| 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 | 37.4 | Very low | 46 | Very low | 236 Ų | 236 | 141.5 Ų | 141.5 | 100% | 1.163 | 80% | 0.8 | S | S | * | * | 0 | 84.7 | 0 | -66.9 | -178.8 | 169.1 | 0 | 0 | 106.2 | |||||
| 2 | S | 41.9 | Very low | 46.4 | Very low | 104 Ų | 104 | 139.6 Ų | 139.6 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | 92.4 | 89.7 | 102.7 | -48.8 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 3 | A | 35.2 | Very low | 47.1 | Very low | 95 Ų | 95 | 138.8 Ų | 138.8 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -57.7 | 140.1 | 160 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 4 | F | 46 | Very low | 47.3 | Very low | 190 Ų | 190 | 139.6 Ų | 139.6 | 83% | 0.833 | 80% | 0.797 | S | S | * | * | trans | -124.4 | 121.1 | 158.7 | -91.8 | -77.7 | 0 | 0 | 0 | 108.8 | ||||
| 5 | D | 44.9 | Very low | 47.7 | Very low | 154 Ų | 154 | 138 Ų | 138 | 82% | 0.824 | 79% | 0.79 | S | S | * | * | trans | -50.7 | 126.2 | 177.2 | -68.5 | -78 | 0 | 0 | 0 | 113.2 | ||||
| 6 | T | 52.5 | Low | 48.1 | Very low | 139 Ų | 139 | 134.4 Ų | 134.4 | 85% | 0.853 | 77% | 0.768 | S | S | * | * | trans | -104.4 | 103.1 | 154 | -50.3 | 0 | 0 | 0 | 0 | 106.5 | P8 | T6-P8 VanDerWaalsContact O-CD 3.3Å; T6-P8 WeakPolarHBondContact O-CD 3.33Å | ||
| 7 | N | 49.2 | Very low | 48.5 | Very low | 113 Ų | 113 | 132.3 Ų | 132.3 | 60% | 0.604 | 76% | 0.76 | S | S | * | * | trans | -67.6 | 114.8 | -175.2 | -163.2 | -7.4 | 0 | 0 | 0 | 109.8 | F9 A10 | N7-F9 PolarHBondContact O-N 3.12Å; N7-F9 VanDerWaalsContact O-N 3.1Å; N7-A10 PolarHBondContact O-N 3.1Å | ||
| 8 | P | 51.5 | Low | 48.3 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 73% | 0.734 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | 8.4 | -173.8 | 31.3 | -34.4 | 0 | 0 | 0 | 114 | T6 | T6-P8 VanDerWaalsContact O-CD 3.3Å; T6-P8 WeakPolarHBondContact O-CD 3.33Å |
| 9 | F | 42 | Very low | 48.5 | Very low | 179 Ų | 179 | 134.9 Ų | 134.9 | 79% | 0.785 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118 | 19.9 | 177.5 | -65.2 | -79 | 0 | 0 | 0 | 113.4 | N7 D11 | N7-F9 PolarHBondContact O-N 3.12Å; N7-F9 VanDerWaalsContact O-N 3.1Å; F9-D11 PolarHBondContact O-N 3.25Å |
| 10 | A | 53.4 | Low | 48.7 | Very low | 83 Ų | 83 | 132.2 Ų | 132.2 | 69% | 0.686 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 118.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | N7 | N7-A10 PolarHBondContact O-N 3.1Š|
| 11 | D | 52.4 | Low | 48.9 | Very low | 150 Ų | 150 | 130.5 Ų | 130.5 | 80% | 0.802 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 139.8 | 176.5 | -74.1 | -50.3 | 0 | 0 | 0 | 111.1 | F9 V13 | F9-D11 PolarHBondContact O-N 3.25Å; D11-V13 PolarHBondContact O-N 3.1Å |
| 12 | P | 51 | Low | 49.7 | Very low | 119 Ų | 119 | 122.8 Ų | 122.8 | 77% | 0.773 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 125.9 | 174.1 | 25.4 | -31.1 | 0 | 0 | 0 | 108.6 | D14 | P12-D14 PolarHBondContact O-N 2.92Š|
| 13 | V | 54.4 | Low | 50.2 | Low | 129 Ų | 129 | 120.9 Ų | 120.9 | 78% | 0.782 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -47.7 | 117 | 164.3 | -84 | 0 | 0 | 0 | 0 | 108.3 | D11 V15 | D11-V13 PolarHBondContact O-N 3.1Å; V13-V15 HydrophobicContact CG2-CG2 4.22Å; V13-V15 WeakPolarHBondContact O-CG2 3.5Å; V13-V15 PolarHBondContact O-N 3.43Å |
| 14 | D | 50.1 | Low | 50.9 | Low | 151 Ų | 151 | 120.2 Ų | 120.2 | 81% | 0.807 | 67% | 0.673 | S | S | * | * | trans | -70.7 | 81.9 | 179 | -154 | -4.1 | 0 | 0 | 0 | 107.9 | P12 N16 | P12-D14 PolarHBondContact O-N 2.92Å; D14-N16 VanDerWaalsContact C-N 3.3Å; D14-N16 PolarHBondContact O-N 3.45Å | ||
| 15 | V | 54.4 | Low | 51.1 | Low | 115 Ų | 115 | 119.1 Ų | 119.1 | 70% | 0.697 | 67% | 0.67 | S | S | * | * | trans | -72.3 | 93 | 176.3 | -173.3 | 0 | 0 | 0 | 0 | 106.4 | V13 P17 | V13-V15 HydrophobicContact CG2-CG2 4.22Å; V13-V15 WeakPolarHBondContact O-CG2 3.5Å; V13-V15 PolarHBondContact O-N 3.43Å; V15-P17 WeakPolarHBondContact O-CD 3.3Å | ||
| 16 | N | 53.8 | Low | 51.2 | Low | 81 Ų | 81 | 119.1 Ų | 119.1 | 43% | 0.433 | 67% | 0.67 | S | S | . | * | trans | -57.7 | 110.8 | 175.9 | -122.6 | -48.6 | 0 | 0 | 0 | 108.9 | D14 F18 Q19 | D14-N16 VanDerWaalsContact C-N 3.3Å; D14-N16 PolarHBondContact O-N 3.45Å; N16-F18 PolarHBondContact O-N 3.42Å; N16-Q19 HydrophobicContact CB-CG 4.24Å; N16-Q19 PolarHBondContact O-N 3.4Å; N16-Q19 VanDerWaalsContact O-N 3.17Å | ||
| 17 | P | 54.5 | Low | 50.8 | Low | 98 Ų | 98 | 117.6 Ų | 117.6 | 64% | 0.636 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | -0.4 | -172.1 | 28.3 | -33.8 | 0 | 0 | 0 | 113.3 | V15 | V15-P17 WeakPolarHBondContact O-CD 3.3Š|
| 18 | F | 44.6 | Very low | 50.7 | Low | 157 Ų | 157 | 118.6 Ų | 118.6 | 69% | 0.689 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.1 | 1.5 | 178.6 | -61.1 | -76.3 | 0 | 0 | 0 | 113.9 | N16 D20 | N16-F18 PolarHBondContact O-N 3.42Å; F18-D20 VanDerWaalsContact C-N 3.27Å; F18-D20 PolarHBondContact O-N 3.47Å |
| 19 | Q | 52.3 | Low | 50.2 | Low | 158 Ų | 158 | 117.1 Ų | 117.1 | 74% | 0.738 | 66% | 0.663 | S | S | * | * | trans | -87.5 | 12 | 176.2 | -75.6 | -179.1 | -11.7 | 0 | 0 | 113.8 | N16 | N16-Q19 HydrophobicContact CB-CG 4.24Å; N16-Q19 PolarHBondContact O-N 3.4Å; N16-Q19 VanDerWaalsContact O-N 3.17Å | ||
| 20 | D | 52.7 | Low | 50.2 | Low | 80 Ų | 80 | 114.6 Ų | 114.6 | 43% | 0.428 | 66% | 0.664 | S | S | . | * | trans | -70.7 | 127.8 | 174.8 | -167.6 | -48.1 | 0 | 0 | 0 | 110.8 | F18 S22 V23 T24 | F18-D20 VanDerWaalsContact C-N 3.27Å; F18-D20 PolarHBondContact O-N 3.47Å; D20-S22 PolarHBondContact O-N 3.4Å; D20-S22 WeakPolarHBondContact OD1-CB 3.21Å; D20-S22 PolarHBondContact OD1-N 2.63Å; D20-S22 PolarHBondContact OD1-OG 2.88Å; D20-V23 HydrophobicContact CB-CG2 4.26Å; D20-V23 PolarHBondContact O-N 3.05Å; D20-T24 PolarHBondContact O-OG1 3.48Å | ||
| 21 | P | 53.5 | Low | 49.9 | Very low | 97 Ų | 97 | 120.4 Ų | 120.4 | 63% | 0.63 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.5 | -14.1 | 179 | 23.8 | -33.9 | 0 | 0 | 0 | 114.4 | ||
| 22 | S | 53.9 | Low | 49.2 | Very low | 73 Ų | 73 | 116.8 Ų | 116.8 | 51% | 0.51 | 68% | 0.676 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.3 | -24.3 | 172.5 | 62 | 0 | 0 | 0 | 0 | 113.7 | D20 | D20-S22 PolarHBondContact O-N 3.4Å; D20-S22 WeakPolarHBondContact OD1-CB 3.21Å; D20-S22 PolarHBondContact OD1-N 2.63Å; D20-S22 PolarHBondContact OD1-OG 2.88Å |
| 23 | V | 51.6 | Low | 48.5 | Very low | 65 Ų | 65 | 114.6 Ų | 114.6 | 39% | 0.394 | 67% | 0.674 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85 | -30.1 | -179.7 | -179.5 | 0 | 0 | 0 | 0 | 111.4 | D20 Q25 L26 | D20-V23 HydrophobicContact CB-CG2 4.26Å; D20-V23 PolarHBondContact O-N 3.05Å; V23-Q25 VanDerWaalsContact C-N 3.29Å; V23-Q25 PolarHBondContact O-N 3.17Å; V23-L26 PolarHBondContact O-N 2.94Å |
| 24 | T | 49.4 | Very low | 47.8 | Very low | 81 Ų | 81 | 117.8 Ų | 117.8 | 50% | 0.497 | 69% | 0.686 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.8 | -15.1 | 179.3 | 5.3 | 0 | 0 | 0 | 0 | 113.9 | D20 T27 | D20-T24 PolarHBondContact O-OG1 3.48Å; T24-T27 PolarHBondContact O-OG1 2.98Å |
| 25 | Q | 50.6 | Low | 47.7 | Very low | 166 Ų | 166 | 114.4 Ų | 114.4 | 78% | 0.776 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.7 | -17.5 | 176.2 | -68.7 | -159.6 | 12.5 | 0 | 0 | 114 | V23 | V23-Q25 VanDerWaalsContact C-N 3.29Å; V23-Q25 PolarHBondContact O-N 3.17Å |
| 26 | L | 47.3 | Very low | 47.6 | Very low | 155 Ų | 155 | 117.5 Ų | 117.5 | 81% | 0.812 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.1 | -19.2 | 175.2 | -81.3 | 159.8 | 0 | 0 | 0 | 113.1 | V23 | V23-L26 PolarHBondContact O-N 2.94Š|
| 27 | T | 45.3 | Very low | 47 | Very low | 106 Ų | 106 | 122.8 Ų | 122.8 | 65% | 0.65 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -95.4 | -10 | -178.3 | 39.4 | 0 | 0 | 0 | 0 | 114.6 | T24 | T24-T27 PolarHBondContact O-OG1 2.98Š|
| 28 | N | 46.3 | Very low | 47 | Very low | 135 Ų | 135 | 123.5 Ų | 123.5 | 72% | 0.722 | 70% | 0.704 | S | S | * | * | trans | -118.7 | 70.4 | 175.7 | -81.7 | -28.5 | 0 | 0 | 0 | 111.3 | ||||
| 29 | A | 41.6 | Very low | 46.8 | Very low | 81 Ų | 81 | 120 Ų | 120 | 67% | 0.669 | 70% | 0.698 | S | S | * | * | trans | -82.4 | 132.6 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | Q31 | A29-Q31 PolarHBondContact O-N 2.95Š| ||
| 30 | P | 41.1 | Very low | 46 | Very low | 126 Ų | 126 | 121.6 Ų | 121.6 | 82% | 0.818 | 70% | 0.702 | S | S | * | * | trans | -64.8 | 122.3 | 175.9 | 24.4 | -30 | 0 | 0 | 0 | 110.2 | G32 | P30-G32 PolarHBondContact O-N 2.81Å; P30-G32 VanDerWaalsContact O-N 3.1Å | ||
| 31 | Q | 47 | Very low | 45.3 | Very low | 205 Ų | 205 | 122.8 Ų | 122.8 | 96% | 0.958 | 72% | 0.717 | S | S | * | * | trans | -63.5 | 106.4 | 169.9 | -70.4 | -178.5 | -22.5 | 0 | 0 | 109.2 | A29 | A29-Q31 PolarHBondContact O-N 2.95Š| ||
| 32 | G | 37.6 | Very low | 44.6 | Very low | 75 Ų | 75 | 126.9 Ų | 126.9 | 77% | 0.773 | 73% | 0.727 | S | S | * | * | trans | -165 | 94.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | P30 | P30-G32 PolarHBondContact O-N 2.81Å; P30-G32 VanDerWaalsContact O-N 3.1Å | ||
| 33 | G | 35.8 | Very low | 43.7 | Very low | 72 Ų | 72 | 128.8 Ų | 128.8 | 74% | 0.742 | 74% | 0.736 | S | S | * | * | trans | 74.8 | 80.5 | 149.4 | 0 | 0 | 0 | 0 | 0 | 119 | A35 | G33-A35 VanDerWaalsContact C-N 3.28Å; G33-A35 PolarHBondContact O-N 3.04Å | ||
| 34 | L | 40.6 | Very low | 42.7 | Very low | 196 Ų | 196 | 133.8 Ų | 133.8 | 100% | 1.026 | 76% | 0.761 | S | S | * | * | trans | -93.1 | 54.3 | 156.8 | -81 | 172.6 | 0 | 0 | 0 | 111.2 | ||||
| 35 | A | 48.3 | Very low | 41.8 | Very low | 81 Ų | 81 | 134.5 Ų | 134.5 | 67% | 0.669 | 78% | 0.775 | S | S | * | * | trans | -119.2 | 137.5 | 157.8 | 0 | 0 | 0 | 0 | 0 | 106.4 | G33 | G33-A35 VanDerWaalsContact C-N 3.28Å; G33-A35 PolarHBondContact O-N 3.04Å | ||
| 36 | E | 50.9 | Low | 40.8 | Very low | 180 Ų | 180 | 130.8 Ų | 130.8 | 84% | 0.841 | 77% | 0.772 | S | S | * | * | trans | 87.4 | 62.5 | 171.2 | -130.3 | 104 | -157.1 | 0 | 0 | 117.4 | ||||
| 37 | F | 42.8 | Very low | 40 | Very low | 191 Ų | 191 | 129.3 Ų | 129.3 | 84% | 0.838 | 77% | 0.77 | S | S | * | * | trans | -112.9 | 98.5 | 146.9 | -168.9 | -97.6 | 0 | 0 | 0 | 108.8 | P39 | F37-P39 HydrophobicContact CE1-CB 3.95Å; F37-P39 HydrophobicContact CE1-CG 4.32Å; F37-P39 HydrophobicContact CZ-CB 4.41Å | ||
| 38 | N | 54.6 | Low | 39.3 | Very low | 113 Ų | 113 | 130.5 Ų | 130.5 | 60% | 0.604 | 78% | 0.777 | S | S | * | * | trans | -119.5 | 101.6 | 178.5 | -142.1 | -7.7 | 0 | 0 | 0 | 108.2 | F40 | N38-F40 PolarHBondContact O-N 3.19Š| ||
| 39 | P | 39.4 | Very low | 38.6 | Very low | 85 Ų | 85 | 129.9 Ų | 129.9 | 55% | 0.552 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | 24.9 | -165.4 | 31.2 | -35.1 | 0 | 0 | 0 | 114.9 | F37 | F37-P39 HydrophobicContact CE1-CB 3.95Å; F37-P39 HydrophobicContact CE1-CG 4.32Å; F37-P39 HydrophobicContact CZ-CB 4.41Å |
| 40 | F | 36.4 | Very low | 38.2 | Very low | 191 Ų | 191 | 131.9 Ų | 131.9 | 84% | 0.838 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.2 | 17.3 | -178.8 | -72.7 | -71.2 | 0 | 0 | 0 | 115.2 | N38 | N38-F40 PolarHBondContact O-N 3.19Š|
| 41 | S | 37.8 | Very low | 37.6 | Very low | 104 Ų | 104 | 131.3 Ų | 131.3 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | -113.9 | 81.1 | -179.6 | -58.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 42 | E | 38.5 | Very low | 36.7 | Very low | 184 Ų | 184 | 127.1 Ų | 127.1 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | -101 | 116.1 | 159.7 | -86.7 | -154.3 | 132.4 | 0 | 0 | 111.2 | ||||
| 43 | T | 34.4 | Very low | 36.3 | Very low | 112 Ų | 112 | 132.3 Ų | 132.3 | 69% | 0.687 | 77% | 0.771 | S | S | * | * | 61 | 103.9 | 126.6 | -42.2 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 44 | N | 30.2 | Very low | 36.1 | Very low | 171 Ų | 171 | 136.8 Ų | 136.8 | 91% | 0.914 | 78% | 0.777 | S | S | * | * | -148.6 | 140.8 | 128 | -101.9 | -51.4 | 0 | 0 | 0 | 111.7 | |||||
| 45 | A | 32.2 | Very low | 36.2 | Very low | 96 Ų | 96 | 133.4 Ų | 133.4 | 79% | 0.793 | 77% | 0.767 | S | S | * | * | trans | -58.4 | 150.4 | -165.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 46 | A | 29.8 | Very low | 35.2 | Very low | 88 Ų | 88 | 132.9 Ų | 132.9 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | 167.1 | 119.4 | 121.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 47 | T | 30 | Very low | 34.4 | Very low | 124 Ų | 124 | 129.7 Ų | 129.7 | 76% | 0.761 | 77% | 0.767 | S | S | * | * | 78.1 | 133.8 | 126.3 | -48.1 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 48 | T | 30.6 | Very low | 34 | Very low | 131 Ų | 131 | 126.3 Ų | 126.3 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | 86.7 | 105.4 | 153.2 | 37 | 0 | 0 | 0 | 0 | 122 | ||||
| 49 | V | 31 | Very low | 33 | Very low | 122 Ų | 122 | 129.5 Ų | 129.5 | 74% | 0.739 | 78% | 0.778 | S | S | * | * | trans | -65.9 | 156.9 | 148.8 | -131.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 50 | P | 33.8 | Very low | 33 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 79% | 0.792 | 79% | 0.789 | S | S | * | * | -145.2 | 149.7 | 78.8 | 34.7 | -14.7 | 0 | 0 | 0 | 118.1 | |||||
| 51 | V | 28.5 | Very low | 33 | Very low | 115 Ų | 115 | 126.2 Ų | 126.2 | 70% | 0.697 | 78% | 0.783 | S | S | * | * | trans | -14.7 | 142 | 141.3 | -150.5 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 52 | T | 28.4 | Very low | 32.8 | Very low | 116 Ų | 116 | 127.8 Ų | 127.8 | 71% | 0.712 | 79% | 0.788 | S | S | * | * | 173.1 | 156.9 | 67.1 | -33.5 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 53 | Q | 28.1 | Very low | 32.6 | Very low | 184 Ų | 184 | 127.1 Ų | 127.1 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | trans | 97 | 121.7 | 147 | -62.8 | -178.7 | -51.2 | 0 | 0 | 123.6 | ||||
| 54 | L | 31.5 | Very low | 32.5 | Very low | 166 Ų | 166 | 130.6 Ų | 130.6 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | -111.8 | 172.9 | 145 | -89.6 | 144.5 | 0 | 0 | 0 | 106.7 | ||||
| 55 | P | 42.6 | Very low | 32.7 | Very low | 125 Ų | 125 | 128 Ų | 128 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | cis | -132.5 | 178.3 | -16.9 | 35.4 | -15.9 | 0 | 0 | 0 | 113.5 | ||||
| 56 | G | 26.8 | Very low | 32.7 | Very low | 70 Ų | 70 | 128.7 Ų | 128.7 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | 141.8 | 109.1 | 150.9 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 57 | S | 35.1 | Very low | 33.4 | Very low | 114 Ų | 114 | 131 Ų | 131 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | 26.4 | 129.2 | 144.8 | 60.6 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 58 | S | 33.6 | Very low | 33.6 | Very low | 120 Ų | 120 | 132.5 Ų | 132.5 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | 175.9 | 132.1 | 114.1 | -71.3 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 59 | Q | 35.3 | Very low | 34.1 | Very low | 179 Ų | 179 | 131.8 Ų | 131.8 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -72.9 | 167.4 | 174.5 | -119.9 | -178.7 | 12.2 | 0 | 0 | 111.3 | ||||
| 60 | P | 38.9 | Very low | 34.4 | Very low | 120 Ų | 120 | 132 Ų | 132 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | -142.7 | 162.5 | 63.7 | 29.9 | -6.6 | 0 | 0 | 0 | 117.9 | |||||
| 61 | A | 35.5 | Very low | 34.8 | Very low | 87 Ų | 87 | 134.7 Ų | 134.7 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -36.3 | 130.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 62 | V | 33.9 | Very low | 35.5 | Very low | 138 Ų | 138 | 134 Ų | 134 | 84% | 0.836 | 79% | 0.792 | S | S | * | * | trans | -128.9 | 121.4 | 155.8 | -174.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 63 | L | 34 | Very low | 36.6 | Very low | 170 Ų | 170 | 132.7 Ų | 132.7 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | trans | -65.1 | 125.4 | 178.7 | -63.7 | 161 | 0 | 0 | 0 | 109.7 | ||||
| 64 | Q | 33.3 | Very low | 37.9 | Very low | 185 Ų | 185 | 128.8 Ų | 128.8 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | trans | -110.8 | 141.5 | 160.6 | -94.8 | 176.9 | 16.5 | 0 | 0 | 109.5 | ||||
| 65 | P | 33.7 | Very low | 39 | Very low | 115 Ų | 115 | 128.4 Ų | 128.4 | 75% | 0.747 | 77% | 0.768 | S | S | * | * | trans | -71.4 | 141.8 | -171 | 10.5 | 0.9 | 0 | 0 | 0 | 111.2 | V67 | P65-V67 PolarHBondContact O-N 3.28Å; P65-V67 VanDerWaalsContact O-N 3.12Å | ||
| 66 | S | 33.1 | Very low | 39.7 | Very low | 112 Ų | 112 | 124.7 Ų | 124.7 | 78% | 0.783 | 75% | 0.749 | S | S | * | * | trans | -42.3 | 111.6 | 168.5 | -176 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 67 | V | 43 | Very low | 41.2 | Very low | 135 Ų | 135 | 124 Ų | 124 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | trans | -92.4 | 109.3 | 159.1 | -163.7 | 0 | 0 | 0 | 0 | 106 | P65 | P65-V67 PolarHBondContact O-N 3.28Å; P65-V67 VanDerWaalsContact O-N 3.12Å | ||
| 68 | E | 35.1 | Very low | 42.5 | Very low | 156 Ų | 156 | 122.6 Ų | 122.6 | 73% | 0.729 | 72% | 0.722 | S | S | * | * | trans | -50.9 | 122.2 | 174.2 | -167.1 | 144.2 | 104.2 | 0 | 0 | 110.8 | T70 | E68-T70 PolarHBondContact O-N 3.46Å; E68-T70 VanDerWaalsContact O-N 3.1Å | ||
| 69 | P | 40.9 | Very low | 44.1 | Very low | 116 Ų | 116 | 120.1 Ų | 120.1 | 75% | 0.753 | 71% | 0.705 | S | S | * | * | trans | -77.1 | 100.4 | 169.2 | 27.7 | -24.1 | 0 | 0 | 0 | 107.2 | Q71 | P69-Q71 PolarHBondContact O-N 3.1Š| ||
| 70 | T | 38.3 | Very low | 45.7 | Very low | 128 Ų | 128 | 114.5 Ų | 114.5 | 79% | 0.785 | 69% | 0.689 | S | S | * | * | trans | -60.2 | 103.2 | 166.9 | -46.4 | 0 | 0 | 0 | 0 | 108.1 | E68 | E68-T70 PolarHBondContact O-N 3.46Å; E68-T70 VanDerWaalsContact O-N 3.1Å | ||
| 71 | Q | 40.6 | Very low | 47.2 | Very low | 177 Ų | 177 | 111.4 Ų | 111.4 | 83% | 0.827 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 129.5 | 169.6 | -85.7 | 174.6 | -71.5 | 0 | 0 | 109.5 | P69 T73 | P69-Q71 PolarHBondContact O-N 3.1Å; Q71-T73 PolarHBondContact O-N 2.95Å |
| 72 | P | 44.6 | Very low | 48.9 | Very low | 101 Ų | 101 | 113 Ų | 113 | 66% | 0.656 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 129.2 | 164.3 | -5.9 | 21.6 | 0 | 0 | 0 | 108.1 | ||
| 73 | T | 50.4 | Low | 51 | Low | 88 Ų | 88 | 108.5 Ų | 108.5 | 54% | 0.54 | 64% | 0.644 | S | S | . | * | P | Polyproline II helix | trans | -52.3 | 136.7 | 169.9 | -0.8 | 0 | 0 | 0 | 0 | 109.7 | Q71 Q75 A76 A77 | Q71-T73 PolarHBondContact O-N 2.95Å; T73-Q75 PolarHBondContact O-N 2.99Å; T73-A76 PolarHBondContact O-N 3.41Å; T73-A77 PolarHBondContact O-N 2.95Å |
| 74 | P | 56.1 | Low | 53 | Low | 102 Ų | 102 | 102 Ų | 102 | 66% | 0.662 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -55.9 | -25.3 | -178 | 16.1 | -29 | 0 | 0 | 0 | 113.6 | V78 | P74-V78 WeakPolarHBondContact O-CG2 3.18Å; P74-V78 PolarHBondContact O-N 3.17Å; P74-V78 VanDerWaalsContact O-N 3.17Å |
| 75 | Q | 54.1 | Low | 55.1 | Low | 158 Ų | 158 | 98.4 Ų | 98.4 | 74% | 0.738 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -70.2 | -32.4 | 175.4 | -71 | 158.5 | -34.3 | 0 | 0 | 113.8 | T73 S79 | T73-Q75 PolarHBondContact O-N 2.99Å; Q75-S79 PolarHBondContact O-N 3.02Å; Q75-S79 VanDerWaalsContact O-N 3.13Å |
| 76 | A | 57.4 | Low | 57.3 | Low | 48 Ų | 48 | 99 Ų | 99 | 40% | 0.397 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -77.7 | -32.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | T73 S79 A80 | T73-A76 PolarHBondContact O-N 3.41Å; A76-S79 PolarHBondContact O-OG 2.91Å; A76-A80 VanDerWaalsContact O-CB 3.26Å; A76-A80 WeakPolarHBondContact O-CB 3.39Å; A76-A80 PolarHBondContact O-N 3.3Å |
| 77 | A | 59.6 | Low | 59.6 | Low | 56 Ų | 56 | 102 Ų | 102 | 46% | 0.463 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -68.9 | -38.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | T73 A81 | T73-A77 PolarHBondContact O-N 2.95Å; A77-A81 WeakPolarHBondContact O-CB 3.48Å; A77-A81 PolarHBondContact O-N 2.92Å |
| 78 | V | 61.7 | Low | 61.6 | Low | 84 Ų | 84 | 101 Ų | 101 | 51% | 0.509 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.8 | -39.1 | 176.3 | 175.2 | 0 | 0 | 0 | 0 | 111.7 | P74 A81 Q82 | P74-V78 WeakPolarHBondContact O-CG2 3.18Å; P74-V78 PolarHBondContact O-N 3.17Å; P74-V78 VanDerWaalsContact O-N 3.17Å; V78-A81 PolarHBondContact O-N 3.13Å; V78-Q82 WeakPolarHBondContact O-CB 3.26Å; V78-Q82 WeakPolarHBondContact O-CG 3.33Å; V78-Q82 PolarHBondContact O-N 3.45Å |
| 79 | S | 67.3 | Low | 63.9 | Low | 67 Ų | 67 | 98.7 Ų | 98.7 | 47% | 0.469 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.6 | -36.3 | 176.5 | 82.4 | 0 | 0 | 0 | 0 | 112.4 | Q75 A76 Q82 A83 | Q75-S79 PolarHBondContact O-N 3.02Å; Q75-S79 VanDerWaalsContact O-N 3.13Å; A76-S79 PolarHBondContact O-OG 2.91Å; S79-Q82 PolarHBondContact O-N 2.96Å; S79-A83 WeakPolarHBondContact O-CB 3.47Å; S79-A83 PolarHBondContact O-N 3.5Å |
| 80 | A | 68.4 | Low | 66.1 | Low | 62 Ų | 62 | 99.9 Ų | 99.9 | 51% | 0.512 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65.8 | -38.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112 | A76 A83 G84 | A76-A80 VanDerWaalsContact O-CB 3.26Å; A76-A80 WeakPolarHBondContact O-CB 3.39Å; A76-A80 PolarHBondContact O-N 3.3Å; A80-A83 PolarHBondContact O-N 3.4Å; A80-G84 PolarHBondContact O-N 2.97Å |
| 81 | A | 70.5 | Confident | 68.3 | Low | 55 Ų | 55 | 99.6 Ų | 99.6 | 46% | 0.455 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67 | -41.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A77 V78 G84 L85 | A77-A81 WeakPolarHBondContact O-CB 3.48Å; A77-A81 PolarHBondContact O-N 2.92Å; V78-A81 PolarHBondContact O-N 3.13Å; A81-G84 PolarHBondContact O-N 3.34Å; A81-L85 WeakPolarHBondContact O-CG 3.49Å; A81-L85 PolarHBondContact O-N 3.15Å |
| 82 | Q | 71.4 | Confident | 70.1 | Confident | 119 Ų | 119 | 95.8 Ų | 95.8 | 56% | 0.556 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.4 | -38.8 | 173.9 | -77.9 | 176.2 | -23.9 | 0 | 0 | 112.4 | V78 S79 G84 L85 L86 | V78-Q82 WeakPolarHBondContact O-CB 3.26Å; V78-Q82 WeakPolarHBondContact O-CG 3.33Å; V78-Q82 PolarHBondContact O-N 3.45Å; S79-Q82 PolarHBondContact O-N 2.96Å; Q82-G84 VanDerWaalsContact C-N 3.33Å; Q82-L85 PolarHBondContact O-N 2.89Å; Q82-L86 PolarHBondContact O-N 3.42Å |
| 83 | A | 76.8 | Confident | 72.1 | Confident | 44 Ų | 44 | 95.5 Ų | 95.5 | 36% | 0.364 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67 | -33.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | S79 A80 R87 | S79-A83 WeakPolarHBondContact O-CB 3.47Å; S79-A83 PolarHBondContact O-N 3.5Å; A80-A83 PolarHBondContact O-N 3.4Å; A83-R87 PolarHBondContact O-N 3.27Å; A83-R87 VanDerWaalsContact O-N 3.15Å |
| 84 | G | 77.3 | Confident | 73.9 | Confident | 35 Ų | 35 | 100.5 Ų | 100.5 | 36% | 0.361 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.3 | -44 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A80 A81 Q82 R87 Q88 | A80-G84 PolarHBondContact O-N 2.97Å; A81-G84 PolarHBondContact O-N 3.34Å; Q82-G84 VanDerWaalsContact C-N 3.33Å; G84-R87 PolarHBondContact O-N 3.24Å; G84-Q88 WeakPolarHBondContact O-CB 3.45Å; G84-Q88 PolarHBondContact O-N 3.01Å |
| 85 | L | 76.1 | Confident | 75.4 | Confident | 109 Ų | 109 | 102.2 Ų | 102.2 | 57% | 0.571 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.7 | -40.2 | 176.8 | -70.5 | 170.2 | 0 | 0 | 0 | 112.3 | A81 Q82 Q88 Q89 | A81-L85 WeakPolarHBondContact O-CG 3.49Å; A81-L85 PolarHBondContact O-N 3.15Å; Q82-L85 PolarHBondContact O-N 2.89Å; L85-Q88 PolarHBondContact O-N 3.4Å; L85-Q89 WeakPolarHBondContact O-CB 3.35Å; L85-Q89 PolarHBondContact O-N 3.4Å |
| 86 | L | 81.6 | Confident | 76.8 | Confident | 126 Ų | 126 | 97.3 Ų | 97.3 | 66% | 0.66 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.9 | -41.3 | 175.1 | -90.1 | 166.8 | 0 | 0 | 0 | 112.4 | Q82 Q88 Q89 E90 | Q82-L86 PolarHBondContact O-N 3.42Å; L86-Q88 VanDerWaalsContact C-N 3.33Å; L86-Q88 PolarHBondContact O-N 2.96Å; L86-Q89 WeakPolarHBondContact O-CB 3.24Å; L86-Q89 PolarHBondContact O-N 3.08Å; L86-E90 PolarHBondContact O-N 2.96Å |
| 87 | R | 81.5 | Confident | 78.1 | Confident | 176 Ų | 176 | 97.9 Ų | 97.9 | 66% | 0.664 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.1 | -39.8 | 173.1 | -83.5 | -170.2 | 172.3 | 116 | -1.5 | 112.3 | A83 G84 Q89 E90 E91 | A83-R87 PolarHBondContact O-N 3.27Å; A83-R87 VanDerWaalsContact O-N 3.15Å; G84-R87 PolarHBondContact O-N 3.24Å; R87-Q89 VanDerWaalsContact C-N 3.34Å; R87-E90 PolarHBondContact O-N 3.47Å; R87-E91 WeakPolarHBondContact O-CG 3.37Å; R87-E91 PolarHBondContact O-N 3.44Å |
| 88 | Q | 83.1 | Confident | 79.4 | Confident | 114 Ų | 114 | 99.8 Ų | 99.8 | 53% | 0.533 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.7 | -36.2 | 178.2 | -165 | 170.2 | 8.6 | 0 | 0 | 111.8 | G84 L85 L86 E91 L92 | G84-Q88 WeakPolarHBondContact O-CB 3.45Å; G84-Q88 PolarHBondContact O-N 3.01Å; L85-Q88 PolarHBondContact O-N 3.4Å; L86-Q88 VanDerWaalsContact C-N 3.33Å; L86-Q88 PolarHBondContact O-N 2.96Å; Q88-E91 PolarHBondContact O-N 2.96Å; Q88-L92 WeakPolarHBondContact O-CB 3.48Å; Q88-L92 VanDerWaalsContact O-CG 3.26Å; Q88-L92 WeakPolarHBondContact O-CG 3.45Å; Q88-L92 PolarHBondContact O-N 2.89Å |
| 89 | Q | 83.8 | Confident | 80.3 | Confident | 107 Ų | 107 | 101.5 Ų | 101.5 | 50% | 0.5 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.6 | -45.5 | 173 | -167.8 | 68.9 | 37.3 | 0 | 0 | 111.3 | L85 L86 R87 E91 L92 D93 | L85-Q89 WeakPolarHBondContact O-CB 3.35Å; L85-Q89 PolarHBondContact O-N 3.4Å; L86-Q89 WeakPolarHBondContact O-CB 3.24Å; L86-Q89 PolarHBondContact O-N 3.08Å; R87-Q89 VanDerWaalsContact C-N 3.34Å; Q89-E91 PolarHBondContact O-N 2.95Å; Q89-L92 PolarHBondContact O-N 3.35Å; Q89-D93 PolarHBondContact O-N 3.24Å |
| 90 | E | 86.7 | Confident | 81.2 | Confident | 142 Ų | 142 | 104 Ų | 104 | 66% | 0.664 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.2 | -38.6 | 177.6 | -170.7 | 177.9 | -177.6 | 0 | 0 | 112.2 | L86 R87 R94 | L86-E90 PolarHBondContact O-N 2.96Å; R87-E90 PolarHBondContact O-N 3.47Å; E90-R94 WeakPolarHBondContact O-CB 3.26Å; E90-R94 PolarHBondContact O-N 3.05Å |
| 91 | E | 85.6 | Confident | 82.2 | Confident | 122 Ų | 122 | 108.9 Ų | 108.9 | 57% | 0.57 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.1 | -36.6 | 174 | -76.3 | -175.6 | -175 | 0 | 0 | 113.1 | R87 Q88 Q89 K95 | R87-E91 WeakPolarHBondContact O-CG 3.37Å; R87-E91 PolarHBondContact O-N 3.44Å; Q88-E91 PolarHBondContact O-N 2.96Å; Q89-E91 PolarHBondContact O-N 2.95Å; E91-K95 PolarHBondContact O-N 3.21Å |
| 92 | L | 78.4 | Confident | 82.8 | Confident | 96 Ų | 96 | 111.6 Ų | 111.6 | 50% | 0.503 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.8 | -44.2 | 175.9 | -75.8 | 173 | 0 | 0 | 0 | 111.4 | Q88 Q89 R94 K95 A96 | Q88-L92 WeakPolarHBondContact O-CB 3.48Å; Q88-L92 VanDerWaalsContact O-CG 3.26Å; Q88-L92 WeakPolarHBondContact O-CG 3.45Å; Q88-L92 PolarHBondContact O-N 2.89Å; Q89-L92 PolarHBondContact O-N 3.35Å; L92-R94 VanDerWaalsContact C-N 3.29Å; L92-R94 PolarHBondContact O-N 3.35Å; L92-K95 PolarHBondContact O-N 2.99Å; L92-K95 VanDerWaalsContact O-N 3.15Å; L92-A96 WeakPolarHBondContact O-CB 3.45Å; L92-A96 PolarHBondContact O-N 3.36Å |
| 93 | D | 85.6 | Confident | 83.2 | Confident | 96 Ų | 96 | 111.6 Ų | 111.6 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.3 | -38 | 177.6 | -74.1 | -14 | 0 | 0 | 0 | 111.2 | Q89 A96 A97 | Q89-D93 PolarHBondContact O-N 3.24Å; D93-A96 PolarHBondContact O-N 3.28Å; D93-A97 PolarHBondContact O-N 3.41Å |
| 94 | R | 89.4 | Confident | 83.5 | Confident | 193 Ų | 193 | 116.9 Ų | 116.9 | 73% | 0.728 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -63.6 | -41.6 | 173.4 | -179.3 | 178.4 | 155.8 | 178 | -6.2 | 112.4 | E90 L92 E98 | E90-R94 WeakPolarHBondContact O-CB 3.26Å; E90-R94 PolarHBondContact O-N 3.05Å; L92-R94 VanDerWaalsContact C-N 3.29Å; L92-R94 PolarHBondContact O-N 3.35Å; R94-E98 PolarHBondContact O-N 2.85Å; R94-E98 VanDerWaalsContact O-N 3.16Å |
| 95 | K | 87.4 | Confident | 83.7 | Confident | 137 Ų | 137 | 119.4 Ų | 119.4 | 60% | 0.596 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -69 | -38 | 176.5 | -78.2 | -178.9 | -179.5 | 171.8 | 0 | 112 | E91 L92 E98 L99 | E91-K95 PolarHBondContact O-N 3.21Å; L92-K95 PolarHBondContact O-N 2.99Å; L92-K95 VanDerWaalsContact O-N 3.15Å; K95-E98 PolarHBondContact O-N 2.89Å; K95-L99 WeakPolarHBondContact O-CB 3.5Å; K95-L99 PolarHBondContact O-N 3.16Å |
| 96 | A | 83.9 | Confident | 83.4 | Confident | 56 Ų | 56 | 119.8 Ų | 119.8 | 46% | 0.463 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.8 | -44.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | L92 D93 E98 L99 E100 | L92-A96 WeakPolarHBondContact O-CB 3.45Å; L92-A96 PolarHBondContact O-N 3.36Å; D93-A96 PolarHBondContact O-N 3.28Å; A96-E98 PolarHBondContact O-N 3.47Å; A96-L99 PolarHBondContact O-N 3.37Å; A96-E100 WeakPolarHBondContact O-CB 3.3Å; A96-E100 PolarHBondContact O-N 2.93Å |
| 97 | A | 85.1 | Confident | 83 | Confident | 59 Ų | 59 | 119.8 Ų | 119.8 | 49% | 0.488 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.2 | -36.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | D93 R101 | D93-A97 PolarHBondContact O-N 3.41Å; A97-R101 WeakPolarHBondContact O-CB 3.21Å; A97-R101 PolarHBondContact O-N 3.41Å |
| 98 | E | 85.6 | Confident | 82.6 | Confident | 96 Ų | 96 | 116 Ų | 116 | 45% | 0.449 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.7 | -39.4 | 174.8 | -167.4 | -174.1 | 152 | 0 | 0 | 111.8 | R94 K95 A96 R101 K102 | R94-E98 PolarHBondContact O-N 2.85Å; R94-E98 VanDerWaalsContact O-N 3.16Å; K95-E98 PolarHBondContact O-N 2.89Å; A96-E98 PolarHBondContact O-N 3.47Å; E98-R101 PolarHBondContact O-N 2.87Å; E98-K102 PolarHBondContact O-N 3.28Å; E98-K102 IonicContact OE1-NZ 2.95Å; E98-K102 PolarHBondContact OE1-NZ 3.48Å |
| 99 | L | 80.1 | Confident | 81.9 | Confident | 121 Ų | 121 | 114.4 Ų | 114.4 | 63% | 0.634 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -68.3 | -41.6 | 179.8 | -151.5 | 140.2 | 0 | 0 | 0 | 111 | K95 A96 R101 K102 E103 | K95-L99 WeakPolarHBondContact O-CB 3.5Å; K95-L99 PolarHBondContact O-N 3.16Å; A96-L99 PolarHBondContact O-N 3.37Å; L99-R101 VanDerWaalsContact C-N 3.32Å; L99-R101 PolarHBondContact O-N 3.42Å; L99-K102 PolarHBondContact O-N 3.22Å; L99-E103 WeakPolarHBondContact O-CB 3.42Å; L99-E103 PolarHBondContact O-N 3.13Å |
| 100 | E | 87.9 | Confident | 80.9 | Confident | 118 Ų | 118 | 112.8 Ų | 112.8 | 55% | 0.551 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.4 | -38.1 | 172.8 | -171.4 | -179.4 | 177.9 | 0 | 0 | 111.4 | A96 E103 R104 | A96-E100 WeakPolarHBondContact O-CB 3.3Å; A96-E100 PolarHBondContact O-N 2.93Å; E100-E103 PolarHBondContact O-N 3.05Å; E100-R104 VanDerWaalsContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CB 3.49Å; E100-R104 PolarHBondContact O-N 3.18Å |
| 101 | R | 87.6 | Confident | 79.6 | Confident | 165 Ų | 165 | 108.3 Ų | 108.3 | 62% | 0.623 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64 | -44.5 | 174.8 | -158.6 | -173 | 109.4 | 174.1 | 3.1 | 111.5 | A97 E98 L99 R104 E105 | A97-R101 WeakPolarHBondContact O-CB 3.21Å; A97-R101 PolarHBondContact O-N 3.41Å; E98-R101 PolarHBondContact O-N 2.87Å; L99-R101 VanDerWaalsContact C-N 3.32Å; L99-R101 PolarHBondContact O-N 3.42Å; R101-R104 PolarHBondContact O-N 3.23Å; R101-E105 IonicContact CZ-OE1 3.34Å; R101-E105 IonicContact NE-OE1 2.81Å; R101-E105 PolarHBondContact NE-OE1 3.13Å; R101-E105 IonicContact NH2-OE1 2.98Å; R101-E105 PolarHBondContact NH2-OE1 2.95Å; R101-E105 WeakPolarHBondContact O-CB 3.44Å; R101-E105 VanDerWaalsContact O-CG 3.29Å; R101-E105 WeakPolarHBondContact O-CG 3.43Å; R101-E105 PolarHBondContact O-N 2.96Å |
| 102 | K | 83.9 | Confident | 78.2 | Confident | 112 Ų | 112 | 108 Ų | 108 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.2 | -38.5 | 175.4 | -77.1 | -175.5 | -176.4 | 157.9 | 0 | 112.1 | E98 L99 R104 E105 L106 | E98-K102 PolarHBondContact O-N 3.28Å; E98-K102 IonicContact OE1-NZ 2.95Å; E98-K102 PolarHBondContact OE1-NZ 3.48Å; L99-K102 PolarHBondContact O-N 3.22Å; K102-R104 VanDerWaalsContact C-N 3.34Å; K102-E105 PolarHBondContact O-N 3.31Å; K102-L106 WeakPolarHBondContact O-CB 3.33Å; K102-L106 PolarHBondContact O-N 2.95Å |
| 103 | E | 80.8 | Confident | 77.2 | Confident | 119 Ų | 119 | 107 Ų | 107 | 56% | 0.556 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.4 | -42.9 | 174.5 | -173.7 | 175.4 | -171.5 | 0 | 0 | 110.6 | L99 E100 L106 Q107 | L99-E103 WeakPolarHBondContact O-CB 3.42Å; L99-E103 PolarHBondContact O-N 3.13Å; E100-E103 PolarHBondContact O-N 3.05Å; E103-L106 PolarHBondContact O-N 3.43Å; E103-Q107 WeakPolarHBondContact O-CB 3.47Å; E103-Q107 PolarHBondContact O-N 3.39Å |
| 104 | R | 81.4 | Confident | 75.5 | Confident | 156 Ų | 156 | 107.9 Ų | 107.9 | 59% | 0.589 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -68.5 | -36.1 | 177.2 | -154.2 | 171 | -167.7 | 147.7 | 0.2 | 112.5 | E100 R101 K102 N108 | E100-R104 VanDerWaalsContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CB 3.49Å; E100-R104 PolarHBondContact O-N 3.18Å; R101-R104 PolarHBondContact O-N 3.23Å; K102-R104 VanDerWaalsContact C-N 3.34Å; R104-N108 VanDerWaalsContact O-CB 3.23Å; R104-N108 WeakPolarHBondContact O-CB 3.46Å; R104-N108 PolarHBondContact O-N 3.24Å; R104-N108 PolarHBondContact O-ND2 2.91Å |
| 105 | E | 81.6 | Confident | 73.7 | Confident | 88 Ų | 88 | 103.9 Ų | 103.9 | 41% | 0.411 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.5 | -44.1 | 172 | -75.4 | 172.8 | -166.3 | 0 | 0 | 111.2 | R101 K102 T109 | R101-E105 IonicContact CZ-OE1 3.34Å; R101-E105 IonicContact NE-OE1 2.81Å; R101-E105 PolarHBondContact NE-OE1 3.13Å; R101-E105 IonicContact NH2-OE1 2.98Å; R101-E105 PolarHBondContact NH2-OE1 2.95Å; R101-E105 WeakPolarHBondContact O-CB 3.44Å; R101-E105 VanDerWaalsContact O-CG 3.29Å; R101-E105 WeakPolarHBondContact O-CG 3.43Å; R101-E105 PolarHBondContact O-N 2.96Å; K102-E105 PolarHBondContact O-N 3.31Å; E105-T109 WeakPolarHBondContact O-CB 3.4Å; E105-T109 PolarHBondContact O-N 2.93Å; E105-T109 PolarHBondContact O-OG1 3.15Å |
| 106 | L | 69.6 | Low | 72 | Confident | 117 Ų | 117 | 107.1 Ų | 107.1 | 61% | 0.613 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.7 | -44.4 | 173.2 | -91.3 | 162.4 | 0 | 0 | 0 | 111.7 | K102 E103 T109 V110 | K102-L106 WeakPolarHBondContact O-CB 3.33Å; K102-L106 PolarHBondContact O-N 2.95Å; E103-L106 PolarHBondContact O-N 3.43Å; L106-T109 WeakPolarHBondContact O-CB 3.48Å; L106-T109 PolarHBondContact O-N 3.16Å; L106-T109 VanDerWaalsContact O-N 3.16Å; L106-V110 WeakPolarHBondContact O-CB 3.36Å; L106-V110 VanDerWaalsContact O-CG2 3.27Å; L106-V110 WeakPolarHBondContact O-CG2 3.38Å; L106-V110 PolarHBondContact O-N 3.07Å |
| 107 | Q | 74.6 | Confident | 70.4 | Confident | 126 Ų | 126 | 111.1 Ų | 111.1 | 59% | 0.589 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.8 | -39 | 179.9 | -164.2 | 173.8 | 19 | 0 | 0 | 111.3 | E103 V110 A111 | E103-Q107 WeakPolarHBondContact O-CB 3.47Å; E103-Q107 PolarHBondContact O-N 3.39Å; Q107-V110 PolarHBondContact O-N 3.02Å; Q107-A111 WeakPolarHBondContact O-CB 3.41Å; Q107-A111 PolarHBondContact O-N 2.91Å |
| 108 | N | 72.4 | Confident | 68.9 | Low | 96 Ų | 96 | 113.6 Ų | 113.6 | 51% | 0.513 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.8 | -35.1 | 171.1 | -83.8 | -20.9 | 0 | 0 | 0 | 112.4 | R104 N112 | R104-N108 VanDerWaalsContact O-CB 3.23Å; R104-N108 WeakPolarHBondContact O-CB 3.46Å; R104-N108 PolarHBondContact O-N 3.24Å; R104-N108 PolarHBondContact O-ND2 2.91Å; N108-N112 WeakPolarHBondContact O-CB 3.48Å; N108-N112 PolarHBondContact O-N 3.38Å; N108-N112 PolarHBondContact O-ND2 3.41Å |
| 109 | T | 67.6 | Low | 67.2 | Low | 80 Ų | 80 | 114 Ų | 114 | 49% | 0.491 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68.5 | -44.3 | 175.6 | -57.8 | 0 | 0 | 0 | 0 | 110.9 | E105 L106 N112 L113 | E105-T109 WeakPolarHBondContact O-CB 3.4Å; E105-T109 PolarHBondContact O-N 2.93Å; E105-T109 PolarHBondContact O-OG1 3.15Å; L106-T109 WeakPolarHBondContact O-CB 3.48Å; L106-T109 PolarHBondContact O-N 3.16Å; L106-T109 VanDerWaalsContact O-N 3.16Å; T109-N112 PolarHBondContact O-N 3.44Å; T109-L113 HydrophobicContact CG2-CD1 4.31Å; T109-L113 WeakPolarHBondContact O-CG 3.48Å; T109-L113 PolarHBondContact O-N 3.31Å |
| 110 | V | 62.9 | Low | 65.7 | Low | 74 Ų | 74 | 110.3 Ų | 110.3 | 45% | 0.448 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.3 | -40.3 | 173.9 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | L106 Q107 L113 H114 | L106-V110 WeakPolarHBondContact O-CB 3.36Å; L106-V110 VanDerWaalsContact O-CG2 3.27Å; L106-V110 WeakPolarHBondContact O-CG2 3.38Å; L106-V110 PolarHBondContact O-N 3.07Å; Q107-V110 PolarHBondContact O-N 3.02Å; V110-L113 PolarHBondContact O-N 3.05Å; V110-H114 PolarHBondContact O-N 3.15Å |
| 111 | A | 60.3 | Low | 63.9 | Low | 47 Ų | 47 | 109.6 Ų | 109.6 | 39% | 0.388 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66 | -38.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q107 H114 V115 | Q107-A111 WeakPolarHBondContact O-CB 3.41Å; Q107-A111 PolarHBondContact O-N 2.91Å; A111-H114 PolarHBondContact O-N 3.45Å; A111-V115 WeakPolarHBondContact O-CG2 3.22Å |
| 112 | N | 56.9 | Low | 62 | Low | 116 Ų | 116 | 104.9 Ų | 104.9 | 62% | 0.62 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -73 | -31.3 | 175.8 | -88.9 | -84.6 | 0 | 0 | 0 | 113 | N108 T109 H114 V115 | N108-N112 WeakPolarHBondContact O-CB 3.48Å; N108-N112 PolarHBondContact O-N 3.38Å; N108-N112 PolarHBondContact O-ND2 3.41Å; T109-N112 PolarHBondContact O-N 3.44Å; N112-H114 VanDerWaalsContact C-N 3.3Å; N112-H114 PolarHBondContact O-N 3.37Å; N112-V115 PolarHBondContact O-N 2.85Å |
| 113 | L | 55.7 | Low | 60.7 | Low | 76 Ų | 76 | 104.3 Ų | 104.3 | 40% | 0.398 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64 | -35.9 | 172 | -79.2 | 162.9 | 0 | 0 | 0 | 111.8 | T109 V110 V115 Y133 | T109-L113 HydrophobicContact CG2-CD1 4.31Å; T109-L113 WeakPolarHBondContact O-CG 3.48Å; T109-L113 PolarHBondContact O-N 3.31Å; V110-L113 PolarHBondContact O-N 3.05Å; L113-V115 PolarHBondContact O-N 3.05Å; L113-V115 VanDerWaalsContact O-N 3.16Å; L113-Y133 WeakPolarHBondContact O-CD2 3.28Å; L113-Y133 VanDerWaalsContact O-CE2 3.22Å; L113-Y133 WeakPolarHBondContact O-CE2 3.36Å |
| 114 | H | 50.8 | Low | 59.5 | Low | 114 Ų | 114 | 105.1 Ų | 105.1 | 53% | 0.528 | 55% | 0.551 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.2 | -7.6 | 175.5 | -75.4 | 157.4 | 0 | 0 | 0 | 114.9 | V110 A111 N112 | V110-H114 PolarHBondContact O-N 3.15Å; A111-H114 PolarHBondContact O-N 3.45Å; N112-H114 VanDerWaalsContact C-N 3.3Å; N112-H114 PolarHBondContact O-N 3.37Å |
| 115 | V | 52.3 | Low | 58.3 | Low | 109 Ų | 109 | 109 Ų | 109 | 66% | 0.661 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.5 | -5.8 | -174.9 | 177.1 | 0 | 0 | 0 | 0 | 113.6 | A111 N112 L113 E117 | A111-V115 WeakPolarHBondContact O-CG2 3.22Å; N112-V115 PolarHBondContact O-N 2.85Å; L113-V115 PolarHBondContact O-N 3.05Å; L113-V115 VanDerWaalsContact O-N 3.16Å; V115-E117 PolarHBondContact O-N 3.08Å; V115-E117 VanDerWaalsContact O-N 3.11Å |
| 116 | R | 50.8 | Low | 56.4 | Low | 204 Ų | 204 | 107.3 Ų | 107.3 | 77% | 0.77 | 56% | 0.563 | S | S | * | * | trans | -88.9 | 73.2 | -177.2 | -112.7 | -171.7 | -178 | 179.2 | 2.3 | 114 | N118 Y133 | R116-N118 PolarHBondContact O-N 3.42Å; R116-N118 VanDerWaalsContact O-N 3.08Å; R116-Y133 HydrophobicContact CB-CD2 4.3Å; R116-Y133 HydrophobicContact CB-CE2 3.86Å; R116-Y133 WeakPolarHBondContact O-CD2 3.31Å; R116-Y133 WeakPolarHBondContact O-CE2 3.37Å | ||
| 117 | E | 50.5 | Low | 55.4 | Low | 140 Ų | 140 | 107.8 Ų | 107.8 | 65% | 0.654 | 57% | 0.573 | S | S | * | * | trans | -46.5 | 111.9 | 174.2 | -65.6 | -178.4 | 179.4 | 0 | 0 | 112.7 | V115 P130 | V115-E117 PolarHBondContact O-N 3.08Å; V115-E117 VanDerWaalsContact O-N 3.11Å; E117-P130 HydrophobicContact CB-CB 4.17Å | ||
| 118 | N | 52.9 | Low | 54 | Low | 112 Ų | 112 | 106.1 Ų | 106.1 | 60% | 0.599 | 57% | 0.571 | S | S | * | * | trans | -133.8 | 19.2 | -175 | -169.9 | 47.4 | 0 | 0 | 0 | 113.9 | R116 | R116-N118 PolarHBondContact O-N 3.42Å; R116-N118 VanDerWaalsContact O-N 3.08Å | ||
| 119 | W | 51.3 | Low | 52.7 | Low | 104 Ų | 104 | 109.5 Ų | 109.5 | 39% | 0.394 | 58% | 0.582 | S | S | . | * | S | Bend | trans | -162.2 | 140.6 | 168.9 | -160.7 | -101.1 | 0 | 0 | 0 | 116 | P121 Y152 M156 | W119-P121 HydrophobicContact CE3-CG 4.4Å; W119-P121 VanDerWaalsContact CZ3-CD 3.41Å; W119-P121 HydrophobicContact CZ3-CG 4.05Å; W119-Y152 WeakPolarHBondContact CZ2-OH 3.44Å; W119-Y152 AromaticContact NE1-CZ 3.77Å; W119-Y152 PolarHBondContact NE1-OH 3.32Å; W119-M156 HydrophobicContact CZ2-SD 4.2Å |
| 120 | P | 47.6 | Very low | 51.9 | Low | 43 Ų | 43 | 107.9 Ų | 107.9 | 28% | 0.279 | 57% | 0.572 | S | S | . | * | cis | -80.9 | 150.1 | -13.2 | 6 | 11.4 | 0 | 0 | 0 | 111.4 | L122 | P120-L122 HydrophobicContact CB-CD2 4.42Å; P120-L122 HydrophobicContact CB-CG 4.05Å; P120-L122 HydrophobicContact CG-CD1 4.12Å; P120-L122 HydrophobicContact CG-CD2 4.39Å; P120-L122 HydrophobicContact CG-CG 3.99Å; P120-L122 PolarHBondContact O-N 2.89Å | ||
| 121 | P | 50.5 | Low | 51.3 | Low | 103 Ų | 103 | 109.7 Ų | 109.7 | 67% | 0.669 | 59% | 0.587 | S | S | * | * | trans | -69.2 | 79.7 | 163.1 | 30.8 | -32.9 | 0 | 0 | 0 | 108 | W119 | W119-P121 HydrophobicContact CE3-CG 4.4Å; W119-P121 VanDerWaalsContact CZ3-CD 3.41Å; W119-P121 HydrophobicContact CZ3-CG 4.05Å | ||
| 122 | L | 47.4 | Very low | 50.9 | Low | 66 Ų | 66 | 110.8 Ų | 110.8 | 35% | 0.346 | 58% | 0.583 | S | S | . | * | trans | -74.3 | 139.6 | 174 | -71.4 | 164.6 | 0 | 0 | 0 | 108.5 | P120 C126 V128 | P120-L122 HydrophobicContact CB-CD2 4.42Å; P120-L122 HydrophobicContact CB-CG 4.05Å; P120-L122 HydrophobicContact CG-CD1 4.12Å; P120-L122 HydrophobicContact CG-CD2 4.39Å; P120-L122 HydrophobicContact CG-CG 3.99Å; P120-L122 PolarHBondContact O-N 2.89Å; L122-C126 HydrophobicContact CB-CB 3.8Å; L122-C126 HydrophobicContact CD1-CB 3.97Å; L122-C126 HydrophobicContact CD2-CB 4.02Å; L122-C126 HydrophobicContact CG-CB 4.14Å; L122-V128 HydrophobicContact CD1-CB 3.76Å; L122-V128 HydrophobicContact CD1-CG1 4.21Å; L122-V128 VanDerWaalsContact CD1-O 3.23Å; L122-V128 WeakPolarHBondContact CD1-O 3.46Å | ||
| 123 | P | 56.5 | Low | 50.5 | Low | 100 Ų | 100 | 107.3 Ų | 107.3 | 65% | 0.649 | 56% | 0.561 | S | S | * | * | trans | -51.2 | 147 | 163.7 | -20.6 | 30.7 | 0 | 0 | 0 | 109.6 | W125 C126 | P123-W125 PolarHBondContact O-N 3.45Å; P123-C126 PolarHBondContact O-N 2.86Å | ||
| 124 | S | 56.7 | Low | 50.4 | Low | 137 Ų | 137 | 104.5 Ų | 104.5 | 96% | 0.958 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -5.8 | -175.8 | 54.1 | 0 | 0 | 0 | 0 | 115.9 | ||
| 125 | W | 55.3 | Low | 50.6 | Low | 236 Ų | 236 | 101 Ų | 101 | 89% | 0.894 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.3 | -5.3 | 179.2 | -168.4 | 67.7 | 0 | 0 | 0 | 114.2 | P123 | P123-W125 PolarHBondContact O-N 3.45Š|
| 126 | C | 42.8 | Very low | 50.8 | Low | 54 Ų | 54 | 97.1 Ų | 97.1 | 37% | 0.365 | 51% | 0.506 | S | S | . | . | trans | -88.7 | 123.1 | 177.3 | -156.1 | 0 | 0 | 0 | 0 | 111.2 | L122 P123 V128 | L122-C126 HydrophobicContact CB-CB 3.8Å; L122-C126 HydrophobicContact CD1-CB 3.97Å; L122-C126 HydrophobicContact CD2-CB 4.02Å; L122-C126 HydrophobicContact CG-CB 4.14Å; P123-C126 PolarHBondContact O-N 2.86Å; C126-V128 PolarHBondContact O-N 2.95Å; C126-V128 VanDerWaalsContact O-N 3.14Å | ||
| 127 | P | 47.3 | Very low | 50.9 | Low | 126 Ų | 126 | 91.2 Ų | 91.2 | 82% | 0.818 | 50% | 0.496 | S | S | * | . | trans | -74.6 | 3.2 | -179.3 | 27.9 | -33.2 | 0 | 0 | 0 | 114.4 | K129 | P127-K129 PolarHBondContact O-N 2.84Š| ||
| 128 | V | 46.5 | Very low | 51.1 | Low | 92 Ų | 92 | 88.8 Ų | 88.8 | 56% | 0.558 | 49% | 0.49 | S | S | * | . | trans | -83.8 | 107.6 | 176.5 | -176.7 | 0 | 0 | 0 | 0 | 108.3 | L122 C126 | L122-V128 HydrophobicContact CD1-CB 3.76Å; L122-V128 HydrophobicContact CD1-CG1 4.21Å; L122-V128 VanDerWaalsContact CD1-O 3.23Å; L122-V128 WeakPolarHBondContact CD1-O 3.46Å; C126-V128 PolarHBondContact O-N 2.95Å; C126-V128 VanDerWaalsContact O-N 3.14Å | ||
| 129 | K | 45.3 | Very low | 51.4 | Low | 167 Ų | 167 | 84.9 Ų | 84.9 | 73% | 0.726 | 47% | 0.469 | S | S | * | . | trans | -59.6 | 145.3 | 172.9 | -75.1 | 173.8 | 174.5 | 156 | 0 | 110.3 | P127 C131 | P127-K129 PolarHBondContact O-N 2.84Å; K129-C131 VanDerWaalsContact C-N 3.3Å; K129-C131 PolarHBondContact O-N 3.31Å | ||
| 130 | P | 50.7 | Low | 51.9 | Low | 45 Ų | 45 | 80.1 Ų | 80.1 | 29% | 0.292 | 45% | 0.451 | S | S | . | . | trans | -64.7 | 87.9 | 172.4 | -15.1 | 29.4 | 0 | 0 | 0 | 110.2 | E117 F132 | E117-P130 HydrophobicContact CB-CB 4.17Å; P130-F132 VanDerWaalsContact C-N 3.29Å; P130-F132 PolarHBondContact O-N 3.15Å | ||
| 131 | C | 50.4 | Low | 52.9 | Low | 112 Ų | 112 | 81.4 Ų | 81.4 | 76% | 0.757 | 46% | 0.459 | S | S | * | . | trans | -85.7 | 12.8 | -172.8 | -77.3 | 0 | 0 | 0 | 0 | 114.4 | K129 | K129-C131 VanDerWaalsContact C-N 3.3Å; K129-C131 PolarHBondContact O-N 3.31Å | ||
| 132 | F | 50.8 | Low | 53.8 | Low | 71 Ų | 71 | 80.1 Ų | 80.1 | 31% | 0.311 | 46% | 0.458 | S | S | . | . | trans | -151.6 | 130.1 | -177.3 | -145.2 | -112.4 | 0 | 0 | 0 | 115.1 | P130 Q134 | P130-F132 VanDerWaalsContact C-N 3.29Å; P130-F132 PolarHBondContact O-N 3.15Å; F132-Q134 HydrophobicContact CD1-CB 4.03Å | ||
| 133 | Y | 49.7 | Very low | 54.8 | Low | 42 Ų | 42 | 83.2 Ų | 83.2 | 17% | 0.165 | 47% | 0.474 | C | S | . | . | trans | -80.4 | 114.9 | 160.9 | -174.1 | -95.8 | 0 | 0 | 0 | 108 | L113 R116 D135 | L113-Y133 WeakPolarHBondContact O-CD2 3.28Å; L113-Y133 VanDerWaalsContact O-CE2 3.22Å; L113-Y133 WeakPolarHBondContact O-CE2 3.36Å; R116-Y133 HydrophobicContact CB-CD2 4.3Å; R116-Y133 HydrophobicContact CB-CE2 3.86Å; R116-Y133 WeakPolarHBondContact O-CD2 3.31Å; R116-Y133 WeakPolarHBondContact O-CE2 3.37Å; Y133-D135 HydrophobicContact CD1-CB 4.46Å; Y133-D135 HydrophobicContact CE1-CB 3.66Å | ||
| 134 | Q | 52.6 | Low | 55.7 | Low | 18 Ų | 18 | 79.9 Ų | 79.9 | 8% | 0.084 | 45% | 0.449 | C | S | . | . | trans | -126.9 | 83.7 | 177.5 | -171.5 | 60.5 | 89.5 | 0 | 0 | 109.5 | F132 F136 Y202 Y206 | F132-Q134 HydrophobicContact CD1-CB 4.03Å; Q134-F136 HydrophobicContact CG-CD2 4.3Å; Q134-F136 HydrophobicContact CG-CE1 4.37Å; Q134-F136 HydrophobicContact CG-CE2 3.71Å; Q134-F136 HydrophobicContact CG-CZ 3.74Å; Q134-Y202 PolarHBondContact OE1-OH 3.46Å; Q134-Y206 PolarHBondContact NE2-OH 3.35Å | ||
| 135 | D | 53.9 | Low | 56.8 | Low | 41 Ų | 41 | 75.2 Ų | 75.2 | 22% | 0.219 | 41% | 0.412 | C | S | . | . | trans | -104.3 | 97.6 | 171.2 | -167.9 | -7 | 0 | 0 | 0 | 110.5 | Y133 S137 T138 E139 | Y133-D135 HydrophobicContact CD1-CB 4.46Å; Y133-D135 HydrophobicContact CE1-CB 3.66Å; D135-S137 PolarHBondContact O-N 3.36Å; D135-S137 WeakPolarHBondContact OD1-CB 3.45Å; D135-S137 PolarHBondContact OD1-N 3.44Å; D135-S137 PolarHBondContact OD1-OG 2.91Å; D135-T138 VanDerWaalsContact CG-OG1 3.3Å; D135-T138 PolarHBondContact O-N 3.36Å; D135-T138 PolarHBondContact OD2-OG1 3.45Å; D135-E139 PolarHBondContact O-N 2.96Å; D135-E139 VanDerWaalsContact O-N 3.16Å | ||
| 136 | F | 58.3 | Low | 58.1 | Low | 27 Ų | 27 | 73.6 Ų | 73.6 | 12% | 0.118 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -59.2 | -26.2 | 176.6 | -64.2 | -81.5 | 0 | 0 | 0 | 112.8 | Q134 I140 Q145 C148 K149 Y152 | Q134-F136 HydrophobicContact CG-CD2 4.3Å; Q134-F136 HydrophobicContact CG-CE1 4.37Å; Q134-F136 HydrophobicContact CG-CE2 3.71Å; Q134-F136 HydrophobicContact CG-CZ 3.74Å; F136-I140 HydrophobicContact CD1-CD1 4.28Å; F136-Q145 VanDerWaalsContact O-CD 3.26Å; F136-Q145 WeakPolarHBondContact O-CG 3.28Å; F136-Q145 PolarHBondContact O-NE2 2.81Å; F136-Q145 VanDerWaalsContact O-NE2 3.1Å; F136-C148 HydrophobicContact CD1-CB 4.38Å; F136-C148 HydrophobicContact CE1-CB 4.41Å; F136-K149 VanDerWaalsContact CB-CE 3.47Å; F136-K149 HydrophobicContact CB-CG 4.34Å; F136-K149 HydrophobicContact CD1-CG 3.93Å; F136-K149 HydrophobicContact CD2-CG 4.05Å; F136-K149 HydrophobicContact CE1-CG 4.23Å; F136-K149 HydrophobicContact CE2-CG 4.34Å; F136-K149 HydrophobicContact CG-CG 3.84Å; F136-K149 HydrophobicContact CZ-CG 4.43Å; F136-Y152 HydrophobicContact CZ-CD1 4.21Å; F136-Y152 AromaticContact CZ-CG 3.95Å; F136-Y152 HydrophobicContact CZ-CG 3.95Å |
| 137 | S | 52.8 | Low | 60.2 | Low | 79 Ų | 79 | 72.1 Ų | 72.1 | 55% | 0.552 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -75.3 | -33.5 | -174.5 | -19.9 | 0 | 0 | 0 | 0 | 112 | D135 Q145 | D135-S137 PolarHBondContact O-N 3.36Å; D135-S137 WeakPolarHBondContact OD1-CB 3.45Å; D135-S137 PolarHBondContact OD1-N 3.44Å; D135-S137 PolarHBondContact OD1-OG 2.91Å; S137-Q145 PolarHBondContact O-NE2 3Å |
| 138 | T | 54.3 | Low | 62.1 | Low | 89 Ų | 89 | 66.1 Ų | 66.1 | 55% | 0.546 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -103 | -27.8 | -169.2 | -47.5 | 0 | 0 | 0 | 0 | 111.6 | D135 | D135-T138 VanDerWaalsContact CG-OG1 3.3Å; D135-T138 PolarHBondContact O-N 3.36Å; D135-T138 PolarHBondContact OD2-OG1 3.45Å |
| 139 | E | 58 | Low | 63.9 | Low | 30 Ų | 30 | 65.3 Ų | 65.3 | 14% | 0.14 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -102.3 | -16 | -175.5 | -61.6 | -161.8 | 178.8 | 0 | 0 | 115.9 | D135 Y206 R210 | D135-E139 PolarHBondContact O-N 2.96Å; D135-E139 VanDerWaalsContact O-N 3.16Å; E139-Y206 VanDerWaalsContact CD-OH 3.3Å; E139-Y206 PolarHBondContact OE2-OH 3.4Å; E139-R210 IonicContact OE1-CZ 3.98Å; E139-R210 IonicContact OE1-NH1 3.3Å; E139-R210 PolarHBondContact OE1-NH1 2.95Å; E139-R210 IonicContact OE2-CZ 3.39Å; E139-R210 IonicContact OE2-NE 3.71Å; E139-R210 IonicContact OE2-NH1 2.68Å; E139-R210 PolarHBondContact OE2-NH1 3.22Å |
| 140 | I | 63.5 | Low | 66 | Low | 5 Ų | 5 | 60.7 Ų | 60.7 | 3% | 0.026 | 33% | 0.326 | C | S | . | . | S | Bend | trans | -123.3 | 131.7 | -175.8 | -64.3 | -173.5 | 0 | 0 | 0 | 109.7 | F136 Q145 C148 Y206 F209 | F136-I140 HydrophobicContact CD1-CD1 4.28Å; I140-Q145 HydrophobicContact CB-CG 4.05Å; I140-Q145 HydrophobicContact CG2-CG 3.89Å; I140-Q145 WeakPolarHBondContact O-CG 3.39Å; I140-Q145 PolarHBondContact O-NE2 3.5Å; I140-C148 HydrophobicContact CD1-CB 3.75Å; I140-C148 WeakPolarHBondContact CD1-SG 3.4Å; I140-Y206 HydrophobicContact CD1-CD2 3.98Å; I140-Y206 HydrophobicContact CD1-CE2 3.65Å; I140-Y206 HydrophobicContact CG1-CE2 4.24Å; I140-F209 HydrophobicContact CD1-CB 4.14Å; I140-F209 HydrophobicContact CG1-CB 4.5Å; I140-F209 HydrophobicContact CG2-CB 4.25Å |
| 141 | P | 67.4 | Low | 68 | Low | 69 Ų | 69 | 58.5 Ų | 58.5 | 45% | 0.448 | 31% | 0.312 | S | S | . | . | trans | -59.2 | 143.8 | 176 | -16.6 | 26.8 | 0 | 0 | 0 | 111.5 | D143 Y144 Q145 | P141-D143 PolarHBondContact O-N 2.94Å; P141-Y144 HydrophobicContact CB-CD2 3.95Å; P141-Y144 HydrophobicContact CB-CE2 4.43Å; P141-Y144 HydrophobicContact CG-CD2 3.99Å; P141-Y144 HydrophobicContact CG-CE2 4.4Å; P141-Y144 PolarHBondContact O-N 3.42Å; P141-Q145 PolarHBondContact O-N 2.87Å | ||
| 142 | A | 69.1 | Low | 69.9 | Low | 77 Ų | 77 | 53.9 Ų | 53.9 | 64% | 0.636 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -50.2 | -32.9 | -169.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y144 | A142-Y144 VanDerWaalsContact C-N 3.34Å; A142-Y144 PolarHBondContact O-N 2.72Å |
| 143 | D | 68.8 | Low | 71.7 | Confident | 130 Ų | 130 | 57.5 Ų | 57.5 | 70% | 0.695 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -66 | -31.9 | 179.6 | -61.3 | -42.3 | 0 | 0 | 0 | 113.7 | P141 | P141-D143 PolarHBondContact O-N 2.94Å |
| 144 | Y | 75.6 | Confident | 73.8 | Confident | 31 Ų | 31 | 55.7 Ų | 55.7 | 12% | 0.122 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -94.4 | -19 | -176.8 | -59.7 | -80.3 | 0 | 0 | 0 | 113.1 | P141 A142 R146 I147 C148 F209 L288 T292 | P141-Y144 HydrophobicContact CB-CD2 3.95Å; P141-Y144 HydrophobicContact CB-CE2 4.43Å; P141-Y144 HydrophobicContact CG-CD2 3.99Å; P141-Y144 HydrophobicContact CG-CE2 4.4Å; P141-Y144 PolarHBondContact O-N 3.42Å; A142-Y144 VanDerWaalsContact C-N 3.34Å; A142-Y144 PolarHBondContact O-N 2.72Å; Y144-R146 PolarHBondContact O-N 3.32Å; Y144-I147 PolarHBondContact O-N 3.47Å; Y144-C148 PolarHBondContact O-N 2.81Å; Y144-F209 AromaticContact CD1-CD1 3.43Å; Y144-F209 HydrophobicContact CD1-CD1 3.43Å; Y144-F209 VanDerWaalsContact CD1-CD1 3.43Å; Y144-F209 AromaticContact CD1-CE1 3.63Å; Y144-F209 HydrophobicContact CD1-CE1 3.63Å; Y144-F209 HydrophobicContact CD1-CG 4.41Å; Y144-F209 HydrophobicContact CE1-CD1 4.26Å; Y144-F209 HydrophobicContact CE1-CE1 4.38Å; Y144-F209 AromaticContact CG-CD1 3.92Å; Y144-F209 HydrophobicContact CG-CD1 3.92Å; Y144-F209 HydrophobicContact CG-CE1 4.44Å; Y144-L288 HydrophobicContact CD1-CD1 4.46Å; Y144-L288 HydrophobicContact CD1-CD2 3.15Å; Y144-L288 HydrophobicContact CD1-CG 3.93Å; Y144-L288 HydrophobicContact CE1-CD1 4Å; Y144-L288 HydrophobicContact CE1-CD2 3.33Å; Y144-L288 HydrophobicContact CE1-CG 3.53Å; Y144-L288 HydrophobicContact CG-CD2 4.26Å; Y144-T292 WeakPolarHBondContact OH-CG2 3.43Å; Y144-T292 PolarHBondContact OH-OG1 2.76Å |
| 145 | Q | 79.9 | Confident | 75.8 | Confident | 39 Ų | 39 | 56.9 Ų | 56.9 | 18% | 0.182 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.7 | -43.3 | -172.5 | -68.9 | -177.4 | 4.1 | 0 | 0 | 113.3 | F136 S137 I140 P141 I147 C148 K149 | F136-Q145 VanDerWaalsContact O-CD 3.26Å; F136-Q145 WeakPolarHBondContact O-CG 3.28Å; F136-Q145 PolarHBondContact O-NE2 2.81Å; F136-Q145 VanDerWaalsContact O-NE2 3.1Å; S137-Q145 PolarHBondContact O-NE2 3Å; I140-Q145 HydrophobicContact CB-CG 4.05Å; I140-Q145 HydrophobicContact CG2-CG 3.89Å; I140-Q145 WeakPolarHBondContact O-CG 3.39Å; I140-Q145 PolarHBondContact O-NE2 3.5Å; P141-Q145 PolarHBondContact O-N 2.87Å; Q145-I147 PolarHBondContact O-N 3.47Å; Q145-C148 PolarHBondContact O-N 3.47Å; Q145-K149 WeakPolarHBondContact O-CB 3.21Å; Q145-K149 VanDerWaalsContact O-CG 3.28Å; Q145-K149 WeakPolarHBondContact O-CG 3.28Å; Q145-K149 PolarHBondContact O-N 2.98Å |
| 146 | R | 82.3 | Confident | 77.6 | Confident | 201 Ų | 201 | 57.2 Ų | 57.2 | 76% | 0.758 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -62.9 | -44.5 | -177.9 | -179.9 | 176.6 | -87.5 | 161.2 | -6.6 | 111 | Y144 K149 M150 | Y144-R146 PolarHBondContact O-N 3.32Å; R146-K149 PolarHBondContact O-N 2.91Å; R146-M150 HydrophobicContact CG-SD 4.45Å; R146-M150 VanDerWaalsContact O-CG 3.28Å; R146-M150 WeakPolarHBondContact O-CG 3.34Å; R146-M150 PolarHBondContact O-N 3.44Å |
| 147 | I | 86.6 | Confident | 79.3 | Confident | 23 Ų | 23 | 57.6 Ų | 57.6 | 12% | 0.118 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -69.5 | -43.7 | -179.4 | -70.5 | 163.5 | 0 | 0 | 0 | 110.2 | Y144 Q145 K149 M150 L151 F209 R284 V285 L288 | Y144-I147 PolarHBondContact O-N 3.47Å; Q145-I147 PolarHBondContact O-N 3.47Å; I147-K149 VanDerWaalsContact C-N 3.35Å; I147-K149 PolarHBondContact O-N 3.37Å; I147-M150 PolarHBondContact O-N 3.36Å; I147-M150 VanDerWaalsContact O-N 3.16Å; I147-L151 HydrophobicContact CG2-CD1 3.67Å; I147-L151 WeakPolarHBondContact O-CD1 3.42Å; I147-L151 PolarHBondContact O-N 3.1Å; I147-F209 HydrophobicContact CG2-CE2 4.27Å; I147-F209 HydrophobicContact CG2-CZ 3.94Å; I147-R284 HydrophobicContact CD1-CB 4.29Å; I147-R284 HydrophobicContact CG1-CB 4.5Å; I147-V285 HydrophobicContact CG2-CG2 3.56Å; I147-L288 HydrophobicContact CD1-CD2 3.71Å |
| 148 | C | 86.6 | Confident | 81.3 | Confident | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.5 | -43.9 | 176.1 | -167.1 | 0 | 0 | 0 | 0 | 112.2 | F136 I140 Y144 Q145 M150 L151 Y152 F209 | F136-C148 HydrophobicContact CD1-CB 4.38Å; F136-C148 HydrophobicContact CE1-CB 4.41Å; I140-C148 HydrophobicContact CD1-CB 3.75Å; I140-C148 WeakPolarHBondContact CD1-SG 3.4Å; Y144-C148 PolarHBondContact O-N 2.81Å; Q145-C148 PolarHBondContact O-N 3.47Å; C148-M150 PolarHBondContact O-N 3.32Å; C148-L151 PolarHBondContact O-N 3.36Å; C148-Y152 PolarHBondContact O-N 2.86Å; C148-F209 HydrophobicContact CB-CD2 3.73Å; C148-F209 HydrophobicContact CB-CE2 3.99Å |
| 149 | K | 86.1 | Confident | 83.2 | Confident | 75 Ų | 75 | 50.5 Ų | 50.5 | 33% | 0.326 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.1 | -45 | 173.4 | -74.1 | 173.5 | -174.9 | 173.3 | 0 | 111.8 | F136 Q145 R146 I147 L151 Y152 Y153 | F136-K149 VanDerWaalsContact CB-CE 3.47Å; F136-K149 HydrophobicContact CB-CG 4.34Å; F136-K149 HydrophobicContact CD1-CG 3.93Å; F136-K149 HydrophobicContact CD2-CG 4.05Å; F136-K149 HydrophobicContact CE1-CG 4.23Å; F136-K149 HydrophobicContact CE2-CG 4.34Å; F136-K149 HydrophobicContact CG-CG 3.84Å; F136-K149 HydrophobicContact CZ-CG 4.43Å; Q145-K149 WeakPolarHBondContact O-CB 3.21Å; Q145-K149 VanDerWaalsContact O-CG 3.28Å; Q145-K149 WeakPolarHBondContact O-CG 3.28Å; Q145-K149 PolarHBondContact O-N 2.98Å; R146-K149 PolarHBondContact O-N 2.91Å; I147-K149 VanDerWaalsContact C-N 3.35Å; I147-K149 PolarHBondContact O-N 3.37Å; K149-L151 VanDerWaalsContact C-N 3.33Å; K149-L151 PolarHBondContact O-N 3.19Å; K149-Y152 WeakPolarHBondContact O-CB 3.33Å; K149-Y152 PolarHBondContact O-N 3.16Å; K149-Y153 HydrophobicContact CB-CE2 4.39Å; K149-Y153 WeakPolarHBondContact O-CD2 3.26Å; K149-Y153 PolarHBondContact O-N 3.26Å |
| 150 | M | 89.7 | Confident | 85 | Confident | 70 Ų | 70 | 52.6 Ų | 52.6 | 35% | 0.345 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.8 | -38.9 | 177.6 | -69.2 | -179.8 | 75.6 | 0 | 0 | 112.5 | R146 I147 C148 Y152 Y153 L154 F280 L281 | R146-M150 HydrophobicContact CG-SD 4.45Å; R146-M150 VanDerWaalsContact O-CG 3.28Å; R146-M150 WeakPolarHBondContact O-CG 3.34Å; R146-M150 PolarHBondContact O-N 3.44Å; I147-M150 PolarHBondContact O-N 3.36Å; I147-M150 VanDerWaalsContact O-N 3.16Å; C148-M150 PolarHBondContact O-N 3.32Å; M150-Y152 VanDerWaalsContact C-N 3.34Å; M150-Y153 PolarHBondContact O-N 3.3Å; M150-L154 WeakPolarHBondContact O-CB 3.31Å; M150-L154 PolarHBondContact O-N 2.85Å; M150-F280 HydrophobicContact CE-CD1 4.37Å; M150-F280 HydrophobicContact CE-CE1 3.78Å; M150-L281 HydrophobicContact CB-CD1 4.15Å; M150-L281 HydrophobicContact CB-CD2 3.67Å; M150-L281 HydrophobicContact CE-CD2 3.91Å; M150-L281 HydrophobicContact CG-CD2 4.5Å; M150-L281 HydrophobicContact SD-CD2 4.09Å |
| 151 | L | 91.6 | Very high | 86.6 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 173.9 | -92.9 | 80.9 | 0 | 0 | 0 | 111.6 | I147 C148 K149 L154 W155 W201 I205 F220 L281 V285 | I147-L151 HydrophobicContact CG2-CD1 3.67Å; I147-L151 WeakPolarHBondContact O-CD1 3.42Å; I147-L151 PolarHBondContact O-N 3.1Å; C148-L151 PolarHBondContact O-N 3.36Å; K149-L151 VanDerWaalsContact C-N 3.33Å; K149-L151 PolarHBondContact O-N 3.19Å; L151-L154 WeakPolarHBondContact O-CB 3.13Å; L151-L154 PolarHBondContact O-N 2.8Å; L151-W155 PolarHBondContact O-N 3.4Å; L151-W201 HydrophobicContact CB-CZ3 4.02Å; L151-W201 HydrophobicContact CD2-CE3 4.34Å; L151-W201 HydrophobicContact CD2-CZ3 3.99Å; L151-W201 HydrophobicContact CG-CZ3 4.07Å; L151-W201 WeakPolarHBondContact O-CH2 3.38Å; L151-I205 HydrophobicContact CD2-CB 4.19Å; L151-I205 HydrophobicContact CD2-CG1 3.7Å; L151-I205 HydrophobicContact CD2-CG2 3.64Å; L151-F220 HydrophobicContact CD2-CE2 3.63Å; L151-F220 HydrophobicContact CD2-CZ 3.67Å; L151-L281 HydrophobicContact CD1-CB 3.97Å; L151-L281 HydrophobicContact CD1-CD1 3.89Å; L151-L281 HydrophobicContact CD1-CD2 3.99Å; L151-L281 HydrophobicContact CD1-CG 4.17Å; L151-L281 HydrophobicContact CG-CD1 4.22Å; L151-V285 HydrophobicContact CD1-CG2 4Å; L151-V285 HydrophobicContact CD2-CG2 4.47Å |
| 152 | Y | 89.8 | Confident | 87.9 | Confident | 15 Ų | 15 | 49.1 Ų | 49.1 | 6% | 0.059 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.5 | -47.6 | 174.1 | 175.9 | -106.7 | 0 | 0 | 0 | 112.2 | W119 F136 C148 K149 M150 L154 W155 M156 Y202 | W119-Y152 WeakPolarHBondContact CZ2-OH 3.44Å; W119-Y152 AromaticContact NE1-CZ 3.77Å; W119-Y152 PolarHBondContact NE1-OH 3.32Å; F136-Y152 HydrophobicContact CZ-CD1 4.21Å; F136-Y152 AromaticContact CZ-CG 3.95Å; F136-Y152 HydrophobicContact CZ-CG 3.95Å; C148-Y152 PolarHBondContact O-N 2.86Å; K149-Y152 WeakPolarHBondContact O-CB 3.33Å; K149-Y152 PolarHBondContact O-N 3.16Å; M150-Y152 VanDerWaalsContact C-N 3.34Å; Y152-L154 VanDerWaalsContact C-N 3.29Å; Y152-L154 PolarHBondContact O-N 2.85Å; Y152-W155 HydrophobicContact CD2-CE3 4.26Å; Y152-W155 AromaticContact CE2-CE3 3.87Å; Y152-W155 HydrophobicContact CE2-CE3 3.87Å; Y152-W155 AromaticContact CE2-CZ3 3.94Å; Y152-W155 HydrophobicContact CE2-CZ3 3.94Å; Y152-W155 PolarHBondContact O-N 3.41Å; Y152-W155 VanDerWaalsContact O-N 3.17Å; Y152-M156 HydrophobicContact CD1-CE 3.87Å; Y152-M156 HydrophobicContact CE1-CE 3.32Å; Y152-M156 HydrophobicContact CE1-CG 4.13Å; Y152-M156 HydrophobicContact CE1-SD 3.58Å; Y152-M156 VanDerWaalsContact CE1-SD 3.58Å; Y152-M156 HydrophobicContact CE2-CG 4.28Å; Y152-M156 VanDerWaalsContact CZ-SD 3.54Å; Y152-M156 PolarHBondContact O-N 2.93Å; Y152-M156 PolarHBondContact OH-SD 2.94Å; Y152-Y202 HydrophobicContact CD2-CE1 4.46Å; Y152-Y202 AromaticContact CD2-CE2 3.9Å; Y152-Y202 HydrophobicContact CD2-CE2 3.9Å; Y152-Y202 AromaticContact CD2-CZ 3.77Å; Y152-Y202 HydrophobicContact CG-CE2 4.29Å |
| 153 | Y | 90 | Very high | 89.2 | Confident | 147 Ų | 147 | 50 Ų | 50 | 58% | 0.576 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -63 | -34.6 | 175.1 | -73.9 | -67.7 | 0 | 0 | 0 | 112.5 | K149 M150 M156 L157 | K149-Y153 HydrophobicContact CB-CE2 4.39Å; K149-Y153 WeakPolarHBondContact O-CD2 3.26Å; K149-Y153 PolarHBondContact O-N 3.26Å; M150-Y153 PolarHBondContact O-N 3.3Å; Y153-M156 HydrophobicContact CD1-CE 3.12Å; Y153-M156 HydrophobicContact CE1-CE 3.42Å; Y153-M156 VanDerWaalsContact CE1-CE 3.42Å; Y153-M156 HydrophobicContact CG-CE 4.07Å; Y153-M156 PolarHBondContact O-N 3.46Å; Y153-L157 WeakPolarHBondContact O-CB 3.45Å; Y153-L157 PolarHBondContact O-N 3.04Å |
| 154 | L | 93.8 | Very high | 90.6 | Very high | 3 Ų | 3 | 46.2 Ų | 46.2 | 2% | 0.016 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.9 | -41.7 | 173.2 | 178.9 | 66.3 | 0 | 0 | 0 | 111.7 | M150 L151 Y152 L157 H158 W201 F224 L277 L281 | M150-L154 WeakPolarHBondContact O-CB 3.31Å; M150-L154 PolarHBondContact O-N 2.85Å; L151-L154 WeakPolarHBondContact O-CB 3.13Å; L151-L154 PolarHBondContact O-N 2.8Å; Y152-L154 VanDerWaalsContact C-N 3.29Å; Y152-L154 PolarHBondContact O-N 2.85Å; L154-L157 PolarHBondContact O-N 2.99Å; L154-H158 WeakPolarHBondContact O-CB 3.34Å; L154-H158 PolarHBondContact O-N 3.27Å; L154-W201 HydrophobicContact CD2-CH2 4.42Å; L154-F224 HydrophobicContact CD2-CE2 4.13Å; L154-F224 HydrophobicContact CD2-CZ 3.65Å; L154-L277 HydrophobicContact CD1-CB 3.85Å; L154-L277 HydrophobicContact CD1-CD1 4.41Å; L154-L281 HydrophobicContact CB-CD1 4.05Å; L154-L281 HydrophobicContact CD2-CD1 3.84Å |
| 155 | W | 93.9 | Very high | 91.6 | Very high | 43 Ų | 43 | 44.7 Ų | 44.7 | 16% | 0.163 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.2 | -40 | 175.2 | 171.9 | 76.7 | 0 | 0 | 0 | 112.3 | L151 Y152 H158 S159 T194 F198 W201 | L151-W155 PolarHBondContact O-N 3.4Å; Y152-W155 HydrophobicContact CD2-CE3 4.26Å; Y152-W155 AromaticContact CE2-CE3 3.87Å; Y152-W155 HydrophobicContact CE2-CE3 3.87Å; Y152-W155 AromaticContact CE2-CZ3 3.94Å; Y152-W155 HydrophobicContact CE2-CZ3 3.94Å; Y152-W155 PolarHBondContact O-N 3.41Å; Y152-W155 VanDerWaalsContact O-N 3.17Å; W155-H158 WeakPolarHBondContact O-CB 3.39Å; W155-H158 PolarHBondContact O-N 2.89Å; W155-S159 PolarHBondContact O-N 3.48Å; W155-S159 PolarHBondContact O-OG 3.1Å; W155-T194 HydrophobicContact CZ2-CG2 4.47Å; W155-T194 PolarHBondContact NE1-O 2.91Å; W155-F198 HydrophobicContact CD2-CD2 4.07Å; W155-F198 AromaticContact CE2-CD2 3.75Å; W155-F198 HydrophobicContact CE3-CD2 4.4Å; W155-F198 HydrophobicContact CH2-CD2 4.14Å; W155-F198 HydrophobicContact CZ2-CB 4.01Å; W155-F198 AromaticContact CZ2-CD2 3.78Å; W155-F198 HydrophobicContact CZ2-CD2 3.78Å; W155-F198 HydrophobicContact CZ2-CG 4.18Å; W155-F198 HydrophobicContact CZ3-CD2 4.43Å; W155-W201 HydrophobicContact CB-CH2 3.66Å; W155-W201 HydrophobicContact CB-CZ2 3.68Å; W155-W201 HydrophobicContact CG-CZ2 4.35Å |
| 156 | M | 91.8 | Very high | 92.4 | Very high | 48 Ų | 48 | 44.2 Ų | 44.2 | 24% | 0.236 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.9 | -45.3 | 172.9 | -71.5 | -163.3 | -64.1 | 0 | 0 | 111.6 | W119 Y152 Y153 H158 S159 V160 | W119-M156 HydrophobicContact CZ2-SD 4.2Å; Y152-M156 HydrophobicContact CD1-CE 3.87Å; Y152-M156 HydrophobicContact CE1-CE 3.32Å; Y152-M156 HydrophobicContact CE1-CG 4.13Å; Y152-M156 HydrophobicContact CE1-SD 3.58Å; Y152-M156 VanDerWaalsContact CE1-SD 3.58Å; Y152-M156 HydrophobicContact CE2-CG 4.28Å; Y152-M156 VanDerWaalsContact CZ-SD 3.54Å; Y152-M156 PolarHBondContact O-N 2.93Å; Y152-M156 PolarHBondContact OH-SD 2.94Å; Y153-M156 HydrophobicContact CD1-CE 3.12Å; Y153-M156 HydrophobicContact CE1-CE 3.42Å; Y153-M156 VanDerWaalsContact CE1-CE 3.42Å; Y153-M156 HydrophobicContact CG-CE 4.07Å; Y153-M156 PolarHBondContact O-N 3.46Å; M156-H158 VanDerWaalsContact C-N 3.28Å; M156-H158 PolarHBondContact O-N 2.98Å; M156-S159 WeakPolarHBondContact O-CB 3.47Å; M156-S159 PolarHBondContact O-N 3.4Å; M156-V160 WeakPolarHBondContact O-CG2 3.29Å; M156-V160 PolarHBondContact O-N 3.47Å |
| 157 | L | 94.7 | Very high | 93.1 | Very high | 36 Ų | 36 | 38.1 Ų | 38.1 | 19% | 0.188 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.6 | -41.5 | 176.2 | -179.4 | 66 | 0 | 0 | 0 | 111.3 | Y153 L154 V160 T161 F270 L273 L277 | Y153-L157 WeakPolarHBondContact O-CB 3.45Å; Y153-L157 PolarHBondContact O-N 3.04Å; L154-L157 PolarHBondContact O-N 2.99Å; L157-V160 PolarHBondContact O-N 3.38Å; L157-T161 WeakPolarHBondContact O-CB 3.3Å; L157-T161 PolarHBondContact O-N 3.35Å; L157-T161 PolarHBondContact O-OG1 3.5Å; L157-F270 HydrophobicContact CD1-CD1 4.02Å; L157-F270 HydrophobicContact CD1-CE1 4.31Å; L157-L273 HydrophobicContact CD2-CD2 3.91Å; L157-L273 HydrophobicContact CD2-CG 4.02Å; L157-L277 HydrophobicContact CD2-CD1 3.85Å |
| 158 | H | 94.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.7 | -49.5 | 174.1 | 172.9 | 57 | 0 | 0 | 0 | 112.1 | L154 W155 M156 V160 T161 L162 Y231 | L154-H158 WeakPolarHBondContact O-CB 3.34Å; L154-H158 PolarHBondContact O-N 3.27Å; W155-H158 WeakPolarHBondContact O-CB 3.39Å; W155-H158 PolarHBondContact O-N 2.89Å; M156-H158 VanDerWaalsContact C-N 3.28Å; M156-H158 PolarHBondContact O-N 2.98Å; H158-V160 VanDerWaalsContact C-N 3.34Å; H158-V160 PolarHBondContact O-N 2.85Å; H158-T161 WeakPolarHBondContact O-CB 3.47Å; H158-T161 PolarHBondContact O-N 2.95Å; H158-T161 VanDerWaalsContact O-N 3.13Å; H158-L162 VanDerWaalsContact CE1-CD1 3.45Å; H158-L162 WeakPolarHBondContact CE1-CD1 3.38Å; H158-L162 WeakPolarHBondContact NE2-CD1 3.38Å; H158-L162 PolarHBondContact O-N 3.27Å; H158-Y231 WeakPolarHBondContact CB-OH 3.44Å; H158-Y231 AromaticContact CE1-CE1 3.84Å; H158-Y231 AromaticContact ND1-CE1 3.34Å; H158-Y231 VanDerWaalsContact ND1-CE1 3.34Å; H158-Y231 WeakPolarHBondContact ND1-CE1 3.34Å; H158-Y231 AromaticContact ND1-CZ 3.84Å; H158-Y231 PolarHBondContact ND1-OH 3.23Å |
| 159 | S | 94.2 | Very high | 93.9 | Very high | 19 Ų | 19 | 37.2 Ų | 37.2 | 13% | 0.133 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59 | -45 | 178.4 | -53.5 | 0 | 0 | 0 | 0 | 111.6 | W155 M156 L162 F163 | W155-S159 PolarHBondContact O-N 3.48Å; W155-S159 PolarHBondContact O-OG 3.1Å; M156-S159 WeakPolarHBondContact O-CB 3.47Å; M156-S159 PolarHBondContact O-N 3.4Å; S159-L162 PolarHBondContact O-N 3.44Å; S159-F163 PolarHBondContact O-N 3.36Å |
| 160 | V | 95.6 | Very high | 94.3 | Very high | 74 Ų | 74 | 36.9 Ų | 36.9 | 45% | 0.448 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -63.8 | -41 | 175.4 | 172.9 | 0 | 0 | 0 | 0 | 111 | M156 L157 H158 F163 L164 | M156-V160 WeakPolarHBondContact O-CG2 3.29Å; M156-V160 PolarHBondContact O-N 3.47Å; L157-V160 PolarHBondContact O-N 3.38Å; H158-V160 VanDerWaalsContact C-N 3.34Å; H158-V160 PolarHBondContact O-N 2.85Å; V160-F163 WeakPolarHBondContact O-CB 3.3Å; V160-F163 PolarHBondContact O-N 3.46Å; V160-L164 HydrophobicContact CG1-CD1 4.13Å; V160-L164 HydrophobicContact CG1-CG 4.33Å; V160-L164 WeakPolarHBondContact O-CG 3.48Å; V160-L164 PolarHBondContact O-N 3.03Å |
| 161 | T | 96.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.6 | -43.7 | 179 | -56.2 | 0 | 0 | 0 | 0 | 111.4 | L157 H158 F163 L164 N165 F270 F271 | L157-T161 WeakPolarHBondContact O-CB 3.3Å; L157-T161 PolarHBondContact O-N 3.35Å; L157-T161 PolarHBondContact O-OG1 3.5Å; H158-T161 WeakPolarHBondContact O-CB 3.47Å; H158-T161 PolarHBondContact O-N 2.95Å; H158-T161 VanDerWaalsContact O-N 3.13Å; T161-F163 VanDerWaalsContact C-N 3.31Å; T161-F163 PolarHBondContact O-N 3.34Å; T161-L164 PolarHBondContact O-N 3.45Å; T161-N165 WeakPolarHBondContact O-CB 3.18Å; T161-N165 PolarHBondContact O-N 2.92Å; T161-F270 HydrophobicContact CG2-CB 3.66Å; T161-F271 HydrophobicContact CG2-CD1 3.54Å; T161-F271 HydrophobicContact CG2-CD2 4.25Å; T161-F271 HydrophobicContact CG2-CE1 3.59Å; T161-F271 HydrophobicContact CG2-CE2 4.3Å; T161-F271 HydrophobicContact CG2-CG 3.88Å; T161-F271 HydrophobicContact CG2-CZ 3.99Å |
| 162 | L | 96 | Very high | 94.5 | Very high | 1 Ų | 1 | 35.6 Ų | 35.6 | 1% | 0.005 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.2 | -37.2 | 175.2 | -71.7 | 177.6 | 0 | 0 | 0 | 112 | H158 S159 N165 L166 F190 F193 F271 | H158-L162 VanDerWaalsContact CE1-CD1 3.45Å; H158-L162 WeakPolarHBondContact CE1-CD1 3.38Å; H158-L162 WeakPolarHBondContact NE2-CD1 3.38Å; H158-L162 PolarHBondContact O-N 3.27Å; S159-L162 PolarHBondContact O-N 3.44Å; L162-N165 WeakPolarHBondContact O-CB 3.44Å; L162-N165 PolarHBondContact O-N 3.28Å; L162-L166 PolarHBondContact O-N 2.82Å; L162-F190 HydrophobicContact CB-CB 4.48Å; L162-F190 HydrophobicContact CB-CD2 3.79Å; L162-F193 HydrophobicContact CD1-CB 3.82Å; L162-F271 HydrophobicContact CD2-CE1 4.29Å; L162-F271 HydrophobicContact CD2-CZ 4.34Å |
| 163 | F | 96.3 | Very high | 94.7 | Very high | 95 Ų | 95 | 38.2 Ų | 38.2 | 42% | 0.417 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -65.6 | -43.5 | 173.7 | 179.6 | -104.3 | 0 | 0 | 0 | 112 | S159 V160 T161 N165 L166 L167 F190 | S159-F163 PolarHBondContact O-N 3.36Å; V160-F163 WeakPolarHBondContact O-CB 3.3Å; V160-F163 PolarHBondContact O-N 3.46Å; T161-F163 VanDerWaalsContact C-N 3.31Å; T161-F163 PolarHBondContact O-N 3.34Å; F163-N165 VanDerWaalsContact C-N 3.29Å; F163-N165 PolarHBondContact O-N 3.02Å; F163-L166 HydrophobicContact CD2-CD2 4.42Å; F163-L166 WeakPolarHBondContact O-CB 3.44Å; F163-L166 PolarHBondContact O-N 3.27Å; F163-L167 HydrophobicContact CD1-CD1 4.27Å; F163-L167 HydrophobicContact CE1-CD1 3.7Å; F163-L167 HydrophobicContact CE1-CG 4.26Å; F163-L167 HydrophobicContact CZ-CD1 4.09Å; F163-L167 HydrophobicContact CZ-CD2 4.34Å; F163-L167 HydrophobicContact CZ-CG 4.33Å; F163-L167 WeakPolarHBondContact O-CG 3.47Å; F163-L167 PolarHBondContact O-N 3.1Å; F163-L167 VanDerWaalsContact O-N 3.1Å; F163-F190 HydrophobicContact CB-CD2 4.32Å; F163-F190 HydrophobicContact CB-CE2 3.85Å; F163-F190 HydrophobicContact CB-CZ 4.46Å; F163-F190 HydrophobicContact CD2-CE2 4.46Å; F163-F190 HydrophobicContact CD2-CZ 4.29Å |
| 164 | L | 96.4 | Very high | 94.8 | Very high | 50 Ų | 50 | 35.7 Ų | 35.7 | 26% | 0.262 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -64.7 | -35.7 | 174.2 | -67.1 | 176.2 | 0 | 0 | 0 | 111.7 | V160 T161 L167 A168 V267 F270 | V160-L164 HydrophobicContact CG1-CD1 4.13Å; V160-L164 HydrophobicContact CG1-CG 4.33Å; V160-L164 WeakPolarHBondContact O-CG 3.48Å; V160-L164 PolarHBondContact O-N 3.03Å; T161-L164 PolarHBondContact O-N 3.45Å; L164-L167 HydrophobicContact CD2-CD1 4.49Å; L164-L167 PolarHBondContact O-N 3.01Å; L164-A168 WeakPolarHBondContact O-CB 3.44Å; L164-A168 PolarHBondContact O-N 3.27Å; L164-V267 HydrophobicContact CB-CG2 3.94Å; L164-F270 HydrophobicContact CD1-CD2 3.75Å; L164-F270 HydrophobicContact CD1-CE2 3.62Å; L164-F270 HydrophobicContact CD1-CZ 4.34Å |
| 165 | N | 97.1 | Very high | 94.4 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.9 | -43.2 | 173.1 | -177.9 | 63.1 | 0 | 0 | 0 | 111.9 | T161 L162 F163 L167 A168 C169 G242 S244 V267 F271 | T161-N165 WeakPolarHBondContact O-CB 3.18Å; T161-N165 PolarHBondContact O-N 2.92Å; L162-N165 WeakPolarHBondContact O-CB 3.44Å; L162-N165 PolarHBondContact O-N 3.28Å; F163-N165 VanDerWaalsContact C-N 3.29Å; F163-N165 PolarHBondContact O-N 3.02Å; N165-L167 VanDerWaalsContact C-N 3.32Å; N165-L167 PolarHBondContact O-N 3.26Å; N165-A168 PolarHBondContact O-N 3.48Å; N165-C169 PolarHBondContact O-N 3.44Å; N165-C169 PolarHBondContact O-SG 3.44Å; N165-C169 VanDerWaalsContact O-SG 3.39Å; N165-G242 PolarHBondContact ND2-O 2.96Å; N165-S244 VanDerWaalsContact OD1-CB 3.26Å; N165-S244 WeakPolarHBondContact OD1-CB 3.26Å; N165-S244 PolarHBondContact OD1-N 2.96Å; N165-S244 PolarHBondContact OD1-OG 2.75Å; N165-V267 HydrophobicContact CB-CG1 3.79Å; N165-F271 HydrophobicContact CB-CE2 4.16Å; N165-F271 HydrophobicContact CB-CZ 4.04Å |
| 166 | L | 96.7 | Very high | 94.1 | Very high | 28 Ų | 28 | 40.3 Ų | 40.3 | 15% | 0.147 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -56.4 | -46.1 | 172.7 | 171.9 | 69.6 | 0 | 0 | 0 | 111.5 | L162 F163 C169 L170 F183 S186 I187 | L162-L166 PolarHBondContact O-N 2.82Å; F163-L166 HydrophobicContact CD2-CD2 4.42Å; F163-L166 WeakPolarHBondContact O-CB 3.44Å; F163-L166 PolarHBondContact O-N 3.27Å; L166-C169 PolarHBondContact O-N 3.24Å; L166-L170 WeakPolarHBondContact O-CB 3.03Å; L166-L170 PolarHBondContact O-N 3.08Å; L166-F183 HydrophobicContact CD1-CD2 4.15Å; L166-F183 HydrophobicContact CD1-CE2 3.67Å; L166-S186 WeakPolarHBondContact CD1-OG 3.46Å; L166-I187 HydrophobicContact CD1-CB 4.24Å; L166-I187 HydrophobicContact CD1-CD1 4.36Å; L166-I187 HydrophobicContact CD1-CG1 3.27Å |
| 167 | L | 96.3 | Very high | 94 | Very high | 74 Ų | 74 | 42.7 Ų | 42.7 | 39% | 0.387 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -66 | -37.7 | 177.4 | -62.9 | -177.3 | 0 | 0 | 0 | 112.5 | F163 L164 N165 L170 A171 | F163-L167 HydrophobicContact CD1-CD1 4.27Å; F163-L167 HydrophobicContact CE1-CD1 3.7Å; F163-L167 HydrophobicContact CE1-CG 4.26Å; F163-L167 HydrophobicContact CZ-CD1 4.09Å; F163-L167 HydrophobicContact CZ-CD2 4.34Å; F163-L167 HydrophobicContact CZ-CG 4.33Å; F163-L167 WeakPolarHBondContact O-CG 3.47Å; F163-L167 PolarHBondContact O-N 3.1Å; F163-L167 VanDerWaalsContact O-N 3.1Å; L164-L167 HydrophobicContact CD2-CD1 4.49Å; L164-L167 PolarHBondContact O-N 3.01Å; N165-L167 VanDerWaalsContact C-N 3.32Å; N165-L167 PolarHBondContact O-N 3.26Å; L167-L170 PolarHBondContact O-N 3.5Å; L167-A171 WeakPolarHBondContact O-CB 3.39Å; L167-A171 PolarHBondContact O-N 3.31Å |
| 168 | A | 95.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -65.3 | -44.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L164 N165 L170 A171 S172 I263 M264 V267 | L164-A168 WeakPolarHBondContact O-CB 3.44Å; L164-A168 PolarHBondContact O-N 3.27Å; N165-A168 PolarHBondContact O-N 3.48Å; A168-L170 VanDerWaalsContact C-N 3.33Å; A168-L170 PolarHBondContact O-N 3.21Å; A168-A171 PolarHBondContact O-N 3.08Å; A168-S172 WeakPolarHBondContact O-CB 3.41Å; A168-S172 PolarHBondContact O-N 3.09Å; A168-I263 HydrophobicContact CB-CG2 3.85Å; A168-M264 HydrophobicContact CB-CG 4.25Å; A168-V267 HydrophobicContact CB-CG2 3.87Å |
| 169 | C | 94.8 | Very high | 93.5 | Very high | 3 Ų | 3 | 47.8 Ų | 47.8 | 2% | 0.02 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -65.8 | -35.9 | 175.2 | -67.4 | 0 | 0 | 0 | 0 | 112 | N165 L166 S172 F173 F183 S244 | N165-C169 PolarHBondContact O-N 3.44Å; N165-C169 PolarHBondContact O-SG 3.44Å; N165-C169 VanDerWaalsContact O-SG 3.39Å; L166-C169 PolarHBondContact O-N 3.24Å; C169-S172 PolarHBondContact O-N 2.83Å; C169-F173 WeakPolarHBondContact O-CB 3.38Å; C169-F173 PolarHBondContact O-N 3.47Å; C169-F183 HydrophobicContact CB-CB 4.35Å; C169-F183 HydrophobicContact CB-CD2 4.38Å; C169-S244 PolarHBondContact SG-OG 3.22Å; C169-S244 VanDerWaalsContact SG-OG 3.4Å |
| 170 | L | 95.2 | Very high | 93.3 | Very high | 68 Ų | 68 | 48.1 Ų | 48.1 | 36% | 0.356 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.3 | -46.2 | 172.7 | 177.7 | 61 | 0 | 0 | 0 | 111.7 | L166 L167 A168 S172 F173 S174 F183 | L166-L170 WeakPolarHBondContact O-CB 3.03Å; L166-L170 PolarHBondContact O-N 3.08Å; L167-L170 PolarHBondContact O-N 3.5Å; A168-L170 VanDerWaalsContact C-N 3.33Å; A168-L170 PolarHBondContact O-N 3.21Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 3.29Å; L170-F173 PolarHBondContact O-N 3.08Å; L170-S174 WeakPolarHBondContact O-CB 3.41Å; L170-S174 PolarHBondContact O-N 3.27Å; L170-S174 PolarHBondContact O-OG 2.86Å; L170-F183 HydrophobicContact CB-CD2 3.93Å; L170-F183 HydrophobicContact CB-CE2 3.67Å; L170-F183 HydrophobicContact CB-CZ 4.47Å; L170-F183 HydrophobicContact CD1-CD2 4.38Å; L170-F183 HydrophobicContact CD1-CE1 4.29Å; L170-F183 HydrophobicContact CD1-CE2 3.8Å; L170-F183 HydrophobicContact CD1-CZ 3.74Å; L170-F183 HydrophobicContact CG-CE2 4.24Å |
| 171 | A | 93.8 | Very high | 93.2 | Very high | 30 Ų | 30 | 49.2 Ų | 49.2 | 25% | 0.248 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.2 | -39.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | L167 A168 S174 G175 V260 | L167-A171 WeakPolarHBondContact O-CB 3.39Å; L167-A171 PolarHBondContact O-N 3.31Å; A168-A171 PolarHBondContact O-N 3.08Å; A171-S174 PolarHBondContact O-N 2.79Å; A171-G175 PolarHBondContact O-N 3.16Å; A171-V260 HydrophobicContact CB-CG2 4.31Å |
| 172 | S | 92.1 | Very high | 93.1 | Very high | 14 Ų | 14 | 50.6 Ų | 50.6 | 10% | 0.098 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.6 | -47.5 | 175.2 | -167.3 | 0 | 0 | 0 | 0 | 112.3 | A168 C169 L170 S174 G175 D176 | A168-S172 WeakPolarHBondContact O-CB 3.41Å; A168-S172 PolarHBondContact O-N 3.09Å; C169-S172 PolarHBondContact O-N 2.83Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 3.29Å; S172-S174 VanDerWaalsContact C-N 3.29Å; S172-S174 PolarHBondContact O-N 3.43Å; S172-G175 PolarHBondContact O-N 2.94Å; S172-G175 VanDerWaalsContact O-N 3.15Å; S172-D176 PolarHBondContact O-N 2.72Å |
| 173 | F | 93.9 | Very high | 93 | Very high | 70 Ų | 70 | 52.7 Ų | 52.7 | 31% | 0.307 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.4 | -34.5 | 176.2 | 174.9 | -119.1 | 0 | 0 | 0 | 113.4 | C169 L170 G175 D176 S177 K179 G180 F183 | C169-F173 WeakPolarHBondContact O-CB 3.38Å; C169-F173 PolarHBondContact O-N 3.47Å; L170-F173 PolarHBondContact O-N 3.08Å; F173-G175 VanDerWaalsContact C-N 3.26Å; F173-G175 PolarHBondContact O-N 2.95Å; F173-D176 WeakPolarHBondContact CA-O 3.46Å; F173-D176 CarbonylContact O-C 3.31Å; F173-D176 VanDerWaalsContact O-C 3.31Å; F173-D176 PolarHBondContact O-N 2.62Å; F173-S177 WeakPolarHBondContact CE2-O 3.2Å; F173-K179 HydrophobicContact CB-CB 4.47Å; F173-G180 VanDerWaalsContact CD2-N 3.31Å; F173-F183 HydrophobicContact CB-CB 4.02Å; F173-F183 HydrophobicContact CB-CG 4.47Å; F173-F183 HydrophobicContact CD1-CD1 4.01Å; F173-F183 HydrophobicContact CD1-CG 4.45Å; F173-F183 HydrophobicContact CE1-CD1 4.45Å; F173-F183 HydrophobicContact CG-CB 4.33Å |
| 174 | S | 91.4 | Very high | 92.9 | Very high | 93 Ų | 93 | 49.9 Ų | 49.9 | 65% | 0.65 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -66.9 | -28.6 | 176.9 | -56.2 | 0 | 0 | 0 | 0 | 112.7 | L170 A171 S172 | L170-S174 WeakPolarHBondContact O-CB 3.41Å; L170-S174 PolarHBondContact O-N 3.27Å; L170-S174 PolarHBondContact O-OG 2.86Å; A171-S174 PolarHBondContact O-N 2.79Å; S172-S174 VanDerWaalsContact C-N 3.29Å; S172-S174 PolarHBondContact O-N 3.43Å |
| 175 | G | 86.6 | Confident | 92.9 | Very high | 69 Ų | 69 | 49.5 Ų | 49.5 | 71% | 0.711 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -89.4 | -27 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | A171 S172 F173 | A171-G175 PolarHBondContact O-N 3.16Å; S172-G175 PolarHBondContact O-N 2.94Å; S172-G175 VanDerWaalsContact O-N 3.15Å; F173-G175 VanDerWaalsContact C-N 3.26Å; F173-G175 PolarHBondContact O-N 2.95Å |
| 176 | D | 87.3 | Confident | 92.8 | Very high | 74 Ų | 74 | 49.6 Ų | 49.6 | 40% | 0.396 | 32% | 0.318 | S | S | . | . | trans | -145.1 | 107.2 | -178.5 | -179.4 | -5.3 | 0 | 0 | 0 | 110.5 | S172 F173 S178 K179 | S172-D176 PolarHBondContact O-N 2.72Å; F173-D176 WeakPolarHBondContact CA-O 3.46Å; F173-D176 CarbonylContact O-C 3.31Å; F173-D176 VanDerWaalsContact O-C 3.31Å; F173-D176 PolarHBondContact O-N 2.62Å; D176-S178 PolarHBondContact O-N 2.97Å; D176-S178 VanDerWaalsContact O-N 3.08Å; D176-S178 VanDerWaalsContact OD1-CB 3.24Å; D176-S178 WeakPolarHBondContact OD1-CB 3.34Å; D176-S178 PolarHBondContact OD1-N 2.92Å; D176-S178 PolarHBondContact OD1-OG 3.4Å; D176-S178 PolarHBondContact OD2-OG 3.16Å; D176-K179 HydrophobicContact CB-CG 4.07Å; D176-K179 WeakPolarHBondContact O-CB 3.3Å; D176-K179 PolarHBondContact O-N 2.71Å | ||
| 177 | S | 89 | Confident | 92.8 | Very high | 99 Ų | 99 | 51.3 Ų | 51.3 | 69% | 0.692 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -63.5 | -16.6 | -177.9 | -52.2 | 0 | 0 | 0 | 0 | 113.7 | F173 K179 G180 | F173-S177 WeakPolarHBondContact CE2-O 3.2Å; S177-K179 PolarHBondContact O-N 3.2Å; S177-G180 PolarHBondContact O-N 3.44Å |
| 178 | S | 88.4 | Confident | 92.7 | Very high | 85 Ų | 85 | 51.5 Ų | 51.5 | 59% | 0.594 | 33% | 0.328 | S | S | * | . | G | 310 helix | trans | -66.4 | -17 | 173.5 | 74.8 | 0 | 0 | 0 | 0 | 113 | D176 G180 | D176-S178 PolarHBondContact O-N 2.97Å; D176-S178 VanDerWaalsContact O-N 3.08Å; D176-S178 VanDerWaalsContact OD1-CB 3.24Å; D176-S178 WeakPolarHBondContact OD1-CB 3.34Å; D176-S178 PolarHBondContact OD1-N 2.92Å; D176-S178 PolarHBondContact OD1-OG 3.4Å; D176-S178 PolarHBondContact OD2-OG 3.16Å; S178-G180 VanDerWaalsContact C-N 3.27Å; S178-G180 PolarHBondContact O-N 3.48Å |
| 179 | K | 90 | Very high | 92.6 | Very high | 57 Ų | 57 | 54.6 Ų | 54.6 | 25% | 0.248 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -85.3 | 11.4 | 179.2 | -55.7 | -60.9 | -178.6 | -179.8 | 0 | 114.5 | F173 D176 S177 V181 D182 F183 | F173-K179 HydrophobicContact CB-CB 4.47Å; D176-K179 HydrophobicContact CB-CG 4.07Å; D176-K179 WeakPolarHBondContact O-CB 3.3Å; D176-K179 PolarHBondContact O-N 2.71Å; S177-K179 PolarHBondContact O-N 3.2Å; K179-V181 PolarHBondContact O-N 3.49Å; K179-D182 PolarHBondContact O-N 3.16Å; K179-D182 VanDerWaalsContact O-N 3.14Å; K179-F183 PolarHBondContact O-N 2.8Å; K179-F183 VanDerWaalsContact O-N 3.14Å |
| 180 | G | 91.3 | Very high | 92.5 | Very high | 27 Ų | 27 | 57.2 Ų | 57.2 | 28% | 0.278 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.8 | -33 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | F173 S177 S178 F183 G184 | F173-G180 VanDerWaalsContact CD2-N 3.31Å; S177-G180 PolarHBondContact O-N 3.44Å; S178-G180 VanDerWaalsContact C-N 3.27Å; S178-G180 PolarHBondContact O-N 3.48Å; G180-F183 PolarHBondContact O-N 2.74Å; G180-G184 PolarHBondContact O-N 3.41Å |
| 181 | V | 93.4 | Very high | 92.4 | Very high | 97 Ų | 97 | 59.2 Ų | 59.2 | 59% | 0.588 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -65.2 | -44.9 | 175.7 | 178.3 | 0 | 0 | 0 | 0 | 111.1 | K179 F183 G184 L185 | K179-V181 PolarHBondContact O-N 3.49Å; V181-F183 VanDerWaalsContact C-N 3.3Å; V181-F183 PolarHBondContact O-N 2.8Å; V181-G184 PolarHBondContact O-N 2.92Å; V181-L185 HydrophobicContact CG1-CD1 3.91Å; V181-L185 HydrophobicContact CG1-CG 4.38Å; V181-L185 WeakPolarHBondContact O-CB 2.99Å; V181-L185 WeakPolarHBondContact O-CG 3.29Å; V181-L185 PolarHBondContact O-N 3.33Å |
| 182 | D | 93.3 | Very high | 92.3 | Very high | 29 Ų | 29 | 61.7 Ų | 61.7 | 16% | 0.155 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 178.4 | -67.8 | -45.3 | 0 | 0 | 0 | 110.9 | K179 S186 G240 G242 | K179-D182 PolarHBondContact O-N 3.16Å; K179-D182 VanDerWaalsContact O-N 3.14Å; D182-S186 WeakPolarHBondContact O-CB 3.37Å; D182-S186 PolarHBondContact O-N 2.9Å; D182-G240 WeakPolarHBondContact OD1-CA 3.03Å; D182-G240 PolarHBondContact OD1-N 2.85Å; D182-G240 VanDerWaalsContact OD1-N 3.09Å; D182-G242 VanDerWaalsContact O-CA 3.3Å; D182-G242 WeakPolarHBondContact O-CA 3.39Å; D182-G242 PolarHBondContact OD1-N 3.49Å |
| 183 | F | 95.3 | Very high | 92.2 | Very high | 45 Ų | 45 | 62.9 Ų | 62.9 | 20% | 0.197 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -65.1 | -48.5 | 174.3 | 177.4 | -121.8 | 0 | 0 | 0 | 112.6 | L166 C169 L170 F173 K179 G180 V181 L185 S186 I187 | L166-F183 HydrophobicContact CD1-CD2 4.15Å; L166-F183 HydrophobicContact CD1-CE2 3.67Å; C169-F183 HydrophobicContact CB-CB 4.35Å; C169-F183 HydrophobicContact CB-CD2 4.38Å; L170-F183 HydrophobicContact CB-CD2 3.93Å; L170-F183 HydrophobicContact CB-CE2 3.67Å; L170-F183 HydrophobicContact CB-CZ 4.47Å; L170-F183 HydrophobicContact CD1-CD2 4.38Å; L170-F183 HydrophobicContact CD1-CE1 4.29Å; L170-F183 HydrophobicContact CD1-CE2 3.8Å; L170-F183 HydrophobicContact CD1-CZ 3.74Å; L170-F183 HydrophobicContact CG-CE2 4.24Å; F173-F183 HydrophobicContact CB-CB 4.02Å; F173-F183 HydrophobicContact CB-CG 4.47Å; F173-F183 HydrophobicContact CD1-CD1 4.01Å; F173-F183 HydrophobicContact CD1-CG 4.45Å; F173-F183 HydrophobicContact CE1-CD1 4.45Å; F173-F183 HydrophobicContact CG-CB 4.33Å; K179-F183 PolarHBondContact O-N 2.8Å; K179-F183 VanDerWaalsContact O-N 3.14Å; G180-F183 PolarHBondContact O-N 2.74Å; V181-F183 VanDerWaalsContact C-N 3.3Å; V181-F183 PolarHBondContact O-N 2.8Å; F183-L185 VanDerWaalsContact C-N 3.34Å; F183-L185 PolarHBondContact O-N 3.5Å; F183-S186 PolarHBondContact O-N 2.84Å; F183-S186 PolarHBondContact O-OG 2.9Å; F183-I187 HydrophobicContact CD1-CD1 4.4Å; F183-I187 HydrophobicContact CE1-CD1 3.9Å; F183-I187 HydrophobicContact CE2-CD1 4.09Å; F183-I187 HydrophobicContact CE2-CG1 4.28Å; F183-I187 HydrophobicContact CZ-CD1 3.73Å; F183-I187 HydrophobicContact CZ-CG1 4.38Å; F183-I187 PolarHBondContact O-N 3.42Å |
| 184 | G | 94.3 | Very high | 92 | Very high | 36 Ų | 36 | 60.7 Ų | 60.7 | 37% | 0.371 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.6 | -42.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113 | G180 V181 I187 L188 | G180-G184 PolarHBondContact O-N 3.41Å; V181-G184 PolarHBondContact O-N 2.92Å; G184-I187 PolarHBondContact O-N 3.5Å; G184-L188 PolarHBondContact O-N 3.46Å; G184-L188 VanDerWaalsContact O-N 3.16Å |
| 185 | L | 94.8 | Very high | 91.9 | Very high | 42 Ų | 42 | 59.3 Ų | 59.3 | 22% | 0.22 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -66.3 | -38 | 175.7 | -73.1 | 174.3 | 0 | 0 | 0 | 112.2 | V181 F183 I187 L188 W189 G240 | V181-L185 HydrophobicContact CG1-CD1 3.91Å; V181-L185 HydrophobicContact CG1-CG 4.38Å; V181-L185 WeakPolarHBondContact O-CB 2.99Å; V181-L185 WeakPolarHBondContact O-CG 3.29Å; V181-L185 PolarHBondContact O-N 3.33Å; F183-L185 VanDerWaalsContact C-N 3.34Å; F183-L185 PolarHBondContact O-N 3.5Å; L185-I187 VanDerWaalsContact C-N 3.28Å; L185-I187 PolarHBondContact O-N 2.93Å; L185-L188 HydrophobicContact CD2-CD2 4.2Å; L185-L188 WeakPolarHBondContact O-CB 3.38Å; L185-L188 PolarHBondContact O-N 2.93Å; L185-L188 VanDerWaalsContact O-N 3.14Å; L185-W189 HydrophobicContact CD2-CZ2 4.45Å; L185-W189 VanDerWaalsContact O-CG 3.24Å; L185-W189 PolarHBondContact O-N 3.26Å; L185-G240 WeakPolarHBondContact CD1-O 3.45Å |
| 186 | S | 95.7 | Very high | 92 | Very high | 1 Ų | 1 | 58.5 Ų | 58.5 | 1% | 0.007 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.3 | -35.7 | 176.4 | 74.5 | 0 | 0 | 0 | 0 | 113 | L166 D182 F183 F190 | L166-S186 WeakPolarHBondContact CD1-OG 3.46Å; D182-S186 WeakPolarHBondContact O-CB 3.37Å; D182-S186 PolarHBondContact O-N 2.9Å; F183-S186 PolarHBondContact O-N 2.84Å; F183-S186 PolarHBondContact O-OG 2.9Å; S186-F190 WeakPolarHBondContact O-CB 3.27Å; S186-F190 PolarHBondContact O-N 2.92Å |
| 187 | I | 96 | Very high | 92 | Very high | 65 Ų | 65 | 55 Ų | 55 | 33% | 0.333 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65 | -49.4 | 172.6 | -63.4 | 165.3 | 0 | 0 | 0 | 110.1 | L166 F183 G184 L185 W189 F190 L191 | L166-I187 HydrophobicContact CD1-CB 4.24Å; L166-I187 HydrophobicContact CD1-CD1 4.36Å; L166-I187 HydrophobicContact CD1-CG1 3.27Å; F183-I187 HydrophobicContact CD1-CD1 4.4Å; F183-I187 HydrophobicContact CE1-CD1 3.9Å; F183-I187 HydrophobicContact CE2-CD1 4.09Å; F183-I187 HydrophobicContact CE2-CG1 4.28Å; F183-I187 HydrophobicContact CZ-CD1 3.73Å; F183-I187 HydrophobicContact CZ-CG1 4.38Å; F183-I187 PolarHBondContact O-N 3.42Å; G184-I187 PolarHBondContact O-N 3.5Å; L185-I187 VanDerWaalsContact C-N 3.28Å; L185-I187 PolarHBondContact O-N 2.93Å; I187-W189 VanDerWaalsContact C-N 3.34Å; I187-W189 PolarHBondContact O-N 2.98Å; I187-F190 PolarHBondContact O-N 2.86Å; I187-L191 HydrophobicContact CG2-CD1 4.01Å; I187-L191 HydrophobicContact CG2-CG 4.45Å; I187-L191 WeakPolarHBondContact O-CG 3.35Å; I187-L191 PolarHBondContact O-N 2.49Å |
| 188 | L | 95 | Very high | 91.9 | Very high | 78 Ų | 78 | 52.4 Ų | 52.4 | 41% | 0.408 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.5 | -47.4 | -179.9 | -177.5 | 68 | 0 | 0 | 0 | 111.2 | G184 L185 L191 I192 | G184-L188 PolarHBondContact O-N 3.46Å; G184-L188 VanDerWaalsContact O-N 3.16Å; L185-L188 HydrophobicContact CD2-CD2 4.2Å; L185-L188 WeakPolarHBondContact O-CB 3.38Å; L185-L188 PolarHBondContact O-N 2.93Å; L185-L188 VanDerWaalsContact O-N 3.14Å; L188-L191 PolarHBondContact O-N 2.68Å; L188-I192 HydrophobicContact CD1-CD1 3.46Å; L188-I192 VanDerWaalsContact CD1-CD1 3.46Å; L188-I192 HydrophobicContact CD1-CG1 4.22Å; L188-I192 HydrophobicContact CG-CD1 3.9Å; L188-I192 WeakPolarHBondContact O-CB 3.29Å; L188-I192 WeakPolarHBondContact O-CG1 3.18Å; L188-I192 PolarHBondContact O-N 2.83Å |
| 189 | W | 92.9 | Very high | 91.7 | Very high | 65 Ų | 65 | 52.9 Ų | 52.9 | 25% | 0.246 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.3 | -42 | 178.2 | -60.8 | 140.9 | 0 | 0 | 0 | 112.4 | L185 I187 L191 I192 F193 L241 | L185-W189 HydrophobicContact CD2-CZ2 4.45Å; L185-W189 VanDerWaalsContact O-CG 3.24Å; L185-W189 PolarHBondContact O-N 3.26Å; I187-W189 VanDerWaalsContact C-N 3.34Å; I187-W189 PolarHBondContact O-N 2.98Å; W189-L191 VanDerWaalsContact C-N 3.32Å; W189-L191 PolarHBondContact O-N 3.3Å; W189-I192 PolarHBondContact O-N 3.26Å; W189-F193 HydrophobicContact CB-CD2 4Å; W189-F193 HydrophobicContact CB-CE2 4.24Å; W189-F193 HydrophobicContact CD2-CD2 4.43Å; W189-F193 AromaticContact CD2-CE2 3.84Å; W189-F193 HydrophobicContact CD2-CE2 3.84Å; W189-F193 AromaticContact CD2-CZ 3.92Å; W189-F193 HydrophobicContact CD2-CZ 3.92Å; W189-F193 HydrophobicContact CE3-CD1 4.13Å; W189-F193 HydrophobicContact CE3-CD2 4.18Å; W189-F193 AromaticContact CE3-CE1 3.54Å; W189-F193 HydrophobicContact CE3-CE1 3.54Å; W189-F193 AromaticContact CE3-CE2 3.6Å; W189-F193 HydrophobicContact CE3-CE2 3.6Å; W189-F193 HydrophobicContact CE3-CG 4.43Å; W189-F193 AromaticContact CE3-CZ 3.25Å; W189-F193 HydrophobicContact CE3-CZ 3.25Å; W189-F193 HydrophobicContact CG-CD2 4.38Å; W189-F193 HydrophobicContact CG-CE2 4.11Å; W189-F193 HydrophobicContact CH2-CZ 4.3Å; W189-F193 AromaticContact CZ3-CE1 3.7Å; W189-F193 HydrophobicContact CZ3-CE1 3.7Å; W189-F193 HydrophobicContact CZ3-CE2 4.26Å; W189-F193 AromaticContact CZ3-CZ 3.49Å; W189-F193 HydrophobicContact CZ3-CZ 3.49Å; W189-F193 VanDerWaalsContact CZ3-CZ 3.49Å; W189-F193 WeakPolarHBondContact O-CA 3.44Å; W189-F193 WeakPolarHBondContact O-CB 3.27Å; W189-F193 PolarHBondContact O-N 3.27Å; W189-L241 PolarHBondContact NE1-O 3.49Å |
| 190 | F | 94 | Very high | 91.5 | Very high | 57 Ų | 57 | 52.6 Ų | 52.6 | 25% | 0.25 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.2 | -44.5 | 175.1 | 176.9 | -110.5 | 0 | 0 | 0 | 112 | L162 F163 S186 I187 T194 | L162-F190 HydrophobicContact CB-CB 4.48Å; L162-F190 HydrophobicContact CB-CD2 3.79Å; F163-F190 HydrophobicContact CB-CD2 4.32Å; F163-F190 HydrophobicContact CB-CE2 3.85Å; F163-F190 HydrophobicContact CB-CZ 4.46Å; F163-F190 HydrophobicContact CD2-CE2 4.46Å; F163-F190 HydrophobicContact CD2-CZ 4.29Å; S186-F190 WeakPolarHBondContact O-CB 3.27Å; S186-F190 PolarHBondContact O-N 2.92Å; I187-F190 PolarHBondContact O-N 2.86Å; F190-T194 WeakPolarHBondContact O-CB 3.29Å; F190-T194 PolarHBondContact O-N 2.73Å; F190-T194 PolarHBondContact O-OG1 2.93Å |
| 191 | L | 92.9 | Very high | 91.3 | Very high | 111 Ų | 111 | 51.3 Ų | 51.3 | 58% | 0.581 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -75.2 | -32.6 | -177.6 | -67.2 | -179.8 | 0 | 0 | 0 | 113.8 | I187 L188 W189 P195 | I187-L191 HydrophobicContact CG2-CD1 4.01Å; I187-L191 HydrophobicContact CG2-CG 4.45Å; I187-L191 WeakPolarHBondContact O-CG 3.35Å; I187-L191 PolarHBondContact O-N 2.49Å; L188-L191 PolarHBondContact O-N 2.68Å; W189-L191 VanDerWaalsContact C-N 3.32Å; W189-L191 PolarHBondContact O-N 3.3Å; L191-P195 WeakPolarHBondContact O-CD 3.46Å; L191-P195 WeakPolarHBondContact O-CG 3.23Å |
| 192 | I | 91.1 | Very high | 91 | Very high | 82 Ų | 82 | 46.8 Ų | 46.8 | 42% | 0.421 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -89.8 | -49.8 | -178.6 | -65 | 180 | 0 | 0 | 0 | 111.4 | L188 W189 T194 P195 C196 | L188-I192 HydrophobicContact CD1-CD1 3.46Å; L188-I192 VanDerWaalsContact CD1-CD1 3.46Å; L188-I192 HydrophobicContact CD1-CG1 4.22Å; L188-I192 HydrophobicContact CG-CD1 3.9Å; L188-I192 WeakPolarHBondContact O-CB 3.29Å; L188-I192 WeakPolarHBondContact O-CG1 3.18Å; L188-I192 PolarHBondContact O-N 2.83Å; W189-I192 PolarHBondContact O-N 3.26Å; I192-T194 PolarHBondContact O-N 3.5Å; I192-P195 WeakPolarHBondContact O-CD 3.47Å; I192-P195 WeakPolarHBondContact O-CG 3.35Å; I192-C196 WeakPolarHBondContact O-CB 3.34Å; I192-C196 PolarHBondContact O-N 2.96Å |
| 193 | F | 90.6 | Very high | 90.7 | Very high | 38 Ų | 38 | 51.7 Ų | 51.7 | 17% | 0.167 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -71.4 | -32.5 | -172.7 | -68.4 | -12.6 | 0 | 0 | 0 | 112.7 | L162 W189 C196 A197 I230 | L162-F193 HydrophobicContact CD1-CB 3.82Å; W189-F193 HydrophobicContact CB-CD2 4Å; W189-F193 HydrophobicContact CB-CE2 4.24Å; W189-F193 HydrophobicContact CD2-CD2 4.43Å; W189-F193 AromaticContact CD2-CE2 3.84Å; W189-F193 HydrophobicContact CD2-CE2 3.84Å; W189-F193 AromaticContact CD2-CZ 3.92Å; W189-F193 HydrophobicContact CD2-CZ 3.92Å; W189-F193 HydrophobicContact CE3-CD1 4.13Å; W189-F193 HydrophobicContact CE3-CD2 4.18Å; W189-F193 AromaticContact CE3-CE1 3.54Å; W189-F193 HydrophobicContact CE3-CE1 3.54Å; W189-F193 AromaticContact CE3-CE2 3.6Å; W189-F193 HydrophobicContact CE3-CE2 3.6Å; W189-F193 HydrophobicContact CE3-CG 4.43Å; W189-F193 AromaticContact CE3-CZ 3.25Å; W189-F193 HydrophobicContact CE3-CZ 3.25Å; W189-F193 HydrophobicContact CG-CD2 4.38Å; W189-F193 HydrophobicContact CG-CE2 4.11Å; W189-F193 HydrophobicContact CH2-CZ 4.3Å; W189-F193 AromaticContact CZ3-CE1 3.7Å; W189-F193 HydrophobicContact CZ3-CE1 3.7Å; W189-F193 HydrophobicContact CZ3-CE2 4.26Å; W189-F193 AromaticContact CZ3-CZ 3.49Å; W189-F193 HydrophobicContact CZ3-CZ 3.49Å; W189-F193 VanDerWaalsContact CZ3-CZ 3.49Å; W189-F193 WeakPolarHBondContact O-CA 3.44Å; W189-F193 WeakPolarHBondContact O-CB 3.27Å; W189-F193 PolarHBondContact O-N 3.27Å; F193-C196 PolarHBondContact O-N 3.3Å; F193-A197 WeakPolarHBondContact O-CB 3.2Å; F193-A197 PolarHBondContact O-N 3.48Å; F193-I230 HydrophobicContact CE2-CG2 4.11Å |
| 194 | T | 89.4 | Confident | 90.2 | Very high | 25 Ų | 25 | 50.5 Ų | 50.5 | 15% | 0.153 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.2 | -56.3 | 177.1 | -58.2 | 0 | 0 | 0 | 0 | 113.2 | W155 F190 I192 F198 | W155-T194 HydrophobicContact CZ2-CG2 4.47Å; W155-T194 PolarHBondContact NE1-O 2.91Å; F190-T194 WeakPolarHBondContact O-CB 3.29Å; F190-T194 PolarHBondContact O-N 2.73Å; F190-T194 PolarHBondContact O-OG1 2.93Å; I192-T194 PolarHBondContact O-N 3.5Å; T194-F198 PolarHBondContact O-N 2.9Å |
| 195 | P | 88.1 | Confident | 89.9 | Confident | 63 Ų | 63 | 48.8 Ų | 48.8 | 41% | 0.409 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -71.5 | -34.1 | 176.7 | 28.1 | -35.1 | 0 | 0 | 0 | 112.6 | L191 I192 F198 L199 | L191-P195 WeakPolarHBondContact O-CD 3.46Å; L191-P195 WeakPolarHBondContact O-CG 3.23Å; I192-P195 WeakPolarHBondContact O-CD 3.47Å; I192-P195 WeakPolarHBondContact O-CG 3.35Å; P195-F198 PolarHBondContact O-N 3.05Å; P195-L199 WeakPolarHBondContact O-CG 3.35Å; P195-L199 PolarHBondContact O-N 2.99Å |
| 196 | C | 88.4 | Confident | 89.4 | Confident | 52 Ų | 52 | 47.5 Ų | 47.5 | 35% | 0.351 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -61.4 | -47.3 | 176.6 | -177.1 | 0 | 0 | 0 | 0 | 111.2 | I192 F193 F198 L199 C200 | I192-C196 WeakPolarHBondContact O-CB 3.34Å; I192-C196 PolarHBondContact O-N 2.96Å; F193-C196 PolarHBondContact O-N 3.3Å; C196-F198 VanDerWaalsContact C-N 3.28Å; C196-F198 PolarHBondContact O-N 3.18Å; C196-L199 PolarHBondContact O-N 3.19Å; C196-C200 WeakPolarHBondContact O-CB 3.45Å; C196-C200 PolarHBondContact O-N 3.46Å; C196-C200 PolarHBondContact O-SG 3.33Å; C196-C200 VanDerWaalsContact O-SG 3.34Å |
| 197 | A | 88.3 | Confident | 88.8 | Confident | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.008 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -56.6 | -42.8 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | F193 W201 Y202 | F193-A197 WeakPolarHBondContact O-CB 3.2Å; F193-A197 PolarHBondContact O-N 3.48Å; A197-W201 VanDerWaalsContact CB-NE1 3.3Å; A197-W201 PolarHBondContact O-N 3.45Å; A197-W201 PolarHBondContact O-NE1 2.98Å; A197-W201 VanDerWaalsContact O-NE1 3.13Å; A197-Y202 PolarHBondContact O-N 3.5Å |
| 198 | F | 86.2 | Confident | 88.2 | Confident | 45 Ų | 45 | 49.8 Ų | 49.8 | 20% | 0.197 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -63.1 | -47.3 | 177.8 | -173.7 | -102 | 0 | 0 | 0 | 112.2 | W155 T194 P195 C196 Y202 R203 | W155-F198 HydrophobicContact CD2-CD2 4.07Å; W155-F198 AromaticContact CE2-CD2 3.75Å; W155-F198 HydrophobicContact CE3-CD2 4.4Å; W155-F198 HydrophobicContact CH2-CD2 4.14Å; W155-F198 HydrophobicContact CZ2-CB 4.01Å; W155-F198 AromaticContact CZ2-CD2 3.78Å; W155-F198 HydrophobicContact CZ2-CD2 3.78Å; W155-F198 HydrophobicContact CZ2-CG 4.18Å; W155-F198 HydrophobicContact CZ3-CD2 4.43Å; T194-F198 PolarHBondContact O-N 2.9Å; P195-F198 PolarHBondContact O-N 3.05Å; C196-F198 VanDerWaalsContact C-N 3.28Å; C196-F198 PolarHBondContact O-N 3.18Å; F198-Y202 AromaticContact CD2-CD1 3.57Å; F198-Y202 HydrophobicContact CD2-CD1 3.57Å; F198-Y202 HydrophobicContact CD2-CE1 4.27Å; F198-Y202 HydrophobicContact CD2-CG 4.22Å; F198-Y202 AromaticContact CE2-CD1 3.26Å; F198-Y202 HydrophobicContact CE2-CD1 3.26Å; F198-Y202 AromaticContact CE2-CE1 3.54Å; F198-Y202 HydrophobicContact CE2-CE1 3.54Å; F198-Y202 HydrophobicContact CE2-CG 4.29Å; F198-Y202 HydrophobicContact CG-CD1 4.46Å; F198-Y202 AromaticContact CZ-CD1 3.95Å; F198-Y202 HydrophobicContact CZ-CD1 3.95Å; F198-Y202 HydrophobicContact CZ-CE1 4.11Å; F198-Y202 WeakPolarHBondContact O-CB 3.23Å; F198-Y202 PolarHBondContact O-N 3.42Å; F198-R203 HydrophobicContact CE1-CG 4.27Å; F198-R203 PolarHBondContact O-N 3.38Å |
| 199 | L | 85 | Confident | 87.6 | Confident | 94 Ų | 94 | 46.4 Ų | 46.4 | 49% | 0.492 | 23% | 0.231 | S | C | . | . | I | π-helix | trans | -77.9 | -37 | -174.8 | -66.1 | 176.4 | 0 | 0 | 0 | 113.1 | P195 C196 P204 | P195-L199 WeakPolarHBondContact O-CG 3.35Å; P195-L199 PolarHBondContact O-N 2.99Å; C196-L199 PolarHBondContact O-N 3.19Å; L199-P204 VanDerWaalsContact O-CD 3.26Å; L199-P204 WeakPolarHBondContact O-CD 3.49Å |
| 200 | C | 85.2 | Confident | 87 | Confident | 51 Ų | 51 | 49 Ų | 49 | 35% | 0.345 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -91.2 | -24 | -168.2 | -63 | 0 | 0 | 0 | 0 | 113.3 | C196 P204 V223 | C196-C200 WeakPolarHBondContact O-CB 3.45Å; C196-C200 PolarHBondContact O-N 3.46Å; C196-C200 PolarHBondContact O-SG 3.33Å; C196-C200 VanDerWaalsContact O-SG 3.34Å; C200-P204 WeakPolarHBondContact O-CG 3.24Å; C200-V223 HydrophobicContact CB-CG1 3.81Å; C200-V223 WeakPolarHBondContact O-CG1 3.49Å |
| 201 | W | 88.4 | Confident | 85.8 | Confident | 1 Ų | 1 | 49.8 Ų | 49.8 | 0% | 0.004 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -130.2 | -39 | 175.3 | 70 | -100.1 | 0 | 0 | 0 | 114.5 | L151 L154 W155 A197 I205 F220 V223 F224 | L151-W201 HydrophobicContact CB-CZ3 4.02Å; L151-W201 HydrophobicContact CD2-CE3 4.34Å; L151-W201 HydrophobicContact CD2-CZ3 3.99Å; L151-W201 HydrophobicContact CG-CZ3 4.07Å; L151-W201 WeakPolarHBondContact O-CH2 3.38Å; L154-W201 HydrophobicContact CD2-CH2 4.42Å; W155-W201 HydrophobicContact CB-CH2 3.66Å; W155-W201 HydrophobicContact CB-CZ2 3.68Å; W155-W201 HydrophobicContact CG-CZ2 4.35Å; A197-W201 VanDerWaalsContact CB-NE1 3.3Å; A197-W201 PolarHBondContact O-N 3.45Å; A197-W201 PolarHBondContact O-NE1 2.98Å; A197-W201 VanDerWaalsContact O-NE1 3.13Å; W201-I205 VanDerWaalsContact O-CG2 3.24Å; W201-I205 WeakPolarHBondContact O-CG2 3.46Å; W201-I205 PolarHBondContact O-N 3.31Å; W201-I205 VanDerWaalsContact O-N 3.17Å; W201-F220 HydrophobicContact CB-CD2 4.16Å; W201-F220 HydrophobicContact CB-CE2 4.47Å; W201-F220 HydrophobicContact CE3-CE2 4.01Å; W201-V223 HydrophobicContact CB-CG1 4.15Å; W201-F224 HydrophobicContact CB-CB 4.48Å; W201-F224 HydrophobicContact CB-CD2 4.06Å; W201-F224 AromaticContact CD2-CD2 3.6Å; W201-F224 HydrophobicContact CD2-CD2 3.6Å; W201-F224 AromaticContact CD2-CE2 3.74Å; W201-F224 HydrophobicContact CD2-CE2 3.74Å; W201-F224 AromaticContact CE3-CD2 3.67Å; W201-F224 HydrophobicContact CE3-CD2 3.67Å; W201-F224 AromaticContact CE3-CE2 3.57Å; W201-F224 HydrophobicContact CE3-CE2 3.57Å; W201-F224 AromaticContact CG-CD2 3.8Å; W201-F224 HydrophobicContact CG-CD2 3.8Å; W201-F224 HydrophobicContact CG-CE2 4.39Å; W201-F224 AromaticContact CH2-CE2 3.98Å; W201-F224 HydrophobicContact CH2-CE2 3.98Å; W201-F224 HydrophobicContact CZ2-CE2 4.15Å; W201-F224 HydrophobicContact CZ3-CD2 4.27Å; W201-F224 AromaticContact CZ3-CE2 3.7Å; W201-F224 HydrophobicContact CZ3-CE2 3.7Å |
| 202 | Y | 87.1 | Confident | 84.6 | Confident | 2 Ų | 2 | 48.1 Ų | 48.1 | 1% | 0.008 | 25% | 0.245 | C | C | . | . | I | π-helix | trans | -68.9 | -43.7 | 179.4 | 177.6 | -98.9 | 0 | 0 | 0 | 112.4 | Q134 Y152 A197 F198 I205 Y206 | Q134-Y202 PolarHBondContact OE1-OH 3.46Å; Y152-Y202 HydrophobicContact CD2-CE1 4.46Å; Y152-Y202 AromaticContact CD2-CE2 3.9Å; Y152-Y202 HydrophobicContact CD2-CE2 3.9Å; Y152-Y202 AromaticContact CD2-CZ 3.77Å; Y152-Y202 HydrophobicContact CG-CE2 4.29Å; A197-Y202 PolarHBondContact O-N 3.5Å; F198-Y202 AromaticContact CD2-CD1 3.57Å; F198-Y202 HydrophobicContact CD2-CD1 3.57Å; F198-Y202 HydrophobicContact CD2-CE1 4.27Å; F198-Y202 HydrophobicContact CD2-CG 4.22Å; F198-Y202 AromaticContact CE2-CD1 3.26Å; F198-Y202 HydrophobicContact CE2-CD1 3.26Å; F198-Y202 AromaticContact CE2-CE1 3.54Å; F198-Y202 HydrophobicContact CE2-CE1 3.54Å; F198-Y202 HydrophobicContact CE2-CG 4.29Å; F198-Y202 HydrophobicContact CG-CD1 4.46Å; F198-Y202 AromaticContact CZ-CD1 3.95Å; F198-Y202 HydrophobicContact CZ-CD1 3.95Å; F198-Y202 HydrophobicContact CZ-CE1 4.11Å; F198-Y202 WeakPolarHBondContact O-CB 3.23Å; F198-Y202 PolarHBondContact O-N 3.42Å; Y202-I205 WeakPolarHBondContact O-CG2 3.37Å; Y202-Y206 VanDerWaalsContact O-CB 3.24Å; Y202-Y206 WeakPolarHBondContact O-CB 3.2Å; Y202-Y206 PolarHBondContact O-N 3.2Å |
| 203 | R | 85 | Confident | 83.8 | Confident | 131 Ų | 131 | 45.6 Ų | 45.6 | 49% | 0.494 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.8 | -48.6 | 176 | -100.1 | -163.6 | 176.1 | -157.9 | -0.7 | 113.4 | F198 I205 Y206 K207 | F198-R203 HydrophobicContact CE1-CG 4.27Å; F198-R203 PolarHBondContact O-N 3.38Å; R203-I205 VanDerWaalsContact C-N 3.34Å; R203-I205 PolarHBondContact O-N 2.99Å; R203-Y206 PolarHBondContact O-N 2.8Å; R203-K207 WeakPolarHBondContact O-CB 3.24Å; R203-K207 PolarHBondContact O-N 3.37Å |
| 204 | P | 86.4 | Confident | 83.1 | Confident | 21 Ų | 21 | 43.9 Ų | 43.9 | 14% | 0.136 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -57.3 | -46 | 176.8 | -31.7 | 38.8 | 0 | 0 | 0 | 112.4 | L199 C200 Y206 K207 A208 S216 V219 F220 | L199-P204 VanDerWaalsContact O-CD 3.26Å; L199-P204 WeakPolarHBondContact O-CD 3.49Å; C200-P204 WeakPolarHBondContact O-CG 3.24Å; P204-Y206 PolarHBondContact O-N 3.49Å; P204-K207 PolarHBondContact O-N 3.17Å; P204-A208 WeakPolarHBondContact O-CB 3.03Å; P204-A208 PolarHBondContact O-N 2.87Å; P204-S216 WeakPolarHBondContact O-CB 3.4Å; P204-V219 HydrophobicContact CB-CG1 4.35Å; P204-V219 HydrophobicContact CG-CG1 4.27Å; P204-F220 HydrophobicContact CB-CB 4.4Å |
| 205 | I | 87.1 | Confident | 82.5 | Confident | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -69.8 | -34.6 | -179.4 | -163.4 | 51.3 | 0 | 0 | 0 | 112.5 | L151 W201 Y202 R203 A208 F209 F217 F220 V285 | L151-I205 HydrophobicContact CD2-CB 4.19Å; L151-I205 HydrophobicContact CD2-CG1 3.7Å; L151-I205 HydrophobicContact CD2-CG2 3.64Å; W201-I205 VanDerWaalsContact O-CG2 3.24Å; W201-I205 WeakPolarHBondContact O-CG2 3.46Å; W201-I205 PolarHBondContact O-N 3.31Å; W201-I205 VanDerWaalsContact O-N 3.17Å; Y202-I205 WeakPolarHBondContact O-CG2 3.37Å; R203-I205 VanDerWaalsContact C-N 3.34Å; R203-I205 PolarHBondContact O-N 2.99Å; I205-A208 HydrophobicContact CD1-CB 4.19Å; I205-A208 WeakPolarHBondContact O-CB 3.39Å; I205-A208 PolarHBondContact O-N 3.24Å; I205-F209 HydrophobicContact CD1-CD2 4.24Å; I205-F209 HydrophobicContact CD1-CE1 4.04Å; I205-F209 HydrophobicContact CD1-CE2 3.73Å; I205-F209 HydrophobicContact CD1-CZ 3.6Å; I205-F209 HydrophobicContact CG1-CD2 3.93Å; I205-F209 HydrophobicContact CG1-CE2 3.42Å; I205-F209 VanDerWaalsContact CG1-CE2 3.42Å; I205-F209 HydrophobicContact CG1-CZ 3.8Å; I205-F209 VanDerWaalsContact O-CD2 3.3Å; I205-F209 WeakPolarHBondContact O-CD2 3.47Å; I205-F209 WeakPolarHBondContact O-CG 3.31Å; I205-F209 PolarHBondContact O-N 2.97Å; I205-F217 HydrophobicContact CD1-CD1 3.85Å; I205-F217 HydrophobicContact CD1-CE1 3.71Å; I205-F220 HydrophobicContact CB-CB 4.25Å; I205-F220 HydrophobicContact CB-CD2 3.52Å; I205-F220 HydrophobicContact CB-CE2 3.94Å; I205-F220 HydrophobicContact CB-CG 3.82Å; I205-F220 HydrophobicContact CD1-CB 4.31Å; I205-F220 HydrophobicContact CD1-CD1 3.7Å; I205-F220 HydrophobicContact CD1-CD2 4.27Å; I205-F220 HydrophobicContact CD1-CE1 4.06Å; I205-F220 HydrophobicContact CD1-CG 3.8Å; I205-F220 HydrophobicContact CD1-CZ 4.47Å; I205-F220 HydrophobicContact CG1-CD1 4.22Å; I205-F220 HydrophobicContact CG1-CD2 3.96Å; I205-F220 HydrophobicContact CG1-CE1 4.33Å; I205-F220 HydrophobicContact CG1-CE2 4.05Å; I205-F220 HydrophobicContact CG1-CG 4.02Å; I205-F220 HydrophobicContact CG1-CZ 4.24Å; I205-F220 HydrophobicContact CG2-CD2 4.14Å; I205-F220 HydrophobicContact CG2-CE2 4.25Å; I205-V285 HydrophobicContact CD1-CG1 3.91Å |
| 206 | Y | 84.6 | Confident | 82.3 | Confident | 14 Ų | 14 | 44 Ų | 44 | 6% | 0.055 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.5 | -49.2 | 172.4 | -174.7 | -99.9 | 0 | 0 | 0 | 111.4 | Q134 E139 I140 Y202 R203 P204 A208 F209 R210 | Q134-Y206 PolarHBondContact NE2-OH 3.35Å; E139-Y206 VanDerWaalsContact CD-OH 3.3Å; E139-Y206 PolarHBondContact OE2-OH 3.4Å; I140-Y206 HydrophobicContact CD1-CD2 3.98Å; I140-Y206 HydrophobicContact CD1-CE2 3.65Å; I140-Y206 HydrophobicContact CG1-CE2 4.24Å; Y202-Y206 VanDerWaalsContact O-CB 3.24Å; Y202-Y206 WeakPolarHBondContact O-CB 3.2Å; Y202-Y206 PolarHBondContact O-N 3.2Å; R203-Y206 PolarHBondContact O-N 2.8Å; P204-Y206 PolarHBondContact O-N 3.49Å; Y206-A208 VanDerWaalsContact C-N 3.31Å; Y206-A208 PolarHBondContact O-N 3.19Å; Y206-F209 PolarHBondContact O-N 2.94Å; Y206-R210 WeakPolarHBondContact O-CB 3.45Å; Y206-R210 PolarHBondContact O-N 3.19Å |
| 207 | K | 82.3 | Confident | 82.2 | Confident | 115 Ų | 115 | 41.8 Ų | 41.8 | 50% | 0.5 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -62.2 | -39.3 | 175.7 | -175.6 | 178.8 | 176.9 | -176 | 0 | 111.6 | R203 P204 R210 S211 | R203-K207 WeakPolarHBondContact O-CB 3.24Å; R203-K207 PolarHBondContact O-N 3.37Å; P204-K207 PolarHBondContact O-N 3.17Å; K207-R210 PolarHBondContact O-N 2.89Å; K207-S211 WeakPolarHBondContact O-CB 3.41Å; K207-S211 PolarHBondContact O-N 2.96Å; K207-S211 PolarHBondContact O-OG 3.41Å |
| 208 | A | 83.9 | Confident | 82.1 | Confident | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.4 | -47.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | P204 I205 Y206 D212 N213 F217 | P204-A208 WeakPolarHBondContact O-CB 3.03Å; P204-A208 PolarHBondContact O-N 2.87Å; I205-A208 HydrophobicContact CD1-CB 4.19Å; I205-A208 WeakPolarHBondContact O-CB 3.39Å; I205-A208 PolarHBondContact O-N 3.24Å; Y206-A208 VanDerWaalsContact C-N 3.31Å; Y206-A208 PolarHBondContact O-N 3.19Å; A208-D212 WeakPolarHBondContact O-CA 3.43Å; A208-D212 PolarHBondContact O-N 2.81Å; A208-N213 PolarHBondContact O-N 3Å; A208-F217 HydrophobicContact CB-CD1 3.9Å; A208-F217 HydrophobicContact CB-CD2 3.73Å; A208-F217 HydrophobicContact CB-CE1 3.92Å; A208-F217 HydrophobicContact CB-CE2 3.76Å; A208-F217 HydrophobicContact CB-CG 3.8Å; A208-F217 HydrophobicContact CB-CZ 3.85Å |
| 209 | F | 81.9 | Confident | 82.2 | Confident | 6 Ų | 6 | 47.3 Ų | 47.3 | 3% | 0.026 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -72 | -30.6 | 179.3 | -67.3 | -40.9 | 0 | 0 | 0 | 114.4 | I140 Y144 I147 C148 I205 Y206 F217 V285 L288 | I140-F209 HydrophobicContact CD1-CB 4.14Å; I140-F209 HydrophobicContact CG1-CB 4.5Å; I140-F209 HydrophobicContact CG2-CB 4.25Å; Y144-F209 AromaticContact CD1-CD1 3.43Å; Y144-F209 HydrophobicContact CD1-CD1 3.43Å; Y144-F209 VanDerWaalsContact CD1-CD1 3.43Å; Y144-F209 AromaticContact CD1-CE1 3.63Å; Y144-F209 HydrophobicContact CD1-CE1 3.63Å; Y144-F209 HydrophobicContact CD1-CG 4.41Å; Y144-F209 HydrophobicContact CE1-CD1 4.26Å; Y144-F209 HydrophobicContact CE1-CE1 4.38Å; Y144-F209 AromaticContact CG-CD1 3.92Å; Y144-F209 HydrophobicContact CG-CD1 3.92Å; Y144-F209 HydrophobicContact CG-CE1 4.44Å; I147-F209 HydrophobicContact CG2-CE2 4.27Å; I147-F209 HydrophobicContact CG2-CZ 3.94Å; C148-F209 HydrophobicContact CB-CD2 3.73Å; C148-F209 HydrophobicContact CB-CE2 3.99Å; I205-F209 HydrophobicContact CD1-CD2 4.24Å; I205-F209 HydrophobicContact CD1-CE1 4.04Å; I205-F209 HydrophobicContact CD1-CE2 3.73Å; I205-F209 HydrophobicContact CD1-CZ 3.6Å; I205-F209 HydrophobicContact CG1-CD2 3.93Å; I205-F209 HydrophobicContact CG1-CE2 3.42Å; I205-F209 VanDerWaalsContact CG1-CE2 3.42Å; I205-F209 HydrophobicContact CG1-CZ 3.8Å; I205-F209 VanDerWaalsContact O-CD2 3.3Å; I205-F209 WeakPolarHBondContact O-CD2 3.47Å; I205-F209 WeakPolarHBondContact O-CG 3.31Å; I205-F209 PolarHBondContact O-N 2.97Å; Y206-F209 PolarHBondContact O-N 2.94Å; F209-F217 AromaticContact CD1-CE1 3.92Å; F209-F217 HydrophobicContact CD1-CE1 3.92Å; F209-F217 AromaticContact CD1-CZ 3.66Å; F209-F217 HydrophobicContact CD1-CZ 3.66Å; F209-F217 AromaticContact CE1-CE1 3.56Å; F209-F217 HydrophobicContact CE1-CE1 3.56Å; F209-F217 AromaticContact CE1-CZ 3.73Å; F209-F217 HydrophobicContact CE1-CZ 3.73Å; F209-F217 HydrophobicContact CZ-CE1 4.35Å; F209-V285 HydrophobicContact CZ-CG1 4.28Å; F209-V285 HydrophobicContact CZ-CG2 4.24Å; F209-L288 HydrophobicContact CE1-CD2 4.21Å |
| 210 | R | 80.4 | Confident | 82.5 | Confident | 120 Ų | 120 | 42.9 Ų | 42.9 | 45% | 0.453 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -75.2 | -38.5 | 178 | 179.4 | 173.3 | 175.1 | 171.4 | -2.4 | 112.8 | E139 Y206 K207 | E139-R210 IonicContact OE1-CZ 3.98Å; E139-R210 IonicContact OE1-NH1 3.3Å; E139-R210 PolarHBondContact OE1-NH1 2.95Å; E139-R210 IonicContact OE2-CZ 3.39Å; E139-R210 IonicContact OE2-NE 3.71Å; E139-R210 IonicContact OE2-NH1 2.68Å; E139-R210 PolarHBondContact OE2-NH1 3.22Å; Y206-R210 WeakPolarHBondContact O-CB 3.45Å; Y206-R210 PolarHBondContact O-N 3.19Å; K207-R210 PolarHBondContact O-N 2.89Å |
| 211 | S | 69.7 | Low | 82.8 | Confident | 74 Ų | 74 | 42.1 Ų | 42.1 | 52% | 0.517 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -113.3 | 1.3 | -168.9 | -45.5 | 0 | 0 | 0 | 0 | 114.1 | K207 N213 | K207-S211 WeakPolarHBondContact O-CB 3.41Å; K207-S211 PolarHBondContact O-N 2.96Å; K207-S211 PolarHBondContact O-OG 3.41Å; S211-N213 PolarHBondContact O-N 3.22Å; S211-N213 VanDerWaalsContact O-N 3.15Å |
| 212 | D | 67.8 | Low | 82.9 | Confident | 75 Ų | 75 | 48.4 Ų | 48.4 | 40% | 0.401 | 23% | 0.225 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 46.8 | 36 | -168 | -151.7 | 15.8 | 0 | 0 | 0 | 113.6 | A208 S214 | A208-D212 WeakPolarHBondContact O-CA 3.43Å; A208-D212 PolarHBondContact O-N 2.81Å; D212-S214 PolarHBondContact O-N 2.85Å |
| 213 | N | 73 | Confident | 83.2 | Confident | 30 Ų | 30 | 50 Ų | 50 | 16% | 0.16 | 24% | 0.235 | C | C | . | . | trans | -79.7 | 109.9 | -176.5 | 178.4 | 16.9 | 0 | 0 | 0 | 110.6 | A208 S211 F215 S216 F217 E302 | A208-N213 PolarHBondContact O-N 3Å; S211-N213 PolarHBondContact O-N 3.22Å; S211-N213 VanDerWaalsContact O-N 3.15Å; N213-F215 VanDerWaalsContact C-N 3.27Å; N213-F215 PolarHBondContact O-N 3.33Å; N213-F215 WeakPolarHBondContact OD1-CB 3.5Å; N213-F215 PolarHBondContact OD1-N 3.39Å; N213-S216 PolarHBondContact ND2-OG 3.1Å; N213-S216 WeakPolarHBondContact O-CB 3.27Å; N213-S216 PolarHBondContact O-N 3.19Å; N213-S216 VanDerWaalsContact O-N 3.1Å; N213-F217 WeakPolarHBondContact O-CD2 3.35Å; N213-F217 PolarHBondContact O-N 3.16Å; N213-E302 PolarHBondContact OD1-OE2 3.2Å | ||
| 214 | S | 76.4 | Confident | 83.6 | Confident | 1 Ų | 1 | 43.8 Ų | 43.8 | 1% | 0.007 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.5 | -32.3 | -178.1 | -64.6 | 0 | 0 | 0 | 0 | 112.5 | D212 S216 F217 F218 E302 | D212-S214 PolarHBondContact O-N 2.85Å; S214-S216 PolarHBondContact O-N 2.85Å; S214-F217 WeakPolarHBondContact O-CB 3.37Å; S214-F217 PolarHBondContact O-N 3.5Å; S214-F218 PolarHBondContact O-N 3.4Å; S214-F218 VanDerWaalsContact O-N 3.08Å; S214-E302 VanDerWaalsContact CB-OE2 3.31Å; S214-E302 WeakPolarHBondContact CB-OE2 3.42Å; S214-E302 PolarHBondContact N-OE2 2.89Å |
| 215 | F | 76.4 | Confident | 84 | Confident | 84 Ų | 84 | 49.5 Ų | 49.5 | 37% | 0.368 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.8 | -40.2 | 174.9 | 178.9 | -99.6 | 0 | 0 | 0 | 112.1 | N213 F217 F218 V219 F303 | N213-F215 VanDerWaalsContact C-N 3.27Å; N213-F215 PolarHBondContact O-N 3.33Å; N213-F215 WeakPolarHBondContact OD1-CB 3.5Å; N213-F215 PolarHBondContact OD1-N 3.39Å; F215-F217 VanDerWaalsContact C-N 3.29Å; F215-F217 PolarHBondContact O-N 3.42Å; F215-F218 PolarHBondContact O-N 3.25Å; F215-V219 HydrophobicContact CD1-CG2 4.32Å; F215-V219 HydrophobicContact CE1-CG2 3.82Å; F215-V219 HydrophobicContact CE2-CG2 4.35Å; F215-V219 HydrophobicContact CZ-CG2 3.83Å; F215-V219 PolarHBondContact O-N 2.89Å; F215-V219 VanDerWaalsContact O-N 3.09Å; F215-F303 AromaticContact CD2-CD2 3.68Å; F215-F303 HydrophobicContact CD2-CD2 3.68Å; F215-F303 HydrophobicContact CD2-CE2 4.32Å; F215-F303 AromaticContact CE2-CD2 3.58Å; F215-F303 HydrophobicContact CE2-CD2 3.58Å; F215-F303 AromaticContact CE2-CE2 3.74Å; F215-F303 HydrophobicContact CE2-CE2 3.74Å; F215-F303 HydrophobicContact CZ-CD2 4.35Å; F215-F303 HydrophobicContact CZ-CE2 4.26Å |
| 216 | S | 84.6 | Confident | 84.3 | Confident | 8 Ų | 8 | 52.3 Ų | 52.3 | 6% | 0.056 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.5 | -35.7 | 176.2 | -72.6 | 0 | 0 | 0 | 0 | 111.7 | P204 N213 S214 F220 | P204-S216 WeakPolarHBondContact O-CB 3.4Å; N213-S216 PolarHBondContact ND2-OG 3.1Å; N213-S216 WeakPolarHBondContact O-CB 3.27Å; N213-S216 PolarHBondContact O-N 3.19Å; N213-S216 VanDerWaalsContact O-N 3.1Å; S214-S216 PolarHBondContact O-N 2.85Å; S216-F220 WeakPolarHBondContact O-CB 3.41Å; S216-F220 PolarHBondContact O-N 2.68Å |
| 217 | F | 85.8 | Confident | 84.8 | Confident | 4 Ų | 4 | 52.3 Ų | 52.3 | 2% | 0.018 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 172.3 | -82 | -68.3 | 0 | 0 | 0 | 111.9 | I205 A208 F209 N213 S214 F215 F220 F221 V285 Y289 | I205-F217 HydrophobicContact CD1-CD1 3.85Å; I205-F217 HydrophobicContact CD1-CE1 3.71Å; A208-F217 HydrophobicContact CB-CD1 3.9Å; A208-F217 HydrophobicContact CB-CD2 3.73Å; A208-F217 HydrophobicContact CB-CE1 3.92Å; A208-F217 HydrophobicContact CB-CE2 3.76Å; A208-F217 HydrophobicContact CB-CG 3.8Å; A208-F217 HydrophobicContact CB-CZ 3.85Å; F209-F217 AromaticContact CD1-CE1 3.92Å; F209-F217 HydrophobicContact CD1-CE1 3.92Å; F209-F217 AromaticContact CD1-CZ 3.66Å; F209-F217 HydrophobicContact CD1-CZ 3.66Å; F209-F217 AromaticContact CE1-CE1 3.56Å; F209-F217 HydrophobicContact CE1-CE1 3.56Å; F209-F217 AromaticContact CE1-CZ 3.73Å; F209-F217 HydrophobicContact CE1-CZ 3.73Å; F209-F217 HydrophobicContact CZ-CE1 4.35Å; N213-F217 WeakPolarHBondContact O-CD2 3.35Å; N213-F217 PolarHBondContact O-N 3.16Å; S214-F217 WeakPolarHBondContact O-CB 3.37Å; S214-F217 PolarHBondContact O-N 3.5Å; F215-F217 VanDerWaalsContact C-N 3.29Å; F215-F217 PolarHBondContact O-N 3.42Å; F217-F220 WeakPolarHBondContact O-CB 3.34Å; F217-F220 PolarHBondContact O-N 3.2Å; F217-F221 HydrophobicContact CB-CD2 4.44Å; F217-F221 HydrophobicContact CB-CE2 4.16Å; F217-F221 HydrophobicContact CD1-CE2 4.35Å; F217-F221 WeakPolarHBondContact O-CD2 3.18Å; F217-F221 PolarHBondContact O-N 2.99Å; F217-V285 HydrophobicContact CD1-CG1 4.35Å; F217-V285 HydrophobicContact CE1-CG1 4.21Å; F217-Y289 HydrophobicContact CB-CD2 4.11Å; F217-Y289 HydrophobicContact CB-CE2 4.05Å; F217-Y289 HydrophobicContact CD1-CD2 4.25Å; F217-Y289 HydrophobicContact CD2-CD2 4.03Å; F217-Y289 HydrophobicContact CD2-CE2 4.22Å; F217-Y289 AromaticContact CG-CD2 3.88Å; F217-Y289 HydrophobicContact CG-CD2 3.88Å; F217-Y289 HydrophobicContact CG-CE2 4.19Å |
| 218 | F | 87.1 | Confident | 85.5 | Confident | 118 Ų | 118 | 47.4 Ų | 47.4 | 52% | 0.518 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60.1 | -48 | 178.4 | 179.3 | -99 | 0 | 0 | 0 | 112.5 | S214 F215 F220 F221 F222 | S214-F218 PolarHBondContact O-N 3.4Å; S214-F218 VanDerWaalsContact O-N 3.08Å; F215-F218 PolarHBondContact O-N 3.25Å; F218-F220 VanDerWaalsContact C-N 3.32Å; F218-F220 PolarHBondContact O-N 2.89Å; F218-F221 PolarHBondContact O-N 3.24Å; F218-F222 PolarHBondContact O-N 2.93Å; F218-F222 VanDerWaalsContact O-N 3.08Å |
| 219 | V | 88.1 | Confident | 86 | Confident | 45 Ų | 45 | 48.9 Ų | 48.9 | 27% | 0.273 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -60.5 | -43.5 | 176.7 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | P204 F215 F222 V223 | P204-V219 HydrophobicContact CB-CG1 4.35Å; P204-V219 HydrophobicContact CG-CG1 4.27Å; F215-V219 HydrophobicContact CD1-CG2 4.32Å; F215-V219 HydrophobicContact CE1-CG2 3.82Å; F215-V219 HydrophobicContact CE2-CG2 4.35Å; F215-V219 HydrophobicContact CZ-CG2 3.83Å; F215-V219 PolarHBondContact O-N 2.89Å; F215-V219 VanDerWaalsContact O-N 3.09Å; V219-F222 PolarHBondContact O-N 3.41Å; V219-V223 HydrophobicContact CG1-CG2 4.2Å; V219-V223 WeakPolarHBondContact O-CB 3.22Å; V219-V223 VanDerWaalsContact O-CG2 3.31Å; V219-V223 WeakPolarHBondContact O-CG2 3.48Å; V219-V223 PolarHBondContact O-N 3.4Å |
| 220 | F | 91.5 | Very high | 86.6 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -57.7 | -51.8 | 175.1 | 165.4 | -100.6 | 0 | 0 | 0 | 111.6 | L151 W201 P204 I205 S216 F217 F218 F222 V223 F224 V285 | L151-F220 HydrophobicContact CD2-CE2 3.63Å; L151-F220 HydrophobicContact CD2-CZ 3.67Å; W201-F220 HydrophobicContact CB-CD2 4.16Å; W201-F220 HydrophobicContact CB-CE2 4.47Å; W201-F220 HydrophobicContact CE3-CE2 4.01Å; P204-F220 HydrophobicContact CB-CB 4.4Å; I205-F220 HydrophobicContact CB-CB 4.25Å; I205-F220 HydrophobicContact CB-CD2 3.52Å; I205-F220 HydrophobicContact CB-CE2 3.94Å; I205-F220 HydrophobicContact CB-CG 3.82Å; I205-F220 HydrophobicContact CD1-CB 4.31Å; I205-F220 HydrophobicContact CD1-CD1 3.7Å; I205-F220 HydrophobicContact CD1-CD2 4.27Å; I205-F220 HydrophobicContact CD1-CE1 4.06Å; I205-F220 HydrophobicContact CD1-CG 3.8Å; I205-F220 HydrophobicContact CD1-CZ 4.47Å; I205-F220 HydrophobicContact CG1-CD1 4.22Å; I205-F220 HydrophobicContact CG1-CD2 3.96Å; I205-F220 HydrophobicContact CG1-CE1 4.33Å; I205-F220 HydrophobicContact CG1-CE2 4.05Å; I205-F220 HydrophobicContact CG1-CG 4.02Å; I205-F220 HydrophobicContact CG1-CZ 4.24Å; I205-F220 HydrophobicContact CG2-CD2 4.14Å; I205-F220 HydrophobicContact CG2-CE2 4.25Å; S216-F220 WeakPolarHBondContact O-CB 3.41Å; S216-F220 PolarHBondContact O-N 2.68Å; F217-F220 WeakPolarHBondContact O-CB 3.34Å; F217-F220 PolarHBondContact O-N 3.2Å; F218-F220 VanDerWaalsContact C-N 3.32Å; F218-F220 PolarHBondContact O-N 2.89Å; F220-F222 VanDerWaalsContact C-N 3.33Å; F220-F222 PolarHBondContact O-N 3.21Å; F220-V223 PolarHBondContact O-N 2.73Å; F220-F224 HydrophobicContact CD2-CB 4.04Å; F220-F224 HydrophobicContact CD2-CG 4.38Å; F220-F224 HydrophobicContact CE1-CB 4.46Å; F220-F224 HydrophobicContact CE1-CD1 4.49Å; F220-F224 HydrophobicContact CE2-CB 3.71Å; F220-F224 HydrophobicContact CE2-CD1 4.11Å; F220-F224 AromaticContact CE2-CD2 3.69Å; F220-F224 HydrophobicContact CE2-CD2 3.69Å; F220-F224 HydrophobicContact CE2-CE2 4.27Å; F220-F224 AromaticContact CE2-CG 3.58Å; F220-F224 HydrophobicContact CE2-CG 3.58Å; F220-F224 HydrophobicContact CZ-CB 3.95Å; F220-F224 AromaticContact CZ-CD1 3.72Å; F220-F224 HydrophobicContact CZ-CD1 3.72Å; F220-F224 HydrophobicContact CZ-CD2 4.15Å; F220-F224 HydrophobicContact CZ-CE1 4.17Å; F220-F224 AromaticContact CZ-CG 3.68Å; F220-F224 HydrophobicContact CZ-CG 3.68Å; F220-F224 WeakPolarHBondContact O-CB 3.24Å; F220-F224 PolarHBondContact O-N 2.92Å; F220-V285 HydrophobicContact CD1-CG1 4.16Å; F220-V285 HydrophobicContact CE1-CB 4.07Å; F220-V285 HydrophobicContact CE1-CG1 3.7Å; F220-V285 HydrophobicContact CE1-CG2 4.15Å; F220-V285 HydrophobicContact CZ-CG2 4.32Å |
| 221 | F | 91.4 | Very high | 87.3 | Confident | 36 Ų | 36 | 45.3 Ų | 45.3 | 16% | 0.158 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59.1 | -44.3 | -177.4 | -75.1 | -57.7 | 0 | 0 | 0 | 112.2 | F217 F218 F225 L282 V285 H286 Y289 | F217-F221 HydrophobicContact CB-CD2 4.44Å; F217-F221 HydrophobicContact CB-CE2 4.16Å; F217-F221 HydrophobicContact CD1-CE2 4.35Å; F217-F221 WeakPolarHBondContact O-CD2 3.18Å; F217-F221 PolarHBondContact O-N 2.99Å; F218-F221 PolarHBondContact O-N 3.24Å; F221-F225 WeakPolarHBondContact O-CB 3.33Å; F221-F225 PolarHBondContact O-N 2.89Å; F221-L282 HydrophobicContact CD1-CD1 3.54Å; F221-L282 HydrophobicContact CE1-CD1 3.99Å; F221-V285 HydrophobicContact CE1-CB 4.24Å; F221-V285 HydrophobicContact CE1-CG1 3.88Å; F221-V285 HydrophobicContact CZ-CB 4.49Å; F221-V285 HydrophobicContact CZ-CG1 3.77Å; F221-H286 HydrophobicContact CE1-CB 3.89Å; F221-H286 HydrophobicContact CZ-CB 4.17Å; F221-Y289 HydrophobicContact CE2-CD1 4.12Å; F221-Y289 HydrophobicContact CE2-CD2 4.46Å; F221-Y289 HydrophobicContact CE2-CG 4.02Å; F221-Y289 HydrophobicContact CZ-CG 4.33Å |
| 222 | F | 91 | Very high | 88.6 | Confident | 133 Ų | 133 | 46 Ų | 46 | 58% | 0.583 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -63.8 | -53.1 | 178.6 | 177.1 | -102.6 | 0 | 0 | 0 | 112.1 | F218 V219 F220 F224 F225 C226 | F218-F222 PolarHBondContact O-N 2.93Å; F218-F222 VanDerWaalsContact O-N 3.08Å; V219-F222 PolarHBondContact O-N 3.41Å; F220-F222 VanDerWaalsContact C-N 3.33Å; F220-F222 PolarHBondContact O-N 3.21Å; F222-F224 PolarHBondContact O-N 3.06Å; F222-F225 PolarHBondContact O-N 3.42Å; F222-C226 PolarHBondContact O-N 3.34Å |
| 223 | V | 92.4 | Very high | 89.9 | Confident | 35 Ų | 35 | 46.2 Ų | 46.2 | 21% | 0.212 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.1 | -42.3 | -177.6 | 176.1 | 0 | 0 | 0 | 0 | 111.2 | C200 W201 V219 F220 F225 C226 Q227 | C200-V223 HydrophobicContact CB-CG1 3.81Å; C200-V223 WeakPolarHBondContact O-CG1 3.49Å; W201-V223 HydrophobicContact CB-CG1 4.15Å; V219-V223 HydrophobicContact CG1-CG2 4.2Å; V219-V223 WeakPolarHBondContact O-CB 3.22Å; V219-V223 VanDerWaalsContact O-CG2 3.31Å; V219-V223 WeakPolarHBondContact O-CG2 3.48Å; V219-V223 PolarHBondContact O-N 3.4Å; F220-V223 PolarHBondContact O-N 2.73Å; V223-F225 VanDerWaalsContact C-N 3.32Å; V223-F225 PolarHBondContact O-N 2.88Å; V223-C226 WeakPolarHBondContact O-CB 3.49Å; V223-C226 PolarHBondContact O-N 2.86Å; V223-Q227 PolarHBondContact O-N 3.38Å |
| 224 | F | 94.8 | Very high | 90.9 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -69.7 | -30.4 | -178.6 | -161.3 | -108.4 | 0 | 0 | 0 | 112 | L154 W201 F220 F222 Q227 I228 S278 L282 | L154-F224 HydrophobicContact CD2-CE2 4.13Å; L154-F224 HydrophobicContact CD2-CZ 3.65Å; W201-F224 HydrophobicContact CB-CB 4.48Å; W201-F224 HydrophobicContact CB-CD2 4.06Å; W201-F224 AromaticContact CD2-CD2 3.6Å; W201-F224 HydrophobicContact CD2-CD2 3.6Å; W201-F224 AromaticContact CD2-CE2 3.74Å; W201-F224 HydrophobicContact CD2-CE2 3.74Å; W201-F224 AromaticContact CE3-CD2 3.67Å; W201-F224 HydrophobicContact CE3-CD2 3.67Å; W201-F224 AromaticContact CE3-CE2 3.57Å; W201-F224 HydrophobicContact CE3-CE2 3.57Å; W201-F224 AromaticContact CG-CD2 3.8Å; W201-F224 HydrophobicContact CG-CD2 3.8Å; W201-F224 HydrophobicContact CG-CE2 4.39Å; W201-F224 AromaticContact CH2-CE2 3.98Å; W201-F224 HydrophobicContact CH2-CE2 3.98Å; W201-F224 HydrophobicContact CZ2-CE2 4.15Å; W201-F224 HydrophobicContact CZ3-CD2 4.27Å; W201-F224 AromaticContact CZ3-CE2 3.7Å; W201-F224 HydrophobicContact CZ3-CE2 3.7Å; F220-F224 HydrophobicContact CD2-CB 4.04Å; F220-F224 HydrophobicContact CD2-CG 4.38Å; F220-F224 HydrophobicContact CE1-CB 4.46Å; F220-F224 HydrophobicContact CE1-CD1 4.49Å; F220-F224 HydrophobicContact CE2-CB 3.71Å; F220-F224 HydrophobicContact CE2-CD1 4.11Å; F220-F224 AromaticContact CE2-CD2 3.69Å; F220-F224 HydrophobicContact CE2-CD2 3.69Å; F220-F224 HydrophobicContact CE2-CE2 4.27Å; F220-F224 AromaticContact CE2-CG 3.58Å; F220-F224 HydrophobicContact CE2-CG 3.58Å; F220-F224 HydrophobicContact CZ-CB 3.95Å; F220-F224 AromaticContact CZ-CD1 3.72Å; F220-F224 HydrophobicContact CZ-CD1 3.72Å; F220-F224 HydrophobicContact CZ-CD2 4.15Å; F220-F224 HydrophobicContact CZ-CE1 4.17Å; F220-F224 AromaticContact CZ-CG 3.68Å; F220-F224 HydrophobicContact CZ-CG 3.68Å; F220-F224 WeakPolarHBondContact O-CB 3.24Å; F220-F224 PolarHBondContact O-N 2.92Å; F222-F224 PolarHBondContact O-N 3.06Å; F224-Q227 WeakPolarHBondContact O-CB 3.34Å; F224-Q227 PolarHBondContact O-N 3.33Å; F224-I228 HydrophobicContact CD1-CD1 4.27Å; F224-I228 HydrophobicContact CE1-CD1 4.44Å; F224-I228 WeakPolarHBondContact O-CG1 3.42Å; F224-I228 PolarHBondContact O-N 3.33Å; F224-S278 WeakPolarHBondContact CE1-O 3.39Å; F224-L282 HydrophobicContact CD1-CB 4.15Å; F224-L282 HydrophobicContact CD1-CD1 4.09Å; F224-L282 HydrophobicContact CE1-CB 4.13Å |
| 225 | F | 93.7 | Very high | 91.9 | Very high | 141 Ų | 141 | 46.6 Ų | 46.6 | 62% | 0.618 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -63.7 | -46 | 169.8 | -179.6 | -99.2 | 0 | 0 | 0 | 111.8 | F221 F222 V223 Q227 I228 G229 | F221-F225 WeakPolarHBondContact O-CB 3.33Å; F221-F225 PolarHBondContact O-N 2.89Å; F222-F225 PolarHBondContact O-N 3.42Å; V223-F225 VanDerWaalsContact C-N 3.32Å; V223-F225 PolarHBondContact O-N 2.88Å; F225-Q227 VanDerWaalsContact C-N 3.28Å; F225-Q227 PolarHBondContact O-N 3.38Å; F225-I228 WeakPolarHBondContact O-CB 3.5Å; F225-I228 PolarHBondContact O-N 3.02Å; F225-G229 PolarHBondContact O-N 3.39Å |
| 226 | C | 94.3 | Very high | 92.8 | Very high | 60 Ų | 60 | 44.9 Ų | 44.9 | 41% | 0.405 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60 | -39.9 | 172.5 | -66.4 | 0 | 0 | 0 | 0 | 111.8 | F222 V223 I228 G229 I230 | F222-C226 PolarHBondContact O-N 3.34Å; V223-C226 WeakPolarHBondContact O-CB 3.49Å; V223-C226 PolarHBondContact O-N 2.86Å; C226-I228 VanDerWaalsContact C-N 3.32Å; C226-I228 PolarHBondContact O-N 3.17Å; C226-G229 WeakPolarHBondContact O-CA 3.29Å; C226-G229 PolarHBondContact O-N 2.85Å; C226-I230 PolarHBondContact O-N 3.13Å |
| 227 | Q | 94.4 | Very high | 93.1 | Very high | 13 Ų | 13 | 44.5 Ų | 44.5 | 6% | 0.061 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.7 | -38.5 | 176 | -174.6 | 64.7 | 48.7 | 0 | 0 | 112.4 | V223 F224 F225 G229 I230 Y231 | V223-Q227 PolarHBondContact O-N 3.38Å; F224-Q227 WeakPolarHBondContact O-CB 3.34Å; F224-Q227 PolarHBondContact O-N 3.33Å; F225-Q227 VanDerWaalsContact C-N 3.28Å; F225-Q227 PolarHBondContact O-N 3.38Å; Q227-G229 VanDerWaalsContact C-N 3.31Å; Q227-G229 PolarHBondContact O-N 3.42Å; Q227-I230 WeakPolarHBondContact O-CB 3.15Å; Q227-I230 PolarHBondContact O-N 3.27Å; Q227-Y231 HydrophobicContact CG-CD2 4.28Å; Q227-Y231 HydrophobicContact CG-CE2 3.78Å; Q227-Y231 WeakPolarHBondContact O-CD2 3.35Å; Q227-Y231 PolarHBondContact O-N 2.89Å |
| 228 | I | 95.9 | Very high | 93.4 | Very high | 13 Ų | 13 | 48.2 Ų | 48.2 | 7% | 0.067 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -61.7 | -41.8 | 172.5 | -68.8 | 164 | 0 | 0 | 0 | 110.5 | F224 F225 C226 I230 Y231 I232 V279 L282 | F224-I228 HydrophobicContact CD1-CD1 4.27Å; F224-I228 HydrophobicContact CE1-CD1 4.44Å; F224-I228 WeakPolarHBondContact O-CG1 3.42Å; F224-I228 PolarHBondContact O-N 3.33Å; F225-I228 WeakPolarHBondContact O-CB 3.5Å; F225-I228 PolarHBondContact O-N 3.02Å; C226-I228 VanDerWaalsContact C-N 3.32Å; C226-I228 PolarHBondContact O-N 3.17Å; I228-I230 VanDerWaalsContact C-N 3.33Å; I228-I230 PolarHBondContact O-N 3.39Å; I228-Y231 PolarHBondContact O-N 2.92Å; I228-I232 HydrophobicContact CG2-CD1 4.19Å; I228-I232 WeakPolarHBondContact O-CG1 3.27Å; I228-I232 PolarHBondContact O-N 2.86Å; I228-V279 HydrophobicContact CD1-CG2 4.28Å; I228-V279 HydrophobicContact CG2-CG2 3.89Å; I228-L282 HydrophobicContact CD1-CB 4.13Å; I228-L282 HydrophobicContact CD1-CD2 3.5Å; I228-L282 HydrophobicContact CD1-CG 4.38Å |
| 229 | G | 95.6 | Very high | 93.4 | Very high | 31 Ų | 31 | 46.4 Ų | 46.4 | 32% | 0.32 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -57.3 | -44.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | F225 C226 Q227 Y231 I232 I233 | F225-G229 PolarHBondContact O-N 3.39Å; C226-G229 WeakPolarHBondContact O-CA 3.29Å; C226-G229 PolarHBondContact O-N 2.85Å; Q227-G229 VanDerWaalsContact C-N 3.31Å; Q227-G229 PolarHBondContact O-N 3.42Å; G229-Y231 PolarHBondContact O-N 3.47Å; G229-I232 PolarHBondContact O-N 3.1Å; G229-I233 WeakPolarHBondContact O-CG1 3.32Å; G229-I233 PolarHBondContact O-N 3.46Å; G229-I233 VanDerWaalsContact O-N 3.1Å |
| 230 | I | 94.3 | Very high | 93.2 | Very high | 50 Ų | 50 | 46 Ų | 46 | 26% | 0.256 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.2 | -46.1 | 174.4 | -64.3 | 169.9 | 0 | 0 | 0 | 110.4 | F193 C226 Q227 I228 I232 I233 Q234 | F193-I230 HydrophobicContact CE2-CG2 4.11Å; C226-I230 PolarHBondContact O-N 3.13Å; Q227-I230 WeakPolarHBondContact O-CB 3.15Å; Q227-I230 PolarHBondContact O-N 3.27Å; I228-I230 VanDerWaalsContact C-N 3.33Å; I228-I230 PolarHBondContact O-N 3.39Å; I230-I232 VanDerWaalsContact C-N 3.28Å; I230-I232 PolarHBondContact O-N 3.09Å; I230-I233 PolarHBondContact O-N 3.29Å; I230-I233 VanDerWaalsContact O-N 3.09Å; I230-Q234 HydrophobicContact CG2-CG 4.13Å; I230-Q234 VanDerWaalsContact O-CG 3.32Å; I230-Q234 WeakPolarHBondContact O-CG 3.44Å; I230-Q234 PolarHBondContact O-N 3.28Å |
| 231 | Y | 96.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.1 | -37.6 | 177.4 | -73.2 | -41.9 | 0 | 0 | 0 | 113.4 | H158 Q227 I228 G229 Q234 L235 C274 S278 | H158-Y231 WeakPolarHBondContact CB-OH 3.44Å; H158-Y231 AromaticContact CE1-CE1 3.84Å; H158-Y231 AromaticContact ND1-CE1 3.34Å; H158-Y231 VanDerWaalsContact ND1-CE1 3.34Å; H158-Y231 WeakPolarHBondContact ND1-CE1 3.34Å; H158-Y231 AromaticContact ND1-CZ 3.84Å; H158-Y231 PolarHBondContact ND1-OH 3.23Å; Q227-Y231 HydrophobicContact CG-CD2 4.28Å; Q227-Y231 HydrophobicContact CG-CE2 3.78Å; Q227-Y231 WeakPolarHBondContact O-CD2 3.35Å; Q227-Y231 PolarHBondContact O-N 2.89Å; I228-Y231 PolarHBondContact O-N 2.92Å; G229-Y231 PolarHBondContact O-N 3.47Å; Y231-Q234 PolarHBondContact O-N 2.94Å; Y231-L235 WeakPolarHBondContact O-CB 3.48Å; Y231-L235 PolarHBondContact O-N 2.9Å; Y231-C274 HydrophobicContact CD1-CB 4.03Å; Y231-C274 HydrophobicContact CE1-CB 3.88Å; Y231-C274 HydrophobicContact CE2-CB 4.42Å; Y231-C274 HydrophobicContact CG-CB 4.37Å; Y231-S278 WeakPolarHBondContact CD2-OG 3.34Å |
| 232 | I | 95.9 | Very high | 93.1 | Very high | 88 Ų | 88 | 47.3 Ų | 47.3 | 45% | 0.451 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 175.7 | -66.8 | 166.9 | 0 | 0 | 0 | 110.2 | I228 G229 I230 L235 V236 | I228-I232 HydrophobicContact CG2-CD1 4.19Å; I228-I232 WeakPolarHBondContact O-CG1 3.27Å; I228-I232 PolarHBondContact O-N 2.86Å; G229-I232 PolarHBondContact O-N 3.1Å; I230-I232 VanDerWaalsContact C-N 3.28Å; I230-I232 PolarHBondContact O-N 3.09Å; I232-L235 PolarHBondContact O-N 2.95Å; I232-V236 VanDerWaalsContact O-CG2 3.27Å; I232-V236 WeakPolarHBondContact O-CG2 3.39Å; I232-V236 PolarHBondContact O-N 3.4Å |
| 233 | I | 94.8 | Very high | 93.2 | Very high | 81 Ų | 81 | 41.5 Ų | 41.5 | 42% | 0.415 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.9 | -45.3 | 177.1 | -65.4 | 166.8 | 0 | 0 | 0 | 110.9 | G229 I230 V236 G237 L241 | G229-I233 WeakPolarHBondContact O-CG1 3.32Å; G229-I233 PolarHBondContact O-N 3.46Å; G229-I233 VanDerWaalsContact O-N 3.1Å; I230-I233 PolarHBondContact O-N 3.29Å; I230-I233 VanDerWaalsContact O-N 3.09Å; I233-V236 PolarHBondContact O-N 2.89Å; I233-G237 PolarHBondContact O-N 2.77Å; I233-L241 HydrophobicContact CG2-CD1 3.78Å |
| 234 | Q | 94.9 | Very high | 93.3 | Very high | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.005 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65 | -41 | 178.4 | -65.9 | -173.1 | -49.3 | 0 | 0 | 112.2 | I230 Y231 V236 G237 D243 G245 F271 | I230-Q234 HydrophobicContact CG2-CG 4.13Å; I230-Q234 VanDerWaalsContact O-CG 3.32Å; I230-Q234 WeakPolarHBondContact O-CG 3.44Å; I230-Q234 PolarHBondContact O-N 3.28Å; Y231-Q234 PolarHBondContact O-N 2.94Å; Q234-V236 VanDerWaalsContact C-N 3.32Å; Q234-V236 PolarHBondContact O-N 3.25Å; Q234-G237 PolarHBondContact O-N 3.49Å; Q234-D243 HydrophobicContact CB-CB 4.42Å; Q234-D243 PolarHBondContact NE2-OD1 2.9Å; Q234-G245 VanDerWaalsContact O-CA 3.29Å; Q234-G245 WeakPolarHBondContact O-CA 3.37Å; Q234-F271 HydrophobicContact CB-CD1 3.7Å; Q234-F271 HydrophobicContact CB-CD2 4.29Å; Q234-F271 HydrophobicContact CB-CE1 3.71Å; Q234-F271 HydrophobicContact CB-CE2 4.28Å; Q234-F271 HydrophobicContact CB-CG 4.01Å; Q234-F271 HydrophobicContact CB-CZ 4.01Å; Q234-F271 HydrophobicContact CG-CE1 4.19Å; Q234-F271 HydrophobicContact CG-CZ 4.48Å; Q234-F271 VanDerWaalsContact OE1-CE1 3.32Å |
| 235 | L | 96.1 | Very high | 93.2 | Very high | 37 Ų | 37 | 39.9 Ų | 39.9 | 19% | 0.194 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.7 | -42.1 | 172.8 | 160.6 | 145.4 | 0 | 0 | 0 | 111.8 | Y231 I232 G245 W246 F271 T272 | Y231-L235 WeakPolarHBondContact O-CB 3.48Å; Y231-L235 PolarHBondContact O-N 2.9Å; I232-L235 PolarHBondContact O-N 2.95Å; L235-G245 CarbonylContact O-C 3.54Å; L235-G245 VanDerWaalsContact O-CA 3.29Å; L235-G245 WeakPolarHBondContact O-CA 3.26Å; L235-W246 PolarHBondContact O-N 3.22Å; L235-F271 HydrophobicContact CB-CB 4.18Å; L235-T272 HydrophobicContact CD1-CG2 3.81Å; L235-T272 VanDerWaalsContact CD1-OG1 3.24Å; L235-T272 WeakPolarHBondContact CD1-OG1 3.09Å |
| 236 | V | 96.1 | Very high | 93.4 | Very high | 48 Ų | 48 | 37.5 Ų | 37.5 | 29% | 0.291 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -66.7 | -43.6 | 177.7 | 169.8 | 0 | 0 | 0 | 0 | 109.5 | I232 I233 Q234 I238 W246 I247 | I232-V236 VanDerWaalsContact O-CG2 3.27Å; I232-V236 WeakPolarHBondContact O-CG2 3.39Å; I232-V236 PolarHBondContact O-N 3.4Å; I233-V236 PolarHBondContact O-N 2.89Å; Q234-V236 VanDerWaalsContact C-N 3.32Å; Q234-V236 PolarHBondContact O-N 3.25Å; V236-I238 HydrophobicContact CG1-CG1 4.01Å; V236-W246 PolarHBondContact O-N 2.85Å; V236-I247 HydrophobicContact CG1-CD1 3.46Å; V236-I247 VanDerWaalsContact CG1-CD1 3.46Å; V236-I247 HydrophobicContact CG1-CG1 4.11Å; V236-I247 VanDerWaalsContact O-CB 3.27Å; V236-I247 WeakPolarHBondContact O-CB 3.3Å; V236-I247 WeakPolarHBondContact O-CG1 3.34Å; V236-I247 PolarHBondContact O-N 2.95Å |
| 237 | G | 92.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 68.3 | 62.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | I233 Q234 A248 | I233-G237 PolarHBondContact O-N 2.77Å; Q234-G237 PolarHBondContact O-N 3.49Å; G237-A248 PolarHBondContact O-N 3.26Å |
| 238 | I | 91.1 | Very high | 93.2 | Very high | 82 Ų | 82 | 38.5 Ų | 38.5 | 42% | 0.421 | 22% | 0.218 | S | C | . | . | trans | -63.7 | 126.6 | 176.7 | -57 | 174.7 | 0 | 0 | 0 | 108.1 | V236 G240 L241 | V236-I238 HydrophobicContact CG1-CG1 4.01Å; I238-G240 PolarHBondContact O-N 3.46Å; I238-L241 HydrophobicContact CB-CD1 3.71Å; I238-L241 HydrophobicContact CB-CG 4.05Å; I238-L241 HydrophobicContact CD1-CD1 4.17Å; I238-L241 HydrophobicContact CG1-CD1 4.28Å; I238-L241 HydrophobicContact CG2-CD1 4.44Å; I238-L241 HydrophobicContact CG2-CG 4.46Å; I238-L241 WeakPolarHBondContact O-CB 3.14Å; I238-L241 PolarHBondContact O-N 2.9Å | ||
| 239 | P | 86.2 | Confident | 93.1 | Very high | 80 Ų | 80 | 37.9 Ų | 37.9 | 52% | 0.519 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | 136.2 | -179.7 | -25.8 | 34.1 | 0 | 0 | 0 | 112.1 | I247 | P239-I247 HydrophobicContact CG-CG2 4.42Š|
| 240 | G | 84.2 | Confident | 93 | Very high | 37 Ų | 37 | 40.5 Ų | 40.5 | 38% | 0.381 | 22% | 0.221 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 88.1 | -0.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | D182 L185 I238 | D182-G240 WeakPolarHBondContact OD1-CA 3.03Å; D182-G240 PolarHBondContact OD1-N 2.85Å; D182-G240 VanDerWaalsContact OD1-N 3.09Å; L185-G240 WeakPolarHBondContact CD1-O 3.45Å; I238-G240 PolarHBondContact O-N 3.46Å |
| 241 | L | 90.7 | Very high | 92.8 | Very high | 63 Ų | 63 | 40.3 Ų | 40.3 | 33% | 0.33 | 22% | 0.224 | S | C | . | . | S | Bend | trans | -91.4 | -9.4 | 171.2 | -63.5 | -171.3 | 0 | 0 | 0 | 113.4 | W189 I233 I238 D243 | W189-L241 PolarHBondContact NE1-O 3.49Å; I233-L241 HydrophobicContact CG2-CD1 3.78Å; I238-L241 HydrophobicContact CB-CD1 3.71Å; I238-L241 HydrophobicContact CB-CG 4.05Å; I238-L241 HydrophobicContact CD1-CD1 4.17Å; I238-L241 HydrophobicContact CG1-CD1 4.28Å; I238-L241 HydrophobicContact CG2-CD1 4.44Å; I238-L241 HydrophobicContact CG2-CG 4.46Å; I238-L241 WeakPolarHBondContact O-CB 3.14Å; I238-L241 PolarHBondContact O-N 2.9Å; L241-D243 VanDerWaalsContact C-N 3.33Å |
| 242 | G | 89.9 | Confident | 92.5 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 23% | 0.23 | C | C | . | . | S | Bend | trans | 76.8 | 15.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | N165 D182 | N165-G242 PolarHBondContact ND2-O 2.96Å; D182-G242 VanDerWaalsContact O-CA 3.3Å; D182-G242 WeakPolarHBondContact O-CA 3.39Å; D182-G242 PolarHBondContact OD1-N 3.49Å |
| 243 | D | 93.4 | Very high | 92.2 | Very high | 12 Ų | 12 | 40.6 Ų | 40.6 | 6% | 0.064 | 23% | 0.227 | C | C | . | . | trans | -108 | 125.4 | 174.3 | -61.9 | -56.2 | 0 | 0 | 0 | 111.3 | Q234 L241 G245 | Q234-D243 HydrophobicContact CB-CB 4.42Å; Q234-D243 PolarHBondContact NE2-OD1 2.9Å; L241-D243 VanDerWaalsContact C-N 3.33Å; D243-G245 PolarHBondContact O-N 3.21Å | ||
| 244 | S | 93.9 | Very high | 91.8 | Very high | 1 Ų | 1 | 45.6 Ų | 45.6 | 1% | 0.007 | 25% | 0.246 | C | C | . | . | trans | -83.1 | 54.2 | 177.1 | -62.8 | 0 | 0 | 0 | 0 | 111.9 | N165 C169 A268 | N165-S244 VanDerWaalsContact OD1-CB 3.26Å; N165-S244 WeakPolarHBondContact OD1-CB 3.26Å; N165-S244 PolarHBondContact OD1-N 2.96Å; N165-S244 PolarHBondContact OD1-OG 2.75Å; C169-S244 PolarHBondContact SG-OG 3.22Å; C169-S244 VanDerWaalsContact SG-OG 3.4Å; S244-A268 PolarHBondContact O-N 3.15Å | ||
| 245 | G | 94.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 29% | 0.286 | C | S | . | . | trans | -77.1 | -173.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q234 L235 D243 I247 A248 A249 | Q234-G245 VanDerWaalsContact O-CA 3.29Å; Q234-G245 WeakPolarHBondContact O-CA 3.37Å; L235-G245 CarbonylContact O-C 3.54Å; L235-G245 VanDerWaalsContact O-CA 3.29Å; L235-G245 WeakPolarHBondContact O-CA 3.26Å; D243-G245 PolarHBondContact O-N 3.21Å; G245-I247 PolarHBondContact O-N 3.08Å; G245-A248 PolarHBondContact O-N 2.93Å; G245-A249 WeakPolarHBondContact O-CB 3.38Å; G245-A249 PolarHBondContact O-N 3.11Å | ||
| 246 | W | 96.4 | Very high | 90.4 | Very high | 91 Ų | 91 | 55.3 Ų | 55.3 | 35% | 0.345 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | -173.1 | -72.2 | 108.8 | 0 | 0 | 0 | 113.6 | L235 V236 A249 L250 M265 A268 T272 | L235-W246 PolarHBondContact O-N 3.22Å; V236-W246 PolarHBondContact O-N 2.85Å; W246-A249 PolarHBondContact O-N 3.41Å; W246-L250 VanDerWaalsContact O-CB 3.31Å; W246-L250 WeakPolarHBondContact O-CB 3.03Å; W246-L250 WeakPolarHBondContact O-CG 3.44Å; W246-L250 PolarHBondContact O-N 3.19Å; W246-M265 HydrophobicContact CZ3-CB 4.47Å; W246-M265 HydrophobicContact CZ3-CE 3.8Å; W246-M265 HydrophobicContact CZ3-CG 4.34Å; W246-A268 HydrophobicContact CD2-CB 3.8Å; W246-A268 HydrophobicContact CE3-CB 4.22Å; W246-A268 HydrophobicContact CG-CB 4Å; W246-A268 HydrophobicContact CZ2-CB 4.41Å; W246-T272 PolarHBondContact NE1-OG1 3.26Å |
| 247 | I | 94.1 | Very high | 90 | Very high | 84 Ų | 84 | 56 Ų | 56 | 43% | 0.431 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.6 | -47.7 | 179.1 | -64.4 | -177.5 | 0 | 0 | 0 | 110.2 | V236 P239 G245 A249 L250 S251 | V236-I247 HydrophobicContact CG1-CD1 3.46Å; V236-I247 VanDerWaalsContact CG1-CD1 3.46Å; V236-I247 HydrophobicContact CG1-CG1 4.11Å; V236-I247 VanDerWaalsContact O-CB 3.27Å; V236-I247 WeakPolarHBondContact O-CB 3.3Å; V236-I247 WeakPolarHBondContact O-CG1 3.34Å; V236-I247 PolarHBondContact O-N 2.95Å; P239-I247 HydrophobicContact CG-CG2 4.42Å; G245-I247 PolarHBondContact O-N 3.08Å; I247-A249 PolarHBondContact O-N 3.03Å; I247-L250 PolarHBondContact O-N 3.11Å; I247-S251 VanDerWaalsContact O-CB 3.3Å; I247-S251 WeakPolarHBondContact O-CB 3.35Å; I247-S251 PolarHBondContact O-N 3.46Å |
| 248 | A | 91.9 | Very high | 90 | Very high | 10 Ų | 10 | 61.7 Ų | 61.7 | 8% | 0.083 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58 | -48.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | G237 G245 L250 S251 T252 M264 | G237-A248 PolarHBondContact O-N 3.26Å; G245-A248 PolarHBondContact O-N 2.93Å; A248-L250 PolarHBondContact O-N 3.38Å; A248-S251 PolarHBondContact O-N 2.86Å; A248-S251 PolarHBondContact O-OG 3.26Å; A248-T252 PolarHBondContact O-N 3.48Å; A248-T252 PolarHBondContact O-OG1 3.46Å; A248-T252 VanDerWaalsContact O-OG1 3.14Å; A248-M264 HydrophobicContact CB-CE 3.66Å |
| 249 | A | 93.1 | Very high | 90 | Very high | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.7 | -45.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113 | G245 W246 I247 S251 T252 L253 S261 M264 M265 | G245-A249 WeakPolarHBondContact O-CB 3.38Å; G245-A249 PolarHBondContact O-N 3.11Å; W246-A249 PolarHBondContact O-N 3.41Å; I247-A249 PolarHBondContact O-N 3.03Å; A249-S251 VanDerWaalsContact C-N 3.34Å; A249-T252 PolarHBondContact O-N 3Å; A249-L253 PolarHBondContact O-N 2.68Å; A249-S261 PolarHBondContact O-OG 3.46Å; A249-M264 HydrophobicContact CB-CB 3.65Å; A249-M265 HydrophobicContact CB-CG 3.8Å |
| 250 | L | 92.9 | Very high | 90.4 | Very high | 85 Ų | 85 | 58 Ų | 58 | 45% | 0.445 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -68.7 | -31.8 | 177.3 | -69.8 | 172.2 | 0 | 0 | 0 | 112.4 | W246 I247 A248 L253 K254 | W246-L250 VanDerWaalsContact O-CB 3.31Å; W246-L250 WeakPolarHBondContact O-CB 3.03Å; W246-L250 WeakPolarHBondContact O-CG 3.44Å; W246-L250 PolarHBondContact O-N 3.19Å; I247-L250 PolarHBondContact O-N 3.11Å; A248-L250 PolarHBondContact O-N 3.38Å; L250-L253 HydrophobicContact CD2-CD2 4.45Å; L250-L253 WeakPolarHBondContact O-CB 3.5Å; L250-L253 PolarHBondContact O-N 3.13Å; L250-K254 PolarHBondContact O-N 2.82Å |
| 251 | S | 90.3 | Very high | 90.8 | Very high | 47 Ų | 47 | 56.2 Ų | 56.2 | 33% | 0.329 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -67.2 | -41.6 | 175.2 | 80 | 0 | 0 | 0 | 0 | 111.4 | I247 A248 A249 L253 K254 K255 | I247-S251 VanDerWaalsContact O-CB 3.3Å; I247-S251 WeakPolarHBondContact O-CB 3.35Å; I247-S251 PolarHBondContact O-N 3.46Å; A248-S251 PolarHBondContact O-N 2.86Å; A248-S251 PolarHBondContact O-OG 3.26Å; A249-S251 VanDerWaalsContact C-N 3.34Å; S251-L253 VanDerWaalsContact C-N 3.34Å; S251-K254 PolarHBondContact O-N 3.43Å; S251-K255 PolarHBondContact O-N 2.88Å |
| 252 | T | 89.4 | Confident | 91 | Very high | 18 Ų | 18 | 56.8 Ų | 56.8 | 11% | 0.11 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -68.3 | -33.5 | 175.3 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | A248 A249 K254 K255 G256 V260 M264 | A248-T252 PolarHBondContact O-N 3.48Å; A248-T252 PolarHBondContact O-OG1 3.46Å; A248-T252 VanDerWaalsContact O-OG1 3.14Å; A249-T252 PolarHBondContact O-N 3Å; T252-K254 PolarHBondContact O-N 3.15Å; T252-K255 PolarHBondContact O-N 3.45Å; T252-G256 CarbonylContact O-C 3.55Å; T252-G256 VanDerWaalsContact O-CA 3.27Å; T252-G256 WeakPolarHBondContact O-CA 3.39Å; T252-G256 PolarHBondContact O-N 2.91Å; T252-V260 HydrophobicContact CG2-CB 4.35Å; T252-V260 HydrophobicContact CG2-CG1 4.04Å; T252-M264 HydrophobicContact CG2-SD 4.14Å; T252-M264 PolarHBondContact OG1-SD 3.28Å; T252-M264 VanDerWaalsContact OG1-SD 3.38Å |
| 253 | L | 89.4 | Confident | 91.2 | Very high | 76 Ų | 76 | 60.5 Ų | 60.5 | 40% | 0.398 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -58.6 | -37 | 175.9 | -169 | 58.8 | 0 | 0 | 0 | 112.6 | A249 L250 S251 L258 S261 | A249-L253 PolarHBondContact O-N 2.68Å; L250-L253 HydrophobicContact CD2-CD2 4.45Å; L250-L253 WeakPolarHBondContact O-CB 3.5Å; L250-L253 PolarHBondContact O-N 3.13Å; S251-L253 VanDerWaalsContact C-N 3.34Å; L253-L258 HydrophobicContact CD1-CD1 3.58Å; L253-S261 WeakPolarHBondContact CA-OG 3.24Å; L253-S261 VanDerWaalsContact CB-OG 3.24Å; L253-S261 WeakPolarHBondContact CB-OG 3.4Å; L253-S261 PolarHBondContact N-OG 3.43Å |
| 254 | K | 86.4 | Confident | 91.3 | Very high | 186 Ų | 186 | 60.3 Ų | 60.3 | 81% | 0.809 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -81.6 | -29.4 | -176.4 | -68.3 | -179.8 | -178.9 | -178.8 | 0 | 113.7 | L250 S251 T252 | L250-K254 PolarHBondContact O-N 2.82Å; S251-K254 PolarHBondContact O-N 3.43Å; T252-K254 PolarHBondContact O-N 3.15Å |
| 255 | K | 81.1 | Confident | 91.4 | Very high | 197 Ų | 197 | 63.5 Ų | 63.5 | 86% | 0.857 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -123.4 | -14 | -166.6 | -65.6 | -178 | 178.3 | -178.1 | 0 | 114.4 | S251 T252 | S251-K255 PolarHBondContact O-N 2.88Å; T252-K255 PolarHBondContact O-N 3.45Å |
| 256 | G | 80.9 | Confident | 91.5 | Very high | 45 Ų | 45 | 67.3 Ų | 67.3 | 46% | 0.464 | 37% | 0.366 | S | S | . | . | S | Bend | trans | -124.7 | -161.4 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T252 | T252-G256 CarbonylContact O-C 3.55Å; T252-G256 VanDerWaalsContact O-CA 3.27Å; T252-G256 WeakPolarHBondContact O-CA 3.39Å; T252-G256 PolarHBondContact O-N 2.91Å |
| 257 | S | 87.8 | Confident | 91.5 | Very high | 61 Ų | 61 | 63.1 Ų | 63.1 | 43% | 0.427 | 35% | 0.351 | S | S | . | . | trans | -78.5 | 137.5 | -179.6 | 64.3 | 0 | 0 | 0 | 0 | 111.7 | A259 V260 S261 | S257-A259 VanDerWaalsContact C-N 3.26Å; S257-A259 PolarHBondContact O-N 3.18Å; S257-V260 PolarHBondContact O-N 2.92Å; S257-V260 WeakPolarHBondContact OG-CB 3.5Å; S257-V260 WeakPolarHBondContact OG-CG2 3.38Å; S257-S261 PolarHBondContact O-N 2.94Å; S257-S261 VanDerWaalsContact O-N 3.14Å | ||
| 258 | L | 91.8 | Very high | 91.7 | Very high | 121 Ų | 121 | 59.1 Ų | 59.1 | 63% | 0.634 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -56.6 | -42.2 | 177.6 | -179.5 | 64.6 | 0 | 0 | 0 | 111.4 | L253 V260 S261 V262 | L253-L258 HydrophobicContact CD1-CD1 3.58Å; L258-V260 PolarHBondContact O-N 3.41Å; L258-S261 PolarHBondContact O-N 2.93Å; L258-V262 HydrophobicContact CD1-CG2 4.47Å; L258-V262 WeakPolarHBondContact O-CG2 3.5Å; L258-V262 PolarHBondContact O-N 3.47Å |
| 259 | A | 92.4 | Very high | 91.9 | Very high | 68 Ų | 68 | 60 Ų | 60 | 56% | 0.562 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -59.7 | -46.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | S257 S261 V262 I263 | S257-A259 VanDerWaalsContact C-N 3.26Å; S257-A259 PolarHBondContact O-N 3.18Å; A259-S261 VanDerWaalsContact C-N 3.34Å; A259-S261 PolarHBondContact O-N 3.03Å; A259-V262 PolarHBondContact O-N 3.35Å; A259-I263 WeakPolarHBondContact O-CG1 3.46Å; A259-I263 PolarHBondContact O-N 3.29Å; A259-I263 VanDerWaalsContact O-N 3.15Å |
| 260 | V | 92.9 | Very high | 92.2 | Very high | 15 Ų | 15 | 63.1 Ų | 63.1 | 9% | 0.091 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.7 | -40.7 | 178.3 | 174.6 | 0 | 0 | 0 | 0 | 110.4 | A171 T252 S257 L258 V262 I263 M264 | A171-V260 HydrophobicContact CB-CG2 4.31Å; T252-V260 HydrophobicContact CG2-CB 4.35Å; T252-V260 HydrophobicContact CG2-CG1 4.04Å; S257-V260 PolarHBondContact O-N 2.92Å; S257-V260 WeakPolarHBondContact OG-CB 3.5Å; S257-V260 WeakPolarHBondContact OG-CG2 3.38Å; L258-V260 PolarHBondContact O-N 3.41Å; V260-V262 VanDerWaalsContact C-N 3.35Å; V260-V262 PolarHBondContact O-N 2.9Å; V260-I263 PolarHBondContact O-N 3.03Å; V260-M264 HydrophobicContact CG1-CG 4.32Å; V260-M264 HydrophobicContact CG1-SD 4.05Å; V260-M264 VanDerWaalsContact O-CG 3.32Å; V260-M264 WeakPolarHBondContact O-CG 3.34Å; V260-M264 PolarHBondContact O-N 3.28Å |
| 261 | S | 93.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.6 | -42.3 | 176.8 | -178.1 | 0 | 0 | 0 | 0 | 112.6 | A249 L253 S257 L258 A259 I263 M264 M265 | A249-S261 PolarHBondContact O-OG 3.46Å; L253-S261 WeakPolarHBondContact CA-OG 3.24Å; L253-S261 VanDerWaalsContact CB-OG 3.24Å; L253-S261 WeakPolarHBondContact CB-OG 3.4Å; L253-S261 PolarHBondContact N-OG 3.43Å; S257-S261 PolarHBondContact O-N 2.94Å; S257-S261 VanDerWaalsContact O-N 3.14Å; L258-S261 PolarHBondContact O-N 2.93Å; A259-S261 VanDerWaalsContact C-N 3.34Å; A259-S261 PolarHBondContact O-N 3.03Å; S261-I263 PolarHBondContact O-N 3.48Å; S261-M264 PolarHBondContact O-N 3.22Å; S261-M265 WeakPolarHBondContact O-CG 3.48Å; S261-M265 PolarHBondContact O-N 2.93Å |
| 262 | V | 95.1 | Very high | 92.7 | Very high | 76 Ų | 76 | 58.7 Ų | 58.7 | 46% | 0.461 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.6 | -43.6 | 175.7 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | L258 A259 V260 M264 M265 V266 | L258-V262 HydrophobicContact CD1-CG2 4.47Å; L258-V262 WeakPolarHBondContact O-CG2 3.5Å; L258-V262 PolarHBondContact O-N 3.47Å; A259-V262 PolarHBondContact O-N 3.35Å; V260-V262 VanDerWaalsContact C-N 3.35Å; V260-V262 PolarHBondContact O-N 2.9Å; V262-M264 VanDerWaalsContact C-N 3.34Å; V262-M264 PolarHBondContact O-N 3.38Å; V262-M265 PolarHBondContact O-N 2.89Å; V262-V266 WeakPolarHBondContact O-CG2 3.18Å; V262-V266 PolarHBondContact O-N 3.47Å |
| 263 | I | 94.9 | Very high | 93.1 | Very high | 77 Ų | 77 | 61.6 Ų | 61.6 | 40% | 0.395 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.4 | -46.1 | 176.1 | -65.7 | 166.8 | 0 | 0 | 0 | 110.5 | A168 A259 V260 S261 M265 V266 V267 | A168-I263 HydrophobicContact CB-CG2 3.85Å; A259-I263 WeakPolarHBondContact O-CG1 3.46Å; A259-I263 PolarHBondContact O-N 3.29Å; A259-I263 VanDerWaalsContact O-N 3.15Å; V260-I263 PolarHBondContact O-N 3.03Å; S261-I263 PolarHBondContact O-N 3.48Å; I263-M265 PolarHBondContact O-N 3.33Å; I263-V266 PolarHBondContact O-N 3.06Å; I263-V267 PolarHBondContact O-N 2.98Å; I263-V267 VanDerWaalsContact O-N 3.15Å |
| 264 | M | 94.8 | Very high | 93.5 | Very high | 9 Ų | 9 | 58 Ų | 58 | 4% | 0.044 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -63.7 | -38.1 | 177.3 | -65.6 | 178.1 | 84 | 0 | 0 | 112.1 | A168 A248 A249 T252 V260 S261 V262 V266 V267 A268 | A168-M264 HydrophobicContact CB-CG 4.25Å; A248-M264 HydrophobicContact CB-CE 3.66Å; A249-M264 HydrophobicContact CB-CB 3.65Å; T252-M264 HydrophobicContact CG2-SD 4.14Å; T252-M264 PolarHBondContact OG1-SD 3.28Å; T252-M264 VanDerWaalsContact OG1-SD 3.38Å; V260-M264 HydrophobicContact CG1-CG 4.32Å; V260-M264 HydrophobicContact CG1-SD 4.05Å; V260-M264 VanDerWaalsContact O-CG 3.32Å; V260-M264 WeakPolarHBondContact O-CG 3.34Å; V260-M264 PolarHBondContact O-N 3.28Å; S261-M264 PolarHBondContact O-N 3.22Å; V262-M264 VanDerWaalsContact C-N 3.34Å; V262-M264 PolarHBondContact O-N 3.38Å; M264-V266 VanDerWaalsContact C-N 3.34Å; M264-V266 PolarHBondContact O-N 3.2Å; M264-V267 PolarHBondContact O-N 3.35Å; M264-A268 WeakPolarHBondContact O-CB 3.29Å; M264-A268 PolarHBondContact O-N 3.3Å |
| 265 | M | 96.1 | Very high | 94 | Very high | 68 Ų | 68 | 49.6 Ų | 49.6 | 34% | 0.335 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.9 | -37.6 | 175.4 | -75 | -178.7 | 71.7 | 0 | 0 | 112.4 | W246 A249 S261 V262 I263 V267 A268 G269 | W246-M265 HydrophobicContact CZ3-CB 4.47Å; W246-M265 HydrophobicContact CZ3-CE 3.8Å; W246-M265 HydrophobicContact CZ3-CG 4.34Å; A249-M265 HydrophobicContact CB-CG 3.8Å; S261-M265 WeakPolarHBondContact O-CG 3.48Å; S261-M265 PolarHBondContact O-N 2.93Å; V262-M265 PolarHBondContact O-N 2.89Å; I263-M265 PolarHBondContact O-N 3.33Å; M265-V267 VanDerWaalsContact C-N 3.35Å; M265-A268 PolarHBondContact O-N 2.8Å; M265-G269 PolarHBondContact O-N 3.42Å |
| 266 | V | 96.9 | Very high | 94.8 | Very high | 79 Ų | 79 | 44.6 Ų | 44.6 | 48% | 0.479 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.7 | -44.2 | 174.6 | 171.5 | 0 | 0 | 0 | 0 | 110.4 | V262 I263 M264 G269 F270 | V262-V266 WeakPolarHBondContact O-CG2 3.18Å; V262-V266 PolarHBondContact O-N 3.47Å; I263-V266 PolarHBondContact O-N 3.06Å; M264-V266 VanDerWaalsContact C-N 3.34Å; M264-V266 PolarHBondContact O-N 3.2Å; V266-G269 WeakPolarHBondContact O-CA 3.43Å; V266-G269 PolarHBondContact O-N 2.98Å; V266-F270 HydrophobicContact CG1-CD2 3.89Å; V266-F270 HydrophobicContact CG1-CE2 3.59Å; V266-F270 VanDerWaalsContact O-CD2 3.24Å; V266-F270 WeakPolarHBondContact O-CD2 3.44Å; V266-F270 PolarHBondContact O-N 3.34Å |
| 267 | V | 97.1 | Very high | 95.5 | Very high | 3 Ų | 3 | 45 Ų | 45 | 2% | 0.018 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.2 | 175.1 | 0 | 0 | 0 | 0 | 111.6 | L164 N165 A168 I263 M264 M265 G269 F270 F271 | L164-V267 HydrophobicContact CB-CG2 3.94Å; N165-V267 HydrophobicContact CB-CG1 3.79Å; A168-V267 HydrophobicContact CB-CG2 3.87Å; I263-V267 PolarHBondContact O-N 2.98Å; I263-V267 VanDerWaalsContact O-N 3.15Å; M264-V267 PolarHBondContact O-N 3.35Å; M265-V267 VanDerWaalsContact C-N 3.35Å; V267-G269 PolarHBondContact O-N 3.01Å; V267-F270 PolarHBondContact O-N 3.44Å; V267-F271 HydrophobicContact CG1-CD2 3.81Å; V267-F271 HydrophobicContact CG1-CE2 3.52Å; V267-F271 HydrophobicContact CG1-CZ 4.44Å; V267-F271 WeakPolarHBondContact O-CD2 3.31Å; V267-F271 PolarHBondContact O-N 3.48Å |
| 268 | A | 97 | Very high | 95.9 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -58.5 | -38 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | S244 W246 M264 M265 F271 T272 | S244-A268 PolarHBondContact O-N 3.15Å; W246-A268 HydrophobicContact CD2-CB 3.8Å; W246-A268 HydrophobicContact CE3-CB 4.22Å; W246-A268 HydrophobicContact CG-CB 4Å; W246-A268 HydrophobicContact CZ2-CB 4.41Å; M264-A268 WeakPolarHBondContact O-CB 3.29Å; M264-A268 PolarHBondContact O-N 3.3Å; M265-A268 PolarHBondContact O-N 2.8Å; A268-F271 PolarHBondContact O-N 3.49Å; A268-T272 PolarHBondContact O-N 3.33Å; A268-T272 PolarHBondContact O-OG1 3.15Å |
| 269 | G | 97.4 | Very high | 96.1 | Very high | 29 Ų | 29 | 39.2 Ų | 39.2 | 30% | 0.299 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.6 | -44.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | M265 V266 V267 T272 L273 | M265-G269 PolarHBondContact O-N 3.42Å; V266-G269 WeakPolarHBondContact O-CA 3.43Å; V266-G269 PolarHBondContact O-N 2.98Å; V267-G269 PolarHBondContact O-N 3.01Å; G269-T272 WeakPolarHBondContact O-CB 3.45Å; G269-T272 PolarHBondContact O-N 2.79Å; G269-L273 PolarHBondContact O-N 3.47Å |
| 270 | F | 97.8 | Very high | 96.3 | Very high | 65 Ų | 65 | 39.5 Ų | 39.5 | 29% | 0.285 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -66.1 | -40.3 | 175.2 | -78.7 | -65.5 | 0 | 0 | 0 | 113 | L157 T161 L164 V266 V267 T272 L273 C274 | L157-F270 HydrophobicContact CD1-CD1 4.02Å; L157-F270 HydrophobicContact CD1-CE1 4.31Å; T161-F270 HydrophobicContact CG2-CB 3.66Å; L164-F270 HydrophobicContact CD1-CD2 3.75Å; L164-F270 HydrophobicContact CD1-CE2 3.62Å; L164-F270 HydrophobicContact CD1-CZ 4.34Å; V266-F270 HydrophobicContact CG1-CD2 3.89Å; V266-F270 HydrophobicContact CG1-CE2 3.59Å; V266-F270 VanDerWaalsContact O-CD2 3.24Å; V266-F270 WeakPolarHBondContact O-CD2 3.44Å; V266-F270 PolarHBondContact O-N 3.34Å; V267-F270 PolarHBondContact O-N 3.44Å; F270-T272 VanDerWaalsContact C-N 3.27Å; F270-T272 PolarHBondContact O-N 2.97Å; F270-L273 WeakPolarHBondContact O-CB 3.4Å; F270-L273 PolarHBondContact O-N 3.23Å; F270-C274 PolarHBondContact O-N 3.33Å; F270-C274 PolarHBondContact O-SG 3.14Å; F270-C274 VanDerWaalsContact O-SG 3.42Å |
| 271 | F | 97.4 | Very high | 96.3 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.1 | -38.2 | 171.7 | -77 | -54.7 | 0 | 0 | 0 | 111.9 | T161 L162 N165 Q234 L235 V267 A268 C274 A275 | T161-F271 HydrophobicContact CG2-CD1 3.54Å; T161-F271 HydrophobicContact CG2-CD2 4.25Å; T161-F271 HydrophobicContact CG2-CE1 3.59Å; T161-F271 HydrophobicContact CG2-CE2 4.3Å; T161-F271 HydrophobicContact CG2-CG 3.88Å; T161-F271 HydrophobicContact CG2-CZ 3.99Å; L162-F271 HydrophobicContact CD2-CE1 4.29Å; L162-F271 HydrophobicContact CD2-CZ 4.34Å; N165-F271 HydrophobicContact CB-CE2 4.16Å; N165-F271 HydrophobicContact CB-CZ 4.04Å; Q234-F271 HydrophobicContact CB-CD1 3.7Å; Q234-F271 HydrophobicContact CB-CD2 4.29Å; Q234-F271 HydrophobicContact CB-CE1 3.71Å; Q234-F271 HydrophobicContact CB-CE2 4.28Å; Q234-F271 HydrophobicContact CB-CG 4.01Å; Q234-F271 HydrophobicContact CB-CZ 4.01Å; Q234-F271 HydrophobicContact CG-CE1 4.19Å; Q234-F271 HydrophobicContact CG-CZ 4.48Å; Q234-F271 VanDerWaalsContact OE1-CE1 3.32Å; L235-F271 HydrophobicContact CB-CB 4.18Å; V267-F271 HydrophobicContact CG1-CD2 3.81Å; V267-F271 HydrophobicContact CG1-CE2 3.52Å; V267-F271 HydrophobicContact CG1-CZ 4.44Å; V267-F271 WeakPolarHBondContact O-CD2 3.31Å; V267-F271 PolarHBondContact O-N 3.48Å; A268-F271 PolarHBondContact O-N 3.49Å; F271-C274 PolarHBondContact O-N 3.41Å; F271-A275 WeakPolarHBondContact O-CB 3.02Å; F271-A275 PolarHBondContact O-N 2.98Å |
| 272 | T | 97.8 | Very high | 96.3 | Very high | 40 Ų | 40 | 40.5 Ų | 40.5 | 25% | 0.245 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62 | -45.6 | 173.2 | -49.2 | 0 | 0 | 0 | 0 | 111.8 | L235 W246 A268 G269 F270 C274 A275 V276 | L235-T272 HydrophobicContact CD1-CG2 3.81Å; L235-T272 VanDerWaalsContact CD1-OG1 3.24Å; L235-T272 WeakPolarHBondContact CD1-OG1 3.09Å; W246-T272 PolarHBondContact NE1-OG1 3.26Å; A268-T272 PolarHBondContact O-N 3.33Å; A268-T272 PolarHBondContact O-OG1 3.15Å; G269-T272 WeakPolarHBondContact O-CB 3.45Å; G269-T272 PolarHBondContact O-N 2.79Å; F270-T272 VanDerWaalsContact C-N 3.27Å; F270-T272 PolarHBondContact O-N 2.97Å; T272-C274 VanDerWaalsContact C-N 3.34Å; T272-C274 PolarHBondContact O-N 3.35Å; T272-A275 PolarHBondContact O-N 3.43Å; T272-V276 HydrophobicContact CG2-CG2 4.46Å; T272-V276 WeakPolarHBondContact O-CG2 3.33Å; T272-V276 PolarHBondContact O-N 3.47Å |
| 273 | L | 97.7 | Very high | 96.2 | Very high | 78 Ų | 78 | 42.8 Ų | 42.8 | 41% | 0.408 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60.9 | -43.9 | 176 | -176.8 | 61.4 | 0 | 0 | 0 | 111.3 | L157 G269 F270 A275 V276 L277 | L157-L273 HydrophobicContact CD2-CD2 3.91Å; L157-L273 HydrophobicContact CD2-CG 4.02Å; G269-L273 PolarHBondContact O-N 3.47Å; F270-L273 WeakPolarHBondContact O-CB 3.4Å; F270-L273 PolarHBondContact O-N 3.23Å; L273-A275 PolarHBondContact O-N 3.45Å; L273-V276 PolarHBondContact O-N 3.23Å; L273-L277 HydrophobicContact CD1-CD1 3.86Å; L273-L277 HydrophobicContact CD1-CG 3.98Å; L273-L277 HydrophobicContact CG-CD1 3.82Å; L273-L277 HydrophobicContact CG-CG 4.32Å; L273-L277 VanDerWaalsContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CB 3.27Å; L273-L277 VanDerWaalsContact O-CG 3.27Å; L273-L277 WeakPolarHBondContact O-CG 3.4Å; L273-L277 PolarHBondContact O-N 3.25Å |
| 274 | C | 96.8 | Very high | 96 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.4 | -45 | 174.6 | -74.3 | 0 | 0 | 0 | 0 | 112.2 | Y231 F270 F271 T272 S278 | Y231-C274 HydrophobicContact CD1-CB 4.03Å; Y231-C274 HydrophobicContact CE1-CB 3.88Å; Y231-C274 HydrophobicContact CE2-CB 4.42Å; Y231-C274 HydrophobicContact CG-CB 4.37Å; F270-C274 PolarHBondContact O-N 3.33Å; F270-C274 PolarHBondContact O-SG 3.14Å; F270-C274 VanDerWaalsContact O-SG 3.42Å; F271-C274 PolarHBondContact O-N 3.41Å; T272-C274 VanDerWaalsContact C-N 3.34Å; T272-C274 PolarHBondContact O-N 3.35Å; C274-S278 VanDerWaalsContact O-CB 3.23Å; C274-S278 WeakPolarHBondContact O-CB 3.21Å; C274-S278 PolarHBondContact O-N 2.89Å; C274-S278 PolarHBondContact O-OG 2.83Å |
| 275 | A | 97.1 | Very high | 95.8 | Very high | 11 Ų | 11 | 45.2 Ų | 45.2 | 9% | 0.091 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.1 | -45.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | F271 T272 L273 S278 V279 | F271-A275 WeakPolarHBondContact O-CB 3.02Å; F271-A275 PolarHBondContact O-N 2.98Å; T272-A275 PolarHBondContact O-N 3.43Å; L273-A275 PolarHBondContact O-N 3.45Å; A275-S278 WeakPolarHBondContact CA-OG 3.23Å; A275-S278 PolarHBondContact O-N 3.43Å; A275-S278 PolarHBondContact O-OG 3.45Å; A275-V279 WeakPolarHBondContact O-CG2 3.47Å; A275-V279 PolarHBondContact O-N 3.25Å; A275-V279 VanDerWaalsContact O-N 3.1Å |
| 276 | V | 97.7 | Very high | 95.4 | Very high | 91 Ų | 91 | 46.7 Ų | 46.7 | 55% | 0.552 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -66.4 | -46.9 | 179.4 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | T272 L273 S278 V279 F280 | T272-V276 HydrophobicContact CG2-CG2 4.46Å; T272-V276 WeakPolarHBondContact O-CG2 3.33Å; T272-V276 PolarHBondContact O-N 3.47Å; L273-V276 PolarHBondContact O-N 3.23Å; V276-S278 VanDerWaalsContact C-N 3.34Å; V276-S278 PolarHBondContact O-N 3.39Å; V276-V279 PolarHBondContact O-N 2.88Å; V276-F280 WeakPolarHBondContact O-CB 3.24Å; V276-F280 PolarHBondContact O-N 3.29Å |
| 277 | L | 96.2 | Very high | 94.9 | Very high | 54 Ų | 54 | 44.6 Ų | 44.6 | 28% | 0.283 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -65 | -37.4 | 178.9 | -71.8 | 176.5 | 0 | 0 | 0 | 112.1 | L154 L157 L273 F280 L281 | L154-L277 HydrophobicContact CD1-CB 3.85Å; L154-L277 HydrophobicContact CD1-CD1 4.41Å; L157-L277 HydrophobicContact CD2-CD1 3.85Å; L273-L277 HydrophobicContact CD1-CD1 3.86Å; L273-L277 HydrophobicContact CD1-CG 3.98Å; L273-L277 HydrophobicContact CG-CD1 3.82Å; L273-L277 HydrophobicContact CG-CG 4.32Å; L273-L277 VanDerWaalsContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CB 3.27Å; L273-L277 VanDerWaalsContact O-CG 3.27Å; L273-L277 WeakPolarHBondContact O-CG 3.4Å; L273-L277 PolarHBondContact O-N 3.25Å; L277-F280 PolarHBondContact O-N 2.94Å; L277-L281 VanDerWaalsContact O-CB 3.31Å; L277-L281 WeakPolarHBondContact O-CB 3.36Å; L277-L281 VanDerWaalsContact O-CG 3.26Å; L277-L281 WeakPolarHBondContact O-CG 3.41Å; L277-L281 PolarHBondContact O-N 3.35Å |
| 278 | S | 95.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.5 | -44.1 | 176.5 | 52.5 | 0 | 0 | 0 | 0 | 112 | F224 Y231 C274 A275 V276 F280 L281 L282 | F224-S278 WeakPolarHBondContact CE1-O 3.39Å; Y231-S278 WeakPolarHBondContact CD2-OG 3.34Å; C274-S278 VanDerWaalsContact O-CB 3.23Å; C274-S278 WeakPolarHBondContact O-CB 3.21Å; C274-S278 PolarHBondContact O-N 2.89Å; C274-S278 PolarHBondContact O-OG 2.83Å; A275-S278 WeakPolarHBondContact CA-OG 3.23Å; A275-S278 PolarHBondContact O-N 3.43Å; A275-S278 PolarHBondContact O-OG 3.45Å; V276-S278 VanDerWaalsContact C-N 3.34Å; V276-S278 PolarHBondContact O-N 3.39Å; S278-F280 PolarHBondContact O-N 2.85Å; S278-L281 PolarHBondContact O-N 2.94Å; S278-L282 VanDerWaalsContact O-CB 3.3Å; S278-L282 WeakPolarHBondContact O-CB 3.39Å; S278-L282 PolarHBondContact O-N 3.24Å |
| 279 | V | 96.5 | Very high | 93.4 | Very high | 60 Ų | 60 | 47.9 Ų | 47.9 | 36% | 0.364 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.3 | -45.6 | 173.7 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | I228 A275 V276 L281 L282 Q283 | I228-V279 HydrophobicContact CD1-CG2 4.28Å; I228-V279 HydrophobicContact CG2-CG2 3.89Å; A275-V279 WeakPolarHBondContact O-CG2 3.47Å; A275-V279 PolarHBondContact O-N 3.25Å; A275-V279 VanDerWaalsContact O-N 3.1Å; V276-V279 PolarHBondContact O-N 2.88Å; V279-L281 PolarHBondContact O-N 3.47Å; V279-L282 PolarHBondContact O-N 3.04Å; V279-Q283 WeakPolarHBondContact O-CG 3.47Å; V279-Q283 PolarHBondContact O-N 2.81Å; V279-Q283 VanDerWaalsContact O-N 3.08Å |
| 280 | F | 95.5 | Very high | 92.6 | Very high | 74 Ų | 74 | 55.5 Ų | 55.5 | 33% | 0.325 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.3 | -46.2 | 177 | 172.1 | -96.2 | 0 | 0 | 0 | 112.1 | M150 V276 L277 S278 Q283 R284 | M150-F280 HydrophobicContact CE-CD1 4.37Å; M150-F280 HydrophobicContact CE-CE1 3.78Å; V276-F280 WeakPolarHBondContact O-CB 3.24Å; V276-F280 PolarHBondContact O-N 3.29Å; L277-F280 PolarHBondContact O-N 2.94Å; S278-F280 PolarHBondContact O-N 2.85Å; F280-Q283 PolarHBondContact O-N 3.36Å; F280-R284 HydrophobicContact CD1-CG 4.29Å; F280-R284 HydrophobicContact CE1-CG 3.87Å; F280-R284 HydrophobicContact CE2-CG 4.32Å; F280-R284 HydrophobicContact CZ-CG 3.91Å; F280-R284 VanDerWaalsContact CZ-NE 3.26Å; F280-R284 WeakPolarHBondContact O-CG 3.38Å; F280-R284 PolarHBondContact O-N 3.4Å |
| 281 | L | 93.8 | Very high | 91.5 | Very high | 3 Ų | 3 | 62.1 Ų | 62.1 | 2% | 0.016 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -69.2 | -37.7 | -179.9 | -73.3 | 177.6 | 0 | 0 | 0 | 112.2 | M150 L151 L154 L277 S278 V279 Q283 R284 V285 | M150-L281 HydrophobicContact CB-CD1 4.15Å; M150-L281 HydrophobicContact CB-CD2 3.67Å; M150-L281 HydrophobicContact CE-CD2 3.91Å; M150-L281 HydrophobicContact CG-CD2 4.5Å; M150-L281 HydrophobicContact SD-CD2 4.09Å; L151-L281 HydrophobicContact CD1-CB 3.97Å; L151-L281 HydrophobicContact CD1-CD1 3.89Å; L151-L281 HydrophobicContact CD1-CD2 3.99Å; L151-L281 HydrophobicContact CD1-CG 4.17Å; L151-L281 HydrophobicContact CG-CD1 4.22Å; L154-L281 HydrophobicContact CB-CD1 4.05Å; L154-L281 HydrophobicContact CD2-CD1 3.84Å; L277-L281 VanDerWaalsContact O-CB 3.31Å; L277-L281 WeakPolarHBondContact O-CB 3.36Å; L277-L281 VanDerWaalsContact O-CG 3.26Å; L277-L281 WeakPolarHBondContact O-CG 3.41Å; L277-L281 PolarHBondContact O-N 3.35Å; S278-L281 PolarHBondContact O-N 2.94Å; V279-L281 PolarHBondContact O-N 3.47Å; L281-Q283 VanDerWaalsContact C-N 3.31Å; L281-Q283 PolarHBondContact O-N 3.45Å; L281-R284 PolarHBondContact O-N 3.03Å; L281-R284 VanDerWaalsContact O-N 3.15Å; L281-V285 VanDerWaalsContact O-CG2 3.29Å; L281-V285 WeakPolarHBondContact O-CG2 3.26Å; L281-V285 PolarHBondContact O-N 3.21Å |
| 282 | L | 93.8 | Very high | 90 | Very high | 33 Ų | 33 | 64.9 Ų | 64.9 | 17% | 0.173 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -57.4 | -46.2 | 173.3 | 180 | 66 | 0 | 0 | 0 | 110.8 | F221 F224 I228 S278 V279 R284 V285 H286 | F221-L282 HydrophobicContact CD1-CD1 3.54Å; F221-L282 HydrophobicContact CE1-CD1 3.99Å; F224-L282 HydrophobicContact CD1-CB 4.15Å; F224-L282 HydrophobicContact CD1-CD1 4.09Å; F224-L282 HydrophobicContact CE1-CB 4.13Å; I228-L282 HydrophobicContact CD1-CB 4.13Å; I228-L282 HydrophobicContact CD1-CD2 3.5Å; I228-L282 HydrophobicContact CD1-CG 4.38Å; S278-L282 VanDerWaalsContact O-CB 3.3Å; S278-L282 WeakPolarHBondContact O-CB 3.39Å; S278-L282 PolarHBondContact O-N 3.24Å; V279-L282 PolarHBondContact O-N 3.04Å; L282-R284 VanDerWaalsContact C-N 3.34Å; L282-R284 PolarHBondContact O-N 2.71Å; L282-V285 PolarHBondContact O-N 2.88Å; L282-H286 VanDerWaalsContact O-CB 3.22Å; L282-H286 WeakPolarHBondContact O-CB 3.32Å; L282-H286 PolarHBondContact O-N 3.14Å |
| 283 | Q | 92.7 | Very high | 88 | Confident | 125 Ų | 125 | 65.8 Ų | 65.8 | 58% | 0.584 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -62.4 | -39.3 | 176 | -69.9 | 177.1 | -3.7 | 0 | 0 | 112.5 | V279 F280 L281 S287 | V279-Q283 WeakPolarHBondContact O-CG 3.47Å; V279-Q283 PolarHBondContact O-N 2.81Å; V279-Q283 VanDerWaalsContact O-N 3.08Å; F280-Q283 PolarHBondContact O-N 3.36Å; L281-Q283 VanDerWaalsContact C-N 3.31Å; L281-Q283 PolarHBondContact O-N 3.45Å; Q283-S287 VanDerWaalsContact O-CB 3.3Å; Q283-S287 WeakPolarHBondContact O-CB 3.33Å; Q283-S287 PolarHBondContact O-N 3.38Å |
| 284 | R | 90.6 | Very high | 86.1 | Confident | 137 Ų | 137 | 62.7 Ų | 62.7 | 52% | 0.517 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -66.1 | -47.1 | 177.7 | -71.4 | -71.2 | -176.3 | 164.7 | -0.1 | 112.1 | I147 F280 L281 L282 S287 L288 | I147-R284 HydrophobicContact CD1-CB 4.29Å; I147-R284 HydrophobicContact CG1-CB 4.5Å; F280-R284 HydrophobicContact CD1-CG 4.29Å; F280-R284 HydrophobicContact CE1-CG 3.87Å; F280-R284 HydrophobicContact CE2-CG 4.32Å; F280-R284 HydrophobicContact CZ-CG 3.91Å; F280-R284 VanDerWaalsContact CZ-NE 3.26Å; F280-R284 WeakPolarHBondContact O-CG 3.38Å; F280-R284 PolarHBondContact O-N 3.4Å; L281-R284 PolarHBondContact O-N 3.03Å; L281-R284 VanDerWaalsContact O-N 3.15Å; L282-R284 VanDerWaalsContact C-N 3.34Å; L282-R284 PolarHBondContact O-N 2.71Å; R284-S287 PolarHBondContact O-N 3.33Å; R284-L288 WeakPolarHBondContact O-CB 3.43Å; R284-L288 PolarHBondContact O-N 3.4Å |
| 285 | V | 89.6 | Confident | 84.2 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.5 | -44 | 177.2 | 179.2 | 0 | 0 | 0 | 0 | 110.1 | I147 L151 I205 F209 F217 F220 F221 L281 L282 L288 Y289 | I147-V285 HydrophobicContact CG2-CG2 3.56Å; L151-V285 HydrophobicContact CD1-CG2 4Å; L151-V285 HydrophobicContact CD2-CG2 4.47Å; I205-V285 HydrophobicContact CD1-CG1 3.91Å; F209-V285 HydrophobicContact CZ-CG1 4.28Å; F209-V285 HydrophobicContact CZ-CG2 4.24Å; F217-V285 HydrophobicContact CD1-CG1 4.35Å; F217-V285 HydrophobicContact CE1-CG1 4.21Å; F220-V285 HydrophobicContact CD1-CG1 4.16Å; F220-V285 HydrophobicContact CE1-CB 4.07Å; F220-V285 HydrophobicContact CE1-CG1 3.7Å; F220-V285 HydrophobicContact CE1-CG2 4.15Å; F220-V285 HydrophobicContact CZ-CG2 4.32Å; F221-V285 HydrophobicContact CE1-CB 4.24Å; F221-V285 HydrophobicContact CE1-CG1 3.88Å; F221-V285 HydrophobicContact CZ-CB 4.49Å; F221-V285 HydrophobicContact CZ-CG1 3.77Å; L281-V285 VanDerWaalsContact O-CG2 3.29Å; L281-V285 WeakPolarHBondContact O-CG2 3.26Å; L281-V285 PolarHBondContact O-N 3.21Å; L282-V285 PolarHBondContact O-N 2.88Å; V285-L288 WeakPolarHBondContact O-CB 3.48Å; V285-L288 PolarHBondContact O-N 2.77Å; V285-Y289 WeakPolarHBondContact O-CB 3.3Å; V285-Y289 PolarHBondContact O-N 2.99Å |
| 286 | H | 88.8 | Confident | 82.2 | Confident | 99 Ų | 99 | 71.6 Ų | 71.6 | 46% | 0.458 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 177.2 | -177.8 | -99.7 | 0 | 0 | 0 | 112.6 | F221 L282 L288 Y289 R290 | F221-H286 HydrophobicContact CE1-CB 3.89Å; F221-H286 HydrophobicContact CZ-CB 4.17Å; L282-H286 VanDerWaalsContact O-CB 3.22Å; L282-H286 WeakPolarHBondContact O-CB 3.32Å; L282-H286 PolarHBondContact O-N 3.14Å; H286-L288 PolarHBondContact O-N 2.87Å; H286-Y289 PolarHBondContact O-N 2.71Å; H286-R290 WeakPolarHBondContact O-CB 3.04Å; H286-R290 PolarHBondContact O-N 3.48Å |
| 287 | S | 85.9 | Confident | 80.2 | Confident | 34 Ų | 34 | 73.9 Ų | 73.9 | 24% | 0.238 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.6 | -34.3 | 175.3 | 179.7 | 0 | 0 | 0 | 0 | 112 | Q283 R284 R291 | Q283-S287 VanDerWaalsContact O-CB 3.3Å; Q283-S287 WeakPolarHBondContact O-CB 3.33Å; Q283-S287 PolarHBondContact O-N 3.38Å; R284-S287 PolarHBondContact O-N 3.33Å; S287-R291 WeakPolarHBondContact O-CD 3.5Å; S287-R291 VanDerWaalsContact O-CG 3.24Å; S287-R291 WeakPolarHBondContact O-CG 3.43Å; S287-R291 PolarHBondContact O-N 3.29Å |
| 288 | L | 82.8 | Confident | 78.8 | Confident | 30 Ų | 30 | 75 Ų | 75 | 16% | 0.157 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -71.1 | -50.7 | 178 | -174 | 62.7 | 0 | 0 | 0 | 110.3 | Y144 I147 F209 R284 V285 H286 R290 R291 T292 | Y144-L288 HydrophobicContact CD1-CD1 4.46Å; Y144-L288 HydrophobicContact CD1-CD2 3.15Å; Y144-L288 HydrophobicContact CD1-CG 3.93Å; Y144-L288 HydrophobicContact CE1-CD1 4Å; Y144-L288 HydrophobicContact CE1-CD2 3.33Å; Y144-L288 HydrophobicContact CE1-CG 3.53Å; Y144-L288 HydrophobicContact CG-CD2 4.26Å; I147-L288 HydrophobicContact CD1-CD2 3.71Å; F209-L288 HydrophobicContact CE1-CD2 4.21Å; R284-L288 WeakPolarHBondContact O-CB 3.43Å; R284-L288 PolarHBondContact O-N 3.4Å; V285-L288 WeakPolarHBondContact O-CB 3.48Å; V285-L288 PolarHBondContact O-N 2.77Å; H286-L288 PolarHBondContact O-N 2.87Å; L288-R290 VanDerWaalsContact C-N 3.26Å; L288-R290 PolarHBondContact O-N 3.29Å; L288-R291 WeakPolarHBondContact O-CB 3.18Å; L288-R291 PolarHBondContact O-N 3.5Å; L288-T292 PolarHBondContact O-N 3.19Å; L288-T292 VanDerWaalsContact O-N 3.16Å; L288-T292 PolarHBondContact O-OG1 2.82Å |
| 289 | Y | 80.3 | Confident | 77 | Confident | 43 Ų | 43 | 75.7 Ų | 75.7 | 17% | 0.169 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -51.4 | -43.8 | 174.3 | -180 | -105.5 | 0 | 0 | 0 | 112.4 | F217 F221 V285 H286 R291 T292 A294 | F217-Y289 HydrophobicContact CB-CD2 4.11Å; F217-Y289 HydrophobicContact CB-CE2 4.05Å; F217-Y289 HydrophobicContact CD1-CD2 4.25Å; F217-Y289 HydrophobicContact CD2-CD2 4.03Å; F217-Y289 HydrophobicContact CD2-CE2 4.22Å; F217-Y289 AromaticContact CG-CD2 3.88Å; F217-Y289 HydrophobicContact CG-CD2 3.88Å; F217-Y289 HydrophobicContact CG-CE2 4.19Å; F221-Y289 HydrophobicContact CE2-CD1 4.12Å; F221-Y289 HydrophobicContact CE2-CD2 4.46Å; F221-Y289 HydrophobicContact CE2-CG 4.02Å; F221-Y289 HydrophobicContact CZ-CG 4.33Å; V285-Y289 WeakPolarHBondContact O-CB 3.3Å; V285-Y289 PolarHBondContact O-N 2.99Å; H286-Y289 PolarHBondContact O-N 2.71Å; Y289-R291 VanDerWaalsContact C-N 3.33Å; Y289-R291 PolarHBondContact O-N 3.48Å; Y289-T292 PolarHBondContact O-N 3.35Å; Y289-A294 HydrophobicContact CD2-CB 4.24Å; Y289-A294 HydrophobicContact CE2-CB 3.63Å; Y289-A294 PolarHBondContact OH-O 3.02Å |
| 290 | R | 80.3 | Confident | 75.2 | Confident | 189 Ų | 189 | 78.6 Ų | 78.6 | 71% | 0.713 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -68.4 | -27.5 | 177.7 | -167.5 | 175.5 | 65.2 | 159.3 | 0.7 | 113.8 | H286 L288 | H286-R290 WeakPolarHBondContact O-CB 3.04Å; H286-R290 PolarHBondContact O-N 3.48Å; L288-R290 VanDerWaalsContact C-N 3.26Å; L288-R290 PolarHBondContact O-N 3.29Å |
| 291 | R | 74.9 | Confident | 74 | Confident | 204 Ų | 204 | 80.7 Ų | 80.7 | 77% | 0.77 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -77.8 | -29.5 | 177.7 | -75.3 | 170.4 | -176.8 | -168 | -0.8 | 112 | S287 L288 Y289 G293 | S287-R291 WeakPolarHBondContact O-CD 3.5Å; S287-R291 VanDerWaalsContact O-CG 3.24Å; S287-R291 WeakPolarHBondContact O-CG 3.43Å; S287-R291 PolarHBondContact O-N 3.29Å; L288-R291 WeakPolarHBondContact O-CB 3.18Å; L288-R291 PolarHBondContact O-N 3.5Å; Y289-R291 VanDerWaalsContact C-N 3.33Å; Y289-R291 PolarHBondContact O-N 3.48Å; R291-G293 VanDerWaalsContact C-N 3.25Å; R291-G293 PolarHBondContact O-N 3.42Å |
| 292 | T | 65.6 | Low | 72.8 | Confident | 58 Ų | 58 | 83.1 Ų | 83.1 | 36% | 0.356 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -8.5 | -179.8 | -18 | 0 | 0 | 0 | 0 | 113.6 | Y144 L288 Y289 A294 | Y144-T292 WeakPolarHBondContact OH-CG2 3.43Å; Y144-T292 PolarHBondContact OH-OG1 2.76Å; L288-T292 PolarHBondContact O-N 3.19Å; L288-T292 VanDerWaalsContact O-N 3.16Å; L288-T292 PolarHBondContact O-OG1 2.82Å; Y289-T292 PolarHBondContact O-N 3.35Å; T292-A294 PolarHBondContact O-N 2.94Å |
| 293 | G | 55.7 | Low | 71.6 | Confident | 58 Ų | 58 | 86.4 Ų | 86.4 | 60% | 0.598 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.9 | 5.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | R291 S295 | R291-G293 VanDerWaalsContact C-N 3.25Å; R291-G293 PolarHBondContact O-N 3.42Å; G293-S295 PolarHBondContact O-N 3.46Å; G293-S295 VanDerWaalsContact O-N 3.08Å |
| 294 | A | 57.9 | Low | 70.4 | Confident | 13 Ų | 13 | 82.6 Ų | 82.6 | 11% | 0.107 | 40% | 0.397 | C | S | . | . | trans | -62.7 | 109.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y289 T292 | Y289-A294 HydrophobicContact CD2-CB 4.24Å; Y289-A294 HydrophobicContact CE2-CB 3.63Å; Y289-A294 PolarHBondContact OH-O 3.02Å; T292-A294 PolarHBondContact O-N 2.94Å | ||
| 295 | S | 56.1 | Low | 69.2 | Low | 50 Ų | 50 | 82.4 Ų | 82.4 | 35% | 0.35 | 40% | 0.402 | S | S | . | . | trans | -92.3 | 158.2 | -177.5 | 75.4 | 0 | 0 | 0 | 0 | 111.3 | G293 Q297 Q298 A299 | G293-S295 PolarHBondContact O-N 3.46Å; G293-S295 VanDerWaalsContact O-N 3.08Å; S295-Q297 PolarHBondContact O-N 2.77Å; S295-Q297 PolarHBondContact OG-N 3.5Å; S295-Q298 WeakPolarHBondContact O-CB 3.06Å; S295-Q298 PolarHBondContact O-N 3.31Å; S295-Q298 PolarHBondContact OG-N 3.4Å; S295-A299 PolarHBondContact O-N 3.31Å; S295-A299 VanDerWaalsContact O-N 3.13Å | ||
| 296 | F | 55.2 | Low | 67.8 | Low | 149 Ų | 149 | 84.4 Ų | 84.4 | 65% | 0.654 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -56.5 | -29.9 | 173 | -177 | -97.5 | 0 | 0 | 0 | 112.5 | A299 Q300 | F296-A299 WeakPolarHBondContact O-CB 3.39Å; F296-A299 PolarHBondContact O-N 3.39Å; F296-Q300 PolarHBondContact O-N 3.45Å |
| 297 | Q | 55.8 | Low | 66.3 | Low | 139 Ų | 139 | 82.5 Ų | 82.5 | 65% | 0.65 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -66.1 | -42 | 174.6 | -77.2 | 171.9 | -47.1 | 0 | 0 | 112 | S295 A299 Q300 E301 | S295-Q297 PolarHBondContact O-N 2.77Å; S295-Q297 PolarHBondContact OG-N 3.5Å; Q297-A299 VanDerWaalsContact C-N 3.31Å; Q297-A299 PolarHBondContact O-N 2.91Å; Q297-Q300 WeakPolarHBondContact O-CB 3.44Å; Q297-Q300 PolarHBondContact O-N 3.14Å; Q297-Q300 VanDerWaalsContact O-N 3.13Å; Q297-E301 WeakPolarHBondContact O-CG 3.45Å; Q297-E301 PolarHBondContact O-N 2.78Å |
| 298 | Q | 66.6 | Low | 64.9 | Low | 78 Ų | 78 | 86.8 Ų | 86.8 | 36% | 0.364 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.3 | -38.5 | 174.2 | -169.4 | 176.1 | -5.7 | 0 | 0 | 111.5 | S295 Q300 E301 E302 | S295-Q298 WeakPolarHBondContact O-CB 3.06Å; S295-Q298 PolarHBondContact O-N 3.31Å; S295-Q298 PolarHBondContact OG-N 3.4Å; Q298-Q300 VanDerWaalsContact C-N 3.33Å; Q298-Q300 PolarHBondContact O-N 3.38Å; Q298-E301 PolarHBondContact O-N 3.28Å; Q298-E302 WeakPolarHBondContact O-CB 3.44Å; Q298-E302 WeakPolarHBondContact O-CG 3.36Å; Q298-E302 PolarHBondContact O-N 3.49Å |
| 299 | A | 59.1 | Low | 63.7 | Low | 13 Ų | 13 | 88.2 Ų | 88.2 | 11% | 0.107 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -64.4 | -35 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | S295 F296 Q297 F303 | S295-A299 PolarHBondContact O-N 3.31Å; S295-A299 VanDerWaalsContact O-N 3.13Å; F296-A299 WeakPolarHBondContact O-CB 3.39Å; F296-A299 PolarHBondContact O-N 3.39Å; Q297-A299 VanDerWaalsContact C-N 3.31Å; Q297-A299 PolarHBondContact O-N 2.91Å; A299-F303 VanDerWaalsContact O-CB 3.28Å; A299-F303 WeakPolarHBondContact O-CB 3.49Å; A299-F303 PolarHBondContact O-N 2.89Å |
| 300 | Q | 59.1 | Low | 62.4 | Low | 121 Ų | 121 | 89 Ų | 89 | 57% | 0.565 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -71.1 | -39.3 | 176.4 | -171.4 | 175.9 | -6 | 0 | 0 | 111.6 | F296 Q297 Q298 F303 S304 | F296-Q300 PolarHBondContact O-N 3.45Å; Q297-Q300 WeakPolarHBondContact O-CB 3.44Å; Q297-Q300 PolarHBondContact O-N 3.14Å; Q297-Q300 VanDerWaalsContact O-N 3.13Å; Q298-Q300 VanDerWaalsContact C-N 3.33Å; Q298-Q300 PolarHBondContact O-N 3.38Å; Q300-F303 PolarHBondContact O-N 3.31Å; Q300-S304 WeakPolarHBondContact O-CB 3.27Å; Q300-S304 PolarHBondContact O-N 2.95Å; Q300-S304 PolarHBondContact O-OG 3.21Å |
| 301 | E | 69.9 | Low | 61.2 | Low | 119 Ų | 119 | 87.3 Ų | 87.3 | 56% | 0.556 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -63.5 | -47.9 | 173.2 | -74.2 | 175.9 | -174 | 0 | 0 | 111.1 | Q297 Q298 F303 S304 Q305 | Q297-E301 WeakPolarHBondContact O-CG 3.45Å; Q297-E301 PolarHBondContact O-N 2.78Å; Q298-E301 PolarHBondContact O-N 3.28Å; E301-F303 PolarHBondContact O-N 2.93Å; E301-S304 PolarHBondContact O-N 3.39Å; E301-S304 PolarHBondContact O-OG 3.43Å; E301-Q305 WeakPolarHBondContact O-CB 3.11Å; E301-Q305 WeakPolarHBondContact O-CG 3.35Å; E301-Q305 PolarHBondContact O-N 3.1Å |
| 302 | E | 68.4 | Low | 60.5 | Low | 53 Ų | 53 | 82 Ų | 82 | 25% | 0.248 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -62 | -38.7 | 175.9 | -75 | 174 | -162.5 | 0 | 0 | 112.8 | N213 S214 Q298 G306 | N213-E302 PolarHBondContact OD1-OE2 3.2Å; S214-E302 VanDerWaalsContact CB-OE2 3.31Å; S214-E302 WeakPolarHBondContact CB-OE2 3.42Å; S214-E302 PolarHBondContact N-OE2 2.89Å; Q298-E302 WeakPolarHBondContact O-CB 3.44Å; Q298-E302 WeakPolarHBondContact O-CG 3.36Å; Q298-E302 PolarHBondContact O-N 3.49Å; E302-G306 PolarHBondContact O-N 3.25Å |
| 303 | F | 68.6 | Low | 60 | Low | 102 Ų | 102 | 86.6 Ų | 86.6 | 45% | 0.447 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.5 | -43.5 | 175 | -178.3 | -104 | 0 | 0 | 0 | 111.5 | F215 A299 Q300 E301 I307 | F215-F303 AromaticContact CD2-CD2 3.68Å; F215-F303 HydrophobicContact CD2-CD2 3.68Å; F215-F303 HydrophobicContact CD2-CE2 4.32Å; F215-F303 AromaticContact CE2-CD2 3.58Å; F215-F303 HydrophobicContact CE2-CD2 3.58Å; F215-F303 AromaticContact CE2-CE2 3.74Å; F215-F303 HydrophobicContact CE2-CE2 3.74Å; F215-F303 HydrophobicContact CZ-CD2 4.35Å; F215-F303 HydrophobicContact CZ-CE2 4.26Å; A299-F303 VanDerWaalsContact O-CB 3.28Å; A299-F303 WeakPolarHBondContact O-CB 3.49Å; A299-F303 PolarHBondContact O-N 2.89Å; Q300-F303 PolarHBondContact O-N 3.31Å; E301-F303 PolarHBondContact O-N 2.93Å; F303-I307 HydrophobicContact CD1-CD1 3.9Å; F303-I307 HydrophobicContact CD2-CD1 4.35Å; F303-I307 HydrophobicContact CE1-CD1 3.36Å; F303-I307 HydrophobicContact CE2-CD1 3.88Å; F303-I307 HydrophobicContact CG-CD1 4.38Å; F303-I307 HydrophobicContact CZ-CD1 3.37Å; F303-I307 HydrophobicContact CZ-CG1 4.48Å; F303-I307 WeakPolarHBondContact O-CG1 3.35Å; F303-I307 PolarHBondContact O-N 3.33Å; F303-I307 VanDerWaalsContact O-N 3.08Å |
| 304 | S | 66.8 | Low | 60 | Low | 46 Ų | 46 | 90.8 Ų | 90.8 | 32% | 0.322 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.9 | -48.1 | 176.8 | 76.5 | 0 | 0 | 0 | 0 | 110.9 | Q300 E301 G306 I307 F308 | Q300-S304 WeakPolarHBondContact O-CB 3.27Å; Q300-S304 PolarHBondContact O-N 2.95Å; Q300-S304 PolarHBondContact O-OG 3.21Å; E301-S304 PolarHBondContact O-N 3.39Å; E301-S304 PolarHBondContact O-OG 3.43Å; S304-G306 PolarHBondContact O-N 3.01Å; S304-I307 PolarHBondContact O-N 3.4Å; S304-F308 WeakPolarHBondContact O-CD2 3.4Å; S304-F308 PolarHBondContact O-N 3.09Å |
| 305 | Q | 66.6 | Low | 59.9 | Low | 132 Ų | 132 | 99.5 Ų | 99.5 | 62% | 0.617 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.9 | -36.5 | 179.8 | -70.3 | -175.8 | 6.7 | 0 | 0 | 112.5 | E301 F308 S309 | E301-Q305 WeakPolarHBondContact O-CB 3.11Å; E301-Q305 WeakPolarHBondContact O-CG 3.35Å; E301-Q305 PolarHBondContact O-N 3.1Å; Q305-F308 PolarHBondContact O-N 3.37Å; Q305-S309 VanDerWaalsContact O-CB 3.3Å; Q305-S309 WeakPolarHBondContact O-CB 3.4Å; Q305-S309 PolarHBondContact O-N 2.65Å |
| 306 | G | 59.1 | Low | 59.9 | Low | 43 Ų | 43 | 99.6 Ų | 99.6 | 44% | 0.443 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66 | -36.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | E302 S304 S310 | E302-G306 PolarHBondContact O-N 3.25Å; S304-G306 PolarHBondContact O-N 3.01Å; G306-S310 PolarHBondContact O-N 3.34Å; G306-S310 PolarHBondContact O-OG 3.16Å |
| 307 | I | 58.2 | Low | 59.9 | Low | 58 Ų | 58 | 95.3 Ų | 95.3 | 30% | 0.297 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -71.3 | -36.4 | 172.6 | -68.2 | 178.4 | 0 | 0 | 0 | 111.1 | F303 S304 S310 R311 | F303-I307 HydrophobicContact CD1-CD1 3.9Å; F303-I307 HydrophobicContact CD2-CD1 4.35Å; F303-I307 HydrophobicContact CE1-CD1 3.36Å; F303-I307 HydrophobicContact CE2-CD1 3.88Å; F303-I307 HydrophobicContact CG-CD1 4.38Å; F303-I307 HydrophobicContact CZ-CD1 3.37Å; F303-I307 HydrophobicContact CZ-CG1 4.48Å; F303-I307 WeakPolarHBondContact O-CG1 3.35Å; F303-I307 PolarHBondContact O-N 3.33Å; F303-I307 VanDerWaalsContact O-N 3.08Å; S304-I307 PolarHBondContact O-N 3.4Å; I307-S310 WeakPolarHBondContact CA-OG 3.3Å; I307-S310 PolarHBondContact O-OG 3.35Å; I307-R311 WeakPolarHBondContact O-CG 3.35Å; I307-R311 PolarHBondContact O-N 3.43Å |
| 308 | F | 55.6 | Low | 60 | Low | 124 Ų | 124 | 91.5 Ų | 91.5 | 54% | 0.544 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -71.6 | -42.8 | 176.6 | -77.8 | -67.1 | 0 | 0 | 0 | 112.5 | S304 Q305 S310 R311 T312 | S304-F308 WeakPolarHBondContact O-CD2 3.4Å; S304-F308 PolarHBondContact O-N 3.09Å; Q305-F308 PolarHBondContact O-N 3.37Å; F308-S310 PolarHBondContact O-N 2.98Å; F308-R311 PolarHBondContact O-N 3.14Å; F308-R311 VanDerWaalsContact O-N 3.16Å; F308-T312 PolarHBondContact O-N 3.41Å; F308-T312 PolarHBondContact O-OG1 3.3Å |
| 309 | S | 57.4 | Low | 59.6 | Low | 61 Ų | 61 | 91 Ų | 91 | 43% | 0.427 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.2 | -45.6 | 175.7 | 172.5 | 0 | 0 | 0 | 0 | 111.7 | Q305 R311 T312 F313 | Q305-S309 VanDerWaalsContact O-CB 3.3Å; Q305-S309 WeakPolarHBondContact O-CB 3.4Å; Q305-S309 PolarHBondContact O-N 2.65Å; S309-R311 VanDerWaalsContact C-N 3.35Å; S309-R311 PolarHBondContact O-N 2.92Å; S309-T312 PolarHBondContact O-N 2.84Å; S309-F313 WeakPolarHBondContact O-CD2 3.43Å; S309-F313 PolarHBondContact O-N 3.37Å |
| 310 | S | 53.7 | Low | 59.5 | Low | 60 Ų | 60 | 93.6 Ų | 93.6 | 42% | 0.42 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -35.5 | 176.3 | 54.2 | 0 | 0 | 0 | 0 | 113.2 | G306 I307 F308 H314 | G306-S310 PolarHBondContact O-N 3.34Å; G306-S310 PolarHBondContact O-OG 3.16Å; I307-S310 WeakPolarHBondContact CA-OG 3.3Å; I307-S310 PolarHBondContact O-OG 3.35Å; F308-S310 PolarHBondContact O-N 2.98Å; S310-H314 WeakPolarHBondContact O-CB 3.4Å; S310-H314 PolarHBondContact O-N 3.14Å |
| 311 | R | 55.4 | Low | 59.2 | Low | 153 Ų | 153 | 90.3 Ų | 90.3 | 58% | 0.577 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -69.7 | -37.3 | 172.6 | -75.4 | -179 | -174.8 | 179.1 | 3 | 112.9 | I307 F308 S309 H314 R315 | I307-R311 WeakPolarHBondContact O-CG 3.35Å; I307-R311 PolarHBondContact O-N 3.43Å; F308-R311 PolarHBondContact O-N 3.14Å; F308-R311 VanDerWaalsContact O-N 3.16Å; S309-R311 VanDerWaalsContact C-N 3.35Å; S309-R311 PolarHBondContact O-N 2.92Å; R311-H314 PolarHBondContact O-N 3.4Å; R311-R315 WeakPolarHBondContact O-CB 3.21Å; R311-R315 WeakPolarHBondContact O-CG 3.39Å; R311-R315 PolarHBondContact O-N 3.4Å |
| 312 | T | 59.1 | Low | 58.6 | Low | 92 Ų | 92 | 91.4 Ų | 91.4 | 56% | 0.564 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -69.6 | -40.4 | 177.2 | -51.5 | 0 | 0 | 0 | 0 | 111 | F308 S309 R315 A316 | F308-T312 PolarHBondContact O-N 3.41Å; F308-T312 PolarHBondContact O-OG1 3.3Å; S309-T312 PolarHBondContact O-N 2.84Å; T312-R315 PolarHBondContact O-N 3.15Å; T312-A316 VanDerWaalsContact O-CB 3.27Å; T312-A316 WeakPolarHBondContact O-CB 3.41Å; T312-A316 PolarHBondContact O-N 3.47Å |
| 313 | F | 56.1 | Low | 58 | Low | 154 Ų | 154 | 91 Ų | 91 | 68% | 0.675 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65 | -41.2 | 172 | -92.8 | -82.8 | 0 | 0 | 0 | 112.3 | S309 A316 A317 | S309-F313 WeakPolarHBondContact O-CD2 3.43Å; S309-F313 PolarHBondContact O-N 3.37Å; F313-A316 PolarHBondContact O-N 2.93Å; F313-A317 VanDerWaalsContact O-CB 3.26Å; F313-A317 WeakPolarHBondContact O-CB 3.09Å; F313-A317 PolarHBondContact O-N 2.65Å |
| 314 | H | 56.1 | Low | 57.2 | Low | 147 Ų | 147 | 89.8 Ų | 89.8 | 68% | 0.681 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.2 | -37.7 | 173.4 | -103.3 | -60 | 0 | 0 | 0 | 112.7 | S310 R311 S318 | S310-H314 WeakPolarHBondContact O-CB 3.4Å; S310-H314 PolarHBondContact O-N 3.14Å; R311-H314 PolarHBondContact O-N 3.4Å; H314-S318 WeakPolarHBondContact O-CB 3.24Å; H314-S318 PolarHBondContact O-N 3.08Å; H314-S318 PolarHBondContact O-OG 2.95Å |
| 315 | R | 55.5 | Low | 56.6 | Low | 196 Ų | 196 | 96.6 Ų | 96.6 | 74% | 0.74 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.5 | -44.5 | 175.5 | -81.2 | -175.6 | 172.4 | -179.4 | -2.5 | 112 | R311 T312 A317 S318 S319 | R311-R315 WeakPolarHBondContact O-CB 3.21Å; R311-R315 WeakPolarHBondContact O-CG 3.39Å; R311-R315 PolarHBondContact O-N 3.4Å; T312-R315 PolarHBondContact O-N 3.15Å; R315-A317 PolarHBondContact O-N 2.94Å; R315-S318 WeakPolarHBondContact CA-OG 3.47Å; R315-S318 PolarHBondContact O-N 3Å; R315-S318 PolarHBondContact O-OG 3.41Å; R315-S319 PolarHBondContact O-N 3.45Å; R315-S319 PolarHBondContact O-OG 2.75Å; R315-S319 VanDerWaalsContact O-OG 3.11Å |
| 316 | A | 55.8 | Low | 55.9 | Low | 51 Ų | 51 | 98.7 Ų | 98.7 | 42% | 0.421 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.8 | -40.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T312 F313 S319 A320 | T312-A316 VanDerWaalsContact O-CB 3.27Å; T312-A316 WeakPolarHBondContact O-CB 3.41Å; T312-A316 PolarHBondContact O-N 3.47Å; F313-A316 PolarHBondContact O-N 2.93Å; A316-S319 WeakPolarHBondContact CA-OG 3.44Å; A316-S319 PolarHBondContact O-OG 3.38Å; A316-A320 VanDerWaalsContact O-CB 3.3Å; A316-A320 WeakPolarHBondContact O-CB 3.34Å; A316-A320 PolarHBondContact O-N 3Å |
| 317 | A | 54.1 | Low | 55.5 | Low | 59 Ų | 59 | 99.7 Ų | 99.7 | 49% | 0.488 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.4 | -40.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | F313 R315 A321 | F313-A317 VanDerWaalsContact O-CB 3.26Å; F313-A317 WeakPolarHBondContact O-CB 3.09Å; F313-A317 PolarHBondContact O-N 2.65Å; R315-A317 PolarHBondContact O-N 2.94Å; A317-A321 WeakPolarHBondContact O-CB 3.44Å; A317-A321 PolarHBondContact O-N 3.38Å |
| 318 | S | 58.8 | Low | 54.6 | Low | 60 Ų | 60 | 107.9 Ų | 107.9 | 42% | 0.42 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -69.2 | -35.3 | 176.6 | 68.5 | 0 | 0 | 0 | 0 | 113.4 | H314 R315 Q322 | H314-S318 WeakPolarHBondContact O-CB 3.24Å; H314-S318 PolarHBondContact O-N 3.08Å; H314-S318 PolarHBondContact O-OG 2.95Å; R315-S318 WeakPolarHBondContact CA-OG 3.47Å; R315-S318 PolarHBondContact O-N 3Å; R315-S318 PolarHBondContact O-OG 3.41Å; S318-Q322 WeakPolarHBondContact O-CG 3.38Å; S318-Q322 PolarHBondContact O-N 3.14Å |
| 319 | S | 58.9 | Low | 54.5 | Low | 68 Ų | 68 | 107.1 Ų | 107.1 | 48% | 0.476 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -74.1 | -35.4 | 176 | 57.7 | 0 | 0 | 0 | 0 | 112.2 | R315 A316 Q322 G323 | R315-S319 PolarHBondContact O-N 3.45Å; R315-S319 PolarHBondContact O-OG 2.75Å; R315-S319 VanDerWaalsContact O-OG 3.11Å; A316-S319 WeakPolarHBondContact CA-OG 3.44Å; A316-S319 PolarHBondContact O-OG 3.38Å; S319-Q322 PolarHBondContact O-N 2.87Å; S319-G323 PolarHBondContact O-N 3.18Å |
| 320 | A | 55.7 | Low | 54.4 | Low | 67 Ų | 67 | 109.5 Ų | 109.5 | 55% | 0.554 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -67 | -38.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A316 G323 A324 | A316-A320 VanDerWaalsContact O-CB 3.3Å; A316-A320 WeakPolarHBondContact O-CB 3.34Å; A316-A320 PolarHBondContact O-N 3Å; A320-G323 PolarHBondContact O-N 3.41Å; A320-A324 PolarHBondContact O-N 3.25Å; A320-A324 VanDerWaalsContact O-N 3.15Å |
| 321 | A | 54.3 | Low | 54.4 | Low | 52 Ų | 52 | 112.2 Ų | 112.2 | 43% | 0.43 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -65.3 | -39.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A317 A324 F325 | A317-A321 WeakPolarHBondContact O-CB 3.44Å; A317-A321 PolarHBondContact O-N 3.38Å; A321-A324 PolarHBondContact O-N 3.42Å; A321-F325 WeakPolarHBondContact O-CD2 3.46Å |
| 322 | Q | 56.9 | Low | 54.3 | Low | 141 Ų | 141 | 109.8 Ų | 109.8 | 66% | 0.659 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -69.4 | -35 | 175.5 | -76 | 178 | -19.9 | 0 | 0 | 113.1 | S318 S319 A324 F325 | S318-Q322 WeakPolarHBondContact O-CG 3.38Å; S318-Q322 PolarHBondContact O-N 3.14Å; S319-Q322 PolarHBondContact O-N 2.87Å; Q322-A324 VanDerWaalsContact C-N 3.33Å; Q322-A324 PolarHBondContact O-N 3.39Å; Q322-F325 PolarHBondContact O-N 3.26Å |
| 323 | G | 55.2 | Low | 54 | Low | 46 Ų | 46 | 110.9 Ų | 110.9 | 47% | 0.474 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -65.8 | -32.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | S319 A320 F325 | S319-G323 PolarHBondContact O-N 3.18Å; A320-G323 PolarHBondContact O-N 3.41Å; G323-F325 VanDerWaalsContact C-N 3.33Å; G323-F325 PolarHBondContact O-N 2.9Å |
| 324 | A | 51.4 | Low | 53.9 | Low | 76 Ų | 76 | 108.1 Ų | 108.1 | 63% | 0.628 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -73.2 | -21 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | A320 A321 Q322 | A320-A324 PolarHBondContact O-N 3.25Å; A320-A324 VanDerWaalsContact O-N 3.15Å; A321-A324 PolarHBondContact O-N 3.42Å; Q322-A324 VanDerWaalsContact C-N 3.33Å; Q322-A324 PolarHBondContact O-N 3.39Å |
| 325 | F | 53.9 | Low | 53.8 | Low | 188 Ų | 188 | 105.3 Ų | 105.3 | 83% | 0.825 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -89.2 | -10.3 | 177 | -89.2 | -83 | 0 | 0 | 0 | 114.1 | A321 Q322 G323 | A321-F325 WeakPolarHBondContact O-CD2 3.46Å; Q322-F325 PolarHBondContact O-N 3.26Å; G323-F325 VanDerWaalsContact C-N 3.33Å; G323-F325 PolarHBondContact O-N 2.9Å |
| 326 | Q | 53.8 | Low | 53.6 | Low | 177 Ų | 177 | 98.3 Ų | 98.3 | 83% | 0.827 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -99.1 | -0.7 | 174.9 | -78.5 | -179.2 | -18.2 | 0 | 0 | 113.5 | ||
| 327 | G | 50.8 | Low | 53.4 | Low | 64 Ų | 64 | 102.3 Ų | 102.3 | 66% | 0.66 | 64% | 0.639 | S | S | * | * | trans | -100.8 | 17.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 328 | N | 37.7 | Very low | 53.4 | Low | 229 Ų | 229 | 106.2 Ų | 106.2 | 100% | 1.225 | 65% | 0.652 | S | S | * | * | trans | -128.4 | 0 | 177.7 | -121.3 | 25.7 | 0 | 0 | 0 | 111.2 |
Retrieved 328 of 328 residues in 57.4 ms
(Link to these results)