 | -169.1 | 0 | 0 | 0 | 110.9 | I111 P120 M123 Q124 Y149 L155 P156 L157 | I111-I153 HydrophobicContact CG1-CD1 4.21Å; I111-I153 HydrophobicContact CG2-CD1 4.14Å; I111-I153 HydrophobicContact CG2-CG1 4.08Å; P120-I153 HydrophobicContact CB-CG1 4.38Å; M123-I153 HydrophobicContact CB-CD1 3.71Å; Q124-I153 HydrophobicContact CB-CG2 3.72Å; Q124-I153 HydrophobicContact CG-CG2 3.98Å; Y149-I153 HydrophobicContact CD2-CB 4.1Å; Y149-I153 HydrophobicContact CD2-CD1 4Å; Y149-I153 HydrophobicContact CD2-CG1 4.44Å; Y149-I153 HydrophobicContact CD2-CG2 4.33Å; Y149-I153 HydrophobicContact CE2-CB 4.35Å; Y149-I153 HydrophobicContact CE2-CD1 4.47Å; Y149-I153 HydrophobicContact CE2-CG2 4.09Å; Y149-I153 WeakPolarHBondContact O-CA 3.31Å; Y149-I153 VanDerWaalsContact O-CB 3.28Å; Y149-I153 WeakPolarHBondContact O-CB 3.26Å; Y149-I153 PolarHBondContact O-N 3.12Å; Y149-I153 VanDerWaalsContact O-N 3.13Å; I153-L155 PolarHBondContact O-N 3.49Å; I153-P156 WeakPolarHBondContact O-CD 3.27Å; I153-L157 HydrophobicContact CG2-CD1 3.74Å; I153-L157 WeakPolarHBondContact O-CB 3.44Å; I153-L157 WeakPolarHBondContact O-CD1 3.44Å; I153-L157 WeakPolarHBondContact O-CG 3.33Å; I153-L157 PolarHBondContact O-N 3.41Å; I153-L157 VanDerWaalsContact O-N 3.12Å |
| 154 | L | 97 | Very high | 95.8 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 22% | 0.215 | C | C | . | . | I | π-helix | trans | -62.6 | -49.7 | -173.1 | -64.4 | -178.3 | 0 | 0 | 0 | 112.9 | Y149 L150 L157 G158 Q159 E162 A163 F166 | Y149-L154 HydrophobicContact CD1-CD1 3.87Å; Y149-L154 HydrophobicContact CD1-CG 4.02Å; Y149-L154 HydrophobicContact CE1-CD1 3.57Å; Y149-L154 HydrophobicContact CE1-CD2 3.81Å; Y149-L154 HydrophobicContact CE1-CG 3.67Å; Y149-L154 PolarHBondContact O-N 3.21Å; L150-L154 HydrophobicContact CD1-CD1 4.43Å; L154-L157 PolarHBondContact O-N 3.31Å; L154-G158 PolarHBondContact O-N 3.06Å; L154-Q159 HydrophobicContact CD2-CB 4.23Å; L154-Q159 PolarHBondContact O-N 2.94Å; L154-E162 HydrophobicContact CD1-CG 4.47Å; L154-E162 HydrophobicContact CD2-CB 4.41Å; L154-E162 HydrophobicContact CD2-CG 4.09Å; L154-A163 HydrophobicContact CB-CB 4.06Å; L154-A163 HydrophobicContact CD1-CB 4.12Å; L154-F166 HydrophobicContact CD1-CB 4.15Å; L154-F166 HydrophobicContact CD1-CG 4.27Å |
| 155 | L | 93.9 | Very high | 95.7 | Very high | 11 Ų | 11 | 43.6 Ų | 43.6 | 6% | 0.058 | 23% | 0.226 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -46.1 | -177.8 | -66.7 | -178.8 | 0 | 0 | 0 | 113.1 | L150 L151 I153 L157 G158 L160 A163 V187 V188 K191 | L150-L155 HydrophobicContact CD1-CG 4.36Å; L150-L155 WeakPolarHBondContact O-CG 3.42Å; L150-L155 PolarHBondContact O-N 2.97Å; L151-L155 HydrophobicContact CD2-CD1 4.04Å; I153-L155 PolarHBondContact O-N 3.49Å; L155-L157 VanDerWaalsContact C-N 3.27Å; L155-L157 PolarHBondContact O-N 3.48Å; L155-G158 PolarHBondContact O-N 3.42Å; L155-G158 VanDerWaalsContact O-N 3.13Å; L155-L160 HydrophobicContact CD2-CD2 3.76Å; L155-A163 HydrophobicContact CD2-CB 4.13Å; L155-V187 HydrophobicContact CD1-CG1 3.59Å; L155-V188 HydrophobicContact CD2-CB 4.42Å; L155-V188 HydrophobicContact CD2-CG2 3.96Å; L155-K191 HydrophobicContact CD2-CB 4.26Å; L155-K191 HydrophobicContact CD2-CG 4.29Å |
| 156 | P | 93.3 | Very high | 95.7 | Very high | 73 Ų | 73 | 44.6 Ų | 44.6 | 47% | 0.474 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -27.3 | 175.2 | -26.4 | 37.9 | 0 | 0 | 0 | 114.5 | P120 L151 I153 G158 | P120-P156 HydrophobicContact CG-CB 4.2Å; L151-P156 WeakPolarHBondContact O-CD 3.43Å; L151-P156 WeakPolarHBondContact O-CG 3.37Å; I153-P156 WeakPolarHBondContact O-CD 3.27Å; P156-G158 VanDerWaalsContact C-N 3.27Å |
| 157 | L | 94.3 | Very high | 95.5 | Very high | 61 Ų | 61 | 44.6 Ų | 44.6 | 32% | 0.319 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | -7.7 | 174.9 | -67.2 | 174.7 | 0 | 0 | 0 | 113.2 | P120 A121 I153 L154 L155 Q159 | P120-L157 HydrophobicContact CG-CD2 4.08Å; P120-L157 HydrophobicContact CG-CG 4.27Å; A121-L157 HydrophobicContact CB-CD1 4.46Å; A121-L157 HydrophobicContact CB-CD2 3.94Å; I153-L157 HydrophobicContact CG2-CD1 3.74Å; I153-L157 WeakPolarHBondContact O-CB 3.44Å; I153-L157 WeakPolarHBondContact O-CD1 3.44Å; I153-L157 WeakPolarHBondContact O-CG 3.33Å; I153-L157 PolarHBondContact O-N 3.41Å; I153-L157 VanDerWaalsContact O-N 3.12Å; L154-L157 PolarHBondContact O-N 3.31Å; L155-L157 VanDerWaalsContact C-N 3.27Å; L155-L157 PolarHBondContact O-N 3.48Å; L157-Q159 VanDerWaalsContact C-N 3.25Å; L157-Q159 HydrophobicContact CB-CG 4.15Å; L157-Q159 PolarHBondContact O-N 2.88Å |
| 158 | G | 92.3 | Very high | 95.4 | Very high | 37 Ų | 37 | 43.6 Ų | 43.6 | 38% | 0.381 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 72.7 | 16.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L154 L155 P156 L160 | L154-G158 PolarHBondContact O-N 3.06Å; L155-G158 PolarHBondContact O-N 3.42Å; L155-G158 VanDerWaalsContact O-N 3.13Å; P156-G158 VanDerWaalsContact C-N 3.27Å; G158-L160 PolarHBondContact O-N 2.91Å |
| 159 | Q | 95 | Very high | 95.2 | Very high | 57 Ų | 57 | 43.3 Ų | 43.3 | 27% | 0.266 | 23% | 0.231 | S | C | . | . | trans | -80.9 | 63.8 | 178.1 | -69.9 | 168.1 | -32.2 | 0 | 0 | 110.4 | Q124 L154 L157 E162 A163 | Q124-Q159 VanDerWaalsContact NE2-NE2 3.19Å; L154-Q159 HydrophobicContact CD2-CB 4.23Å; L154-Q159 PolarHBondContact O-N 2.94Å; L157-Q159 VanDerWaalsContact C-N 3.25Å; L157-Q159 HydrophobicContact CB-CG 4.15Å; L157-Q159 PolarHBondContact O-N 2.88Å; Q159-E162 HydrophobicContact CB-CB 4.29Å; Q159-E162 PolarHBondContact O-N 3.04Å; Q159-A163 WeakPolarHBondContact O-CB 3.49Å; Q159-A163 PolarHBondContact O-N 3.34Å | ||
| 160 | L | 94.1 | Very high | 94.9 | Very high | 29 Ų | 29 | 49.5 Ų | 49.5 | 15% | 0.152 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -71.1 | -35 | -169.8 | -60.1 | 179.1 | 0 | 0 | 0 | 113.5 | L155 G158 A163 R164 K191 S192 | L155-L160 HydrophobicContact CD2-CD2 3.76Å; G158-L160 PolarHBondContact O-N 2.91Å; L160-A163 WeakPolarHBondContact O-CB 3.31Å; L160-A163 PolarHBondContact O-N 2.87Å; L160-R164 PolarHBondContact O-N 3.41Å; L160-K191 HydrophobicContact CD2-CB 4.21Å; L160-K191 HydrophobicContact CD2-CG 3.96Å; L160-S192 VanDerWaalsContact CD1-CA 3.5Å |
| 161 | D | 93.9 | Very high | 94.7 | Very high | 140 Ų | 140 | 51.5 Ų | 51.5 | 75% | 0.749 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -66.3 | -44.2 | 176.8 | -63.5 | -37.5 | 0 | 0 | 0 | 110.9 | A163 R164 E165 | D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 2.97Å; D161-R164 PolarHBondContact O-N 2.92Å; D161-E165 PolarHBondContact O-N 3.2Å |
| 162 | E | 95.3 | Very high | 94.5 | Very high | 74 Ų | 74 | 47.9 Ų | 47.9 | 35% | 0.346 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63.7 | -39.8 | 174.5 | -167.4 | 178.1 | 158.1 | 0 | 0 | 111.1 | Y149 L154 Q159 R164 E165 F166 | Y149-E162 PolarHBondContact OH-OE1 3.27Å; L154-E162 HydrophobicContact CD1-CG 4.47Å; L154-E162 HydrophobicContact CD2-CB 4.41Å; L154-E162 HydrophobicContact CD2-CG 4.09Å; Q159-E162 HydrophobicContact CB-CB 4.29Å; Q159-E162 PolarHBondContact O-N 3.04Å; E162-R164 PolarHBondContact O-N 3.21Å; E162-E165 PolarHBondContact O-N 3.32Å; E162-F166 WeakPolarHBondContact O-CB 3.45Å; E162-F166 PolarHBondContact O-N 3.23Å |
| 163 | A | 95.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.9 | -40.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | L150 L154 L155 Q159 L160 D161 V167 V188 | L150-A163 HydrophobicContact CD1-CB 3.64Å; L154-A163 HydrophobicContact CB-CB 4.06Å; L154-A163 HydrophobicContact CD1-CB 4.12Å; L155-A163 HydrophobicContact CD2-CB 4.13Å; Q159-A163 WeakPolarHBondContact O-CB 3.49Å; Q159-A163 PolarHBondContact O-N 3.34Å; L160-A163 WeakPolarHBondContact O-CB 3.31Å; L160-A163 PolarHBondContact O-N 2.87Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 2.97Å; A163-V167 WeakPolarHBondContact O-CG2 3.28Å; A163-V167 PolarHBondContact O-N 3.46Å; A163-V188 HydrophobicContact CB-CG1 4.35Å; A163-V188 HydrophobicContact CB-CG2 4.02Å |
| 164 | R | 95.8 | Very high | 94.1 | Very high | 90 Ų | 90 | 57.2 Ų | 57.2 | 34% | 0.34 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66.5 | -47.4 | 176.9 | -171.8 | 178.1 | -63.5 | -86.7 | 0.7 | 111.1 | L160 D161 E162 F166 V167 S168 L185 V188 E189 | L160-R164 PolarHBondContact O-N 3.41Å; D161-R164 PolarHBondContact O-N 2.92Å; E162-R164 PolarHBondContact O-N 3.21Å; R164-F166 VanDerWaalsContact C-N 3.32Å; R164-F166 PolarHBondContact O-N 3.27Å; R164-V167 PolarHBondContact O-N 2.9Å; R164-S168 WeakPolarHBondContact O-CB 3.3Å; R164-S168 PolarHBondContact O-N 3.44Å; R164-S168 PolarHBondContact O-OG 2.94Å; R164-L185 HydrophobicContact CG-CD2 4.19Å; R164-V188 HydrophobicContact CB-CG1 4.49Å; R164-E189 IonicContact CZ-OE1 2.68Å; R164-E189 IonicContact NH1-OE1 3.64Å; R164-E189 PolarHBondContact NH1-OE1 2.92Å; R164-E189 IonicContact NH2-OE1 3.61Å |
| 165 | E | 95.6 | Very high | 93.9 | Very high | 129 Ų | 129 | 57.8 Ų | 57.8 | 60% | 0.603 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -63.2 | -40 | 177.6 | -177.4 | 55.2 | -154.6 | 0 | 0 | 111.7 | D161 E162 V167 S168 G169 | D161-E165 PolarHBondContact O-N 3.2Å; E162-E165 PolarHBondContact O-N 3.32Å; E165-V167 PolarHBondContact O-N 2.8Å; E165-S168 PolarHBondContact O-N 3.43Å; E165-G169 WeakPolarHBondContact O-CA 3.28Å; E165-G169 PolarHBondContact O-N 3.35Å |
| 166 | F | 96 | Very high | 93.8 | Very high | 21 Ų | 21 | 58.1 Ų | 58.1 | 9% | 0.092 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -57.6 | -35.3 | 176.8 | -176.8 | -101.7 | 0 | 0 | 0 | 112.9 | L131 A146 Y149 L150 L154 E162 R164 F171 G172 F176 | L131-F166 HydrophobicContact CD1-CE2 4.04Å; L131-F166 HydrophobicContact CD1-CZ 3.96Å; A146-F166 HydrophobicContact CB-CE1 4.33Å; A146-F166 HydrophobicContact CB-CZ 3.93Å; A146-F166 WeakPolarHBondContact O-CE1 3.42Å; Y149-F166 HydrophobicContact CD1-CD2 4.08Å; Y149-F166 HydrophobicContact CD1-CE1 4.19Å; Y149-F166 AromaticContact CD1-CE2 3.67Å; Y149-F166 HydrophobicContact CD1-CE2 3.67Å; Y149-F166 AromaticContact CD1-CZ 3.72Å; Y149-F166 HydrophobicContact CD1-CZ 3.72Å; Y149-F166 HydrophobicContact CE1-CD2 4.18Å; Y149-F166 HydrophobicContact CE1-CE2 4.1Å; L150-F166 HydrophobicContact CB-CD1 4.37Å; L150-F166 HydrophobicContact CB-CE1 4.3Å; L154-F166 HydrophobicContact CD1-CB 4.15Å; L154-F166 HydrophobicContact CD1-CG 4.27Å; E162-F166 WeakPolarHBondContact O-CB 3.45Å; E162-F166 PolarHBondContact O-N 3.23Å; R164-F166 VanDerWaalsContact C-N 3.32Å; R164-F166 PolarHBondContact O-N 3.27Å; F166-F171 AromaticContact CD2-CD1 3.89Å; F166-F171 HydrophobicContact CD2-CD1 3.89Å; F166-F171 HydrophobicContact CD2-CE1 4.14Å; F166-F171 HydrophobicContact CE1-CD1 4.45Å; F166-F171 HydrophobicContact CE1-CE1 4.05Å; F166-F171 AromaticContact CE2-CD1 3.5Å; F166-F171 HydrophobicContact CE2-CD1 3.5Å; F166-F171 AromaticContact CE2-CE1 3.29Å; F166-F171 HydrophobicContact CE2-CE1 3.29Å; F166-F171 HydrophobicContact CE2-CG 4.39Å; F166-F171 AromaticContact CE2-CZ 4Å; F166-F171 HydrophobicContact CE2-CZ 4Å; F166-F171 AromaticContact CZ-CD1 3.83Å; F166-F171 HydrophobicContact CZ-CD1 3.83Å; F166-F171 AromaticContact CZ-CE1 3.25Å; F166-F171 HydrophobicContact CZ-CE1 3.25Å; F166-F171 HydrophobicContact CZ-CZ 4.04Å; F166-G172 VanDerWaalsContact O-CA 3.31Å; F166-G172 WeakPolarHBondContact O-CA 3.02Å; F166-G172 PolarHBondContact O-N 2.94Å; F166-F176 HydrophobicContact CD1-CE2 4.44Å; F166-F176 AromaticContact CE1-CE2 3.99Å; F166-F176 HydrophobicContact CE1-CE2 3.99Å; F166-F176 HydrophobicContact CE1-CZ 4.03Å |
| 167 | V | 95.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -87.9 | -41.8 | 179.7 | 179.7 | 0 | 0 | 0 | 0 | 112.5 | L150 A163 R164 E165 G172 R181 A184 L185 | L150-V167 HydrophobicContact CD1-CG2 4.18Å; L150-V167 HydrophobicContact CD2-CG2 3.72Å; A163-V167 WeakPolarHBondContact O-CG2 3.28Å; A163-V167 PolarHBondContact O-N 3.46Å; R164-V167 PolarHBondContact O-N 2.9Å; E165-V167 PolarHBondContact O-N 2.8Å; V167-G172 WeakPolarHBondContact O-CA 3.41Å; V167-R181 HydrophobicContact CG1-CB 3.91Å; V167-R181 HydrophobicContact CG1-CG 4.18Å; V167-A184 HydrophobicContact CG1-CB 3.91Å; V167-A184 HydrophobicContact CG2-CB 3.93Å; V167-L185 HydrophobicContact CB-CD2 4.1Å; V167-L185 HydrophobicContact CB-CG 4.45Å; V167-L185 HydrophobicContact CG1-CD1 4.5Å; V167-L185 HydrophobicContact CG1-CD2 3.98Å; V167-L185 HydrophobicContact CG1-CG 3.78Å |
| 168 | S | 93.8 | Very high | 93.6 | Very high | 41 Ų | 41 | 60.5 Ų | 60.5 | 29% | 0.287 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -85 | -28.8 | -174.6 | -64.3 | 0 | 0 | 0 | 0 | 114.4 | R164 E165 R173 | R164-S168 WeakPolarHBondContact O-CB 3.3Å; R164-S168 PolarHBondContact O-N 3.44Å; R164-S168 PolarHBondContact O-OG 2.94Å; E165-S168 PolarHBondContact O-N 3.43Å; S168-R173 PolarHBondContact O-NE 3.36Å; S168-R173 PolarHBondContact O-NH2 3.47Å |
| 169 | G | 93.6 | Very high | 93.6 | Very high | 9 Ų | 9 | 66.5 Ų | 66.5 | 9% | 0.093 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -71.9 | 174.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113 | E165 F171 G172 R173 | E165-G169 WeakPolarHBondContact O-CA 3.28Å; E165-G169 PolarHBondContact O-N 3.35Å; G169-F171 PolarHBondContact O-N 2.99Å; G169-F171 VanDerWaalsContact O-N 3.16Å; G169-G172 PolarHBondContact O-N 2.96Å; G169-R173 WeakPolarHBondContact O-CG 3.47Å; G169-R173 PolarHBondContact O-N 3.2Å |
| 170 | D | 92.6 | Very high | 93.4 | Very high | 130 Ų | 130 | 66.5 Ų | 66.5 | 70% | 0.695 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -56 | -36 | -172.6 | -68.4 | -26.5 | 0 | 0 | 0 | 113.3 | R173 S174 | D170-R173 PolarHBondContact O-N 2.89Å; D170-S174 WeakPolarHBondContact O-CB 3.45Å; D170-S174 PolarHBondContact O-N 3.14Å; D170-S174 PolarHBondContact O-OG 3.09Å |
| 171 | F | 92.2 | Very high | 93.3 | Very high | 47 Ų | 47 | 67 Ų | 67 | 21% | 0.206 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -57.2 | -52.4 | 173.8 | 179.8 | -87.5 | 0 | 0 | 0 | 111.5 | L131 F142 A146 F166 G169 R173 S174 T175 | L131-F171 HydrophobicContact CB-CE2 4.32Å; L131-F171 HydrophobicContact CB-CZ 4.29Å; L131-F171 HydrophobicContact CD2-CZ 4.13Å; F142-F171 HydrophobicContact CE1-CE2 4.21Å; F142-F171 HydrophobicContact CE1-CZ 4.01Å; F142-F171 AromaticContact CZ-CE2 3.79Å; F142-F171 HydrophobicContact CZ-CE2 3.79Å; F142-F171 AromaticContact CZ-CZ 3.88Å; F142-F171 HydrophobicContact CZ-CZ 3.88Å; A146-F171 HydrophobicContact CB-CE1 4.09Å; A146-F171 HydrophobicContact CB-CZ 4.19Å; F166-F171 AromaticContact CD2-CD1 3.89Å; F166-F171 HydrophobicContact CD2-CD1 3.89Å; F166-F171 HydrophobicContact CD2-CE1 4.14Å; F166-F171 HydrophobicContact CE1-CD1 4.45Å; F166-F171 HydrophobicContact CE1-CE1 4.05Å; F166-F171 AromaticContact CE2-CD1 3.5Å; F166-F171 HydrophobicContact CE2-CD1 3.5Å; F166-F171 AromaticContact CE2-CE1 3.29Å; F166-F171 HydrophobicContact CE2-CE1 3.29Å; F166-F171 HydrophobicContact CE2-CG 4.39Å; F166-F171 AromaticContact CE2-CZ 4Å; F166-F171 HydrophobicContact CE2-CZ 4Å; F166-F171 AromaticContact CZ-CD1 3.83Å; F166-F171 HydrophobicContact CZ-CD1 3.83Å; F166-F171 AromaticContact CZ-CE1 3.25Å; F166-F171 HydrophobicContact CZ-CE1 3.25Å; F166-F171 HydrophobicContact CZ-CZ 4.04Å; G169-F171 PolarHBondContact O-N 2.99Å; G169-F171 VanDerWaalsContact O-N 3.16Å; F171-R173 VanDerWaalsContact C-N 3.35Å; F171-R173 PolarHBondContact O-N 3.09Å; F171-S174 PolarHBondContact O-N 3.03Å; F171-S174 PolarHBondContact O-OG 2.87Å; F171-T175 HydrophobicContact CE1-CG2 4.29Å; F171-T175 HydrophobicContact CZ-CG2 4.37Å; F171-T175 VanDerWaalsContact O-CB 3.3Å; F171-T175 WeakPolarHBondContact O-CB 3.34Å; F171-T175 PolarHBondContact O-N 3.4Å; F171-T175 PolarHBondContact O-OG1 3.46Å |
| 172 | G | 91.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.4 | -38.4 | 180 | 0 | 0 | 0 | 0 | 0 | 112.6 | F166 V167 G169 S174 T175 F176 | F166-G172 VanDerWaalsContact O-CA 3.31Å; F166-G172 WeakPolarHBondContact O-CA 3.02Å; F166-G172 PolarHBondContact O-N 2.94Å; V167-G172 WeakPolarHBondContact O-CA 3.41Å; G169-G172 PolarHBondContact O-N 2.96Å; G172-S174 VanDerWaalsContact C-N 3.31Å; G172-S174 PolarHBondContact O-N 3.35Å; G172-T175 PolarHBondContact O-N 3.13Å; G172-F176 PolarHBondContact O-N 2.82Å |
| 173 | R | 92.8 | Very high | 93.1 | Very high | 156 Ų | 156 | 68.5 Ų | 68.5 | 59% | 0.589 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -64.5 | -33.3 | 176.4 | -41 | -154.8 | 173 | 162.5 | -2.9 | 113.3 | S168 G169 D170 F171 | S168-R173 PolarHBondContact O-NE 3.36Å; S168-R173 PolarHBondContact O-NH2 3.47Å; G169-R173 WeakPolarHBondContact O-CG 3.47Å; G169-R173 PolarHBondContact O-N 3.2Å; D170-R173 PolarHBondContact O-N 2.89Å; F171-R173 VanDerWaalsContact C-N 3.35Å; F171-R173 PolarHBondContact O-N 3.09Å |
| 174 | S | 92 | Very high | 92.8 | Very high | 97 Ų | 97 | 69.2 Ų | 69.2 | 68% | 0.678 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -85.4 | -23.6 | 180 | 62.2 | 0 | 0 | 0 | 0 | 113.4 | D170 F171 G172 | D170-S174 WeakPolarHBondContact O-CB 3.45Å; D170-S174 PolarHBondContact O-N 3.14Å; D170-S174 PolarHBondContact O-OG 3.09Å; F171-S174 PolarHBondContact O-N 3.03Å; F171-S174 PolarHBondContact O-OG 2.87Å; G172-S174 VanDerWaalsContact C-N 3.31Å; G172-S174 PolarHBondContact O-N 3.35Å |
| 175 | T | 92 | Very high | 92.6 | Very high | 12 Ų | 12 | 66.2 Ų | 66.2 | 7% | 0.074 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -98.3 | -39.7 | -172.8 | -57.7 | 0 | 0 | 0 | 0 | 113.5 | F142 R143 A146 F171 G172 | F142-T175 HydrophobicContact CD1-CG2 4.03Å; F142-T175 HydrophobicContact CE1-CG2 3.81Å; R143-T175 HydrophobicContact CB-CG2 4.48Å; R143-T175 HydrophobicContact CG-CG2 4.4Å; R143-T175 PolarHBondContact NE-O 3.47Å; A146-T175 HydrophobicContact CB-CG2 3.98Å; F171-T175 HydrophobicContact CE1-CG2 4.29Å; F171-T175 HydrophobicContact CZ-CG2 4.37Å; F171-T175 VanDerWaalsContact O-CB 3.3Å; F171-T175 WeakPolarHBondContact O-CB 3.34Å; F171-T175 PolarHBondContact O-N 3.4Å; F171-T175 PolarHBondContact O-OG1 3.46Å; G172-T175 PolarHBondContact O-N 3.13Å |
| 176 | F | 91.8 | Very high | 92.4 | Very high | 17 Ų | 17 | 63.9 Ų | 63.9 | 8% | 0.075 | 32% | 0.32 | C | S | . | . | S | Bend | trans | -107.4 | 150.9 | -173.7 | -56.7 | -60.2 | 0 | 0 | 0 | 111.9 | R143 A146 E147 F166 G172 Q180 R181 | R143-F176 HydrophobicContact CG-CD1 3.95Å; R143-F176 HydrophobicContact CG-CE1 3.97Å; A146-F176 HydrophobicContact CB-CE1 4.02Å; A146-F176 HydrophobicContact CB-CZ 3.6Å; E147-F176 HydrophobicContact CG-CD1 4.46Å; E147-F176 HydrophobicContact CG-CE1 3.71Å; F166-F176 HydrophobicContact CD1-CE2 4.44Å; F166-F176 AromaticContact CE1-CE2 3.99Å; F166-F176 HydrophobicContact CE1-CE2 3.99Å; F166-F176 HydrophobicContact CE1-CZ 4.03Å; G172-F176 PolarHBondContact O-N 2.82Å; F176-Q180 HydrophobicContact CB-CB 4.11Å; F176-R181 HydrophobicContact CB-CG 3.6Å; F176-R181 HydrophobicContact CD2-CG 4.48Å; F176-R181 HydrophobicContact CG-CG 4.48Å |
| 177 | T | 92.2 | Very high | 92.2 | Very high | 66 Ų | 66 | 65.6 Ų | 65.6 | 41% | 0.405 | 33% | 0.332 | S | S | . | . | trans | -72.4 | 160.7 | 168.2 | 70.5 | 0 | 0 | 0 | 0 | 110.6 | E179 Q180 R181 | T177-E179 VanDerWaalsContact C-N 3.28Å; T177-E179 PolarHBondContact O-N 2.84Å; T177-Q180 VanDerWaalsContact N-OE1 3.15Å; T177-Q180 PolarHBondContact O-N 2.94Å; T177-Q180 VanDerWaalsContact O-N 3.08Å; T177-Q180 VanDerWaalsContact OG1-CG 3.29Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.36Å; T177-Q180 PolarHBondContact OG1-N 3.27Å; T177-R181 WeakPolarHBondContact O-CG 3.26Å; T177-R181 PolarHBondContact O-N 3.41Å | ||
| 178 | E | 92.2 | Very high | 92 | Very high | 118 Ų | 118 | 65.6 Ų | 65.6 | 55% | 0.551 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -53.8 | -45.5 | 178.2 | -167.8 | 59.7 | -130 | 0 | 0 | 112.3 | Q180 R181 Q182 | E178-Q180 PolarHBondContact O-N 2.95Å; E178-R181 PolarHBondContact O-N 3.4Å; E178-R181 IonicContact OE1-CZ 3.71Å; E178-R181 IonicContact OE1-NE 3.22Å; E178-R181 IonicContact OE1-NH2 3.04Å; E178-R181 PolarHBondContact OE1-NH2 3.18Å; E178-R181 IonicContact OE2-CZ 3.77Å; E178-R181 VanDerWaalsContact OE2-CZ 3.22Å; E178-R181 IonicContact OE2-NE 3.98Å; E178-R181 IonicContact OE2-NH2 3.74Å; E178-R181 PolarHBondContact OE2-NH2 3.47Å; E178-Q182 PolarHBondContact O-N 3.45Å |
| 179 | E | 91.9 | Very high | 91.9 | Very high | 163 Ų | 163 | 67.8 Ų | 67.8 | 76% | 0.762 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -61.6 | -43.3 | 177.4 | -174.2 | -175.9 | 177.8 | 0 | 0 | 112.1 | T177 R181 Q182 K183 | T177-E179 VanDerWaalsContact C-N 3.28Å; T177-E179 PolarHBondContact O-N 2.84Å; E179-R181 VanDerWaalsContact C-N 3.35Å; E179-R181 PolarHBondContact O-N 3.31Å; E179-Q182 PolarHBondContact O-N 2.85Å; E179-K183 WeakPolarHBondContact O-CB 3.33Å; E179-K183 PolarHBondContact O-N 2.88Å |
| 180 | Q | 89.9 | Confident | 91.7 | Very high | 58 Ų | 58 | 70.9 Ų | 70.9 | 27% | 0.271 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 177.3 | -73.4 | -177.8 | -48.5 | 0 | 0 | 111.8 | E147 F176 T177 E178 A184 | E147-Q180 PolarHBondContact OE1-NE2 3.41Å; F176-Q180 HydrophobicContact CB-CB 4.11Å; T177-Q180 VanDerWaalsContact N-OE1 3.15Å; T177-Q180 PolarHBondContact O-N 2.94Å; T177-Q180 VanDerWaalsContact O-N 3.08Å; T177-Q180 VanDerWaalsContact OG1-CG 3.29Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.36Å; T177-Q180 PolarHBondContact OG1-N 3.27Å; E178-Q180 PolarHBondContact O-N 2.95Å; Q180-A184 VanDerWaalsContact O-CB 3.22Å; Q180-A184 WeakPolarHBondContact O-CB 3.49Å; Q180-A184 PolarHBondContact O-N 3.41Å |
| 181 | R | 93.4 | Very high | 91.5 | Very high | 38 Ų | 38 | 68 Ų | 68 | 14% | 0.143 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.9 | -45.4 | 176.1 | -66.5 | -171.8 | -35.2 | 177 | 9.6 | 111.7 | V167 F176 T177 E178 E179 K183 A184 L185 | V167-R181 HydrophobicContact CG1-CB 3.91Å; V167-R181 HydrophobicContact CG1-CG 4.18Å; F176-R181 HydrophobicContact CB-CG 3.6Å; F176-R181 HydrophobicContact CD2-CG 4.48Å; F176-R181 HydrophobicContact CG-CG 4.48Å; T177-R181 WeakPolarHBondContact O-CG 3.26Å; T177-R181 PolarHBondContact O-N 3.41Å; E178-R181 PolarHBondContact O-N 3.4Å; E178-R181 IonicContact OE1-CZ 3.71Å; E178-R181 IonicContact OE1-NE 3.22Å; E178-R181 IonicContact OE1-NH2 3.04Å; E178-R181 PolarHBondContact OE1-NH2 3.18Å; E178-R181 IonicContact OE2-CZ 3.77Å; E178-R181 VanDerWaalsContact OE2-CZ 3.22Å; E178-R181 IonicContact OE2-NE 3.98Å; E178-R181 IonicContact OE2-NH2 3.74Å; E178-R181 PolarHBondContact OE2-NH2 3.47Å; E179-R181 VanDerWaalsContact C-N 3.35Å; E179-R181 PolarHBondContact O-N 3.31Å; R181-K183 VanDerWaalsContact C-N 3.33Å; R181-K183 PolarHBondContact O-N 2.95Å; R181-A184 PolarHBondContact O-N 3.47Å; R181-A184 VanDerWaalsContact O-N 3.16Å; R181-L185 WeakPolarHBondContact O-CG 3.29Å; R181-L185 PolarHBondContact O-N 3.03Å |
| 182 | Q | 92.6 | Very high | 91.3 | Very high | 96 Ų | 96 | 67 Ų | 67 | 45% | 0.449 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59 | -49.4 | 178.4 | -173.5 | 59.3 | 51.2 | 0 | 0 | 110.1 | E178 E179 A184 L185 D186 | E178-Q182 PolarHBondContact O-N 3.45Å; E179-Q182 PolarHBondContact O-N 2.85Å; Q182-A184 VanDerWaalsContact C-N 3.29Å; Q182-A184 PolarHBondContact O-N 3.33Å; Q182-L185 PolarHBondContact O-N 3.31Å; Q182-L185 VanDerWaalsContact O-N 3.15Å; Q182-D186 PolarHBondContact NE2-OD1 3.3Å; Q182-D186 PolarHBondContact O-N 3.01Å |
| 183 | K | 91.8 | Very high | 91.1 | Very high | 150 Ų | 150 | 71.9 Ų | 71.9 | 65% | 0.652 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -58.7 | -40.6 | 175.8 | -173.6 | 178.5 | -178.5 | -179.5 | 0 | 112.5 | E179 R181 D186 V187 | E179-K183 WeakPolarHBondContact O-CB 3.33Å; E179-K183 PolarHBondContact O-N 2.88Å; R181-K183 VanDerWaalsContact C-N 3.33Å; R181-K183 PolarHBondContact O-N 2.95Å; K183-D186 PolarHBondContact O-N 2.96Å; K183-V187 VanDerWaalsContact O-CG2 3.25Å; K183-V187 WeakPolarHBondContact O-CG2 3.37Å; K183-V187 PolarHBondContact O-N 2.97Å; K183-V187 VanDerWaalsContact O-N 3.12Å |
| 184 | A | 88.9 | Confident | 90.8 | Very high | 15 Ų | 15 | 68 Ų | 68 | 12% | 0.124 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | L150 V167 Q180 R181 Q182 V187 V188 | L150-A184 HydrophobicContact CD2-CB 3.75Å; V167-A184 HydrophobicContact CG1-CB 3.91Å; V167-A184 HydrophobicContact CG2-CB 3.93Å; Q180-A184 VanDerWaalsContact O-CB 3.22Å; Q180-A184 WeakPolarHBondContact O-CB 3.49Å; Q180-A184 PolarHBondContact O-N 3.41Å; R181-A184 PolarHBondContact O-N 3.47Å; R181-A184 VanDerWaalsContact O-N 3.16Å; Q182-A184 VanDerWaalsContact C-N 3.29Å; Q182-A184 PolarHBondContact O-N 3.33Å; A184-V187 PolarHBondContact O-N 2.69Å; A184-V188 VanDerWaalsContact O-CG2 3.28Å; A184-V188 WeakPolarHBondContact O-CG2 3.46Å; A184-V188 PolarHBondContact O-N 2.74Å |
| 185 | L | 92.4 | Very high | 90.2 | Very high | 27 Ų | 27 | 66.6 Ų | 66.6 | 14% | 0.141 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64.9 | -43 | 174.7 | -71.5 | 172 | 0 | 0 | 0 | 111.8 | R164 V167 R181 Q182 V187 V188 E189 | R164-L185 HydrophobicContact CG-CD2 4.19Å; V167-L185 HydrophobicContact CB-CD2 4.1Å; V167-L185 HydrophobicContact CB-CG 4.45Å; V167-L185 HydrophobicContact CG1-CD1 4.5Å; V167-L185 HydrophobicContact CG1-CD2 3.98Å; V167-L185 HydrophobicContact CG1-CG 3.78Å; R181-L185 WeakPolarHBondContact O-CG 3.29Å; R181-L185 PolarHBondContact O-N 3.03Å; Q182-L185 PolarHBondContact O-N 3.31Å; Q182-L185 VanDerWaalsContact O-N 3.15Å; L185-V187 PolarHBondContact O-N 3.09Å; L185-V188 WeakPolarHBondContact O-CB 3.49Å; L185-V188 PolarHBondContact O-N 3.05Å; L185-V188 VanDerWaalsContact O-N 3.09Å; L185-E189 WeakPolarHBondContact O-CB 3.08Å; L185-E189 WeakPolarHBondContact O-CG 3.49Å; L185-E189 PolarHBondContact O-N 3.48Å |
| 186 | D | 91.1 | Very high | 89.5 | Confident | 80 Ų | 80 | 73 Ų | 73 | 43% | 0.428 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -57.7 | -40.5 | 175.8 | -59.5 | -18.1 | 0 | 0 | 0 | 110.8 | Q182 K183 E189 E190 | Q182-D186 PolarHBondContact NE2-OD1 3.3Å; Q182-D186 PolarHBondContact O-N 3.01Å; K183-D186 PolarHBondContact O-N 2.96Å; D186-E189 PolarHBondContact O-N 3.34Å; D186-E190 WeakPolarHBondContact O-CB 3Å; D186-E190 PolarHBondContact O-N 2.96Å |
| 187 | V | 92.1 | Very high | 88.3 | Confident | 57 Ų | 57 | 78.1 Ų | 78.1 | 35% | 0.345 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 176.1 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | L151 L155 K183 A184 L185 E189 K191 | L151-V187 HydrophobicContact CD2-CG1 4.07Å; L155-V187 HydrophobicContact CD1-CG1 3.59Å; K183-V187 VanDerWaalsContact O-CG2 3.25Å; K183-V187 WeakPolarHBondContact O-CG2 3.37Å; K183-V187 PolarHBondContact O-N 2.97Å; K183-V187 VanDerWaalsContact O-N 3.12Å; A184-V187 PolarHBondContact O-N 2.69Å; L185-V187 PolarHBondContact O-N 3.09Å; V187-E189 VanDerWaalsContact C-N 3.35Å; V187-K191 WeakPolarHBondContact O-CB 3.28Å; V187-K191 PolarHBondContact O-N 2.87Å |
| 188 | V | 91.7 | Very high | 86.7 | Confident | 0 Ų | 0 | 81.7 Ų | 81.7 | 0% | 0 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -63.2 | -43 | 176.2 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | L150 L155 A163 R164 A184 L185 K191 S192 | L150-V188 HydrophobicContact CD1-CG2 4.1Å; L155-V188 HydrophobicContact CD2-CB 4.42Å; L155-V188 HydrophobicContact CD2-CG2 3.96Å; A163-V188 HydrophobicContact CB-CG1 4.35Å; A163-V188 HydrophobicContact CB-CG2 4.02Å; R164-V188 HydrophobicContact CB-CG1 4.49Å; A184-V188 VanDerWaalsContact O-CG2 3.28Å; A184-V188 WeakPolarHBondContact O-CG2 3.46Å; A184-V188 PolarHBondContact O-N 2.74Å; L185-V188 WeakPolarHBondContact O-CB 3.49Å; L185-V188 PolarHBondContact O-N 3.05Å; L185-V188 VanDerWaalsContact O-N 3.09Å; V188-K191 PolarHBondContact O-N 3.23Å; V188-S192 PolarHBondContact O-N 3.43Å |
| 189 | E | 90.9 | Very high | 84.8 | Confident | 88 Ų | 88 | 79.8 Ų | 79.8 | 41% | 0.411 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -67.4 | -45.4 | 179.8 | -75.8 | 179.4 | -175.6 | 0 | 0 | 112.1 | R164 L185 D186 V187 K191 S192 R193 | R164-E189 IonicContact CZ-OE1 2.68Å; R164-E189 IonicContact NH1-OE1 3.64Å; R164-E189 PolarHBondContact NH1-OE1 2.92Å; R164-E189 IonicContact NH2-OE1 3.61Å; L185-E189 WeakPolarHBondContact O-CB 3.08Å; L185-E189 WeakPolarHBondContact O-CG 3.49Å; L185-E189 PolarHBondContact O-N 3.48Å; D186-E189 PolarHBondContact O-N 3.34Å; V187-E189 VanDerWaalsContact C-N 3.35Å; E189-K191 VanDerWaalsContact C-N 3.26Å; E189-K191 PolarHBondContact O-N 3.4Å; E189-S192 WeakPolarHBondContact O-CB 3.39Å; E189-S192 PolarHBondContact O-N 2.9Å; E189-S192 VanDerWaalsContact O-N 3.07Å; E189-S192 PolarHBondContact O-OG 2.97Å; E189-R193 PolarHBondContact O-N 2.9Å |
| 190 | E | 90.6 | Very high | 82.6 | Confident | 74 Ų | 74 | 79.5 Ų | 79.5 | 35% | 0.346 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -59.8 | -40.2 | 174.2 | 176.8 | 52.8 | -155.9 | 0 | 0 | 111.2 | D186 S192 R193 Q194 | D186-E190 WeakPolarHBondContact O-CB 3Å; D186-E190 PolarHBondContact O-N 2.96Å; E190-S192 VanDerWaalsContact C-N 3.32Å; E190-S192 PolarHBondContact O-N 2.9Å; E190-R193 PolarHBondContact O-N 3.49Å; E190-R193 IonicContact OE1-CZ 3.73Å; E190-R193 IonicContact OE1-NE 3.52Å; E190-R193 IonicContact OE1-NH2 2.78Å; E190-R193 PolarHBondContact OE1-NH2 2.94Å; E190-R193 IonicContact OE2-CZ 3.77Å; E190-R193 IonicContact OE2-NE 3.11Å; E190-R193 PolarHBondContact OE2-NE 3.26Å; E190-R193 IonicContact OE2-NH2 2.65Å; E190-R193 PolarHBondContact OE2-NH2 3.45Å; E190-R193 VanDerWaalsContact OE2-NH2 3.11Å; E190-Q194 WeakPolarHBondContact O-CG 3.49Å; E190-Q194 PolarHBondContact O-N 3.06Å; E190-Q194 PolarHBondContact OE1-NE2 3.44Å |
| 191 | K | 87.7 | Confident | 80.1 | Confident | 68 Ų | 68 | 83.8 Ų | 83.8 | 30% | 0.296 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.6 | -36 | 175.3 | -168.3 | 63.2 | -177.1 | 163.3 | 0 | 112.5 | L155 L160 V187 V188 E189 N195 | L155-K191 HydrophobicContact CD2-CB 4.26Å; L155-K191 HydrophobicContact CD2-CG 4.29Å; L160-K191 HydrophobicContact CD2-CB 4.21Å; L160-K191 HydrophobicContact CD2-CG 3.96Å; V187-K191 WeakPolarHBondContact O-CB 3.28Å; V187-K191 PolarHBondContact O-N 2.87Å; V188-K191 PolarHBondContact O-N 3.23Å; E189-K191 VanDerWaalsContact C-N 3.26Å; E189-K191 PolarHBondContact O-N 3.4Å; K191-N195 PolarHBondContact O-N 3.37Å; K191-N195 VanDerWaalsContact O-N 3.15Å |
| 192 | S | 87.9 | Confident | 78 | Confident | 26 Ų | 26 | 86.8 Ų | 86.8 | 18% | 0.182 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 175.3 | 79.1 | 0 | 0 | 0 | 0 | 112.6 | L160 V188 E189 E190 N195 Q196 | L160-S192 VanDerWaalsContact CD1-CA 3.5Å; V188-S192 PolarHBondContact O-N 3.43Å; E189-S192 WeakPolarHBondContact O-CB 3.39Å; E189-S192 PolarHBondContact O-N 2.9Å; E189-S192 VanDerWaalsContact O-N 3.07Å; E189-S192 PolarHBondContact O-OG 2.97Å; E190-S192 VanDerWaalsContact C-N 3.32Å; E190-S192 PolarHBondContact O-N 2.9Å; S192-N195 PolarHBondContact O-N 2.93Å; S192-Q196 WeakPolarHBondContact O-CG 3.5Å; S192-Q196 PolarHBondContact O-N 3.13Å; S192-Q196 VanDerWaalsContact O-N 3.07Å |
| 193 | R | 87.9 | Confident | 75.7 | Confident | 104 Ų | 104 | 90.5 Ų | 90.5 | 39% | 0.392 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.5 | -45.2 | 176.8 | -169.4 | -177.3 | 67.4 | 77.5 | 8.8 | 111 | E189 E190 N195 Q196 E197 | E189-R193 PolarHBondContact O-N 2.9Å; E190-R193 PolarHBondContact O-N 3.49Å; E190-R193 IonicContact OE1-CZ 3.73Å; E190-R193 IonicContact OE1-NE 3.52Å; E190-R193 IonicContact OE1-NH2 2.78Å; E190-R193 PolarHBondContact OE1-NH2 2.94Å; E190-R193 IonicContact OE2-CZ 3.77Å; E190-R193 IonicContact OE2-NE 3.11Å; E190-R193 PolarHBondContact OE2-NE 3.26Å; E190-R193 IonicContact OE2-NH2 2.65Å; E190-R193 PolarHBondContact OE2-NH2 3.45Å; E190-R193 VanDerWaalsContact OE2-NH2 3.11Å; R193-N195 VanDerWaalsContact C-N 3.32Å; R193-N195 PolarHBondContact O-N 2.96Å; R193-Q196 PolarHBondContact O-N 2.81Å; R193-Q196 VanDerWaalsContact O-N 3.08Å; R193-E197 IonicContact CZ-OE1 2.79Å; R193-E197 IonicContact CZ-OE2 2.87Å; R193-E197 IonicContact NH1-OE1 2.62Å; R193-E197 PolarHBondContact NH1-OE1 2.91Å; R193-E197 IonicContact NH1-OE2 3.53Å; R193-E197 PolarHBondContact NH1-OE2 3.43Å; R193-E197 WeakPolarHBondContact O-CG 3.39Å; R193-E197 PolarHBondContact O-N 3.26Å |
| 194 | Q | 84.8 | Confident | 72.8 | Confident | 73 Ų | 73 | 91.9 Ų | 91.9 | 34% | 0.341 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -56.6 | -45.5 | 175.3 | -71.7 | 170.7 | 12.4 | 0 | 0 | 112 | E190 Q196 E197 D198 | E190-Q194 WeakPolarHBondContact O-CG 3.49Å; E190-Q194 PolarHBondContact O-N 3.06Å; E190-Q194 PolarHBondContact OE1-NE2 3.44Å; Q194-Q196 VanDerWaalsContact C-N 3.28Å; Q194-Q196 PolarHBondContact O-N 3.45Å; Q194-E197 PolarHBondContact O-N 3.4Å; Q194-D198 PolarHBondContact O-N 3.19Å |
| 195 | N | 80.6 | Confident | 70.7 | Confident | 68 Ų | 68 | 97.9 Ų | 97.9 | 36% | 0.364 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.2 | -26.6 | 178.4 | -68.8 | -2.6 | 0 | 0 | 0 | 113 | K191 S192 R193 | K191-N195 PolarHBondContact O-N 3.37Å; K191-N195 VanDerWaalsContact O-N 3.15Å; S192-N195 PolarHBondContact O-N 2.93Å; R193-N195 VanDerWaalsContact C-N 3.32Å; R193-N195 PolarHBondContact O-N 2.96Å |
| 196 | Q | 76.4 | Confident | 68.1 | Low | 147 Ų | 147 | 102.3 Ų | 102.3 | 69% | 0.687 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -83 | -23.3 | 176.3 | -75 | 177.5 | 16.4 | 0 | 0 | 113.8 | S192 R193 Q194 P199 | S192-Q196 WeakPolarHBondContact O-CG 3.5Å; S192-Q196 PolarHBondContact O-N 3.13Å; S192-Q196 VanDerWaalsContact O-N 3.07Å; R193-Q196 PolarHBondContact O-N 2.81Å; R193-Q196 VanDerWaalsContact O-N 3.08Å; Q194-Q196 VanDerWaalsContact C-N 3.28Å; Q194-Q196 PolarHBondContact O-N 3.45Å; Q196-P199 VanDerWaalsContact C-CD 3.43Å; Q196-P199 WeakPolarHBondContact O-CD 3.21Å; Q196-P199 WeakPolarHBondContact O-CG 3.38Å |
| 197 | E | 67.8 | Low | 65.2 | Low | 124 Ų | 124 | 105.7 Ų | 105.7 | 58% | 0.579 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -83 | -15.9 | 174.2 | -72.6 | 174.5 | 177.6 | 0 | 0 | 112.4 | R193 Q194 | R193-E197 IonicContact CZ-OE1 2.79Å; R193-E197 IonicContact CZ-OE2 2.87Å; R193-E197 IonicContact NH1-OE1 2.62Å; R193-E197 PolarHBondContact NH1-OE1 2.91Å; R193-E197 IonicContact NH1-OE2 3.53Å; R193-E197 PolarHBondContact NH1-OE2 3.43Å; R193-E197 WeakPolarHBondContact O-CG 3.39Å; R193-E197 PolarHBondContact O-N 3.26Å; Q194-E197 PolarHBondContact O-N 3.4Å |
| 198 | D | 57.4 | Low | 62.9 | Low | 141 Ų | 141 | 108.9 Ų | 108.9 | 75% | 0.754 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -86.9 | 22.9 | 176.5 | -84 | -24.5 | 0 | 0 | 0 | 118.2 | Q194 | Q194-D198 PolarHBondContact O-N 3.19Š|
| 199 | P | 53.4 | Low | 59.8 | Low | 79 Ų | 79 | 112.1 Ų | 112.1 | 51% | 0.513 | 61% | 0.606 | S | S | . | * | trans | -119.4 | 110.2 | 166.2 | 35.6 | -22.5 | 0 | 0 | 0 | 113 | Q196 | Q196-P199 VanDerWaalsContact C-CD 3.43Å; Q196-P199 WeakPolarHBondContact O-CD 3.21Å; Q196-P199 WeakPolarHBondContact O-CG 3.38Å | ||
| 200 | I | 45.1 | Very low | 57.1 | Low | 157 Ų | 157 | 113.2 Ų | 113.2 | 81% | 0.805 | 63% | 0.63 | S | S | * | * | trans | 159.9 | 99.9 | 138 | -76.4 | 152.2 | 0 | 0 | 0 | 107.8 | P202 | I200-P202 HydrophobicContact CG2-CG 4.46Š| ||
| 201 | N | 37.9 | Very low | 54 | Low | 148 Ų | 148 | 113.2 Ų | 113.2 | 79% | 0.791 | 65% | 0.65 | S | S | * | * | trans | -144.1 | 82.5 | 140.7 | -151 | 14.9 | 0 | 0 | 0 | 110 | ||||
| 202 | P | 49.4 | Very low | 51.6 | Low | 101 Ų | 101 | 119.6 Ų | 119.6 | 66% | 0.656 | 68% | 0.681 | S | S | * | * | trans | -94.2 | 90.9 | 168.7 | 33.2 | -24.5 | 0 | 0 | 0 | 109.1 | I200 | I200-P202 HydrophobicContact CG2-CG 4.46Š| ||
| 203 | E | 42.9 | Very low | 48.9 | Very low | 173 Ų | 173 | 123.7 Ų | 123.7 | 81% | 0.808 | 71% | 0.71 | S | S | * | * | trans | 151 | 101.7 | 153.2 | -92.4 | -176.2 | 142.7 | 0 | 0 | 108.3 | ||||
| 204 | E | 32.4 | Very low | 46.5 | Very low | 180 Ų | 180 | 124.2 Ų | 124.2 | 84% | 0.841 | 72% | 0.717 | S | S | * | * | trans | -166.6 | 98.6 | 135.8 | -107.9 | 172.9 | -164.4 | 0 | 0 | 107.3 | P206 | E204-P206 VanDerWaalsContact O-CD 3.28Å; E204-P206 WeakPolarHBondContact O-CD 3.48Å | ||
| 205 | T | 45.3 | Very low | 44.5 | Very low | 141 Ų | 141 | 125.7 Ų | 125.7 | 87% | 0.865 | 73% | 0.732 | S | S | * | * | trans | -51 | 130.9 | 160.6 | -34.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 206 | P | 36.7 | Very low | 41.9 | Very low | 120 Ų | 120 | 129.3 Ų | 129.3 | 78% | 0.779 | 75% | 0.752 | S | S | * | * | trans | -111.1 | 111.8 | 160.6 | 8.8 | 13.1 | 0 | 0 | 0 | 109.5 | E204 | E204-P206 VanDerWaalsContact O-CD 3.28Å; E204-P206 WeakPolarHBondContact O-CD 3.48Å | ||
| 207 | D | 29.8 | Very low | 40 | Very low | 151 Ų | 151 | 124.5 Ų | 124.5 | 81% | 0.807 | 73% | 0.734 | S | S | * | * | trans | -55.8 | 147 | 153.6 | -151.2 | 18.6 | 0 | 0 | 0 | 108.8 | G209 | D207-G209 PolarHBondContact O-N 2.87Š| ||
| 208 | P | 43.3 | Very low | 38.9 | Very low | 123 Ų | 123 | 126.2 Ų | 126.2 | 80% | 0.799 | 75% | 0.746 | S | S | * | * | trans | -85.9 | 107.9 | -167.5 | 31.4 | -26.2 | 0 | 0 | 0 | 110.8 | ||||
| 209 | G | 28.6 | Very low | 38.3 | Very low | 69 Ų | 69 | 126.8 Ų | 126.8 | 71% | 0.711 | 74% | 0.744 | S | S | * | * | trans | -160 | 102 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D207 | D207-G209 PolarHBondContact O-N 2.87Š| ||
| 210 | A | 32.5 | Very low | 37.7 | Very low | 111 Ų | 111 | 130.4 Ų | 130.4 | 92% | 0.917 | 75% | 0.747 | S | S | * | * | trans | 34.6 | 115.5 | 149.3 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 211 | G | 25.9 | Very low | 37.9 | Very low | 74 Ų | 74 | 126.6 Ų | 126.6 | 76% | 0.763 | 73% | 0.733 | S | S | * | * | trans | 167.3 | 92.2 | 159.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | S213 | G211-S213 PolarHBondContact O-N 3.26Š| ||
| 212 | Q | 38.1 | Very low | 38.5 | Very low | 202 Ų | 202 | 125.3 Ų | 125.3 | 94% | 0.944 | 73% | 0.725 | S | S | * | * | trans | -61.8 | 118 | 163 | -71.8 | 170.6 | -5.4 | 0 | 0 | 109.8 | ||||
| 213 | S | 31.6 | Very low | 38.6 | Very low | 112 Ų | 112 | 126 Ų | 126 | 78% | 0.783 | 72% | 0.723 | S | S | * | * | trans | -170.7 | 107.4 | 150.9 | 31.8 | 0 | 0 | 0 | 0 | 110.8 | G211 | G211-S213 PolarHBondContact O-N 3.26Š| ||
| 214 | Q | 37.4 | Very low | 39 | Very low | 115 Ų | 115 | 124.3 Ų | 124.3 | 54% | 0.537 | 72% | 0.715 | S | S | . | * | trans | -62.1 | 155.9 | 150.4 | -124.5 | -157 | -38.1 | 0 | 0 | 109.1 | ||||
| 215 | P | 41.2 | Very low | 40.1 | Very low | 104 Ų | 104 | 123 Ų | 123 | 68% | 0.675 | 71% | 0.706 | S | S | * | * | -150.1 | 162.1 | 80.3 | 39.1 | -18.6 | 0 | 0 | 0 | 112.2 | |||||
| 216 | D | 27.6 | Very low | 40.8 | Very low | 144 Ų | 144 | 120.5 Ų | 120.5 | 77% | 0.77 | 69% | 0.691 | S | S | * | * | -158.4 | 121.8 | 69.3 | -88.2 | -39.5 | 0 | 0 | 0 | 111.1 | |||||
| 217 | S | 35.6 | Very low | 42.1 | Very low | 46 Ų | 46 | 120.7 Ų | 120.7 | 32% | 0.322 | 68% | 0.681 | S | S | . | * | trans | -127 | 102.7 | 167.7 | 74.7 | 0 | 0 | 0 | 0 | 108.2 | Q219 R220 | S217-Q219 PolarHBondContact O-N 3.29Å; S217-R220 PolarHBondContact O-N 3Å; S217-R220 WeakPolarHBondContact OG-CB 3.47Å; S217-R220 VanDerWaalsContact OG-CD 3.32Å; S217-R220 WeakPolarHBondContact OG-CD 3.24Å; S217-R220 VanDerWaalsContact OG-CG 3.22Å; S217-R220 WeakPolarHBondContact OG-CG 3.44Å | ||
| 218 | I | 45.1 | Very low | 43.6 | Very low | 160 Ų | 160 | 115.9 Ų | 115.9 | 82% | 0.821 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -9.4 | 176 | -64.2 | 175.5 | 0 | 0 | 0 | 111.7 | ||
| 219 | Q | 44.3 | Very low | 44.8 | Very low | 153 Ų | 153 | 114.5 Ų | 114.5 | 72% | 0.715 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | -18.9 | -177.6 | -131.7 | 171.7 | -2.1 | 0 | 0 | 115.4 | S217 L223 | S217-Q219 PolarHBondContact O-N 3.29Å; Q219-L223 PolarHBondContact O-N 3.47Å |
| 220 | R | 41.3 | Very low | 46.5 | Very low | 154 Ų | 154 | 116.7 Ų | 116.7 | 58% | 0.581 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -71.2 | -37.4 | -179.4 | -86.6 | -176.6 | -167.7 | 163.8 | 11.4 | 115.6 | S217 L222 L223 H224 | S217-R220 PolarHBondContact O-N 3Å; S217-R220 WeakPolarHBondContact OG-CB 3.47Å; S217-R220 VanDerWaalsContact OG-CD 3.32Å; S217-R220 WeakPolarHBondContact OG-CD 3.24Å; S217-R220 VanDerWaalsContact OG-CG 3.22Å; S217-R220 WeakPolarHBondContact OG-CG 3.44Å; R220-L222 VanDerWaalsContact C-N 3.27Å; R220-L222 PolarHBondContact O-N 3.33Å; R220-L223 PolarHBondContact O-N 2.97Å; R220-H224 WeakPolarHBondContact O-CB 3.41Å; R220-H224 PolarHBondContact O-N 2.79Å; R220-H224 VanDerWaalsContact O-N 3.11Å |
| 221 | P | 49.3 | Very low | 48.1 | Very low | 78 Ų | 78 | 119.2 Ų | 119.2 | 51% | 0.506 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -66.2 | -32.2 | -178.4 | -18.5 | 30.2 | 0 | 0 | 0 | 112.5 | K225 | P221-K225 WeakPolarHBondContact O-CB 3Å; P221-K225 VanDerWaalsContact O-CG 3.3Å; P221-K225 WeakPolarHBondContact O-CG 3.2Å; P221-K225 PolarHBondContact O-N 3.13Å |
| 222 | L | 51.3 | Low | 49.8 | Very low | 120 Ų | 120 | 119.7 Ų | 119.7 | 63% | 0.628 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -73.5 | -46.2 | 179.2 | -99.6 | 160 | 0 | 0 | 0 | 111.7 | R220 H224 K225 V226 | R220-L222 VanDerWaalsContact C-N 3.27Å; R220-L222 PolarHBondContact O-N 3.33Å; L222-H224 PolarHBondContact O-N 3.41Å; L222-K225 PolarHBondContact O-N 3.1Å; L222-V226 WeakPolarHBondContact O-CB 3.32Å; L222-V226 VanDerWaalsContact O-CG2 3.23Å; L222-V226 WeakPolarHBondContact O-CG2 3.36Å; L222-V226 PolarHBondContact O-N 3.33Å |
| 223 | L | 51.1 | Low | 50.9 | Low | 116 Ų | 116 | 114.2 Ų | 114.2 | 61% | 0.607 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -64.7 | -41 | 178.6 | -72.4 | 172.9 | 0 | 0 | 0 | 112.1 | Q219 R220 K225 V226 E227 | Q219-L223 PolarHBondContact O-N 3.47Å; R220-L223 PolarHBondContact O-N 2.97Å; L223-K225 PolarHBondContact O-N 3.09Å; L223-V226 PolarHBondContact O-N 2.82Å; L223-E227 WeakPolarHBondContact O-CB 3.19Å; L223-E227 PolarHBondContact O-N 3.3Å |
| 224 | H | 50.8 | Low | 52.1 | Low | 137 Ų | 137 | 114.9 Ų | 114.9 | 63% | 0.634 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -69.5 | -33.3 | 178.3 | -162.7 | -90.3 | 0 | 0 | 0 | 112.5 | R220 L222 A228 | R220-H224 WeakPolarHBondContact O-CB 3.41Å; R220-H224 PolarHBondContact O-N 2.79Å; R220-H224 VanDerWaalsContact O-N 3.11Å; L222-H224 PolarHBondContact O-N 3.41Å; H224-A228 VanDerWaalsContact O-CB 3.31Å; H224-A228 WeakPolarHBondContact O-CB 3.31Å; H224-A228 PolarHBondContact O-N 2.84Å |
| 225 | K | 55.9 | Low | 53.2 | Low | 153 Ų | 153 | 115.8 Ų | 115.8 | 67% | 0.665 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.7 | -42.3 | 171.8 | -82.9 | 177.5 | 175.6 | 178.2 | 0 | 111.9 | P221 L222 L223 A228 V229 | P221-K225 WeakPolarHBondContact O-CB 3Å; P221-K225 VanDerWaalsContact O-CG 3.3Å; P221-K225 WeakPolarHBondContact O-CG 3.2Å; P221-K225 PolarHBondContact O-N 3.13Å; L222-K225 PolarHBondContact O-N 3.1Å; L223-K225 PolarHBondContact O-N 3.09Å; K225-A228 PolarHBondContact O-N 3.38Å; K225-V229 VanDerWaalsContact O-CG2 3.26Å; K225-V229 WeakPolarHBondContact O-CG2 3.1Å; K225-V229 PolarHBondContact O-N 2.8Å |
| 226 | V | 59.3 | Low | 53.8 | Low | 89 Ų | 89 | 118.4 Ų | 118.4 | 54% | 0.539 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.6 | -41.6 | 178.3 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | L222 L223 V229 F230 | L222-V226 WeakPolarHBondContact O-CB 3.32Å; L222-V226 VanDerWaalsContact O-CG2 3.23Å; L222-V226 WeakPolarHBondContact O-CG2 3.36Å; L222-V226 PolarHBondContact O-N 3.33Å; L223-V226 PolarHBondContact O-N 2.82Å; V226-V229 PolarHBondContact O-N 3.46Å; V226-F230 WeakPolarHBondContact O-CB 3.43Å; V226-F230 PolarHBondContact O-N 2.87Å |
| 227 | E | 63.8 | Low | 55 | Low | 123 Ų | 123 | 113.8 Ų | 113.8 | 58% | 0.575 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.1 | -41.6 | 175.9 | -170.9 | -179.6 | 169.4 | 0 | 0 | 112 | L223 V229 F230 R231 | L223-E227 WeakPolarHBondContact O-CB 3.19Å; L223-E227 PolarHBondContact O-N 3.3Å; E227-V229 VanDerWaalsContact C-N 3.35Å; E227-V229 PolarHBondContact O-N 3.4Å; E227-F230 PolarHBondContact O-N 2.93Å; E227-R231 VanDerWaalsContact O-CB 3.26Å; E227-R231 WeakPolarHBondContact O-CB 3.37Å; E227-R231 PolarHBondContact O-N 3.31Å |
| 228 | A | 62.6 | Low | 55.9 | Low | 50 Ų | 50 | 118.2 Ų | 118.2 | 41% | 0.413 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.6 | -39.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | H224 K225 T232 | H224-A228 VanDerWaalsContact O-CB 3.31Å; H224-A228 WeakPolarHBondContact O-CB 3.31Å; H224-A228 PolarHBondContact O-N 2.84Å; K225-A228 PolarHBondContact O-N 3.38Å; A228-T232 PolarHBondContact O-N 2.75Å; A228-T232 PolarHBondContact O-OG1 3.14Å |
| 229 | V | 66.6 | Low | 56 | Low | 95 Ų | 95 | 120.5 Ų | 120.5 | 58% | 0.576 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.6 | -44 | 174.4 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | K225 V226 E227 R231 T232 F233 | K225-V229 VanDerWaalsContact O-CG2 3.26Å; K225-V229 WeakPolarHBondContact O-CG2 3.1Å; K225-V229 PolarHBondContact O-N 2.8Å; V226-V229 PolarHBondContact O-N 3.46Å; E227-V229 VanDerWaalsContact C-N 3.35Å; E227-V229 PolarHBondContact O-N 3.4Å; V229-R231 PolarHBondContact O-N 3.11Å; V229-T232 WeakPolarHBondContact CA-OG1 3.32Å; V229-T232 PolarHBondContact O-N 3.02Å; V229-T232 PolarHBondContact O-OG1 3.27Å; V229-F233 WeakPolarHBondContact O-CB 3.18Å; V229-F233 PolarHBondContact O-N 3.46Å |
| 230 | F | 64.6 | Low | 56.1 | Low | 114 Ų | 114 | 117.8 Ų | 117.8 | 50% | 0.5 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.1 | -42 | 178.1 | -161 | -98.5 | 0 | 0 | 0 | 111.9 | V226 E227 F233 Y234 | V226-F230 WeakPolarHBondContact O-CB 3.43Å; V226-F230 PolarHBondContact O-N 2.87Å; E227-F230 PolarHBondContact O-N 2.93Å; F230-F233 PolarHBondContact O-N 3.22Å; F230-Y234 AromaticContact CD1-CD2 3.82Å; F230-Y234 HydrophobicContact CD1-CD2 3.82Å; F230-Y234 HydrophobicContact CD1-CE2 4.15Å; F230-Y234 AromaticContact CE1-CD2 3.42Å; F230-Y234 HydrophobicContact CE1-CD2 3.42Å; F230-Y234 VanDerWaalsContact CE1-CD2 3.42Å; F230-Y234 AromaticContact CE1-CE2 3.28Å; F230-Y234 HydrophobicContact CE1-CE2 3.28Å; F230-Y234 HydrophobicContact CE2-CE2 4.5Å; F230-Y234 AromaticContact CZ-CD2 3.92Å; F230-Y234 HydrophobicContact CZ-CD2 3.92Å; F230-Y234 AromaticContact CZ-CE2 3.5Å; F230-Y234 HydrophobicContact CZ-CE2 3.5Å; F230-Y234 WeakPolarHBondContact O-CB 3.13Å; F230-Y234 PolarHBondContact O-N 3.44Å |
| 231 | R | 66.9 | Low | 56.4 | Low | 165 Ų | 165 | 113.8 Ų | 113.8 | 62% | 0.623 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -68.6 | -35.7 | 179 | -166.2 | 174.7 | -174.7 | -173.4 | 1.5 | 112.7 | E227 V229 R235 | E227-R231 VanDerWaalsContact O-CB 3.26Å; E227-R231 WeakPolarHBondContact O-CB 3.37Å; E227-R231 PolarHBondContact O-N 3.31Å; V229-R231 PolarHBondContact O-N 3.11Å; R231-R235 WeakPolarHBondContact O-CB 3.15Å; R231-R235 PolarHBondContact O-N 3.11Å |
| 232 | T | 60.5 | Low | 56.6 | Low | 83 Ų | 83 | 115.3 Ų | 115.3 | 51% | 0.509 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -71.7 | -36.1 | 173.5 | 37.8 | 0 | 0 | 0 | 0 | 111.8 | A228 V229 R235 K236 | A228-T232 PolarHBondContact O-N 2.75Å; A228-T232 PolarHBondContact O-OG1 3.14Å; V229-T232 WeakPolarHBondContact CA-OG1 3.32Å; V229-T232 PolarHBondContact O-N 3.02Å; V229-T232 PolarHBondContact O-OG1 3.27Å; T232-R235 PolarHBondContact O-N 3.22Å; T232-K236 PolarHBondContact O-N 2.92Å; T232-K236 VanDerWaalsContact O-N 3.11Å |
| 233 | F | 61.8 | Low | 56.9 | Low | 88 Ų | 88 | 116.5 Ų | 116.5 | 39% | 0.386 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -68.6 | -43.6 | 176 | -150.5 | -92.5 | 0 | 0 | 0 | 112.2 | V229 F230 R235 K236 C237 L251 | V229-F233 WeakPolarHBondContact O-CB 3.18Å; V229-F233 PolarHBondContact O-N 3.46Å; F230-F233 PolarHBondContact O-N 3.22Å; F233-R235 VanDerWaalsContact C-N 3.32Å; F233-R235 PolarHBondContact O-N 3.39Å; F233-K236 PolarHBondContact O-N 2.83Å; F233-C237 PolarHBondContact O-N 2.95Å; F233-L251 HydrophobicContact CD1-CD2 4.23Å; F233-L251 HydrophobicContact CE1-CD2 3.44Å; F233-L251 VanDerWaalsContact CE1-CD2 3.44Å; F233-L251 HydrophobicContact CE2-CD2 3.8Å; F233-L251 HydrophobicContact CZ-CD2 3.19Å |
| 234 | Y | 57 | Low | 57.1 | Low | 125 Ų | 125 | 113.7 Ų | 113.7 | 49% | 0.49 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -59.5 | -41.4 | 173.9 | -113.9 | -94.2 | 0 | 0 | 0 | 112.2 | F230 K236 C237 L238 | F230-Y234 AromaticContact CD1-CD2 3.82Å; F230-Y234 HydrophobicContact CD1-CD2 3.82Å; F230-Y234 HydrophobicContact CD1-CE2 4.15Å; F230-Y234 AromaticContact CE1-CD2 3.42Å; F230-Y234 HydrophobicContact CE1-CD2 3.42Å; F230-Y234 VanDerWaalsContact CE1-CD2 3.42Å; F230-Y234 AromaticContact CE1-CE2 3.28Å; F230-Y234 HydrophobicContact CE1-CE2 3.28Å; F230-Y234 HydrophobicContact CE2-CE2 4.5Å; F230-Y234 AromaticContact CZ-CD2 3.92Å; F230-Y234 HydrophobicContact CZ-CD2 3.92Å; F230-Y234 AromaticContact CZ-CE2 3.5Å; F230-Y234 HydrophobicContact CZ-CE2 3.5Å; F230-Y234 WeakPolarHBondContact O-CB 3.13Å; F230-Y234 PolarHBondContact O-N 3.44Å; Y234-K236 VanDerWaalsContact C-N 3.33Å; Y234-K236 PolarHBondContact O-N 3.36Å; Y234-C237 PolarHBondContact O-N 2.93Å; Y234-L238 HydrophobicContact CD1-CD1 3.91Å; Y234-L238 HydrophobicContact CE1-CD1 4.48Å; Y234-L238 VanDerWaalsContact O-CD1 3.31Å; Y234-L238 WeakPolarHBondContact O-CD1 3.23Å; Y234-L238 PolarHBondContact O-N 3.34Å |
| 235 | R | 60.6 | Low | 57.8 | Low | 134 Ų | 134 | 110.1 Ų | 110.1 | 51% | 0.506 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -68.2 | -30.8 | 179 | -157.8 | -178.5 | -59.4 | 177.2 | 1.4 | 112.8 | R231 T232 F233 | R231-R235 WeakPolarHBondContact O-CB 3.15Å; R231-R235 PolarHBondContact O-N 3.11Å; T232-R235 PolarHBondContact O-N 3.22Å; F233-R235 VanDerWaalsContact C-N 3.32Å; F233-R235 PolarHBondContact O-N 3.39Å |
| 236 | K | 54.3 | Low | 58.4 | Low | 160 Ų | 160 | 108 Ų | 108 | 70% | 0.696 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -73.7 | -40 | 171 | -95.8 | 179.9 | 173.6 | 178.4 | 0 | 112 | T232 F233 Y234 R239 T240 | T232-K236 PolarHBondContact O-N 2.92Å; T232-K236 VanDerWaalsContact O-N 3.11Å; F233-K236 PolarHBondContact O-N 2.83Å; Y234-K236 VanDerWaalsContact C-N 3.33Å; Y234-K236 PolarHBondContact O-N 3.36Å; K236-R239 PolarHBondContact O-N 3.39Å; K236-T240 PolarHBondContact O-N 3.14Å; K236-T240 PolarHBondContact O-OG1 2.71Å |
| 237 | C | 53 | Low | 58.7 | Low | 46 Ų | 46 | 109.8 Ų | 109.8 | 31% | 0.311 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.5 | -37.5 | 176.6 | -76.7 | 0 | 0 | 0 | 0 | 113.4 | F233 Y234 Q248 | F233-C237 PolarHBondContact O-N 2.95Å; Y234-C237 PolarHBondContact O-N 2.93Å; C237-Q248 PolarHBondContact SG-NE2 3.49Å |
| 238 | L | 53.6 | Low | 58.6 | Low | 139 Ų | 139 | 106.9 Ų | 106.9 | 73% | 0.728 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -75.3 | -19.8 | 178.9 | -95.1 | 84.8 | 0 | 0 | 0 | 114.1 | Y234 | Y234-L238 HydrophobicContact CD1-CD1 3.91Å; Y234-L238 HydrophobicContact CE1-CD1 4.48Å; Y234-L238 VanDerWaalsContact O-CD1 3.31Å; Y234-L238 WeakPolarHBondContact O-CD1 3.23Å; Y234-L238 PolarHBondContact O-N 3.34Å |
| 239 | R | 48.2 | Very low | 59.1 | Low | 208 Ų | 208 | 110.9 Ų | 110.9 | 79% | 0.785 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -91.2 | -15.7 | -179.2 | -77.5 | -177.2 | 173.8 | 174.3 | -3 | 113.9 | K236 G241 | K236-R239 PolarHBondContact O-N 3.39Å; R239-G241 PolarHBondContact O-N 2.89Å |
| 240 | T | 46.2 | Very low | 59.6 | Low | 96 Ų | 96 | 112.5 Ų | 112.5 | 59% | 0.589 | 58% | 0.578 | S | S | * | * | trans | -100.9 | 84.2 | 179.5 | -46.9 | 0 | 0 | 0 | 0 | 109.2 | K236 S242 | K236-T240 PolarHBondContact O-N 3.14Å; K236-T240 PolarHBondContact O-OG1 2.71Å; T240-S242 PolarHBondContact O-N 3.32Å | ||
| 241 | G | 48 | Very low | 60.2 | Low | 70 Ų | 70 | 110.1 Ų | 110.1 | 72% | 0.722 | 57% | 0.57 | S | S | * | * | trans | -60.2 | 121.1 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | R239 | R239-G241 PolarHBondContact O-N 2.89Š| ||
| 242 | S | 53.5 | Low | 60.6 | Low | 111 Ų | 111 | 107.2 Ų | 107.2 | 78% | 0.776 | 57% | 0.567 | S | S | * | * | S | Bend | trans | 60.1 | 71.1 | 158.9 | -162.7 | 0 | 0 | 0 | 0 | 116.9 | T240 | T240-S242 PolarHBondContact O-N 3.32Š|
| 243 | N | 55.9 | Low | 61.3 | Low | 145 Ų | 145 | 105.8 Ų | 105.8 | 78% | 0.775 | 56% | 0.563 | S | S | * | * | trans | 174.1 | 81.6 | 136.4 | -89 | -10.5 | 0 | 0 | 0 | 109.3 | S245 | N243-S245 PolarHBondContact O-N 2.86Š| ||
| 244 | S | 57.1 | Low | 62 | Low | 56 Ų | 56 | 104 Ų | 104 | 39% | 0.392 | 57% | 0.565 | S | S | . | * | trans | -64.7 | 122.2 | -179.8 | 62.4 | 0 | 0 | 0 | 0 | 110.8 | K249 | S244-K249 WeakPolarHBondContact OG-CE 3.31Š| ||
| 245 | S | 64.6 | Low | 62.9 | Low | 62 Ų | 62 | 101.4 Ų | 101.4 | 43% | 0.434 | 56% | 0.558 | S | S | . | * | trans | -65.3 | 154.8 | 177.3 | 64.1 | 0 | 0 | 0 | 0 | 111.5 | N243 L247 Q248 K249 | N243-S245 PolarHBondContact O-N 2.86Å; S245-L247 PolarHBondContact O-N 3.28Å; S245-L247 VanDerWaalsContact O-N 3.11Å; S245-Q248 WeakPolarHBondContact O-CB 3.45Å; S245-Q248 PolarHBondContact O-N 2.87Å; S245-K249 PolarHBondContact O-N 2.82Å | ||
| 246 | P | 67.9 | Low | 63.4 | Low | 110 Ų | 110 | 98.7 Ų | 98.7 | 71% | 0.714 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -57.7 | -28.2 | -179.4 | 22.4 | -33.9 | 0 | 0 | 0 | 112.8 | K249 L250 | P246-K249 PolarHBondContact O-N 3.42Å; P246-L250 WeakPolarHBondContact O-CB 3.43Å; P246-L250 PolarHBondContact O-N 3.21Å |
| 247 | L | 65.3 | Low | 64.2 | Low | 126 Ų | 126 | 95.8 Ų | 95.8 | 66% | 0.66 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.1 | -33.8 | 177 | -158.3 | 138.9 | 0 | 0 | 0 | 112.4 | S245 L251 | S245-L247 PolarHBondContact O-N 3.28Å; S245-L247 VanDerWaalsContact O-N 3.11Å; L247-L251 VanDerWaalsContact O-CB 3.31Å; L247-L251 WeakPolarHBondContact O-CB 3.38Å; L247-L251 PolarHBondContact O-N 3.32Å |
| 248 | Q | 63.2 | Low | 65.2 | Low | 62 Ų | 62 | 99.6 Ų | 99.6 | 29% | 0.29 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -70.3 | -37.7 | 174 | -170.6 | -178 | -0.6 | 0 | 0 | 111.5 | C237 S245 L252 | C237-Q248 PolarHBondContact SG-NE2 3.49Å; S245-Q248 WeakPolarHBondContact O-CB 3.45Å; S245-Q248 PolarHBondContact O-N 2.87Å; Q248-L252 VanDerWaalsContact O-CB 3.29Å; Q248-L252 WeakPolarHBondContact O-CB 3.48Å; Q248-L252 PolarHBondContact O-N 2.88Å |
| 249 | K | 71.9 | Confident | 65.5 | Low | 134 Ų | 134 | 95.8 Ų | 95.8 | 58% | 0.583 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -68 | -40.7 | 174.2 | -65.4 | -177.5 | -178 | 176.8 | 0 | 111.6 | S244 S245 P246 L252 A253 | S244-K249 WeakPolarHBondContact OG-CE 3.31Å; S245-K249 PolarHBondContact O-N 2.82Å; P246-K249 PolarHBondContact O-N 3.42Å; K249-L252 PolarHBondContact O-N 2.83Å; K249-A253 VanDerWaalsContact O-CB 3.28Å; K249-A253 WeakPolarHBondContact O-CB 3.31Å; K249-A253 PolarHBondContact O-N 3.32Å |
| 250 | L | 78.2 | Confident | 66.3 | Low | 128 Ų | 128 | 90.8 Ų | 90.8 | 67% | 0.67 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.9 | -43.5 | 175.9 | -168.4 | 77 | 0 | 0 | 0 | 111.3 | P246 A253 A254 | P246-L250 WeakPolarHBondContact O-CB 3.43Å; P246-L250 PolarHBondContact O-N 3.21Å; L250-A253 PolarHBondContact O-N 2.86Å; L250-A254 WeakPolarHBondContact O-CB 3.29Å; L250-A254 PolarHBondContact O-N 2.77Å |
| 251 | L | 77.3 | Confident | 66.9 | Low | 65 Ų | 65 | 91.9 Ų | 91.9 | 34% | 0.34 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.5 | -42.2 | 176 | -172.6 | 73.8 | 0 | 0 | 0 | 111.5 | F233 L247 A253 A254 I255 | F233-L251 HydrophobicContact CD1-CD2 4.23Å; F233-L251 HydrophobicContact CE1-CD2 3.44Å; F233-L251 VanDerWaalsContact CE1-CD2 3.44Å; F233-L251 HydrophobicContact CE2-CD2 3.8Å; F233-L251 HydrophobicContact CZ-CD2 3.19Å; L247-L251 VanDerWaalsContact O-CB 3.31Å; L247-L251 WeakPolarHBondContact O-CB 3.38Å; L247-L251 PolarHBondContact O-N 3.32Å; L251-A253 VanDerWaalsContact C-N 3.35Å; L251-A254 PolarHBondContact O-N 2.89Å; L251-I255 HydrophobicContact CD2-CD1 4.42Å; L251-I255 HydrophobicContact CG-CD1 3.99Å; L251-I255 WeakPolarHBondContact O-CB 3.49Å; L251-I255 VanDerWaalsContact O-CG1 3.23Å; L251-I255 WeakPolarHBondContact O-CG1 3.49Å; L251-I255 PolarHBondContact O-N 2.78Å |
| 252 | L | 74.5 | Confident | 67.1 | Low | 104 Ų | 104 | 95.5 Ų | 95.5 | 55% | 0.545 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 174.7 | -173 | 70.4 | 0 | 0 | 0 | 111.1 | Q248 K249 A254 I255 L256 | Q248-L252 VanDerWaalsContact O-CB 3.29Å; Q248-L252 WeakPolarHBondContact O-CB 3.48Å; Q248-L252 PolarHBondContact O-N 2.88Å; K249-L252 PolarHBondContact O-N 2.83Å; L252-A254 VanDerWaalsContact C-N 3.35Å; L252-I255 PolarHBondContact O-N 3.38Å; L252-L256 HydrophobicContact CG-CD1 4.25Å; L252-L256 WeakPolarHBondContact O-CB 3.35Å; L252-L256 VanDerWaalsContact O-CG 3.26Å; L252-L256 WeakPolarHBondContact O-CG 3.47Å; L252-L256 PolarHBondContact O-N 3.43Å |
| 253 | A | 76.2 | Confident | 66.9 | Low | 53 Ų | 53 | 96.5 Ų | 96.5 | 44% | 0.438 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -40.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | K249 L250 L251 L256 L257 | K249-A253 VanDerWaalsContact O-CB 3.28Å; K249-A253 WeakPolarHBondContact O-CB 3.31Å; K249-A253 PolarHBondContact O-N 3.32Å; L250-A253 PolarHBondContact O-N 2.86Å; L251-A253 VanDerWaalsContact C-N 3.35Å; A253-L256 PolarHBondContact O-N 2.92Å; A253-L257 WeakPolarHBondContact O-CB 3.35Å; A253-L257 PolarHBondContact O-N 3.29Å |
| 254 | A | 76 | Confident | 66.4 | Low | 51 Ų | 51 | 94.9 Ų | 94.9 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L250 L251 L252 Y258 | L250-A254 WeakPolarHBondContact O-CB 3.29Å; L250-A254 PolarHBondContact O-N 2.77Å; L251-A254 PolarHBondContact O-N 2.89Å; L252-A254 VanDerWaalsContact C-N 3.35Å; A254-Y258 WeakPolarHBondContact O-CB 3.4Å; A254-Y258 PolarHBondContact O-N 2.8Å |
| 255 | I | 75.1 | Confident | 65.7 | Low | 69 Ų | 69 | 97.9 Ų | 97.9 | 35% | 0.354 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.4 | -43.8 | 173.5 | -70 | 165.6 | 0 | 0 | 0 | 110.1 | L251 L252 Y258 M259 | L251-I255 HydrophobicContact CD2-CD1 4.42Å; L251-I255 HydrophobicContact CG-CD1 3.99Å; L251-I255 WeakPolarHBondContact O-CB 3.49Å; L251-I255 VanDerWaalsContact O-CG1 3.23Å; L251-I255 WeakPolarHBondContact O-CG1 3.49Å; L251-I255 PolarHBondContact O-N 2.78Å; L252-I255 PolarHBondContact O-N 3.38Å; I255-Y258 PolarHBondContact O-N 2.81Å; I255-M259 HydrophobicContact CG2-CG 4.46Å; I255-M259 WeakPolarHBondContact O-CB 3.26Å; I255-M259 WeakPolarHBondContact O-CG 3.44Å; I255-M259 PolarHBondContact O-N 2.9Å |
| 256 | L | 70.7 | Confident | 64.5 | Low | 77 Ų | 77 | 100.7 Ų | 100.7 | 40% | 0.403 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.5 | -42.5 | 176.3 | -72.6 | 172.5 | 0 | 0 | 0 | 111.6 | L252 A253 M259 L260 L278 | L252-L256 HydrophobicContact CG-CD1 4.25Å; L252-L256 WeakPolarHBondContact O-CB 3.35Å; L252-L256 VanDerWaalsContact O-CG 3.26Å; L252-L256 WeakPolarHBondContact O-CG 3.47Å; L252-L256 PolarHBondContact O-N 3.43Å; A253-L256 PolarHBondContact O-N 2.92Å; L256-M259 CarbonylContact O-C 3.51Å; L256-M259 PolarHBondContact O-N 3.34Å; L256-L260 WeakPolarHBondContact O-CB 3.45Å; L256-L260 PolarHBondContact O-N 3.4Å; L256-L278 HydrophobicContact CD2-CD2 3.6Å |
| 257 | L | 72.4 | Confident | 63.3 | Low | 99 Ų | 99 | 98.8 Ų | 98.8 | 52% | 0.518 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.5 | -41.4 | 175.4 | -171.3 | 78.7 | 0 | 0 | 0 | 111.2 | A253 M259 L260 L261 | A253-L257 WeakPolarHBondContact O-CB 3.35Å; A253-L257 PolarHBondContact O-N 3.29Å; L257-M259 VanDerWaalsContact C-N 3.35Å; L257-L260 CarbonylContact O-C 3.58Å; L257-L260 WeakPolarHBondContact O-CA 3.26Å; L257-L260 WeakPolarHBondContact O-CB 3.4Å; L257-L260 PolarHBondContact O-N 3.27Å; L257-L260 VanDerWaalsContact O-N 3.1Å; L257-L261 HydrophobicContact CD1-CD1 4.29Å; L257-L261 HydrophobicContact CD2-CD1 4.13Å; L257-L261 HydrophobicContact CG-CD1 3.78Å; L257-L261 HydrophobicContact CG-CG 4.28Å; L257-L261 WeakPolarHBondContact O-CB 3.42Å; L257-L261 VanDerWaalsContact O-CG 3.28Å; L257-L261 WeakPolarHBondContact O-CG 3.42Å; L257-L261 PolarHBondContact O-N 3.04Å |
| 258 | Y | 73.9 | Confident | 62.2 | Low | 126 Ų | 126 | 99.8 Ų | 99.8 | 49% | 0.494 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.9 | -45 | 173.2 | 170.7 | -98.7 | 0 | 0 | 0 | 110.9 | A254 I255 L260 L261 F262 | A254-Y258 WeakPolarHBondContact O-CB 3.4Å; A254-Y258 PolarHBondContact O-N 2.8Å; I255-Y258 PolarHBondContact O-N 2.81Å; Y258-L260 VanDerWaalsContact C-N 3.28Å; Y258-L260 PolarHBondContact O-N 3.47Å; Y258-L261 PolarHBondContact O-N 3.39Å; Y258-F262 HydrophobicContact CD2-CB 4.24Å; Y258-F262 AromaticContact CD2-CD2 3.54Å; Y258-F262 HydrophobicContact CD2-CD2 3.54Å; Y258-F262 HydrophobicContact CD2-CE2 4.16Å; Y258-F262 HydrophobicContact CD2-CG 4.07Å; Y258-F262 HydrophobicContact CE2-CB 3.92Å; Y258-F262 HydrophobicContact CE2-CD1 4.32Å; Y258-F262 AromaticContact CE2-CD2 3.53Å; Y258-F262 HydrophobicContact CE2-CD2 3.53Å; Y258-F262 HydrophobicContact CE2-CE2 4.09Å; Y258-F262 AromaticContact CE2-CG 3.66Å; Y258-F262 HydrophobicContact CE2-CG 3.66Å; Y258-F262 WeakPolarHBondContact O-CB 3.48Å; Y258-F262 PolarHBondContact O-N 2.96Å |
| 259 | M | 60.2 | Low | 61.5 | Low | 59 Ų | 59 | 100.2 Ų | 100.2 | 29% | 0.291 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.4 | -37 | 172.7 | -66.7 | -68 | -71.1 | 0 | 0 | 111 | I255 L256 L257 R263 | I255-M259 HydrophobicContact CG2-CG 4.46Å; I255-M259 WeakPolarHBondContact O-CB 3.26Å; I255-M259 WeakPolarHBondContact O-CG 3.44Å; I255-M259 PolarHBondContact O-N 2.9Å; L256-M259 CarbonylContact O-C 3.51Å; L256-M259 PolarHBondContact O-N 3.34Å; L257-M259 VanDerWaalsContact C-N 3.35Å; M259-R263 HydrophobicContact CE-CG 3.96Å; M259-R263 WeakPolarHBondContact O-CA 3.28Å; M259-R263 WeakPolarHBondContact O-CB 3.26Å; M259-R263 PolarHBondContact O-N 3.19Å; M259-R263 VanDerWaalsContact O-N 3.09Å; M259-R263 HydrophobicContact SD-CG 3.85Å |
| 260 | L | 63.7 | Low | 60.3 | Low | 103 Ų | 103 | 98.1 Ų | 98.1 | 54% | 0.539 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -71 | -31.1 | 177.5 | -144.3 | 95.1 | 0 | 0 | 0 | 113.4 | L256 L257 Y258 L264 | L256-L260 WeakPolarHBondContact O-CB 3.45Å; L256-L260 PolarHBondContact O-N 3.4Å; L257-L260 CarbonylContact O-C 3.58Å; L257-L260 WeakPolarHBondContact O-CA 3.26Å; L257-L260 WeakPolarHBondContact O-CB 3.4Å; L257-L260 PolarHBondContact O-N 3.27Å; L257-L260 VanDerWaalsContact O-N 3.1Å; Y258-L260 VanDerWaalsContact C-N 3.28Å; Y258-L260 PolarHBondContact O-N 3.47Å; L260-L264 HydrophobicContact CG-CD1 4.17Å; L260-L264 VanDerWaalsContact O-CB 3.32Å; L260-L264 WeakPolarHBondContact O-CB 3.39Å; L260-L264 WeakPolarHBondContact O-CD1 3.19Å |
| 261 | L | 60 | Low | 58.7 | Low | 119 Ų | 119 | 92.7 Ų | 92.7 | 62% | 0.623 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -95.4 | -36.3 | -175.2 | -67.7 | 175.1 | 0 | 0 | 0 | 112.6 | L257 Y258 | L257-L261 HydrophobicContact CD1-CD1 4.29Å; L257-L261 HydrophobicContact CD2-CD1 4.13Å; L257-L261 HydrophobicContact CG-CD1 3.78Å; L257-L261 HydrophobicContact CG-CG 4.28Å; L257-L261 WeakPolarHBondContact O-CB 3.42Å; L257-L261 VanDerWaalsContact O-CG 3.28Å; L257-L261 WeakPolarHBondContact O-CG 3.42Å; L257-L261 PolarHBondContact O-N 3.04Å; Y258-L261 PolarHBondContact O-N 3.39Å |
| 262 | F | 51.8 | Low | 57.6 | Low | 146 Ų | 146 | 95.4 Ų | 95.4 | 64% | 0.64 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -100.3 | -18.2 | -177 | -86.5 | -92.3 | 0 | 0 | 0 | 114.4 | Y258 | Y258-F262 HydrophobicContact CD2-CB 4.24Å; Y258-F262 AromaticContact CD2-CD2 3.54Å; Y258-F262 HydrophobicContact CD2-CD2 3.54Å; Y258-F262 HydrophobicContact CD2-CE2 4.16Å; Y258-F262 HydrophobicContact CD2-CG 4.07Å; Y258-F262 HydrophobicContact CE2-CB 3.92Å; Y258-F262 HydrophobicContact CE2-CD1 4.32Å; Y258-F262 AromaticContact CE2-CD2 3.53Å; Y258-F262 HydrophobicContact CE2-CD2 3.53Å; Y258-F262 HydrophobicContact CE2-CE2 4.09Å; Y258-F262 AromaticContact CE2-CG 3.66Å; Y258-F262 HydrophobicContact CE2-CG 3.66Å; Y258-F262 WeakPolarHBondContact O-CB 3.48Å; Y258-F262 PolarHBondContact O-N 2.96Å |
| 263 | R | 50.1 | Low | 56.5 | Low | 133 Ų | 133 | 92.7 Ų | 92.7 | 50% | 0.502 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -107.5 | 3.5 | 176.5 | -59.9 | -84 | -145.7 | -136.2 | 1 | 113.8 | M259 D265 | M259-R263 HydrophobicContact CE-CG 3.96Å; M259-R263 WeakPolarHBondContact O-CA 3.28Å; M259-R263 WeakPolarHBondContact O-CB 3.26Å; M259-R263 PolarHBondContact O-N 3.19Å; M259-R263 VanDerWaalsContact O-N 3.09Å; M259-R263 HydrophobicContact SD-CG 3.85Å; R263-D265 VanDerWaalsContact C-N 3.3Å |
| 264 | L | 44.6 | Very low | 55.3 | Low | 111 Ų | 111 | 99 Ų | 99 | 58% | 0.581 | 51% | 0.508 | S | S | * | . | trans | -86.3 | -1 | 166 | -101.2 | 79 | 0 | 0 | 0 | 112.9 | L260 S266 | L260-L264 HydrophobicContact CG-CD1 4.17Å; L260-L264 VanDerWaalsContact O-CB 3.32Å; L260-L264 WeakPolarHBondContact O-CB 3.39Å; L260-L264 WeakPolarHBondContact O-CD1 3.19Å; L264-S266 PolarHBondContact O-N 3.05Å | ||
| 265 | D | 41.5 | Very low | 54.4 | Low | 118 Ų | 118 | 99.4 Ų | 99.4 | 63% | 0.631 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -67.6 | 126.7 | 168.8 | -161.7 | -1.9 | 0 | 0 | 0 | 109.4 | R263 A267 | R263-D265 VanDerWaalsContact C-N 3.3Å; D265-A267 PolarHBondContact O-N 2.76Å |
| 266 | S | 39.3 | Very low | 53.7 | Low | 122 Ų | 122 | 97.5 Ų | 97.5 | 85% | 0.853 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | 11.5 | -157.7 | 76.8 | 0 | 0 | 0 | 0 | 116 | L264 | L264-S266 PolarHBondContact O-N 3.05Š|
| 267 | A | 43.5 | Very low | 53.2 | Low | 69 Ų | 69 | 99.2 Ų | 99.2 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.9 | -2.8 | -171.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | D265 | D265-A267 PolarHBondContact O-N 2.76Š|
| 268 | F | 42.9 | Very low | 52.6 | Low | 148 Ų | 148 | 97.9 Ų | 97.9 | 65% | 0.649 | 49% | 0.491 | S | S | * | . | trans | -136 | 108.2 | -178.2 | -75.2 | -82.8 | 0 | 0 | 0 | 114.5 | S270 S271 | F268-S270 VanDerWaalsContact C-N 3.35Å; F268-S270 PolarHBondContact O-N 3.46Å; F268-S271 PolarHBondContact O-OG 3.44Å | ||
| 269 | P | 48.1 | Very low | 52.2 | Low | 70 Ų | 70 | 96.6 Ų | 96.6 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | G | 310 helix | trans | -75.9 | -11.2 | -178.5 | 26.8 | -32 | 0 | 0 | 0 | 115.2 | S271 | P269-S271 PolarHBondContact O-N 3.23Š|
| 270 | S | 45.8 | Very low | 52.5 | Low | 91 Ų | 91 | 97.1 Ų | 97.1 | 64% | 0.636 | 49% | 0.494 | S | S | * | . | G | 310 helix | trans | -77.3 | -18.3 | -173.8 | 70.6 | 0 | 0 | 0 | 0 | 115.1 | F268 | F268-S270 VanDerWaalsContact C-N 3.35Å; F268-S270 PolarHBondContact O-N 3.46Å |
| 271 | S | 45.9 | Very low | 52.7 | Low | 13 Ų | 13 | 97 Ų | 97 | 9% | 0.091 | 49% | 0.493 | C | S | . | . | G | 310 helix | trans | -82 | -21 | 178 | 49.6 | 0 | 0 | 0 | 0 | 113.2 | F268 P269 M273 W274 I275 | F268-S271 PolarHBondContact O-OG 3.44Å; P269-S271 PolarHBondContact O-N 3.23Å; S271-M273 PolarHBondContact O-N 2.8Å; S271-W274 PolarHBondContact O-N 3.32Å; S271-I275 PolarHBondContact O-N 2.88Å |
| 272 | Y | 53.3 | Low | 53.1 | Low | 123 Ų | 123 | 95.5 Ų | 95.5 | 48% | 0.482 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.8 | -37.2 | -178.4 | -167.4 | -90.7 | 0 | 0 | 0 | 112 | M36 W274 I275 V276 | M36-Y272 HydrophobicContact CB-CD1 3.92Å; M36-Y272 HydrophobicContact CB-CE1 4.13Å; M36-Y272 HydrophobicContact CE-CD1 4.23Å; M36-Y272 HydrophobicContact CE-CE1 4.26Å; M36-Y272 HydrophobicContact CG-CD1 3.87Å; M36-Y272 HydrophobicContact CG-CE1 4.12Å; M36-Y272 HydrophobicContact SD-CD1 3.32Å; M36-Y272 WeakPolarHBondContact SD-CD1 3.44Å; M36-Y272 HydrophobicContact SD-CE1 3.1Å; M36-Y272 WeakPolarHBondContact SD-CE1 3.32Å; M36-Y272 HydrophobicContact SD-CG 4.37Å; Y272-W274 VanDerWaalsContact C-N 3.25Å; Y272-W274 PolarHBondContact O-N 2.84Å; Y272-I275 PolarHBondContact O-N 3.33Å; Y272-I275 VanDerWaalsContact O-N 3.13Å; Y272-V276 HydrophobicContact CD1-CG2 3.72Å; Y272-V276 HydrophobicContact CE1-CG2 3.35Å; Y272-V276 WeakPolarHBondContact O-CG2 3.34Å; Y272-V276 PolarHBondContact O-N 3.37Å |
| 273 | M | 52.4 | Low | 53.7 | Low | 46 Ų | 46 | 94.4 Ų | 94.4 | 23% | 0.227 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -59.5 | -35.6 | 176.5 | -62.3 | -153.8 | 77.3 | 0 | 0 | 113.1 | M35 M36 S271 K277 | M35-M273 WeakPolarHBondContact O-CE 3.39Å; M36-M273 VanDerWaalsContact O-CA 3.31Å; M36-M273 WeakPolarHBondContact O-CA 3.35Å; M36-M273 WeakPolarHBondContact O-CB 3.33Å; M36-M273 WeakPolarHBondContact O-CE 3.34Å; M36-M273 WeakPolarHBondContact O-CG 3.19Å; S271-M273 PolarHBondContact O-N 2.8Å; M273-K277 WeakPolarHBondContact O-CB 3.31Å; M273-K277 PolarHBondContact O-N 2.86Å |
| 274 | W | 51 | Low | 54.5 | Low | 185 Ų | 185 | 93.7 Ų | 93.7 | 70% | 0.701 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -74.3 | -35.4 | 178.1 | -93.1 | 85 | 0 | 0 | 0 | 112.4 | S271 Y272 L278 | S271-W274 PolarHBondContact O-N 3.32Å; Y272-W274 VanDerWaalsContact C-N 3.25Å; Y272-W274 PolarHBondContact O-N 2.84Å; W274-L278 VanDerWaalsContact O-CB 3.26Å; W274-L278 WeakPolarHBondContact O-CB 3.23Å; W274-L278 PolarHBondContact O-N 3.19Å |
| 275 | I | 56.7 | Low | 55.4 | Low | 60 Ų | 60 | 92.3 Ų | 92.3 | 31% | 0.308 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68 | -43.3 | 176.4 | -64.9 | 168.5 | 0 | 0 | 0 | 110 | S271 Y272 L278 L279 | S271-I275 PolarHBondContact O-N 2.88Å; Y272-I275 PolarHBondContact O-N 3.33Å; Y272-I275 VanDerWaalsContact O-N 3.13Å; I275-L278 PolarHBondContact O-N 3.3Å; I275-L279 WeakPolarHBondContact O-CB 3.44Å; I275-L279 PolarHBondContact O-N 2.98Å |
| 276 | V | 59.4 | Low | 56.4 | Low | 29 Ų | 29 | 94.5 Ų | 94.5 | 18% | 0.176 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -68.4 | -41.6 | 177.1 | -177.5 | 0 | 0 | 0 | 0 | 111.4 | V37 Y272 L278 L279 Q280 | V37-V276 HydrophobicContact CG2-CB 4.43Å; V37-V276 HydrophobicContact CG2-CG1 3.52Å; Y272-V276 HydrophobicContact CD1-CG2 3.72Å; Y272-V276 HydrophobicContact CE1-CG2 3.35Å; Y272-V276 WeakPolarHBondContact O-CG2 3.34Å; Y272-V276 PolarHBondContact O-N 3.37Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 3.11Å; V276-L279 PolarHBondContact O-N 3.45Å; V276-Q280 HydrophobicContact CG1-CG 4.37Å; V276-Q280 WeakPolarHBondContact O-CB 3.42Å; V276-Q280 WeakPolarHBondContact O-CG 3.32Å; V276-Q280 PolarHBondContact O-N 3.27Å |
| 277 | K | 59.9 | Low | 57.5 | Low | 113 Ų | 113 | 96.6 Ų | 96.6 | 49% | 0.491 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 171.8 | -90.2 | -176.6 | 172.9 | 175.8 | 0 | 112.2 | M273 Q280 L281 | M273-K277 WeakPolarHBondContact O-CB 3.31Å; M273-K277 PolarHBondContact O-N 2.86Å; K277-Q280 PolarHBondContact O-N 3.47Å; K277-L281 WeakPolarHBondContact O-CB 3.41Å; K277-L281 VanDerWaalsContact O-CG 3.26Å; K277-L281 WeakPolarHBondContact O-CG 3.44Å; K277-L281 PolarHBondContact O-N 3.28Å |
| 278 | L | 61 | Low | 58.5 | Low | 72 Ų | 72 | 96.4 Ų | 96.4 | 38% | 0.377 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 176.2 | -172.5 | 69.5 | 0 | 0 | 0 | 111.2 | L256 W274 I275 V276 Q280 L281 I282 | L256-L278 HydrophobicContact CD2-CD2 3.6Å; W274-L278 VanDerWaalsContact O-CB 3.26Å; W274-L278 WeakPolarHBondContact O-CB 3.23Å; W274-L278 PolarHBondContact O-N 3.19Å; I275-L278 PolarHBondContact O-N 3.3Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 3.11Å; L278-Q280 VanDerWaalsContact C-N 3.31Å; L278-Q280 PolarHBondContact O-N 2.85Å; L278-L281 PolarHBondContact O-N 2.99Å; L278-I282 HydrophobicContact CG-CD1 4.07Å; L278-I282 WeakPolarHBondContact O-CB 3.28Å; L278-I282 VanDerWaalsContact O-CG1 3.23Å; L278-I282 WeakPolarHBondContact O-CG1 3.29Å; L278-I282 PolarHBondContact O-N 2.71Å |
| 279 | L | 64.5 | Low | 59 | Low | 98 Ų | 98 | 97 Ų | 97 | 51% | 0.513 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.6 | -36.2 | 177.3 | -153.4 | 103.8 | 0 | 0 | 0 | 112 | I275 V276 K283 | I275-L279 WeakPolarHBondContact O-CB 3.44Å; I275-L279 PolarHBondContact O-N 2.98Å; V276-L279 PolarHBondContact O-N 3.45Å; L279-K283 WeakPolarHBondContact O-CB 3.4Å; L279-K283 PolarHBondContact O-N 3.31Å |
| 280 | Q | 67.4 | Low | 59.3 | Low | 71 Ų | 71 | 99.1 Ų | 99.1 | 33% | 0.332 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -70 | -42.3 | 174.6 | -76.1 | -174.9 | -12.4 | 0 | 0 | 112.1 | V276 K277 L278 I282 K283 Q284 | V276-Q280 HydrophobicContact CG1-CG 4.37Å; V276-Q280 WeakPolarHBondContact O-CB 3.42Å; V276-Q280 WeakPolarHBondContact O-CG 3.32Å; V276-Q280 PolarHBondContact O-N 3.27Å; K277-Q280 PolarHBondContact O-N 3.47Å; L278-Q280 VanDerWaalsContact C-N 3.31Å; L278-Q280 PolarHBondContact O-N 2.85Å; Q280-I282 VanDerWaalsContact C-N 3.29Å; Q280-I282 PolarHBondContact O-N 2.83Å; Q280-K283 CarbonylContact O-C 3.34Å; Q280-K283 PolarHBondContact O-N 3.47Å; Q280-Q284 WeakPolarHBondContact O-CB 3.41Å; Q280-Q284 WeakPolarHBondContact O-CG 3.35Å; Q280-Q284 PolarHBondContact O-N 2.76Å |
| 281 | L | 68.1 | Low | 59.4 | Low | 99 Ų | 99 | 99.7 Ų | 99.7 | 52% | 0.518 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.1 | -38.3 | 173.6 | -72.9 | 170 | 0 | 0 | 0 | 111.3 | K277 L278 Q284 T285 | K277-L281 WeakPolarHBondContact O-CB 3.41Å; K277-L281 VanDerWaalsContact O-CG 3.26Å; K277-L281 WeakPolarHBondContact O-CG 3.44Å; K277-L281 PolarHBondContact O-N 3.28Å; L278-L281 PolarHBondContact O-N 2.99Å; L281-Q284 PolarHBondContact O-N 2.9Å; L281-T285 WeakPolarHBondContact O-CB 3.45Å; L281-T285 WeakPolarHBondContact O-CG2 3.28Å; L281-T285 PolarHBondContact O-N 3.48Å; L281-T285 PolarHBondContact O-OG1 2.77Å |
| 282 | I | 67 | Low | 59.6 | Low | 89 Ų | 89 | 103.5 Ų | 103.5 | 46% | 0.456 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.7 | -49.8 | 171.8 | -68.9 | 166.3 | 0 | 0 | 0 | 109.6 | L278 Q280 Q284 T285 W286 | L278-I282 HydrophobicContact CG-CD1 4.07Å; L278-I282 WeakPolarHBondContact O-CB 3.28Å; L278-I282 VanDerWaalsContact O-CG1 3.23Å; L278-I282 WeakPolarHBondContact O-CG1 3.29Å; L278-I282 PolarHBondContact O-N 2.71Å; Q280-I282 VanDerWaalsContact C-N 3.29Å; Q280-I282 PolarHBondContact O-N 2.83Å; I282-Q284 VanDerWaalsContact C-N 3.29Å; I282-Q284 PolarHBondContact O-N 3.35Å; I282-T285 WeakPolarHBondContact CA-OG1 3.39Å; I282-T285 PolarHBondContact O-N 2.78Å; I282-T285 PolarHBondContact O-OG1 3.26Å; I282-W286 WeakPolarHBondContact O-CB 3.27Å; I282-W286 PolarHBondContact O-N 2.93Å |
| 283 | K | 65.9 | Low | 59.4 | Low | 123 Ų | 123 | 106.9 Ų | 106.9 | 54% | 0.535 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.4 | -36.8 | 176.2 | -91.9 | -177.3 | 174.7 | 176.4 | 0 | 112.9 | L279 Q280 R287 | L279-K283 WeakPolarHBondContact O-CB 3.4Å; L279-K283 PolarHBondContact O-N 3.31Å; Q280-K283 CarbonylContact O-C 3.34Å; Q280-K283 PolarHBondContact O-N 3.47Å; K283-R287 VanDerWaalsContact O-CB 3.28Å; K283-R287 WeakPolarHBondContact O-CB 3.4Å; K283-R287 WeakPolarHBondContact O-CG 3.42Å; K283-R287 PolarHBondContact O-N 3.28Å |
| 284 | Q | 65.2 | Low | 59.4 | Low | 117 Ų | 117 | 115.8 Ų | 115.8 | 55% | 0.547 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -71.2 | -43.7 | 178.3 | -79.4 | 179.9 | -11.8 | 0 | 0 | 111.3 | Q280 L281 I282 R287 A288 | Q280-Q284 WeakPolarHBondContact O-CB 3.41Å; Q280-Q284 WeakPolarHBondContact O-CG 3.35Å; Q280-Q284 PolarHBondContact O-N 2.76Å; L281-Q284 PolarHBondContact O-N 2.9Å; I282-Q284 VanDerWaalsContact C-N 3.29Å; I282-Q284 PolarHBondContact O-N 3.35Å; Q284-R287 PolarHBondContact O-N 3.43Å; Q284-A288 VanDerWaalsContact O-CB 3.27Å; Q284-A288 WeakPolarHBondContact O-CB 3.18Å; Q284-A288 PolarHBondContact O-N 2.87Å |
| 285 | T | 65.3 | Low | 58.8 | Low | 83 Ų | 83 | 112 Ų | 112 | 51% | 0.509 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69.4 | -34.2 | 174.8 | 46.8 | 0 | 0 | 0 | 0 | 112.2 | L281 I282 A288 K289 | L281-T285 WeakPolarHBondContact O-CB 3.45Å; L281-T285 WeakPolarHBondContact O-CG2 3.28Å; L281-T285 PolarHBondContact O-N 3.48Å; L281-T285 PolarHBondContact O-OG1 2.77Å; I282-T285 WeakPolarHBondContact CA-OG1 3.39Å; I282-T285 PolarHBondContact O-N 2.78Å; I282-T285 PolarHBondContact O-OG1 3.26Å; T285-A288 PolarHBondContact O-N 3.13Å; T285-K289 WeakPolarHBondContact O-CB 3.36Å; T285-K289 WeakPolarHBondContact O-CG 3.47Å; T285-K289 PolarHBondContact O-N 2.97Å |
| 286 | W | 61.7 | Low | 58.3 | Low | 163 Ų | 163 | 117.2 Ų | 117.2 | 62% | 0.617 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -68.2 | -44.4 | 174.1 | -140.9 | 87 | 0 | 0 | 0 | 111.1 | I282 K289 F290 | I282-W286 WeakPolarHBondContact O-CB 3.27Å; I282-W286 PolarHBondContact O-N 2.93Å; W286-K289 PolarHBondContact O-N 3.13Å; W286-F290 AromaticContact CD2-CD2 3.65Å; W286-F290 HydrophobicContact CD2-CD2 3.65Å; W286-F290 AromaticContact CD2-CE2 3.88Å; W286-F290 HydrophobicContact CD2-CE2 3.88Å; W286-F290 AromaticContact CE2-CD2 3.82Å; W286-F290 AromaticContact CE2-CE2 3.52Å; W286-F290 AromaticContact CE3-CD2 3.71Å; W286-F290 HydrophobicContact CE3-CD2 3.71Å; W286-F290 HydrophobicContact CE3-CE2 4.24Å; W286-F290 HydrophobicContact CE3-CG 4.31Å; W286-F290 HydrophobicContact CG-CD2 4.24Å; W286-F290 HydrophobicContact CG-CE2 4.48Å; W286-F290 HydrophobicContact CH2-CD2 4.1Å; W286-F290 AromaticContact CH2-CE2 3.99Å; W286-F290 HydrophobicContact CH2-CE2 3.99Å; W286-F290 HydrophobicContact CH2-CZ 4.35Å; W286-F290 HydrophobicContact CZ2-CD2 4.05Å; W286-F290 AromaticContact CZ2-CE2 3.59Å; W286-F290 HydrophobicContact CZ2-CE2 3.59Å; W286-F290 HydrophobicContact CZ2-CZ 4.1Å; W286-F290 AromaticContact CZ3-CD2 3.93Å; W286-F290 HydrophobicContact CZ3-CD2 3.93Å; W286-F290 HydrophobicContact CZ3-CE2 4.29Å; W286-F290 HydrophobicContact CZ3-CG 4.26Å; W286-F290 AromaticContact NE1-CE2 3.93Å; W286-F290 WeakPolarHBondContact O-CB 3.37Å; W286-F290 WeakPolarHBondContact O-CD2 3.33Å; W286-F290 PolarHBondContact O-N 3.17Å |
| 287 | R | 62 | Low | 57.2 | Low | 167 Ų | 167 | 126.2 Ų | 126.2 | 63% | 0.63 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -59.8 | -49.6 | 170.8 | -81.2 | -166.8 | -90.5 | -173.3 | -5.4 | 110.9 | K283 Q284 K289 F290 T291 | K283-R287 VanDerWaalsContact O-CB 3.28Å; K283-R287 WeakPolarHBondContact O-CB 3.4Å; K283-R287 WeakPolarHBondContact O-CG 3.42Å; K283-R287 PolarHBondContact O-N 3.28Å; Q284-R287 PolarHBondContact O-N 3.43Å; R287-K289 VanDerWaalsContact C-N 3.34Å; R287-K289 PolarHBondContact O-N 3.31Å; R287-F290 PolarHBondContact O-N 3.41Å; R287-T291 WeakPolarHBondContact O-CB 3.29Å; R287-T291 VanDerWaalsContact O-CG2 3.29Å; R287-T291 WeakPolarHBondContact O-CG2 3.34Å; R287-T291 PolarHBondContact O-N 3.37Å; R287-T291 PolarHBondContact O-OG1 3.08Å |
| 288 | A | 64 | Low | 57.1 | Low | 64 Ų | 64 | 126.9 Ų | 126.9 | 53% | 0.529 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -61.7 | -36.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q284 T285 | Q284-A288 VanDerWaalsContact O-CB 3.27Å; Q284-A288 WeakPolarHBondContact O-CB 3.18Å; Q284-A288 PolarHBondContact O-N 2.87Å; T285-A288 PolarHBondContact O-N 3.13Å |
| 289 | K | 54.2 | Low | 56.9 | Low | 160 Ų | 160 | 129.7 Ų | 129.7 | 70% | 0.696 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -77.8 | -29.2 | 177.1 | -74.5 | -160 | -179.7 | -165.3 | 0 | 113.8 | T285 W286 R287 | T285-K289 WeakPolarHBondContact O-CB 3.36Å; T285-K289 WeakPolarHBondContact O-CG 3.47Å; T285-K289 PolarHBondContact O-N 2.97Å; W286-K289 PolarHBondContact O-N 3.13Å; R287-K289 VanDerWaalsContact C-N 3.34Å; R287-K289 PolarHBondContact O-N 3.31Å |
| 290 | F | 55.4 | Low | 56.5 | Low | 116 Ų | 116 | 131.5 Ų | 131.5 | 51% | 0.509 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -97.8 | -15.8 | 179.2 | -80.9 | -83.2 | 0 | 0 | 0 | 114.6 | W286 R287 Y293 | W286-F290 AromaticContact CD2-CD2 3.65Å; W286-F290 HydrophobicContact CD2-CD2 3.65Å; W286-F290 AromaticContact CD2-CE2 3.88Å; W286-F290 HydrophobicContact CD2-CE2 3.88Å; W286-F290 AromaticContact CE2-CD2 3.82Å; W286-F290 AromaticContact CE2-CE2 3.52Å; W286-F290 AromaticContact CE3-CD2 3.71Å; W286-F290 HydrophobicContact CE3-CD2 3.71Å; W286-F290 HydrophobicContact CE3-CE2 4.24Å; W286-F290 HydrophobicContact CE3-CG 4.31Å; W286-F290 HydrophobicContact CG-CD2 4.24Å; W286-F290 HydrophobicContact CG-CE2 4.48Å; W286-F290 HydrophobicContact CH2-CD2 4.1Å; W286-F290 AromaticContact CH2-CE2 3.99Å; W286-F290 HydrophobicContact CH2-CE2 3.99Å; W286-F290 HydrophobicContact CH2-CZ 4.35Å; W286-F290 HydrophobicContact CZ2-CD2 4.05Å; W286-F290 AromaticContact CZ2-CE2 3.59Å; W286-F290 HydrophobicContact CZ2-CE2 3.59Å; W286-F290 HydrophobicContact CZ2-CZ 4.1Å; W286-F290 AromaticContact CZ3-CD2 3.93Å; W286-F290 HydrophobicContact CZ3-CD2 3.93Å; W286-F290 HydrophobicContact CZ3-CE2 4.29Å; W286-F290 HydrophobicContact CZ3-CG 4.26Å; W286-F290 AromaticContact NE1-CE2 3.93Å; W286-F290 WeakPolarHBondContact O-CB 3.37Å; W286-F290 WeakPolarHBondContact O-CD2 3.33Å; W286-F290 PolarHBondContact O-N 3.17Å; R287-F290 PolarHBondContact O-N 3.41Å; F290-Y293 PolarHBondContact O-N 3.27Å |
| 291 | T | 46.4 | Very low | 55.8 | Low | 102 Ų | 102 | 135.1 Ų | 135.1 | 63% | 0.626 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -74.9 | -16.3 | 167.8 | 50.9 | 0 | 0 | 0 | 0 | 112.5 | R287 Y293 | R287-T291 WeakPolarHBondContact O-CB 3.29Å; R287-T291 VanDerWaalsContact O-CG2 3.29Å; R287-T291 WeakPolarHBondContact O-CG2 3.34Å; R287-T291 PolarHBondContact O-N 3.37Å; R287-T291 PolarHBondContact O-OG1 3.08Å; T291-Y293 PolarHBondContact O-N 3.45Å |
| 292 | S | 51.5 | Low | 55 | Low | 94 Ų | 94 | 137.3 Ų | 137.3 | 66% | 0.657 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -78.1 | -2.5 | 171.9 | -161.2 | 0 | 0 | 0 | 0 | 113.6 | ||
| 293 | Y | 49.1 | Very low | 54.2 | Low | 194 Ų | 194 | 140.5 Ų | 140.5 | 76% | 0.761 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -103.1 | 31.1 | 174.4 | -80 | -79.7 | 0 | 0 | 0 | 113.5 | F290 T291 | F290-Y293 PolarHBondContact O-N 3.27Å; T291-Y293 PolarHBondContact O-N 3.45Å |
| 294 | R | 51.9 | Low | 53.4 | Low | 233 Ų | 233 | 141.8 Ų | 141.8 | 88% | 0.879 | 70% | 0.703 | S | S | * | * | trans | -130 | 108.4 | 151.6 | -86.2 | -163 | -170.2 | -166.3 | 3.9 | 111.1 | ||||
| 295 | P | 37.4 | Very low | 52.5 | Low | 105 Ų | 105 | 143.7 Ų | 143.7 | 68% | 0.682 | 72% | 0.715 | S | S | * | * | trans | -114.1 | 122.3 | 133.5 | 25.7 | -11.1 | 0 | 0 | 0 | 110.2 | ||||
| 296 | L | 46 | Very low | 51.4 | Low | 170 Ų | 170 | 148.8 Ų | 148.8 | 89% | 0.89 | 73% | 0.733 | S | S | * | * | trans | 26.6 | 103.3 | 139.6 | -63.7 | 129.3 | 0 | 0 | 0 | 117.4 | ||||
| 297 | V | 37.6 | Very low | 50.5 | Low | 217 Ų | 217 | 147.5 Ų | 147.5 | 100% | 1.315 | 74% | 0.743 | S | S | * | * | -170 | 0 | 95.3 | 161.4 | 0 | 0 | 0 | 0 | 107.3 |
Retrieved 297 of 297 residues in 55.7 ms
(Link to these results)