| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36 | Very low | 29.2 | Very low | 250 Ų | 250 | 155.1 Ų | 155.1 | 100% | 1.232 | 87% | 0.874 | S | S | * | * | 0 | 102.2 | 0 | -79.4 | -172.3 | -112 | 0 | 0 | 107.5 | |||||
| 2 | A | 23.9 | Very low | 29.5 | Very low | 93 Ų | 93 | 151.7 Ų | 151.7 | 77% | 0.769 | 86% | 0.863 | S | S | * | * | trans | -87.3 | 147.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 3 | Q | 27.8 | Very low | 29.5 | Very low | 193 Ų | 193 | 148.3 Ų | 148.3 | 90% | 0.902 | 85% | 0.851 | S | S | * | * | trans | 81.6 | 144.1 | 153 | -73.4 | 179.5 | -16.6 | 0 | 0 | 122.3 | ||||
| 4 | A | 28.7 | Very low | 30.1 | Very low | 92 Ų | 92 | 151.7 Ų | 151.7 | 76% | 0.76 | 86% | 0.855 | S | S | * | * | trans | 98.5 | 126.5 | 152 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 5 | L | 33.2 | Very low | 30.3 | Very low | 173 Ų | 173 | 152.4 Ų | 152.4 | 91% | 0.906 | 86% | 0.855 | S | S | * | * | cis | -154.7 | 150 | 16.1 | -66.9 | 162.9 | 0 | 0 | 0 | 106.7 | ||||
| 6 | G | 27.8 | Very low | 30.3 | Very low | 76 Ų | 76 | 153.6 Ų | 153.6 | 78% | 0.784 | 85% | 0.851 | S | S | * | * | 111 | 127.2 | 69.1 | 0 | 0 | 0 | 0 | 0 | 110 | |||||
| 7 | E | 30.6 | Very low | 30.3 | Very low | 190 Ų | 190 | 152.7 Ų | 152.7 | 89% | 0.888 | 85% | 0.845 | S | S | * | * | trans | -69.9 | 155.5 | -161.7 | -59.6 | 165 | 134.5 | 0 | 0 | 116.8 | ||||
| 8 | D | 27.5 | Very low | 30.4 | Very low | 160 Ų | 160 | 153.4 Ų | 153.4 | 86% | 0.856 | 85% | 0.847 | S | S | * | * | -166.7 | 144.1 | 124.6 | -105.6 | -27.9 | 0 | 0 | 0 | 113.5 | |||||
| 9 | L | 28.5 | Very low | 30.9 | Very low | 155 Ų | 155 | 150.4 Ų | 150.4 | 81% | 0.812 | 84% | 0.838 | S | S | * | * | trans | -69.9 | 143.9 | -166.3 | -72.2 | 90.4 | 0 | 0 | 0 | 116.3 | ||||
| 10 | V | 28.2 | Very low | 31.3 | Very low | 142 Ų | 142 | 148.3 Ų | 148.3 | 86% | 0.861 | 83% | 0.834 | S | S | * | * | trans | -155.9 | 120 | 134.3 | 179.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 11 | Q | 29 | Very low | 31.6 | Very low | 182 Ų | 182 | 146.9 Ų | 146.9 | 85% | 0.85 | 83% | 0.834 | S | S | * | * | trans | -86 | 150.5 | 156.9 | -78.7 | -174.7 | -18.1 | 0 | 0 | 108.5 | ||||
| 12 | P | 33.1 | Very low | 31.9 | Very low | 114 Ų | 114 | 143.7 Ų | 143.7 | 74% | 0.74 | 82% | 0.821 | S | S | * | * | cis | -152.1 | -152.2 | 50 | 41.6 | -18.2 | 0 | 0 | 0 | 112.4 | ||||
| 13 | P | 29.7 | Very low | 32.7 | Very low | 108 Ų | 108 | 142.8 Ų | 142.8 | 70% | 0.701 | 82% | 0.82 | S | S | * | * | cis | -114.8 | 171.7 | -28.5 | 35.1 | -18.3 | 0 | 0 | 0 | 113 | L15 | P13-L15 PolarHBondContact O-N 3.12Š| ||
| 14 | E | 37.8 | Very low | 33 | Very low | 196 Ų | 196 | 137.4 Ų | 137.4 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | trans | -51.9 | 124.3 | 173.9 | -63.3 | 172.7 | 144.1 | 0 | 0 | 112.6 | ||||
| 15 | L | 32.8 | Very low | 33.9 | Very low | 162 Ų | 162 | 139.4 Ų | 139.4 | 85% | 0.848 | 80% | 0.802 | S | S | * | * | trans | -123.7 | 132.4 | 163.5 | -81.8 | 168.7 | 0 | 0 | 0 | 108.8 | P13 | P13-L15 PolarHBondContact O-N 3.12Š| ||
| 16 | Q | 30.6 | Very low | 34.2 | Very low | 171 Ų | 171 | 135.6 Ų | 135.6 | 80% | 0.799 | 79% | 0.79 | S | S | * | * | trans | -60.8 | 137.5 | -161.8 | -73.1 | 153.5 | -31.9 | 0 | 0 | 114 | D18 | Q16-D18 PolarHBondContact O-N 3.26Å; Q16-D18 VanDerWaalsContact O-N 3.16Å | ||
| 17 | D | 29.8 | Very low | 34.8 | Very low | 139 Ų | 139 | 140.2 Ų | 140.2 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | trans | -71.6 | 90.3 | 167.1 | -167.3 | 15.1 | 0 | 0 | 0 | 108.9 | S19 | D17-S19 PolarHBondContact O-N 3.35Š| ||
| 18 | D | 32.1 | Very low | 35.5 | Very low | 165 Ų | 165 | 135.9 Ų | 135.9 | 88% | 0.882 | 77% | 0.774 | S | S | * | * | trans | -75.3 | 52.6 | 173.4 | -84 | -22 | 0 | 0 | 0 | 111.5 | Q16 | Q16-D18 PolarHBondContact O-N 3.26Å; Q16-D18 VanDerWaalsContact O-N 3.16Å | ||
| 19 | S | 40.3 | Very low | 36.2 | Very low | 96 Ų | 96 | 133.1 Ų | 133.1 | 67% | 0.671 | 77% | 0.767 | S | S | * | * | trans | -129.4 | 54.5 | 170.9 | -179.5 | 0 | 0 | 0 | 0 | 110.6 | D17 | D17-S19 PolarHBondContact O-N 3.35Š| ||
| 20 | S | 38.8 | Very low | 36.7 | Very low | 109 Ų | 109 | 128 Ų | 128 | 76% | 0.762 | 75% | 0.751 | S | S | * | * | trans | -159.7 | 87.9 | 163.6 | 55.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 21 | S | 37.2 | Very low | 37.2 | Very low | 118 Ų | 118 | 126.9 Ų | 126.9 | 83% | 0.825 | 75% | 0.747 | S | S | * | * | trans | -153.2 | 55 | 157.7 | -152.7 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 22 | L | 41.7 | Very low | 38.2 | Very low | 183 Ų | 183 | 121.8 Ų | 121.8 | 96% | 0.958 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -144.4 | 86.1 | 158.2 | -73.3 | -179 | 0 | 0 | 0 | 107.5 | ||
| 23 | G | 42.3 | Very low | 38.8 | Very low | 74 Ų | 74 | 121.2 Ų | 121.2 | 76% | 0.763 | 74% | 0.739 | S | S | * | * | trans | 150 | 51.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 24 | S | 33.8 | Very low | 39.8 | Very low | 80 Ų | 80 | 125.6 Ų | 125.6 | 56% | 0.559 | 74% | 0.743 | S | S | * | * | trans | -91.5 | 108 | 158 | -168.9 | 0 | 0 | 0 | 0 | 107.4 | S26 E27 | S24-S26 PolarHBondContact O-N 3.41Å; S24-E27 PolarHBondContact O-N 3.27Å | ||
| 25 | D | 46.8 | Very low | 40.8 | Very low | 135 Ų | 135 | 124.5 Ų | 124.5 | 72% | 0.722 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.9 | -6 | 174.3 | -79 | -32.8 | 0 | 0 | 0 | 114.1 | ||
| 26 | S | 40.7 | Very low | 42.9 | Very low | 93 Ų | 93 | 123.2 Ų | 123.2 | 65% | 0.65 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -20.9 | 178 | -58.8 | 0 | 0 | 0 | 0 | 113.7 | S24 | S24-S26 PolarHBondContact O-N 3.41Š|
| 27 | E | 39 | Very low | 45.5 | Very low | 173 Ų | 173 | 116.2 Ų | 116.2 | 81% | 0.808 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -81.4 | -19.6 | 177.3 | -61.3 | -138.6 | 128.2 | 0 | 0 | 113.1 | S24 S29 | S24-E27 PolarHBondContact O-N 3.27Å; E27-S29 VanDerWaalsContact C-N 3.3Å |
| 28 | L | 45.8 | Very low | 48.4 | Very low | 99 Ų | 99 | 111 Ų | 111 | 52% | 0.518 | 66% | 0.664 | S | S | . | * | G | 310 helix | trans | -81.3 | -7.1 | 174.4 | -89.3 | 112.4 | 0 | 0 | 0 | 114 | R35 | L28-R35 PolarHBondContact O-NH2 3.26Š|
| 29 | S | 41.9 | Very low | 51 | Low | 102 Ų | 102 | 109.4 Ų | 109.4 | 71% | 0.713 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -104.9 | 6.1 | -177.3 | -60.7 | 0 | 0 | 0 | 0 | 114.1 | E27 | E27-S29 VanDerWaalsContact C-N 3.3Š|
| 30 | G | 39 | Very low | 53.4 | Low | 46 Ų | 46 | 106.2 Ų | 106.2 | 47% | 0.474 | 62% | 0.619 | S | S | . | * | S | Bend | trans | -79.5 | 157.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 31 | P | 38.5 | Very low | 55.9 | Low | 120 Ų | 120 | 101.2 Ų | 101.2 | 78% | 0.779 | 59% | 0.585 | S | S | * | * | trans | -71.1 | 137.7 | -173.3 | 28.7 | -32.7 | 0 | 0 | 0 | 112.2 | P33 | P31-P33 WeakPolarHBondContact O-CD 3.43Š| ||
| 32 | G | 50 | Low | 58.5 | Low | 75 Ų | 75 | 97 Ų | 97 | 77% | 0.773 | 55% | 0.552 | S | S | * | * | S | Bend | trans | 90.7 | -85.3 | 141.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||
| 33 | P | 46.2 | Very low | 60.8 | Low | 101 Ų | 101 | 90.3 Ų | 90.3 | 66% | 0.656 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -95.8 | -6.4 | -161.6 | 25 | -14.4 | 0 | 0 | 0 | 116.1 | P31 | P31-P33 WeakPolarHBondContact O-CD 3.43Š|
| 34 | Y | 50 | Low | 62.5 | Low | 201 Ų | 201 | 90 Ų | 90 | 79% | 0.788 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | 1.3 | -176.9 | -71 | -80 | 0 | 0 | 0 | 115.4 | ||
| 35 | R | 59.7 | Low | 64.1 | Low | 173 Ų | 173 | 87.5 Ų | 87.5 | 65% | 0.653 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.3 | 8.4 | -179.5 | -77.7 | -166 | -172.4 | -178.6 | 3 | 115 | L28 A37 | L28-R35 PolarHBondContact O-NH2 3.26Å; R35-A37 PolarHBondContact O-N 3.5Å; R35-A37 VanDerWaalsContact O-N 3.16Å |
| 36 | Q | 77.4 | Confident | 64.6 | Low | 135 Ų | 135 | 87 Ų | 87 | 63% | 0.631 | 51% | 0.507 | S | S | * | . | trans | -75.2 | 114.9 | -179.8 | -162.9 | 165.9 | 22.8 | 0 | 0 | 109.8 | ||||
| 37 | A | 85.4 | Confident | 65.2 | Low | 24 Ų | 24 | 85.3 Ų | 85.3 | 20% | 0.198 | 50% | 0.495 | C | S | . | . | B | Isolated β-bridge | trans | -70 | 143 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | R35 F42 E147 | R35-A37 PolarHBondContact O-N 3.5Å; R35-A37 VanDerWaalsContact O-N 3.16Å; A37-F42 CarbonylContact C-O 3.59Å; A37-F42 WeakPolarHBondContact CA-O 3.39Å; A37-E147 WeakPolarHBondContact CB-OE2 3.41Å |
| 38 | D | 88.8 | Confident | 65.7 | Low | 29 Ų | 29 | 80.4 Ų | 80.4 | 16% | 0.155 | 48% | 0.484 | C | S | . | . | trans | -68.1 | 178.5 | 168 | 74.2 | 8.4 | 0 | 0 | 0 | 111.3 | Y40 G41 F42 | D38-Y40 PolarHBondContact O-N 3.09Å; D38-Y40 VanDerWaalsContact OD1-C 3.3Å; D38-Y40 VanDerWaalsContact OD1-CA 3.3Å; D38-Y40 WeakPolarHBondContact OD1-CA 3.46Å; D38-Y40 WeakPolarHBondContact OD1-CB 3.42Å; D38-Y40 PolarHBondContact OD1-N 2.92Å; D38-G41 PolarHBondContact O-N 3Å; D38-G41 PolarHBondContact OD1-N 2.95Å; D38-G41 VanDerWaalsContact OD1-N 3.08Å; D38-F42 PolarHBondContact N-O 3.15Å; D38-F42 PolarHBondContact OD1-N 3.03Å | ||
| 39 | R | 87.3 | Confident | 65.9 | Low | 131 Ų | 131 | 83.1 Ų | 83.1 | 49% | 0.494 | 49% | 0.494 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | -11.5 | 179.4 | 76.4 | -179.1 | -136.4 | 170.6 | 1.3 | 115.2 | H54 | R39-H54 PolarHBondContact NH1-CD2 2.77Å; R39-H54 PolarHBondContact NH1-NE2 3.14Å |
| 40 | Y | 90.8 | Very high | 66.5 | Low | 29 Ų | 29 | 82.3 Ų | 82.3 | 11% | 0.114 | 49% | 0.487 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110 | 7.6 | 179.5 | -62.8 | -70.1 | 0 | 0 | 0 | 112.2 | D38 H146 F266 P267 L270 | D38-Y40 PolarHBondContact O-N 3.09Å; D38-Y40 VanDerWaalsContact OD1-C 3.3Å; D38-Y40 VanDerWaalsContact OD1-CA 3.3Å; D38-Y40 WeakPolarHBondContact OD1-CA 3.46Å; D38-Y40 WeakPolarHBondContact OD1-CB 3.42Å; D38-Y40 PolarHBondContact OD1-N 2.92Å; Y40-H146 PolarHBondContact O-CD2 2.8Å; Y40-H146 PolarHBondContact O-NE2 3Å; Y40-F266 AromaticContact CD1-CD1 3.7Å; Y40-F266 HydrophobicContact CD1-CD1 3.7Å; Y40-F266 AromaticContact CD1-CE1 3.72Å; Y40-F266 HydrophobicContact CD1-CE1 3.72Å; Y40-F266 HydrophobicContact CD2-CD1 4.33Å; Y40-F266 HydrophobicContact CE1-CD1 4.37Å; Y40-F266 AromaticContact CG-CD1 3.63Å; Y40-F266 HydrophobicContact CG-CD1 3.63Å; Y40-F266 AromaticContact CG-CE1 3.97Å; Y40-F266 HydrophobicContact CG-CE1 3.97Å; Y40-P267 HydrophobicContact CD2-CG 4.21Å; Y40-P267 HydrophobicContact CE2-CB 3.92Å; Y40-P267 HydrophobicContact CE2-CG 3.5Å; Y40-P267 WeakPolarHBondContact OH-CB 3.35Å; Y40-L270 HydrophobicContact CD1-CD1 3.93Å; Y40-L270 HydrophobicContact CE1-CD1 3.56Å |
| 41 | G | 91.8 | Very high | 67.3 | Low | 4 Ų | 4 | 82.2 Ų | 82.2 | 4% | 0.041 | 49% | 0.486 | C | S | . | . | S | Bend | trans | 87.8 | 5.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | D38 H146 E147 | D38-G41 PolarHBondContact O-N 3Å; D38-G41 PolarHBondContact OD1-N 2.95Å; D38-G41 VanDerWaalsContact OD1-N 3.08Å; G41-H146 CarbonylContact O-C 3.6Å; G41-H146 VanDerWaalsContact O-CA 3.32Å; G41-H146 WeakPolarHBondContact O-CA 3.3Å; G41-E147 PolarHBondContact O-N 2.76Å |
| 42 | F | 92.1 | Very high | 67.8 | Low | 31 Ų | 31 | 83.6 Ų | 83.6 | 14% | 0.136 | 49% | 0.494 | C | S | . | . | B | Isolated β-bridge | trans | -88.9 | 121.2 | -179 | -70 | -87.1 | 0 | 0 | 0 | 112.5 | A37 D38 G45 F143 H146 M189 F266 | A37-F42 CarbonylContact C-O 3.59Å; A37-F42 WeakPolarHBondContact CA-O 3.39Å; D38-F42 PolarHBondContact N-O 3.15Å; D38-F42 PolarHBondContact OD1-N 3.03Å; F42-G45 PolarHBondContact O-N 3.38Å; F42-F143 HydrophobicContact CE1-CB 4.23Å; F42-F143 AromaticContact CE1-CD1 3.69Å; F42-F143 HydrophobicContact CE1-CD1 3.69Å; F42-F143 HydrophobicContact CE1-CG 4.38Å; F42-F143 AromaticContact CZ-CD1 3.68Å; F42-F143 HydrophobicContact CZ-CD1 3.68Å; F42-F143 HydrophobicContact CZ-CE1 4.18Å; F42-F143 HydrophobicContact CZ-CG 4.45Å; F42-H146 HydrophobicContact CD1-CB 4.04Å; F42-H146 AromaticContact CD2-CD2 3.96Å; F42-H146 HydrophobicContact CE1-CB 3.89Å; F42-H146 AromaticContact CE2-CD2 3.7Å; F42-H146 HydrophobicContact CZ-CB 4.35Å; F42-H146 AromaticContact CZ-CD2 3.81Å; F42-M189 HydrophobicContact CZ-CE 4.22Å; F42-F266 HydrophobicContact CD2-CD1 4.47Å; F42-F266 HydrophobicContact CD2-CG 4.43Å; F42-F266 HydrophobicContact CE2-CB 3.88Å; F42-F266 AromaticContact CE2-CD1 3.69Å; F42-F266 HydrophobicContact CE2-CD1 3.69Å; F42-F266 AromaticContact CE2-CD2 3.63Å; F42-F266 HydrophobicContact CE2-CD2 3.63Å; F42-F266 HydrophobicContact CE2-CE1 4.02Å; F42-F266 AromaticContact CE2-CE2 3.97Å; F42-F266 HydrophobicContact CE2-CE2 3.97Å; F42-F266 AromaticContact CE2-CG 3.45Å; F42-F266 HydrophobicContact CE2-CG 3.45Å; F42-F266 VanDerWaalsContact CE2-CG 3.45Å; F42-F266 HydrophobicContact CE2-CZ 4.14Å; F42-F266 HydrophobicContact CZ-CB 4.37Å; F42-F266 AromaticContact CZ-CD2 3.71Å; F42-F266 HydrophobicContact CZ-CD2 3.71Å; F42-F266 HydrophobicContact CZ-CE2 4.04Å; F42-F266 AromaticContact CZ-CG 4Å; F42-F266 HydrophobicContact CZ-CG 4Å |
| 43 | I | 89.8 | Confident | 68.4 | Low | 42 Ų | 42 | 83.8 Ų | 83.8 | 22% | 0.215 | 50% | 0.496 | C | S | . | . | B | Isolated β-bridge | trans | -71.9 | 134.4 | 176.8 | -57.2 | 166.3 | 0 | 0 | 0 | 109.5 | G45 L145 V150 | I43-G45 PolarHBondContact O-N 3.36Å; I43-L145 WeakPolarHBondContact CB-O 3.4Å; I43-L145 WeakPolarHBondContact CG1-O 3.4Å; I43-L145 PolarHBondContact N-O 3.37Å; I43-V150 HydrophobicContact CD1-CB 4.11Å; I43-V150 HydrophobicContact CD1-CG1 4.11Å; I43-V150 HydrophobicContact CD1-CG2 3.93Å |
| 44 | G | 78.7 | Confident | 69.6 | Low | 67 Ų | 67 | 82.5 Ų | 82.5 | 69% | 0.691 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.3 | 6.4 | -176 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 45 | G | 65.6 | Low | 71 | Confident | 28 Ų | 28 | 74.6 Ų | 74.6 | 29% | 0.289 | 46% | 0.455 | S | S | . | . | trans | -64.4 | 133.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | F42 I43 S47 | F42-G45 PolarHBondContact O-N 3.38Å; I43-G45 PolarHBondContact O-N 3.36Å; G45-S47 PolarHBondContact O-N 3.11Å | ||
| 46 | S | 57.5 | Low | 72.3 | Confident | 125 Ų | 125 | 70.6 Ų | 70.6 | 87% | 0.874 | 45% | 0.451 | S | S | * | . | S | Bend | trans | -74.6 | 61.4 | 175.2 | -46.5 | 0 | 0 | 0 | 0 | 111.1 | ||
| 47 | S | 54.7 | Low | 72.8 | Confident | 56 Ų | 56 | 67.8 Ų | 67.8 | 39% | 0.392 | 45% | 0.451 | S | S | . | . | trans | -161.7 | 68.4 | 179 | -77.4 | 0 | 0 | 0 | 0 | 111.9 | G45 E49 | G45-S47 PolarHBondContact O-N 3.11Å; S47-E49 VanDerWaalsContact C-N 3.34Å | ||
| 48 | A | 48.7 | Very low | 73.1 | Confident | 71 Ų | 71 | 71.8 Ų | 71.8 | 59% | 0.587 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -79.5 | -20.7 | 159 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 49 | E | 49.2 | Very low | 73.1 | Confident | 155 Ų | 155 | 73.3 Ų | 73.3 | 72% | 0.724 | 48% | 0.477 | S | S | * | . | S | Bend | trans | -124 | 143.1 | -176.5 | -73.9 | -69.3 | 140.7 | 0 | 0 | 111.6 | S47 G51 | S47-E49 VanDerWaalsContact C-N 3.34Å; E49-G51 PolarHBondContact O-N 3.05Å |
| 50 | P | 54.7 | Low | 73.3 | Confident | 86 Ų | 86 | 69 Ų | 69 | 56% | 0.558 | 46% | 0.464 | S | S | * | . | trans | -61 | 110.6 | 172.1 | 5.6 | -0.2 | 0 | 0 | 0 | 109.7 | H54 | P50-H54 HydrophobicContact CB-CB 3.57Š| ||
| 51 | G | 57.3 | Low | 73.4 | Confident | 44 Ų | 44 | 75.8 Ų | 75.8 | 45% | 0.454 | 49% | 0.489 | S | S | . | . | trans | -58.3 | 159.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | E49 G53 H54 | E49-G51 PolarHBondContact O-N 3.05Å; G51-G53 PolarHBondContact O-N 3.34Å; G51-H54 PolarHBondContact O-N 3.41Å; G51-H54 VanDerWaalsContact O-N 3.09Å | ||
| 52 | P | 49.1 | Very low | 73.5 | Confident | 148 Ų | 148 | 80.7 Ų | 80.7 | 96% | 0.961 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | 109 | 175.8 | 23.4 | -31.9 | 0 | 0 | 0 | 109.5 | ||
| 53 | G | 61.9 | Low | 73.6 | Confident | 79 Ų | 79 | 82.1 Ų | 82.1 | 81% | 0.814 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 130.3 | -9.2 | -173 | 0 | 0 | 0 | 0 | 0 | 114.8 | G51 | G51-G53 PolarHBondContact O-N 3.34Š|
| 54 | H | 71.5 | Confident | 73.9 | Confident | 75 Ų | 75 | 82.8 Ų | 82.8 | 35% | 0.347 | 52% | 0.518 | S | S | . | . | P | Polyproline II helix | trans | -65.7 | 130.8 | 173.2 | -165.1 | -99.9 | 0 | 0 | 0 | 111.4 | R39 P50 G51 I60 | R39-H54 PolarHBondContact NH1-CD2 2.77Å; R39-H54 PolarHBondContact NH1-NE2 3.14Å; P50-H54 HydrophobicContact CB-CB 3.57Å; G51-H54 PolarHBondContact O-N 3.41Å; G51-H54 VanDerWaalsContact O-N 3.09Å; H54-I60 WeakPolarHBondContact CE1-CD1 3.33Å |
| 55 | P | 79.7 | Confident | 74.8 | Confident | 34 Ų | 34 | 85.5 Ų | 85.5 | 22% | 0.221 | 51% | 0.514 | C | S | . | . | P | Polyproline II helix | trans | -63 | 144.7 | 178.4 | 22.7 | -30.5 | 0 | 0 | 0 | 111.1 | L59 I60 | P55-L59 HydrophobicContact CB-CB 4.48Å; P55-L59 HydrophobicContact CB-CD2 3.88Å; P55-L59 HydrophobicContact CB-CG 4.37Å; P55-I60 HydrophobicContact CB-CG1 4.21Å; P55-I60 HydrophobicContact CG-CD1 4.07Å; P55-I60 HydrophobicContact CG-CG1 3.84Å |
| 56 | P | 87.2 | Confident | 76.2 | Confident | 89 Ų | 89 | 88.1 Ų | 88.1 | 58% | 0.578 | 52% | 0.517 | S | S | * | . | P | Polyproline II helix | trans | -54.9 | 146.7 | 173.8 | -25 | 33.4 | 0 | 0 | 0 | 111.7 | D58 L59 I60 | P56-D58 PolarHBondContact O-N 2.95Å; P56-D58 VanDerWaalsContact O-N 3.15Å; P56-L59 WeakPolarHBondContact O-CA 3.4Å; P56-L59 WeakPolarHBondContact O-CB 3.25Å; P56-L59 PolarHBondContact O-N 3.19Å; P56-I60 PolarHBondContact O-N 3.16Å; P56-I60 VanDerWaalsContact O-N 3.15Å |
| 57 | A | 88 | Confident | 78.1 | Confident | 77 Ų | 77 | 82.2 Ų | 82.2 | 64% | 0.636 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -53.9 | -38.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L59 I60 R61 | A57-L59 VanDerWaalsContact C-N 3.33Å; A57-L59 PolarHBondContact O-N 2.98Å; A57-I60 WeakPolarHBondContact O-CB 3.41Å; A57-I60 PolarHBondContact O-N 3.11Å; A57-R61 PolarHBondContact O-N 3.41Å |
| 58 | D | 90.9 | Very high | 80.1 | Confident | 108 Ų | 108 | 81.5 Ų | 81.5 | 58% | 0.578 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -63 | -38.5 | 176.6 | -67.1 | -33.6 | 0 | 0 | 0 | 112.7 | P56 I60 R61 Q62 | P56-D58 PolarHBondContact O-N 2.95Å; P56-D58 VanDerWaalsContact O-N 3.15Å; D58-I60 VanDerWaalsContact C-N 3.33Å; D58-R61 PolarHBondContact O-N 3.34Å; D58-Q62 WeakPolarHBondContact O-CB 3.34Å; D58-Q62 VanDerWaalsContact O-CG 3.23Å; D58-Q62 WeakPolarHBondContact O-CG 3.14Å; D58-Q62 PolarHBondContact O-N 3.43Å |
| 59 | L | 89.6 | Confident | 82.4 | Confident | 60 Ų | 60 | 82.2 Ų | 82.2 | 31% | 0.314 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 176.4 | -179.9 | 59.2 | 0 | 0 | 0 | 111 | P55 P56 A57 Q62 R63 | P55-L59 HydrophobicContact CB-CB 4.48Å; P55-L59 HydrophobicContact CB-CD2 3.88Å; P55-L59 HydrophobicContact CB-CG 4.37Å; P56-L59 WeakPolarHBondContact O-CA 3.4Å; P56-L59 WeakPolarHBondContact O-CB 3.25Å; P56-L59 PolarHBondContact O-N 3.19Å; A57-L59 VanDerWaalsContact C-N 3.33Å; A57-L59 PolarHBondContact O-N 2.98Å; L59-Q62 PolarHBondContact O-N 2.77Å; L59-R63 VanDerWaalsContact O-CG 3.29Å; L59-R63 WeakPolarHBondContact O-CG 3.42Å; L59-R63 PolarHBondContact O-N 3.05Å |
| 60 | I | 90.4 | Very high | 84.7 | Confident | 42 Ų | 42 | 74.8 Ų | 74.8 | 22% | 0.215 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -63.1 | -51.5 | 174.9 | -61.9 | 172.5 | 0 | 0 | 0 | 109.7 | H54 P55 P56 A57 D58 Q62 R63 E64 | H54-I60 WeakPolarHBondContact CE1-CD1 3.33Å; P55-I60 HydrophobicContact CB-CG1 4.21Å; P55-I60 HydrophobicContact CG-CD1 4.07Å; P55-I60 HydrophobicContact CG-CG1 3.84Å; P56-I60 PolarHBondContact O-N 3.16Å; P56-I60 VanDerWaalsContact O-N 3.15Å; A57-I60 WeakPolarHBondContact O-CB 3.41Å; A57-I60 PolarHBondContact O-N 3.11Å; D58-I60 VanDerWaalsContact C-N 3.33Å; I60-Q62 VanDerWaalsContact C-N 3.3Å; I60-Q62 PolarHBondContact O-N 3.4Å; I60-R63 CarbonylContact O-C 3.57Å; I60-R63 WeakPolarHBondContact O-CA 3.24Å; I60-R63 WeakPolarHBondContact O-CB 3.23Å; I60-R63 PolarHBondContact O-N 3.11Å; I60-E64 HydrophobicContact CG2-CG 4.39Å; I60-E64 WeakPolarHBondContact O-CG 3.34Å; I60-E64 PolarHBondContact O-N 3.41Å |
| 61 | R | 93.5 | Very high | 86.7 | Confident | 171 Ų | 171 | 71.1 Ų | 71.1 | 65% | 0.645 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -57.8 | -41.7 | 178 | -172 | -177.9 | -69 | -178.3 | -0.9 | 112.1 | A57 D58 R63 E64 M65 | A57-R61 PolarHBondContact O-N 3.41Å; D58-R61 PolarHBondContact O-N 3.34Å; R61-R63 VanDerWaalsContact C-N 3.34Å; R61-R63 PolarHBondContact O-N 2.95Å; R61-E64 PolarHBondContact O-N 3.29Å; R61-M65 WeakPolarHBondContact O-CG 3.43Å; R61-M65 PolarHBondContact O-N 3.4Å |
| 62 | Q | 93.9 | Very high | 88.5 | Confident | 107 Ų | 107 | 74.2 Ų | 74.2 | 50% | 0.5 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.5 | -38 | 175 | -75.4 | 177.1 | 17.6 | 0 | 0 | 112.8 | D58 L59 I60 K66 | D58-Q62 WeakPolarHBondContact O-CB 3.34Å; D58-Q62 VanDerWaalsContact O-CG 3.23Å; D58-Q62 WeakPolarHBondContact O-CG 3.14Å; D58-Q62 PolarHBondContact O-N 3.43Å; L59-Q62 PolarHBondContact O-N 2.77Å; I60-Q62 VanDerWaalsContact C-N 3.3Å; I60-Q62 PolarHBondContact O-N 3.4Å; Q62-K66 WeakPolarHBondContact O-CD 3.28Å; Q62-K66 WeakPolarHBondContact O-CG 3.32Å; Q62-K66 PolarHBondContact O-N 3.43Å |
| 63 | R | 94.1 | Very high | 90.7 | Very high | 61 Ų | 61 | 72.1 Ų | 72.1 | 23% | 0.23 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -67.6 | -40.7 | 174.8 | -72.3 | 174.3 | -178 | -159.1 | 2.4 | 110.7 | L59 I60 R61 K66 W67 K91 P94 | L59-R63 VanDerWaalsContact O-CG 3.29Å; L59-R63 WeakPolarHBondContact O-CG 3.42Å; L59-R63 PolarHBondContact O-N 3.05Å; I60-R63 CarbonylContact O-C 3.57Å; I60-R63 WeakPolarHBondContact O-CA 3.24Å; I60-R63 WeakPolarHBondContact O-CB 3.23Å; I60-R63 PolarHBondContact O-N 3.11Å; R61-R63 VanDerWaalsContact C-N 3.34Å; R61-R63 PolarHBondContact O-N 2.95Å; R63-K66 PolarHBondContact O-N 2.86Å; R63-W67 PolarHBondContact O-N 2.88Å; R63-W67 VanDerWaalsContact O-N 3.16Å; R63-K91 PolarHBondContact NH1-O 3.4Å; R63-P94 HydrophobicContact CB-CG 3.92Å |
| 64 | E | 96.3 | Very high | 92.3 | Very high | 56 Ų | 56 | 69.3 Ų | 69.3 | 26% | 0.262 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61 | -50.9 | 176.5 | -72.4 | 171.9 | 165.9 | 0 | 0 | 111.8 | I60 R61 K66 W67 V68 P94 L97 | I60-E64 HydrophobicContact CG2-CG 4.39Å; I60-E64 WeakPolarHBondContact O-CG 3.34Å; I60-E64 PolarHBondContact O-N 3.41Å; R61-E64 PolarHBondContact O-N 3.29Å; E64-K66 PolarHBondContact O-N 2.96Å; E64-W67 WeakPolarHBondContact O-CA 3.46Å; E64-W67 WeakPolarHBondContact O-CB 3.36Å; E64-W67 PolarHBondContact O-N 3.48Å; E64-V68 WeakPolarHBondContact O-CG2 3.45Å; E64-V68 PolarHBondContact O-N 2.99Å; E64-P94 HydrophobicContact CG-CB 3.48Å; E64-P94 VanDerWaalsContact CG-CB 3.48Å; E64-P94 HydrophobicContact CG-CG 3.66Å; E64-L97 HydrophobicContact CB-CD1 3.92Å; E64-L97 HydrophobicContact CG-CD1 4.09Å; E64-L97 HydrophobicContact CG-CG 4.42Å; E64-L97 VanDerWaalsContact O-CD1 3.3Å; E64-L97 WeakPolarHBondContact O-CD1 3.44Å |
| 65 | M | 96.3 | Very high | 93.4 | Very high | 124 Ų | 124 | 71.7 Ų | 71.7 | 61% | 0.611 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -57.6 | -38.1 | 178.8 | -72.2 | -58 | -62.6 | 0 | 0 | 112.6 | R61 V68 E69 | R61-M65 WeakPolarHBondContact O-CG 3.43Å; R61-M65 PolarHBondContact O-N 3.4Å; M65-V68 PolarHBondContact O-N 3.19Å; M65-E69 PolarHBondContact O-N 3.48Å |
| 66 | K | 95.5 | Very high | 94.2 | Very high | 83 Ų | 83 | 76.1 Ų | 76.1 | 36% | 0.361 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 174.7 | -74.3 | 168.2 | -174.3 | 164.8 | 0 | 111.9 | Q62 R63 E64 M70 | Q62-K66 WeakPolarHBondContact O-CD 3.28Å; Q62-K66 WeakPolarHBondContact O-CG 3.32Å; Q62-K66 PolarHBondContact O-N 3.43Å; R63-K66 PolarHBondContact O-N 2.86Å; E64-K66 PolarHBondContact O-N 2.96Å; K66-M70 WeakPolarHBondContact O-CB 3.34Å; K66-M70 VanDerWaalsContact O-CG 3.28Å; K66-M70 WeakPolarHBondContact O-CG 3.32Å; K66-M70 PolarHBondContact O-N 3.45Å; K66-M70 VanDerWaalsContact O-N 3.09Å |
| 67 | W | 97.4 | Very high | 94.6 | Very high | 1 Ų | 1 | 71.9 Ų | 71.9 | 0% | 0.004 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -69.3 | -40.5 | 177.3 | -86.3 | 112.3 | 0 | 0 | 0 | 112.2 | R63 E64 E69 M70 T71 V85 Q88 C89 I93 L97 | R63-W67 PolarHBondContact O-N 2.88Å; R63-W67 VanDerWaalsContact O-N 3.16Å; E64-W67 WeakPolarHBondContact O-CA 3.46Å; E64-W67 WeakPolarHBondContact O-CB 3.36Å; E64-W67 PolarHBondContact O-N 3.48Å; W67-E69 PolarHBondContact O-N 2.8Å; W67-M70 HydrophobicContact CD2-CE 3.52Å; W67-M70 HydrophobicContact CE3-CE 3.39Å; W67-M70 HydrophobicContact CG-CE 4.08Å; W67-M70 HydrophobicContact CH2-CE 4.09Å; W67-M70 HydrophobicContact CZ2-CE 4.23Å; W67-M70 HydrophobicContact CZ3-CE 3.7Å; W67-M70 PolarHBondContact O-N 3.07Å; W67-T71 HydrophobicContact CE3-CG2 4.32Å; W67-T71 WeakPolarHBondContact O-CB 3.42Å; W67-T71 VanDerWaalsContact O-CG2 3.3Å; W67-T71 WeakPolarHBondContact O-CG2 3.42Å; W67-T71 PolarHBondContact O-N 3.09Å; W67-T71 PolarHBondContact O-OG1 3.44Å; W67-V85 HydrophobicContact CH2-CG1 4.16Å; W67-V85 HydrophobicContact CZ3-CG1 4.33Å; W67-Q88 HydrophobicContact CH2-CB 4.08Å; W67-Q88 HydrophobicContact CZ2-CB 3.36Å; W67-C89 VanDerWaalsContact CH2-SG 3.56Å; W67-I93 HydrophobicContact CH2-CD1 4.17Å; W67-I93 HydrophobicContact CH2-CG1 4.2Å; W67-I93 HydrophobicContact CZ2-CD1 4.1Å; W67-I93 HydrophobicContact CZ2-CG1 3.62Å; W67-L97 HydrophobicContact CB-CD1 3.31Å; W67-L97 HydrophobicContact CG-CD1 4.23Å |
| 68 | V | 97.4 | Very high | 95 | Very high | 40 Ų | 40 | 68.4 Ų | 68.4 | 24% | 0.242 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -57.9 | -49.1 | 173.1 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | E64 M65 M70 T71 L72 L97 | E64-V68 WeakPolarHBondContact O-CG2 3.45Å; E64-V68 PolarHBondContact O-N 2.99Å; M65-V68 PolarHBondContact O-N 3.19Å; V68-M70 PolarHBondContact O-N 2.88Å; V68-T71 PolarHBondContact O-N 2.81Å; V68-T71 PolarHBondContact O-OG1 2.77Å; V68-T71 VanDerWaalsContact O-OG1 3.14Å; V68-L72 HydrophobicContact CG1-CD1 3.85Å; V68-L72 HydrophobicContact CG1-CG 4.33Å; V68-L72 WeakPolarHBondContact O-CB 3.26Å; V68-L72 VanDerWaalsContact O-CG 3.23Å; V68-L72 WeakPolarHBondContact O-CG 3.27Å; V68-L72 PolarHBondContact O-N 3.19Å; V68-L97 HydrophobicContact CG2-CD1 4.14Å; V68-L97 HydrophobicContact CG2-CD2 4.13Å |
| 69 | E | 96.2 | Very high | 95.2 | Very high | 86 Ų | 86 | 67 Ų | 67 | 40% | 0.402 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.4 | -44 | 177.9 | -169.8 | -145.3 | 133.1 | 0 | 0 | 112.3 | M65 W67 H73 R81 | M65-E69 PolarHBondContact O-N 3.48Å; W67-E69 PolarHBondContact O-N 2.8Å; E69-H73 PolarHBondContact O-ND1 3.44Å; E69-R81 IonicContact OE1-CZ 3.57Å; E69-R81 IonicContact OE1-NH1 3.89Å; E69-R81 PolarHBondContact OE1-NH1 3.26Å; E69-R81 VanDerWaalsContact OE1-NH1 3.09Å; E69-R81 IonicContact OE1-NH2 2.77Å |
| 70 | M | 96.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 73.7 Ų | 73.7 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.9 | -42.7 | 179.7 | -76.7 | -170.3 | -50.1 | 0 | 0 | 112.6 | K66 W67 V68 H73 W74 T77 K84 V85 Q88 | K66-M70 WeakPolarHBondContact O-CB 3.34Å; K66-M70 VanDerWaalsContact O-CG 3.28Å; K66-M70 WeakPolarHBondContact O-CG 3.32Å; K66-M70 PolarHBondContact O-N 3.45Å; K66-M70 VanDerWaalsContact O-N 3.09Å; W67-M70 HydrophobicContact CD2-CE 3.52Å; W67-M70 HydrophobicContact CE3-CE 3.39Å; W67-M70 HydrophobicContact CG-CE 4.08Å; W67-M70 HydrophobicContact CH2-CE 4.09Å; W67-M70 HydrophobicContact CZ2-CE 4.23Å; W67-M70 HydrophobicContact CZ3-CE 3.7Å; W67-M70 PolarHBondContact O-N 3.07Å; V68-M70 PolarHBondContact O-N 2.88Å; M70-H73 CarbonylContact O-C 3.59Å; M70-H73 PolarHBondContact O-N 3.45Å; M70-W74 PolarHBondContact O-N 2.93Å; M70-T77 HydrophobicContact CB-CG2 3.96Å; M70-T77 HydrophobicContact CG-CG2 3.95Å; M70-T77 PolarHBondContact O-OG1 2.96Å; M70-T77 HydrophobicContact SD-CG2 4.39Å; M70-K84 HydrophobicContact SD-CD 4.26Å; M70-K84 HydrophobicContact SD-CG 4.19Å; M70-V85 HydrophobicContact SD-CG2 4.22Å; M70-Q88 HydrophobicContact CE-CB 4.05Å; M70-Q88 HydrophobicContact CE-CG 3.77Å; M70-Q88 HydrophobicContact SD-CG 4.24Å |
| 71 | T | 96.8 | Very high | 95.7 | Very high | 9 Ų | 9 | 75.2 Ų | 75.2 | 6% | 0.055 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -78.4 | -26.9 | -177 | 53 | 0 | 0 | 0 | 0 | 112.9 | W67 V68 H73 R100 L104 | W67-T71 HydrophobicContact CE3-CG2 4.32Å; W67-T71 WeakPolarHBondContact O-CB 3.42Å; W67-T71 VanDerWaalsContact O-CG2 3.3Å; W67-T71 WeakPolarHBondContact O-CG2 3.42Å; W67-T71 PolarHBondContact O-N 3.09Å; W67-T71 PolarHBondContact O-OG1 3.44Å; V68-T71 PolarHBondContact O-N 2.81Å; V68-T71 PolarHBondContact O-OG1 2.77Å; V68-T71 VanDerWaalsContact O-OG1 3.14Å; T71-H73 PolarHBondContact O-N 3.45Å; T71-R100 HydrophobicContact CG2-CG 4.42Å; T71-R100 PolarHBondContact OG1-NE 2.73Å; T71-R100 PolarHBondContact OG1-NH2 2.81Å; T71-L104 HydrophobicContact CG2-CD1 3.66Å |
| 72 | L | 96.4 | Very high | 95.8 | Very high | 109 Ų | 109 | 68.3 Ų | 68.3 | 57% | 0.571 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -61.9 | -31.6 | 170.4 | -78.3 | 169.4 | 0 | 0 | 0 | 112.4 | V68 | V68-L72 HydrophobicContact CG1-CD1 3.85Å; V68-L72 HydrophobicContact CG1-CG 4.33Å; V68-L72 WeakPolarHBondContact O-CB 3.26Å; V68-L72 VanDerWaalsContact O-CG 3.23Å; V68-L72 WeakPolarHBondContact O-CG 3.27Å; V68-L72 PolarHBondContact O-N 3.19Å |
| 73 | H | 94.6 | Very high | 95.9 | Very high | 104 Ų | 104 | 72 Ų | 72 | 48% | 0.481 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -120 | 51.2 | -179.2 | -55.2 | 94.1 | 0 | 0 | 0 | 110.5 | E69 M70 T71 E75 K76 T77 | E69-H73 PolarHBondContact O-ND1 3.44Å; M70-H73 CarbonylContact O-C 3.59Å; M70-H73 PolarHBondContact O-N 3.45Å; T71-H73 PolarHBondContact O-N 3.45Å; H73-E75 PolarHBondContact O-N 2.95Å; H73-K76 PolarHBondContact O-N 3.4Å; H73-T77 VanDerWaalsContact O-CB 3.24Å; H73-T77 WeakPolarHBondContact O-CB 3.26Å; H73-T77 PolarHBondContact O-N 3.49Å; H73-T77 PolarHBondContact O-OG1 3.45Å |
| 74 | W | 95.9 | Very high | 96.1 | Very high | 19 Ų | 19 | 72.6 Ų | 72.6 | 7% | 0.072 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -57.9 | -51.6 | -167.3 | -174.9 | -123.1 | 0 | 0 | 0 | 113.4 | M70 K76 T77 M78 V85 L104 L105 | M70-W74 PolarHBondContact O-N 2.93Å; W74-K76 PolarHBondContact O-N 3.31Å; W74-T77 CarbonylContact O-C 3.3Å; W74-T77 PolarHBondContact O-N 2.98Å; W74-M78 HydrophobicContact CD2-CG 3.76Å; W74-M78 HydrophobicContact CE3-CG 4.1Å; W74-M78 HydrophobicContact CG-CG 4.43Å; W74-M78 HydrophobicContact CH2-CG 3.83Å; W74-M78 HydrophobicContact CH2-SD 3.4Å; W74-M78 WeakPolarHBondContact CH2-SD 3.43Å; W74-M78 HydrophobicContact CZ2-CE 4.21Å; W74-M78 HydrophobicContact CZ2-CG 3.45Å; W74-M78 VanDerWaalsContact CZ2-CG 3.45Å; W74-M78 HydrophobicContact CZ2-SD 3.43Å; W74-M78 WeakPolarHBondContact CZ2-SD 3.4Å; W74-M78 HydrophobicContact CZ3-CG 4.13Å; W74-M78 HydrophobicContact CZ3-SD 4Å; W74-M78 PolarHBondContact O-N 3.25Å; W74-V85 HydrophobicContact CH2-CG1 3.95Å; W74-V85 HydrophobicContact CZ3-CG1 4.14Å; W74-V85 HydrophobicContact CZ3-CG2 4.23Å; W74-L104 HydrophobicContact CB-CD2 4.48Å; W74-L104 HydrophobicContact CD2-CB 4.1Å; W74-L104 HydrophobicContact CD2-CD1 4.26Å; W74-L104 HydrophobicContact CD2-CD2 4.49Å; W74-L104 HydrophobicContact CE3-CD1 4.47Å; W74-L104 HydrophobicContact CG-CB 4.49Å; W74-L104 HydrophobicContact CG-CD1 4.32Å; W74-L104 HydrophobicContact CG-CD2 4.01Å; W74-L104 HydrophobicContact CH2-CB 4.47Å; W74-L104 HydrophobicContact CZ2-CB 3.93Å; W74-L104 WeakPolarHBondContact CZ2-O 3.46Å; W74-L104 PolarHBondContact NE1-O 3.38Å; W74-L105 HydrophobicContact CH2-CD2 3.85Å; W74-L105 HydrophobicContact CH2-CG 4.31Å; W74-L105 HydrophobicContact CZ2-CD2 4.39Å |
| 75 | E | 94.6 | Very high | 96.1 | Very high | 126 Ų | 126 | 70 Ų | 70 | 59% | 0.589 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -59.4 | -46.3 | -178.4 | -63.4 | -178.8 | -171 | 0 | 0 | 112.8 | H73 T77 M78 S79 F375 | H73-E75 PolarHBondContact O-N 2.95Å; E75-T77 VanDerWaalsContact C-N 3.3Å; E75-T77 PolarHBondContact O-N 3.14Å; E75-M78 PolarHBondContact O-N 2.95Å; E75-S79 WeakPolarHBondContact O-CB 3.41Å; E75-S79 PolarHBondContact O-N 3.32Å; E75-S79 PolarHBondContact O-OG 2.93Å; E75-F375 HydrophobicContact CB-CE2 4.32Å; E75-F375 HydrophobicContact CB-CZ 4.24Å; E75-F375 HydrophobicContact CG-CE2 4.24Å |
| 76 | K | 95.6 | Very high | 96.2 | Very high | 126 Ų | 126 | 66.5 Ų | 66.5 | 55% | 0.548 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.1 | -37.4 | 175.6 | -176.4 | 178.6 | 178.8 | -179.9 | 0 | 111.4 | H73 W74 S79 R80 | H73-K76 PolarHBondContact O-N 3.4Å; W74-K76 PolarHBondContact O-N 3.31Å; K76-S79 WeakPolarHBondContact CA-OG 3.32Å; K76-S79 PolarHBondContact O-OG 3.1Å; K76-R80 WeakPolarHBondContact O-CB 3.49Å; K76-R80 PolarHBondContact O-N 3.09Å; K76-R80 VanDerWaalsContact O-N 3.11Å |
| 77 | T | 96.7 | Very high | 96.3 | Very high | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -70.9 | -42.3 | -179.9 | -62.3 | 0 | 0 | 0 | 0 | 111.4 | M70 H73 W74 E75 R81 Y82 V85 | M70-T77 HydrophobicContact CB-CG2 3.96Å; M70-T77 HydrophobicContact CG-CG2 3.95Å; M70-T77 PolarHBondContact O-OG1 2.96Å; M70-T77 HydrophobicContact SD-CG2 4.39Å; H73-T77 VanDerWaalsContact O-CB 3.24Å; H73-T77 WeakPolarHBondContact O-CB 3.26Å; H73-T77 PolarHBondContact O-N 3.49Å; H73-T77 PolarHBondContact O-OG1 3.45Å; W74-T77 CarbonylContact O-C 3.3Å; W74-T77 PolarHBondContact O-N 2.98Å; E75-T77 VanDerWaalsContact C-N 3.3Å; E75-T77 PolarHBondContact O-N 3.14Å; T77-R81 HydrophobicContact CG2-CB 4.2Å; T77-R81 CarbonylContact O-C 3.15Å; T77-R81 WeakPolarHBondContact O-CA 3.34Å; T77-R81 WeakPolarHBondContact O-CB 3.28Å; T77-R81 PolarHBondContact O-N 3.43Å; T77-R81 PolarHBondContact OG1-NH2 2.91Å; T77-Y82 PolarHBondContact O-N 3.18Å; T77-V85 HydrophobicContact CG2-CG2 3.53Å |
| 78 | M | 96.6 | Very high | 96.3 | Very high | 5 Ų | 5 | 66.5 Ų | 66.5 | 3% | 0.025 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.3 | -45.8 | 176.4 | -74.9 | -59.5 | -72.9 | 0 | 0 | 111.9 | W74 E75 R80 Y82 V85 A371 F375 | W74-M78 HydrophobicContact CD2-CG 3.76Å; W74-M78 HydrophobicContact CE3-CG 4.1Å; W74-M78 HydrophobicContact CG-CG 4.43Å; W74-M78 HydrophobicContact CH2-CG 3.83Å; W74-M78 HydrophobicContact CH2-SD 3.4Å; W74-M78 WeakPolarHBondContact CH2-SD 3.43Å; W74-M78 HydrophobicContact CZ2-CE 4.21Å; W74-M78 HydrophobicContact CZ2-CG 3.45Å; W74-M78 VanDerWaalsContact CZ2-CG 3.45Å; W74-M78 HydrophobicContact CZ2-SD 3.43Å; W74-M78 WeakPolarHBondContact CZ2-SD 3.4Å; W74-M78 HydrophobicContact CZ3-CG 4.13Å; W74-M78 HydrophobicContact CZ3-SD 4Å; W74-M78 PolarHBondContact O-N 3.25Å; E75-M78 PolarHBondContact O-N 2.95Å; M78-R80 PolarHBondContact O-N 3.42Å; M78-Y82 HydrophobicContact CE-CD2 3.76Å; M78-Y82 HydrophobicContact CE-CE2 4.26Å; M78-Y82 WeakPolarHBondContact O-CB 3.42Å; M78-Y82 HydrophobicContact SD-CD2 4Å; M78-V85 HydrophobicContact SD-CG1 4.38Å; M78-V85 HydrophobicContact SD-CG2 4.31Å; M78-A371 HydrophobicContact CE-CB 3.89Å; M78-A371 WeakPolarHBondContact CE-O 3.42Å; M78-F375 HydrophobicContact CB-CD1 3.75Å; M78-F375 HydrophobicContact CB-CD2 3.91Å; M78-F375 HydrophobicContact CB-CE1 3.84Å; M78-F375 HydrophobicContact CB-CE2 4Å; M78-F375 HydrophobicContact CB-CG 3.78Å; M78-F375 HydrophobicContact CB-CZ 3.97Å; M78-F375 HydrophobicContact CE-CB 3.88Å; M78-F375 HydrophobicContact CE-CG 4.35Å; M78-F375 HydrophobicContact CG-CD2 4.2Å; M78-F375 HydrophobicContact CG-CG 4.26Å |
| 79 | S | 94.4 | Very high | 96.3 | Very high | 79 Ų | 79 | 64.6 Ų | 64.6 | 55% | 0.552 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -65.7 | -35.7 | -180 | 54.2 | 0 | 0 | 0 | 0 | 114.3 | E75 K76 | E75-S79 WeakPolarHBondContact O-CB 3.41Å; E75-S79 PolarHBondContact O-N 3.32Å; E75-S79 PolarHBondContact O-OG 2.93Å; K76-S79 WeakPolarHBondContact CA-OG 3.32Å; K76-S79 PolarHBondContact O-OG 3.1Å |
| 80 | R | 95.3 | Very high | 96.3 | Very high | 199 Ų | 199 | 63.7 Ų | 63.7 | 75% | 0.751 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -112.8 | -23.5 | -172.9 | -58.3 | -173.4 | -179.7 | -162.3 | 0.1 | 115 | K76 M78 | K76-R80 WeakPolarHBondContact O-CB 3.49Å; K76-R80 PolarHBondContact O-N 3.09Å; K76-R80 VanDerWaalsContact O-N 3.11Å; M78-R80 PolarHBondContact O-N 3.42Å |
| 81 | R | 95.1 | Very high | 96.2 | Very high | 74 Ų | 74 | 68.3 Ų | 68.3 | 28% | 0.279 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -131 | 21.6 | -168.2 | -56.4 | -170.8 | -66.3 | 177.8 | 3.3 | 112.9 | E69 T77 K83 K84 V85 | E69-R81 IonicContact OE1-CZ 3.57Å; E69-R81 IonicContact OE1-NH1 3.89Å; E69-R81 PolarHBondContact OE1-NH1 3.26Å; E69-R81 VanDerWaalsContact OE1-NH1 3.09Å; E69-R81 IonicContact OE1-NH2 2.77Å; T77-R81 HydrophobicContact CG2-CB 4.2Å; T77-R81 CarbonylContact O-C 3.15Å; T77-R81 WeakPolarHBondContact O-CA 3.34Å; T77-R81 WeakPolarHBondContact O-CB 3.28Å; T77-R81 PolarHBondContact O-N 3.43Å; T77-R81 PolarHBondContact OG1-NH2 2.91Å; R81-K83 VanDerWaalsContact C-N 3.26Å; R81-K83 PolarHBondContact O-N 3.2Å; R81-K84 HydrophobicContact CB-CB 4.33Å; R81-K84 WeakPolarHBondContact O-CA 3.47Å; R81-K84 VanDerWaalsContact O-CB 3.26Å; R81-K84 WeakPolarHBondContact O-CB 3.35Å; R81-K84 PolarHBondContact O-N 3.33Å; R81-V85 PolarHBondContact O-N 3.49Å |
| 82 | Y | 95.9 | Very high | 96.1 | Very high | 26 Ų | 26 | 68.1 Ų | 68.1 | 10% | 0.102 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -53.1 | -39.9 | 179.4 | 171 | -109.8 | 0 | 0 | 0 | 113.5 | T77 M78 K84 V85 K86 S278 A371 Q372 | T77-Y82 PolarHBondContact O-N 3.18Å; M78-Y82 HydrophobicContact CE-CD2 3.76Å; M78-Y82 HydrophobicContact CE-CE2 4.26Å; M78-Y82 WeakPolarHBondContact O-CB 3.42Å; M78-Y82 HydrophobicContact SD-CD2 4Å; Y82-K84 PolarHBondContact O-N 2.98Å; Y82-V85 WeakPolarHBondContact O-CB 3.32Å; Y82-V85 PolarHBondContact O-N 3.39Å; Y82-K86 HydrophobicContact CE1-CB 4.44Å; Y82-K86 HydrophobicContact CE1-CD 4.32Å; Y82-K86 HydrophobicContact CE2-CB 4.42Å; Y82-K86 WeakPolarHBondContact O-CB 3.3Å; Y82-K86 PolarHBondContact O-N 2.94Å; Y82-S278 PolarHBondContact OH-O 3.42Å; Y82-A371 HydrophobicContact CE2-CB 4.34Å; Y82-Q372 HydrophobicContact CD1-CB 3.85Å; Y82-Q372 HydrophobicContact CD1-CG 4.12Å; Y82-Q372 HydrophobicContact CD2-CB 3.84Å; Y82-Q372 HydrophobicContact CE1-CB 3.7Å; Y82-Q372 HydrophobicContact CE1-CG 4.37Å; Y82-Q372 HydrophobicContact CE2-CB 3.7Å; Y82-Q372 HydrophobicContact CG-CB 3.91Å; Y82-Q372 HydrophobicContact CG-CG 4.22Å |
| 83 | K | 96.7 | Very high | 96.1 | Very high | 185 Ų | 185 | 63.1 Ų | 63.1 | 80% | 0.804 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -55.5 | -36.3 | 175.2 | -68.1 | -177.2 | -178.8 | 177 | 0 | 112.5 | R81 M87 | R81-K83 VanDerWaalsContact C-N 3.26Å; R81-K83 PolarHBondContact O-N 3.2Å; K83-M87 WeakPolarHBondContact O-CB 3.4Å; K83-M87 PolarHBondContact O-N 3.09Å; K83-M87 VanDerWaalsContact O-N 3.12Å |
| 84 | K | 96.7 | Very high | 96.2 | Very high | 74 Ų | 74 | 58.9 Ų | 58.9 | 32% | 0.322 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -68.2 | -48.3 | 174.7 | -173.8 | -179.8 | 176.8 | -176.9 | 0 | 110.2 | M70 R81 Y82 K86 M87 Q88 | M70-K84 HydrophobicContact SD-CD 4.26Å; M70-K84 HydrophobicContact SD-CG 4.19Å; R81-K84 HydrophobicContact CB-CB 4.33Å; R81-K84 WeakPolarHBondContact O-CA 3.47Å; R81-K84 VanDerWaalsContact O-CB 3.26Å; R81-K84 WeakPolarHBondContact O-CB 3.35Å; R81-K84 PolarHBondContact O-N 3.33Å; Y82-K84 PolarHBondContact O-N 2.98Å; K84-K86 PolarHBondContact O-N 3.05Å; K84-M87 PolarHBondContact O-N 3.12Å; K84-Q88 WeakPolarHBondContact O-CG 3.5Å; K84-Q88 PolarHBondContact O-N 3.11Å |
| 85 | V | 97.8 | Very high | 96 | Very high | 0 Ų | 0 | 60.8 Ų | 60.8 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -54.2 | -53.4 | 176.8 | 178 | 0 | 0 | 0 | 0 | 110.5 | W67 M70 W74 T77 M78 R81 Y82 M87 Q88 C89 L105 | W67-V85 HydrophobicContact CH2-CG1 4.16Å; W67-V85 HydrophobicContact CZ3-CG1 4.33Å; M70-V85 HydrophobicContact SD-CG2 4.22Å; W74-V85 HydrophobicContact CH2-CG1 3.95Å; W74-V85 HydrophobicContact CZ3-CG1 4.14Å; W74-V85 HydrophobicContact CZ3-CG2 4.23Å; T77-V85 HydrophobicContact CG2-CG2 3.53Å; M78-V85 HydrophobicContact SD-CG1 4.38Å; M78-V85 HydrophobicContact SD-CG2 4.31Å; R81-V85 PolarHBondContact O-N 3.49Å; Y82-V85 WeakPolarHBondContact O-CB 3.32Å; Y82-V85 PolarHBondContact O-N 3.39Å; V85-M87 VanDerWaalsContact C-N 3.3Å; V85-M87 PolarHBondContact O-N 3.18Å; V85-Q88 PolarHBondContact O-N 3.38Å; V85-C89 PolarHBondContact O-N 3.37Å; V85-C89 PolarHBondContact O-SG 3.43Å; V85-L105 HydrophobicContact CG1-CD2 3.96Å |
| 86 | K | 97.4 | Very high | 96 | Very high | 51 Ų | 51 | 58.4 Ų | 58.4 | 22% | 0.222 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -51.9 | -47.7 | 176.3 | 176.3 | 176.6 | 173.1 | 145.9 | 0 | 112.3 | Y82 K84 Q88 C89 R90 E279 | Y82-K86 HydrophobicContact CE1-CB 4.44Å; Y82-K86 HydrophobicContact CE1-CD 4.32Å; Y82-K86 HydrophobicContact CE2-CB 4.42Å; Y82-K86 WeakPolarHBondContact O-CB 3.3Å; Y82-K86 PolarHBondContact O-N 2.94Å; K84-K86 PolarHBondContact O-N 3.05Å; K86-Q88 PolarHBondContact O-N 3.23Å; K86-C89 WeakPolarHBondContact O-CB 3.49Å; K86-C89 PolarHBondContact O-N 2.97Å; K86-R90 WeakPolarHBondContact O-CG 3.41Å; K86-R90 PolarHBondContact O-N 3.18Å; K86-R90 VanDerWaalsContact O-N 3.09Å; K86-E279 HydrophobicContact CD-CG 4.16Å; K86-E279 WeakPolarHBondContact CE-OE2 3.36Å; K86-E279 HydrophobicContact CG-CG 4.07Å; K86-E279 IonicContact NZ-OE2 3.67Å; K86-E279 PolarHBondContact NZ-OE2 2.87Å |
| 87 | M | 97.2 | Very high | 96.1 | Very high | 70 Ų | 70 | 53.4 Ų | 53.4 | 35% | 0.345 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65.5 | -38.8 | 179.5 | -169.1 | -74 | -55.5 | 0 | 0 | 111.9 | K83 K84 V85 R90 K91 | K83-M87 WeakPolarHBondContact O-CB 3.4Å; K83-M87 PolarHBondContact O-N 3.09Å; K83-M87 VanDerWaalsContact O-N 3.12Å; K84-M87 PolarHBondContact O-N 3.12Å; V85-M87 VanDerWaalsContact C-N 3.3Å; V85-M87 PolarHBondContact O-N 3.18Å; M87-R90 PolarHBondContact O-N 3.03Å; M87-K91 HydrophobicContact CE-CD 4.18Å; M87-K91 PolarHBondContact O-N 3.21Å; M87-K91 VanDerWaalsContact O-N 3.14Å; M87-K91 HydrophobicContact SD-CD 3.44Å; M87-K91 WeakPolarHBondContact SD-CD 3.44Å; M87-K91 WeakPolarHBondContact SD-CE 3.23Å; M87-K91 HydrophobicContact SD-CG 3.88Å; M87-K91 PolarHBondContact SD-NZ 2.84Å |
| 88 | Q | 97.3 | Very high | 96.1 | Very high | 14 Ų | 14 | 53.9 Ų | 53.9 | 7% | 0.065 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -66.4 | -38.3 | 174.9 | -61.5 | -59.6 | -22.1 | 0 | 0 | 112 | W67 M70 K84 V85 K86 R90 K91 G92 | W67-Q88 HydrophobicContact CH2-CB 4.08Å; W67-Q88 HydrophobicContact CZ2-CB 3.36Å; M70-Q88 HydrophobicContact CE-CB 4.05Å; M70-Q88 HydrophobicContact CE-CG 3.77Å; M70-Q88 HydrophobicContact SD-CG 4.24Å; K84-Q88 WeakPolarHBondContact O-CG 3.5Å; K84-Q88 PolarHBondContact O-N 3.11Å; V85-Q88 PolarHBondContact O-N 3.38Å; K86-Q88 PolarHBondContact O-N 3.23Å; Q88-R90 VanDerWaalsContact C-N 3.33Å; Q88-R90 PolarHBondContact O-N 2.98Å; Q88-K91 PolarHBondContact O-N 2.93Å; Q88-G92 PolarHBondContact O-N 2.9Å |
| 89 | C | 97.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.5 | -44.4 | 172.5 | -69.2 | 0 | 0 | 0 | 0 | 111.4 | W67 V85 K86 K91 G92 D274 S278 | W67-C89 VanDerWaalsContact CH2-SG 3.56Å; V85-C89 PolarHBondContact O-N 3.37Å; V85-C89 PolarHBondContact O-SG 3.43Å; K86-C89 WeakPolarHBondContact O-CB 3.49Å; K86-C89 PolarHBondContact O-N 2.97Å; C89-K91 VanDerWaalsContact C-N 3.28Å; C89-K91 PolarHBondContact O-N 3.16Å; C89-G92 PolarHBondContact O-N 3.3Å; C89-D274 WeakPolarHBondContact CB-O 3.18Å; C89-S278 VanDerWaalsContact SG-CB 3.54Å; C89-S278 PolarHBondContact SG-OG 2.97Å |
| 90 | R | 96.4 | Very high | 96.3 | Very high | 68 Ų | 68 | 56 Ų | 56 | 26% | 0.257 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.9 | -34.3 | 177.3 | -67.6 | -174.1 | 176.2 | -168 | -11.1 | 113.4 | K86 M87 Q88 G92 R271 E279 H333 | K86-R90 WeakPolarHBondContact O-CG 3.41Å; K86-R90 PolarHBondContact O-N 3.18Å; K86-R90 VanDerWaalsContact O-N 3.09Å; M87-R90 PolarHBondContact O-N 3.03Å; Q88-R90 VanDerWaalsContact C-N 3.33Å; Q88-R90 PolarHBondContact O-N 2.98Å; R90-G92 PolarHBondContact O-N 2.86Å; R90-R271 PolarHBondContact O-NH2 2.75Å; R90-E279 IonicContact CZ-OE1 2.8Å; R90-E279 VanDerWaalsContact CZ-OE1 3.27Å; R90-E279 IonicContact CZ-OE2 3.22Å; R90-E279 IonicContact NE-OE1 2.91Å; R90-E279 PolarHBondContact NE-OE1 3.45Å; R90-E279 IonicContact NE-OE2 3.91Å; R90-E279 VanDerWaalsContact NH2-CD 3.32Å; R90-E279 IonicContact NH2-OE1 3.55Å; R90-E279 PolarHBondContact NH2-OE1 2.98Å; R90-E279 IonicContact NH2-OE2 2.75Å; R90-E279 PolarHBondContact NH2-OE2 3.49Å; R90-H333 VanDerWaalsContact CG-CE1 3.41Å; R90-H333 WeakPolarHBondContact CG-CE1 3.5Å; R90-H333 PolarHBondContact O-NE2 3.16Å |
| 91 | K | 94.3 | Very high | 96.5 | Very high | 96 Ų | 96 | 46.7 Ų | 46.7 | 42% | 0.417 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -9.6 | 174 | -74.4 | -176.2 | 169.9 | 172.4 | 0 | 114 | R63 M87 Q88 C89 R271 | R63-K91 PolarHBondContact NH1-O 3.4Å; M87-K91 HydrophobicContact CE-CD 4.18Å; M87-K91 PolarHBondContact O-N 3.21Å; M87-K91 VanDerWaalsContact O-N 3.14Å; M87-K91 HydrophobicContact SD-CD 3.44Å; M87-K91 WeakPolarHBondContact SD-CD 3.44Å; M87-K91 WeakPolarHBondContact SD-CE 3.23Å; M87-K91 HydrophobicContact SD-CG 3.88Å; M87-K91 PolarHBondContact SD-NZ 2.84Å; Q88-K91 PolarHBondContact O-N 2.93Å; C89-K91 VanDerWaalsContact C-N 3.28Å; C89-K91 PolarHBondContact O-N 3.16Å; K91-R271 VanDerWaalsContact C-CZ 3.49Å; K91-R271 VanDerWaalsContact O-CZ 3.27Å; K91-R271 PolarHBondContact O-NH2 3.02Å |
| 92 | G | 95.6 | Very high | 96.6 | Very high | 6 Ų | 6 | 43.1 Ų | 43.1 | 6% | 0.062 | 22% | 0.217 | C | C | . | . | trans | 91.4 | 135.1 | -176 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q88 C89 R90 | Q88-G92 PolarHBondContact O-N 2.9Å; C89-G92 PolarHBondContact O-N 3.3Å; R90-G92 PolarHBondContact O-N 2.86Å | ||
| 93 | I | 97.2 | Very high | 96.8 | Very high | 4 Ų | 4 | 42.2 Ų | 42.2 | 2% | 0.021 | 22% | 0.215 | C | C | . | . | trans | -82.4 | 130.8 | 172.6 | -55.2 | -178.9 | 0 | 0 | 0 | 107.5 | W67 S95 L97 R98 C101 L105 D274 | W67-I93 HydrophobicContact CH2-CD1 4.17Å; W67-I93 HydrophobicContact CH2-CG1 4.2Å; W67-I93 HydrophobicContact CZ2-CD1 4.1Å; W67-I93 HydrophobicContact CZ2-CG1 3.62Å; I93-S95 PolarHBondContact O-N 3.14Å; I93-L97 HydrophobicContact CG2-CB 4.16Å; I93-R98 HydrophobicContact CB-CG 4.18Å; I93-R98 HydrophobicContact CG2-CG 4.02Å; I93-R98 VanDerWaalsContact O-CZ 3.32Å; I93-R98 PolarHBondContact O-NH2 3.23Å; I93-R98 VanDerWaalsContact O-NH2 3.07Å; I93-C101 HydrophobicContact CD1-CB 3.85Å; I93-C101 HydrophobicContact CG2-CB 4.14Å; I93-L105 HydrophobicContact CD1-CD1 3.77Å; I93-D274 HydrophobicContact CD1-CB 4.12Å; I93-D274 HydrophobicContact CG1-CB 3.99Å; I93-D274 PolarHBondContact N-OD2 3.31Å | ||
| 94 | P | 95.7 | Very high | 96.8 | Very high | 15 Ų | 15 | 34.8 Ų | 34.8 | 10% | 0.097 | 18% | 0.183 | C | C | . | . | trans | -54.2 | 140.6 | 171.7 | -25.6 | 35.1 | 0 | 0 | 0 | 111.1 | R63 E64 A96 L97 R98 | R63-P94 HydrophobicContact CB-CG 3.92Å; E64-P94 HydrophobicContact CG-CB 3.48Å; E64-P94 VanDerWaalsContact CG-CB 3.48Å; E64-P94 HydrophobicContact CG-CG 3.66Å; P94-A96 VanDerWaalsContact C-N 3.26Å; P94-A96 PolarHBondContact O-N 3.28Å; P94-L97 PolarHBondContact O-N 3.46Å; P94-R98 PolarHBondContact O-N 2.92Å | ||
| 95 | S | 92.4 | Very high | 96.9 | Very high | 59 Ų | 59 | 31.3 Ų | 31.3 | 41% | 0.413 | 17% | 0.168 | S | C | . | . | G | 310 helix | trans | -53.4 | -45.4 | -173 | -153.9 | 0 | 0 | 0 | 0 | 112.3 | I93 L97 R98 | I93-S95 PolarHBondContact O-N 3.14Å; S95-L97 PolarHBondContact O-N 3.13Å; S95-R98 PolarHBondContact O-N 3.01Å |
| 96 | A | 93.8 | Very high | 96.9 | Very high | 75 Ų | 75 | 31.3 Ų | 31.3 | 62% | 0.62 | 17% | 0.168 | S | C | * | . | G | 310 helix | trans | -60.7 | -16.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | P94 | P94-A96 VanDerWaalsContact C-N 3.26Å; P94-A96 PolarHBondContact O-N 3.28Å |
| 97 | L | 97.5 | Very high | 96.9 | Very high | 22 Ų | 22 | 28.9 Ų | 28.9 | 12% | 0.115 | 16% | 0.158 | C | C | . | . | G | 310 helix | trans | -109.3 | -2.7 | -176.5 | -64.2 | -174.4 | 0 | 0 | 0 | 114.2 | E64 W67 V68 I93 P94 S95 A99 R100 C101 | E64-L97 HydrophobicContact CB-CD1 3.92Å; E64-L97 HydrophobicContact CG-CD1 4.09Å; E64-L97 HydrophobicContact CG-CG 4.42Å; E64-L97 VanDerWaalsContact O-CD1 3.3Å; E64-L97 WeakPolarHBondContact O-CD1 3.44Å; W67-L97 HydrophobicContact CB-CD1 3.31Å; W67-L97 HydrophobicContact CG-CD1 4.23Å; V68-L97 HydrophobicContact CG2-CD1 4.14Å; V68-L97 HydrophobicContact CG2-CD2 4.13Å; I93-L97 HydrophobicContact CG2-CB 4.16Å; P94-L97 PolarHBondContact O-N 3.46Å; S95-L97 PolarHBondContact O-N 3.13Å; L97-A99 VanDerWaalsContact C-N 3.31Å; L97-A99 PolarHBondContact O-N 2.91Å; L97-R100 PolarHBondContact O-N 3.05Å; L97-C101 WeakPolarHBondContact O-CB 3.22Å; L97-C101 PolarHBondContact O-N 3.16Å; L97-C101 PolarHBondContact O-SG 3.18Å |
| 98 | R | 97.9 | Very high | 97 | Very high | 10 Ų | 10 | 25.6 Ų | 25.6 | 4% | 0.038 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.4 | -41.3 | 176.5 | -74 | -177.3 | 174.6 | 110.9 | 6 | 112.2 | I93 P94 S95 R100 C101 W102 L270 D274 | I93-R98 HydrophobicContact CB-CG 4.18Å; I93-R98 HydrophobicContact CG2-CG 4.02Å; I93-R98 VanDerWaalsContact O-CZ 3.32Å; I93-R98 PolarHBondContact O-NH2 3.23Å; I93-R98 VanDerWaalsContact O-NH2 3.07Å; P94-R98 PolarHBondContact O-N 2.92Å; S95-R98 PolarHBondContact O-N 3.01Å; R98-R100 PolarHBondContact O-N 3.2Å; R98-C101 PolarHBondContact O-N 3.41Å; R98-C101 VanDerWaalsContact O-N 3.09Å; R98-W102 HydrophobicContact CB-CD2 4.15Å; R98-W102 HydrophobicContact CB-CG 4.46Å; R98-W102 HydrophobicContact CB-CZ2 4.38Å; R98-W102 VanDerWaalsContact CD-CZ2 3.48Å; R98-W102 HydrophobicContact CG-CZ2 4.15Å; R98-W102 WeakPolarHBondContact O-CB 3.47Å; R98-W102 PolarHBondContact O-N 3.46Å; R98-L270 VanDerWaalsContact NH1-CD1 3.33Å; R98-D274 IonicContact CZ-OD2 3.02Å; R98-D274 IonicContact NE-OD1 3.06Å; R98-D274 PolarHBondContact NE-OD1 3.46Å; R98-D274 IonicContact NE-OD2 3.46Å; R98-D274 IonicContact NH2-OD2 3.98Å; R98-D274 PolarHBondContact NH2-OD2 2.92Å |
| 99 | A | 97.3 | Very high | 96.9 | Very high | 37 Ų | 37 | 27.7 Ų | 27.7 | 31% | 0.306 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -51.6 | -41.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | L97 P103 H190 L191 | L97-A99 VanDerWaalsContact C-N 3.31Å; L97-A99 PolarHBondContact O-N 2.91Å; A99-P103 WeakPolarHBondContact O-CD 3.26Å; A99-P103 WeakPolarHBondContact O-CG 3.29Å; A99-H190 WeakPolarHBondContact CB-O 3.44Å; A99-L191 HydrophobicContact CB-CD2 4.29Å; A99-L191 VanDerWaalsContact O-CD2 3.31Å; A99-L191 WeakPolarHBondContact O-CD2 3.09Å |
| 100 | R | 97.2 | Very high | 96.9 | Very high | 92 Ų | 92 | 29.3 Ų | 29.3 | 35% | 0.347 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -79.7 | -39.4 | 177.7 | -173.5 | 174.3 | -175 | 178.5 | -3.3 | 113.4 | T71 L97 R98 L104 | T71-R100 HydrophobicContact CG2-CG 4.42Å; T71-R100 PolarHBondContact OG1-NE 2.73Å; T71-R100 PolarHBondContact OG1-NH2 2.81Å; L97-R100 PolarHBondContact O-N 3.05Å; R98-R100 PolarHBondContact O-N 3.2Å; R100-L104 HydrophobicContact CG-CD1 4.41Å; R100-L104 WeakPolarHBondContact O-CD1 3.46Å; R100-L104 VanDerWaalsContact O-CG 3.32Å; R100-L104 WeakPolarHBondContact O-CG 3.43Å |
| 101 | C | 98.4 | Very high | 96.8 | Very high | 2 Ų | 2 | 27.4 Ų | 27.4 | 1% | 0.014 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -83.9 | -39.4 | -168 | -64.5 | 0 | 0 | 0 | 0 | 113 | I93 L97 R98 L104 L105 | I93-C101 HydrophobicContact CD1-CB 3.85Å; I93-C101 HydrophobicContact CG2-CB 4.14Å; L97-C101 WeakPolarHBondContact O-CB 3.22Å; L97-C101 PolarHBondContact O-N 3.16Å; L97-C101 PolarHBondContact O-SG 3.18Å; R98-C101 PolarHBondContact O-N 3.41Å; R98-C101 VanDerWaalsContact O-N 3.09Å; C101-L104 WeakPolarHBondContact O-CB 3.38Å; C101-L104 PolarHBondContact O-N 3.02Å; C101-L105 HydrophobicContact CB-CD1 4.41Å; C101-L105 WeakPolarHBondContact O-CB 3.41Å; C101-L105 VanDerWaalsContact O-CG 3.28Å; C101-L105 WeakPolarHBondContact O-CG 3.46Å; C101-L105 PolarHBondContact O-N 3.02Å |
| 102 | W | 98.7 | Very high | 96.9 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.1 | -47.9 | -175.6 | -71.4 | -2.3 | 0 | 0 | 0 | 112.6 | R98 L104 L105 C106 V186 L187 H190 L191 L270 W273 D274 L277 | R98-W102 HydrophobicContact CB-CD2 4.15Å; R98-W102 HydrophobicContact CB-CG 4.46Å; R98-W102 HydrophobicContact CB-CZ2 4.38Å; R98-W102 VanDerWaalsContact CD-CZ2 3.48Å; R98-W102 HydrophobicContact CG-CZ2 4.15Å; R98-W102 WeakPolarHBondContact O-CB 3.47Å; R98-W102 PolarHBondContact O-N 3.46Å; W102-L104 PolarHBondContact O-N 2.95Å; W102-L105 PolarHBondContact O-N 3.27Å; W102-L105 VanDerWaalsContact O-N 3.16Å; W102-C106 PolarHBondContact O-N 3.45Å; W102-C106 PolarHBondContact O-SG 3.17Å; W102-V186 HydrophobicContact CH2-CG1 4.19Å; W102-V186 HydrophobicContact CZ3-CG1 4.46Å; W102-L187 HydrophobicContact CE3-CD2 4.15Å; W102-L187 HydrophobicContact CZ3-CD2 4.32Å; W102-H190 HydrophobicContact CE3-CB 4.42Å; W102-H190 AromaticContact CH2-ND1 3.95Å; W102-H190 HydrophobicContact CZ3-CB 4.02Å; W102-H190 AromaticContact CZ3-CG 3.95Å; W102-H190 AromaticContact CZ3-ND1 3.92Å; W102-L191 HydrophobicContact CE3-CD1 4.33Å; W102-L270 HydrophobicContact CH2-CD2 3.89Å; W102-L270 HydrophobicContact CZ2-CD2 4.23Å; W102-W273 AromaticContact CH2-CE3 3.81Å; W102-W273 HydrophobicContact CH2-CE3 3.81Å; W102-W273 HydrophobicContact CH2-CZ3 4.46Å; W102-W273 HydrophobicContact CZ2-CB 4Å; W102-W273 HydrophobicContact CZ2-CE3 4.28Å; W102-W273 AromaticContact CZ3-CE3 3.97Å; W102-W273 HydrophobicContact CZ3-CE3 3.97Å; W102-W273 HydrophobicContact CZ3-CZ3 4.27Å; W102-D274 PolarHBondContact NE1-OD1 2.96Å; W102-L277 HydrophobicContact CB-CD1 3.74Å; W102-L277 HydrophobicContact CD2-CD1 3.98Å; W102-L277 HydrophobicContact CG-CD1 3.5Å |
| 103 | P | 98.6 | Very high | 96.9 | Very high | 7 Ų | 7 | 33 Ų | 33 | 5% | 0.045 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63 | -29.1 | 176.7 | -23 | 34.7 | 0 | 0 | 0 | 113.8 | A99 G107 A108 H109 L191 E195 | A99-P103 WeakPolarHBondContact O-CD 3.26Å; A99-P103 WeakPolarHBondContact O-CG 3.29Å; P103-G107 CarbonylContact O-C 2.99Å; P103-G107 PolarHBondContact O-N 3.29Å; P103-A108 HydrophobicContact CB-CB 4.23Å; P103-A108 PolarHBondContact O-N 3.5Å; P103-H109 HydrophobicContact CB-CB 4.46Å; P103-H109 PolarHBondContact O-N 2.95Å; P103-H109 PolarHBondContact O-ND1 3.48Å; P103-L191 HydrophobicContact CG-CD2 3.73Å; P103-E195 HydrophobicContact CG-CB 4.44Å |
| 104 | L | 98.3 | Very high | 96.8 | Very high | 28 Ų | 28 | 36.8 Ų | 36.8 | 15% | 0.147 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -72 | -44.2 | 174.2 | -70.5 | 177.2 | 0 | 0 | 0 | 111.9 | T71 W74 R100 C101 W102 | T71-L104 HydrophobicContact CG2-CD1 3.66Å; W74-L104 HydrophobicContact CB-CD2 4.48Å; W74-L104 HydrophobicContact CD2-CB 4.1Å; W74-L104 HydrophobicContact CD2-CD1 4.26Å; W74-L104 HydrophobicContact CD2-CD2 4.49Å; W74-L104 HydrophobicContact CE3-CD1 4.47Å; W74-L104 HydrophobicContact CG-CB 4.49Å; W74-L104 HydrophobicContact CG-CD1 4.32Å; W74-L104 HydrophobicContact CG-CD2 4.01Å; W74-L104 HydrophobicContact CH2-CB 4.47Å; W74-L104 HydrophobicContact CZ2-CB 3.93Å; W74-L104 WeakPolarHBondContact CZ2-O 3.46Å; W74-L104 PolarHBondContact NE1-O 3.38Å; R100-L104 HydrophobicContact CG-CD1 4.41Å; R100-L104 WeakPolarHBondContact O-CD1 3.46Å; R100-L104 VanDerWaalsContact O-CG 3.32Å; R100-L104 WeakPolarHBondContact O-CG 3.43Å; C101-L104 WeakPolarHBondContact O-CB 3.38Å; C101-L104 PolarHBondContact O-N 3.02Å; W102-L104 PolarHBondContact O-N 2.95Å |
| 105 | L | 98.5 | Very high | 96.8 | Very high | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.005 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.5 | -45.9 | -179.3 | -75.1 | 165.8 | 0 | 0 | 0 | 112.3 | W74 V85 I93 C101 W102 G107 L277 A371 | W74-L105 HydrophobicContact CH2-CD2 3.85Å; W74-L105 HydrophobicContact CH2-CG 4.31Å; W74-L105 HydrophobicContact CZ2-CD2 4.39Å; V85-L105 HydrophobicContact CG1-CD2 3.96Å; I93-L105 HydrophobicContact CD1-CD1 3.77Å; C101-L105 HydrophobicContact CB-CD1 4.41Å; C101-L105 WeakPolarHBondContact O-CB 3.41Å; C101-L105 VanDerWaalsContact O-CG 3.28Å; C101-L105 WeakPolarHBondContact O-CG 3.46Å; C101-L105 PolarHBondContact O-N 3.02Å; W102-L105 PolarHBondContact O-N 3.27Å; W102-L105 VanDerWaalsContact O-N 3.16Å; L105-G107 VanDerWaalsContact C-N 3.3Å; L105-L277 HydrophobicContact CB-CB 4.05Å; L105-L277 HydrophobicContact CD1-CB 4.41Å; L105-A371 HydrophobicContact CB-CB 4.38Å; L105-A371 HydrophobicContact CD2-CB 3.83Å; L105-A371 VanDerWaalsContact O-CA 3.29Å; L105-A371 WeakPolarHBondContact O-CA 3.27Å; L105-A371 WeakPolarHBondContact O-CB 3.45Å |
| 106 | C | 98 | Very high | 97 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -82.9 | -7.8 | -179.9 | 73.4 | 0 | 0 | 0 | 0 | 113.3 | W102 A108 C199 Q202 Y207 L277 | W102-C106 PolarHBondContact O-N 3.45Å; W102-C106 PolarHBondContact O-SG 3.17Å; C106-A108 VanDerWaalsContact C-N 3.29Å; C106-A108 PolarHBondContact O-N 3.22Å; C106-A108 WeakPolarHBondContact SG-CB 3.4Å; C106-C199 VanDerWaalsContact SG-SG 3.62Å; C106-Q202 HydrophobicContact CB-CB 4.06Å; C106-Q202 HydrophobicContact CB-CG 4.48Å; C106-Q202 VanDerWaalsContact O-CG 3.26Å; C106-Q202 WeakPolarHBondContact O-CG 3.49Å; C106-Q202 PolarHBondContact O-OE1 3.09Å; C106-Y207 HydrophobicContact CB-CE2 3.89Å; C106-L277 HydrophobicContact CB-CD2 4.08Å |
| 107 | G | 97.4 | Very high | 97.1 | Very high | 1 Ų | 1 | 37.5 Ų | 37.5 | 1% | 0.01 | 20% | 0.203 | C | C | . | . | S | Bend | trans | 78.6 | 7.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | P103 L105 H109 V110 Q378 | P103-G107 CarbonylContact O-C 2.99Å; P103-G107 PolarHBondContact O-N 3.29Å; L105-G107 VanDerWaalsContact C-N 3.3Å; G107-H109 PolarHBondContact O-N 3.09Å; G107-V110 PolarHBondContact O-N 3.42Å; G107-V110 VanDerWaalsContact O-N 3.09Å; G107-Q378 PolarHBondContact O-NE2 3.46Å |
| 108 | A | 97.9 | Very high | 97.2 | Very high | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.008 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -55.9 | -37.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | P103 C106 V110 C111 Q112 W198 Q202 | P103-A108 HydrophobicContact CB-CB 4.23Å; P103-A108 PolarHBondContact O-N 3.5Å; C106-A108 VanDerWaalsContact C-N 3.29Å; C106-A108 PolarHBondContact O-N 3.22Å; C106-A108 WeakPolarHBondContact SG-CB 3.4Å; A108-V110 PolarHBondContact O-N 3.46Å; A108-C111 WeakPolarHBondContact O-CB 3.28Å; A108-C111 PolarHBondContact O-N 3.16Å; A108-Q112 PolarHBondContact O-N 3.32Å; A108-W198 HydrophobicContact CB-CB 3.72Å; A108-Q202 HydrophobicContact CB-CG 4.17Å |
| 109 | H | 96.6 | Very high | 97.2 | Very high | 58 Ų | 58 | 38.1 Ų | 38.1 | 27% | 0.269 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -58.2 | -32.3 | 177.7 | 73 | -71.7 | 0 | 0 | 0 | 113.4 | P103 G107 K113 | P103-H109 HydrophobicContact CB-CB 4.46Å; P103-H109 PolarHBondContact O-N 2.95Å; P103-H109 PolarHBondContact O-ND1 3.48Å; G107-H109 PolarHBondContact O-N 3.09Å; H109-K113 VanDerWaalsContact O-CB 3.32Å; H109-K113 WeakPolarHBondContact O-CB 3.45Å; H109-K113 PolarHBondContact O-N 3.25Å |
| 110 | V | 96.2 | Very high | 97.2 | Very high | 33 Ų | 33 | 41.9 Ų | 41.9 | 20% | 0.2 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -74.1 | -37.4 | 176.3 | 177.8 | 0 | 0 | 0 | 0 | 110.7 | G107 A108 K113 N114 Q378 | G107-V110 PolarHBondContact O-N 3.42Å; G107-V110 VanDerWaalsContact O-N 3.09Å; A108-V110 PolarHBondContact O-N 3.46Å; V110-K113 PolarHBondContact O-N 3.26Å; V110-N114 WeakPolarHBondContact CG1-ND2 3.44Å; V110-N114 VanDerWaalsContact O-CB 3.26Å; V110-N114 WeakPolarHBondContact O-CB 3.38Å; V110-N114 PolarHBondContact O-N 3.06Å; V110-N114 PolarHBondContact O-ND2 3.31Å; V110-Q378 HydrophobicContact CG1-CG 4.31Å |
| 111 | C | 96.1 | Very high | 97.3 | Very high | 28 Ų | 28 | 43.7 Ų | 43.7 | 19% | 0.189 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.3 | -50.5 | 174.4 | -69.6 | 0 | 0 | 0 | 0 | 111 | A108 K113 N114 S115 W198 Q202 | A108-C111 WeakPolarHBondContact O-CB 3.28Å; A108-C111 PolarHBondContact O-N 3.16Å; C111-K113 VanDerWaalsContact C-N 3.34Å; C111-K113 PolarHBondContact O-N 2.98Å; C111-N114 PolarHBondContact O-N 3.46Å; C111-N114 VanDerWaalsContact O-N 3.11Å; C111-S115 WeakPolarHBondContact O-CB 3.22Å; C111-S115 PolarHBondContact O-N 2.89Å; C111-W198 HydrophobicContact CB-CD2 3.91Å; C111-W198 HydrophobicContact CB-CE3 3.47Å; C111-W198 VanDerWaalsContact CB-CE3 3.47Å; C111-W198 HydrophobicContact CB-CH2 4.48Å; C111-W198 HydrophobicContact CB-CZ3 3.8Å; C111-Q202 PolarHBondContact SG-NE2 3.17Å |
| 112 | Q | 96.1 | Very high | 97.2 | Very high | 47 Ų | 47 | 44.9 Ų | 44.9 | 22% | 0.22 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -55.8 | -48.3 | 176.1 | -169.9 | -179.6 | 2.8 | 0 | 0 | 111.7 | A108 N114 S115 E194 W198 | A108-Q112 PolarHBondContact O-N 3.32Å; Q112-N114 VanDerWaalsContact C-N 3.29Å; Q112-N114 PolarHBondContact O-N 3.14Å; Q112-S115 CarbonylContact O-C 3.11Å; Q112-S115 VanDerWaalsContact O-C 3.29Å; Q112-S115 PolarHBondContact O-N 2.89Å; Q112-E194 HydrophobicContact CG-CG 4.24Å; Q112-E194 PolarHBondContact NE2-OE2 3.25Å; Q112-W198 HydrophobicContact CB-CG 4.14Å |
| 113 | K | 95.8 | Very high | 97.1 | Very high | 174 Ų | 174 | 45.7 Ų | 45.7 | 76% | 0.757 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -61.2 | -36.1 | 178 | -177.7 | 178.6 | 177 | -178.4 | 0 | 113.1 | H109 V110 C111 S115 | H109-K113 VanDerWaalsContact O-CB 3.32Å; H109-K113 WeakPolarHBondContact O-CB 3.45Å; H109-K113 PolarHBondContact O-N 3.25Å; V110-K113 PolarHBondContact O-N 3.26Å; C111-K113 VanDerWaalsContact C-N 3.34Å; C111-K113 PolarHBondContact O-N 2.98Å; K113-S115 VanDerWaalsContact C-N 3.35Å |
| 114 | N | 95.2 | Very high | 97 | Very high | 83 Ų | 83 | 53.1 Ų | 53.1 | 44% | 0.444 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -84.3 | -11.5 | -178.1 | -72.3 | -23.5 | 0 | 0 | 0 | 113.5 | V110 C111 Q112 | V110-N114 WeakPolarHBondContact CG1-ND2 3.44Å; V110-N114 VanDerWaalsContact O-CB 3.26Å; V110-N114 WeakPolarHBondContact O-CB 3.38Å; V110-N114 PolarHBondContact O-N 3.06Å; V110-N114 PolarHBondContact O-ND2 3.31Å; C111-N114 PolarHBondContact O-N 3.46Å; C111-N114 VanDerWaalsContact O-N 3.11Å; Q112-N114 VanDerWaalsContact C-N 3.29Å; Q112-N114 PolarHBondContact O-N 3.14Å |
| 115 | S | 95.3 | Very high | 97 | Very high | 40 Ų | 40 | 53.4 Ų | 53.4 | 28% | 0.28 | 29% | 0.285 | S | S | . | . | S | Bend | trans | -138.3 | 59.8 | -176.7 | -63 | 0 | 0 | 0 | 0 | 110 | C111 Q112 K113 T118 | C111-S115 WeakPolarHBondContact O-CB 3.22Å; C111-S115 PolarHBondContact O-N 2.89Å; Q112-S115 CarbonylContact O-C 3.11Å; Q112-S115 VanDerWaalsContact O-C 3.29Å; Q112-S115 PolarHBondContact O-N 2.89Å; K113-S115 VanDerWaalsContact C-N 3.35Å; S115-T118 WeakPolarHBondContact O-CB 3.34Å; S115-T118 PolarHBondContact O-N 3.2Å; S115-T118 PolarHBondContact O-OG1 2.9Å |
| 116 | P | 96.2 | Very high | 96.9 | Very high | 102 Ų | 102 | 59 Ų | 59 | 66% | 0.662 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | 140 | -178.8 | 28.9 | -35.3 | 0 | 0 | 0 | 110.6 | T118 | P116-T118 PolarHBondContact O-N 3.45Š|
| 117 | G | 96.8 | Very high | 96.9 | Very high | 21 Ų | 21 | 59.8 Ų | 59.8 | 22% | 0.216 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 80.2 | -15.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115 | Y119 Q120 E121 | G117-Y119 VanDerWaalsContact C-N 3.34Å; G117-Y119 PolarHBondContact O-N 3.09Å; G117-Q120 PolarHBondContact O-N 3.22Å; G117-E121 WeakPolarHBondContact O-CG 3.29Å; G117-E121 PolarHBondContact O-N 3.44Å |
| 118 | T | 98.2 | Very high | 96.8 | Very high | 30 Ų | 30 | 63.2 Ų | 63.2 | 18% | 0.184 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57.8 | -41.8 | -176.3 | -61.2 | 0 | 0 | 0 | 0 | 113.1 | S115 P116 L122 Y170 W198 | S115-T118 WeakPolarHBondContact O-CB 3.34Å; S115-T118 PolarHBondContact O-N 3.2Å; S115-T118 PolarHBondContact O-OG1 2.9Å; P116-T118 PolarHBondContact O-N 3.45Å; T118-L122 HydrophobicContact CG2-CD1 3.77Å; T118-L122 HydrophobicContact CG2-CG 4.4Å; T118-L122 WeakPolarHBondContact O-CB 3.14Å; T118-L122 WeakPolarHBondContact O-CD1 3.42Å; T118-L122 WeakPolarHBondContact O-CG 3.46Å; T118-L122 PolarHBondContact O-N 3.1Å; T118-Y170 HydrophobicContact CG2-CD2 4.49Å; T118-Y170 HydrophobicContact CG2-CE2 4.45Å; T118-W198 HydrophobicContact CG2-CH2 4.28Å; T118-W198 HydrophobicContact CG2-CZ2 4.27Å |
| 119 | Y | 98.2 | Very high | 96.7 | Very high | 15 Ų | 15 | 68.1 Ų | 68.1 | 6% | 0.059 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 177.2 | 172.4 | -103.9 | 0 | 0 | 0 | 112.1 | G117 L122 A123 V163 A166 P193 E194 F197 | G117-Y119 VanDerWaalsContact C-N 3.34Å; G117-Y119 PolarHBondContact O-N 3.09Å; Y119-L122 PolarHBondContact O-N 2.87Å; Y119-A123 HydrophobicContact CE1-CB 4.17Å; Y119-A123 HydrophobicContact CE2-CB 4.33Å; Y119-A123 WeakPolarHBondContact O-CB 3.45Å; Y119-A123 PolarHBondContact O-N 3.18Å; Y119-V163 HydrophobicContact CE2-CG2 4.3Å; Y119-A166 HydrophobicContact CD2-CB 4.02Å; Y119-A166 HydrophobicContact CE2-CB 3.89Å; Y119-P193 HydrophobicContact CE1-CB 3.98Å; Y119-P193 VanDerWaalsContact OH-CB 3.24Å; Y119-P193 WeakPolarHBondContact OH-CB 3.31Å; Y119-E194 HydrophobicContact CD1-CB 3.54Å; Y119-E194 HydrophobicContact CD1-CG 4Å; Y119-E194 HydrophobicContact CE1-CB 4.16Å; Y119-E194 HydrophobicContact CG-CB 3.94Å; Y119-E194 HydrophobicContact CG-CG 3.99Å; Y119-F197 HydrophobicContact CD2-CB 3.48Å; Y119-F197 VanDerWaalsContact CD2-CB 3.48Å; Y119-F197 AromaticContact CD2-CD1 3.7Å; Y119-F197 HydrophobicContact CD2-CD1 3.7Å; Y119-F197 AromaticContact CD2-CD2 3.99Å; Y119-F197 HydrophobicContact CD2-CD2 3.99Å; Y119-F197 HydrophobicContact CD2-CE1 4.43Å; Y119-F197 AromaticContact CD2-CG 3.44Å; Y119-F197 HydrophobicContact CD2-CG 3.44Å; Y119-F197 VanDerWaalsContact CD2-CG 3.44Å; Y119-F197 HydrophobicContact CE2-CB 3.7Å; Y119-F197 HydrophobicContact CE2-CD2 4.4Å; Y119-F197 HydrophobicContact CE2-CG 4.03Å; Y119-F197 HydrophobicContact CG-CB 4.38Å; Y119-F197 HydrophobicContact CG-CD1 4.24Å; Y119-F197 HydrophobicContact CG-CG 4.37Å |
| 120 | Q | 97.9 | Very high | 96.7 | Very high | 117 Ų | 117 | 70.9 Ų | 70.9 | 55% | 0.547 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62 | -47.1 | 178.9 | -79 | 166.3 | -32.5 | 0 | 0 | 110.9 | G117 L122 A123 E124 | G117-Q120 PolarHBondContact O-N 3.22Å; Q120-L122 VanDerWaalsContact C-N 3.33Å; Q120-L122 PolarHBondContact O-N 2.99Å; Q120-A123 PolarHBondContact O-N 3.19Å; Q120-E124 WeakPolarHBondContact O-CB 3.3Å; Q120-E124 WeakPolarHBondContact O-CG 3.48Å; Q120-E124 PolarHBondContact O-N 3.39Å |
| 121 | E | 98.3 | Very high | 96.7 | Very high | 129 Ų | 129 | 72.1 Ų | 72.1 | 60% | 0.603 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -56.2 | -46.3 | 175.9 | -69.3 | 171.3 | -176.8 | 0 | 0 | 111.8 | G117 E124 A125 | G117-E121 WeakPolarHBondContact O-CG 3.29Å; G117-E121 PolarHBondContact O-N 3.44Å; E121-E124 PolarHBondContact O-N 3.02Å; E121-A125 VanDerWaalsContact O-CB 3.26Å; E121-A125 WeakPolarHBondContact O-CB 3.39Å; E121-A125 PolarHBondContact O-N 2.85Å |
| 122 | L | 98.3 | Very high | 96.8 | Very high | 28 Ų | 28 | 73.8 Ų | 73.8 | 15% | 0.147 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -70 | -36.1 | 178.4 | -65.1 | 166.8 | 0 | 0 | 0 | 112.8 | T118 Y119 Q120 E124 K165 A166 L169 Y170 F197 | T118-L122 HydrophobicContact CG2-CD1 3.77Å; T118-L122 HydrophobicContact CG2-CG 4.4Å; T118-L122 WeakPolarHBondContact O-CB 3.14Å; T118-L122 WeakPolarHBondContact O-CD1 3.42Å; T118-L122 WeakPolarHBondContact O-CG 3.46Å; T118-L122 PolarHBondContact O-N 3.1Å; Y119-L122 PolarHBondContact O-N 2.87Å; Q120-L122 VanDerWaalsContact C-N 3.33Å; Q120-L122 PolarHBondContact O-N 2.99Å; L122-E124 VanDerWaalsContact C-N 3.31Å; L122-K165 WeakPolarHBondContact O-CE 3.4Å; L122-A166 HydrophobicContact CB-CB 3.83Å; L122-L169 HydrophobicContact CD2-CB 3.69Å; L122-L169 WeakPolarHBondContact O-CD1 3.4Å; L122-Y170 HydrophobicContact CD1-CD2 3.96Å; L122-Y170 HydrophobicContact CD1-CG 4.39Å; L122-F197 HydrophobicContact CD1-CE1 4.42Å; L122-F197 HydrophobicContact CD1-CE2 4.26Å; L122-F197 HydrophobicContact CD1-CZ 3.7Å |
| 123 | A | 96 | Very high | 96.8 | Very high | 17 Ų | 17 | 77.6 Ų | 77.6 | 14% | 0.14 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -70.3 | -28.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y119 Q120 K165 | Y119-A123 HydrophobicContact CE1-CB 4.17Å; Y119-A123 HydrophobicContact CE2-CB 4.33Å; Y119-A123 WeakPolarHBondContact O-CB 3.45Å; Y119-A123 PolarHBondContact O-N 3.18Å; Q120-A123 PolarHBondContact O-N 3.19Å; A123-K165 PolarHBondContact O-NZ 3.25Å |
| 124 | E | 96.8 | Very high | 96.8 | Very high | 162 Ų | 162 | 71.4 Ų | 71.4 | 76% | 0.757 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -87.1 | -30.3 | 175.3 | -70.7 | 174.7 | -174.9 | 0 | 0 | 112.6 | Q120 E121 L122 | Q120-E124 WeakPolarHBondContact O-CB 3.3Å; Q120-E124 WeakPolarHBondContact O-CG 3.48Å; Q120-E124 PolarHBondContact O-N 3.39Å; E121-E124 PolarHBondContact O-N 3.02Å; L122-E124 VanDerWaalsContact C-N 3.31Å |
| 125 | A | 97.8 | Very high | 96.9 | Very high | 34 Ų | 34 | 67.4 Ų | 67.4 | 28% | 0.281 | 37% | 0.372 | S | S | . | . | S | Bend | trans | -60.3 | 146.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E121 G127 K165 L169 | E121-A125 VanDerWaalsContact O-CB 3.26Å; E121-A125 WeakPolarHBondContact O-CB 3.39Å; E121-A125 PolarHBondContact O-N 2.85Å; A125-G127 PolarHBondContact O-N 3.31Å; A125-K165 PolarHBondContact O-NZ 2.88Å; A125-L169 HydrophobicContact CB-CD1 3.97Å |
| 126 | P | 97.3 | Very high | 97 | Very high | 118 Ų | 118 | 67.2 Ų | 67.2 | 77% | 0.766 | 38% | 0.376 | S | S | * | . | P | Polyproline II helix | trans | -62.4 | 130.4 | 173.7 | 26.8 | -33.7 | 0 | 0 | 0 | 109.9 | ||
| 127 | G | 96.2 | Very high | 96.9 | Very high | 17 Ų | 17 | 69.7 Ų | 69.7 | 18% | 0.175 | 37% | 0.373 | C | S | . | . | P | Polyproline II helix | trans | -77.3 | 156.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | A125 | A125-G127 PolarHBondContact O-N 3.31Š|
| 128 | D | 96 | Very high | 96.8 | Very high | 73 Ų | 73 | 69 Ų | 69 | 39% | 0.39 | 36% | 0.364 | S | S | . | . | P | Polyproline II helix | trans | -59.6 | 125.7 | 168.3 | -173.1 | -53.8 | 0 | 0 | 0 | 109.8 | Q130 W131 M132 | D128-Q130 PolarHBondContact O-N 3.5Å; D128-Q130 VanDerWaalsContact OD1-CB 3.3Å; D128-Q130 WeakPolarHBondContact OD1-CB 3.47Å; D128-Q130 PolarHBondContact OD1-N 2.92Å; D128-W131 HydrophobicContact CB-CB 4.32Å; D128-W131 HydrophobicContact CB-CG 4.29Å; D128-W131 PolarHBondContact O-N 3.44Å; D128-W131 VanDerWaalsContact O-N 3.09Å; D128-M132 VanDerWaalsContact O-CG 3.31Å; D128-M132 WeakPolarHBondContact O-CG 3.5Å; D128-M132 PolarHBondContact O-N 3.43Å |
| 129 | P | 96.9 | Very high | 96.6 | Very high | 104 Ų | 104 | 68.3 Ų | 68.3 | 68% | 0.675 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -53.3 | -38.2 | -178.5 | -27.6 | 35.3 | 0 | 0 | 0 | 114.1 | M132 E133 | P129-M132 PolarHBondContact O-N 3.41Å; P129-E133 PolarHBondContact O-N 3.43Å |
| 130 | Q | 95.9 | Very high | 96.2 | Very high | 117 Ų | 117 | 73.4 Ų | 73.4 | 55% | 0.547 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.1 | -43.7 | 179.8 | -178.3 | -175 | -31.4 | 0 | 0 | 111.1 | D128 T134 | D128-Q130 PolarHBondContact O-N 3.5Å; D128-Q130 VanDerWaalsContact OD1-CB 3.3Å; D128-Q130 WeakPolarHBondContact OD1-CB 3.47Å; D128-Q130 PolarHBondContact OD1-N 2.92Å; Q130-T134 WeakPolarHBondContact O-CB 3.27Å; Q130-T134 PolarHBondContact O-N 2.9Å; Q130-T134 VanDerWaalsContact O-N 3.08Å; Q130-T134 PolarHBondContact O-OG1 3.02Å |
| 131 | W | 96.4 | Very high | 95.9 | Very high | 58 Ų | 58 | 71.9 Ų | 71.9 | 22% | 0.22 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -71.6 | -37.6 | 177.9 | -64.5 | 135 | 0 | 0 | 0 | 112 | D128 E133 T134 I135 T168 Y176 | D128-W131 HydrophobicContact CB-CB 4.32Å; D128-W131 HydrophobicContact CB-CG 4.29Å; D128-W131 PolarHBondContact O-N 3.44Å; D128-W131 VanDerWaalsContact O-N 3.09Å; W131-E133 VanDerWaalsContact C-N 3.34Å; W131-E133 PolarHBondContact O-N 2.91Å; W131-T134 PolarHBondContact O-N 3.19Å; W131-I135 HydrophobicContact CB-CD1 4.43Å; W131-I135 WeakPolarHBondContact O-CB 3.29Å; W131-I135 WeakPolarHBondContact O-CD1 3.38Å; W131-I135 WeakPolarHBondContact O-CG1 3.38Å; W131-I135 PolarHBondContact O-N 3.15Å; W131-T168 HydrophobicContact CB-CG2 4.13Å; W131-T168 HydrophobicContact CG-CG2 4.05Å; W131-Y176 WeakPolarHBondContact CZ3-O 3.4Å |
| 132 | M | 97.5 | Very high | 95.7 | Very high | 64 Ų | 64 | 66.1 Ų | 66.1 | 32% | 0.315 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.8 | -44.4 | 175.3 | -70.2 | -64 | -68.1 | 0 | 0 | 111.7 | D128 P129 G136 L161 K165 | D128-M132 VanDerWaalsContact O-CG 3.31Å; D128-M132 WeakPolarHBondContact O-CG 3.5Å; D128-M132 PolarHBondContact O-N 3.43Å; P129-M132 PolarHBondContact O-N 3.41Å; M132-G136 PolarHBondContact O-N 2.61Å; M132-L161 HydrophobicContact CE-CD1 4.14Å; M132-L161 HydrophobicContact CE-CD2 4.1Å; M132-L161 HydrophobicContact CE-CG 4.32Å; M132-L161 HydrophobicContact SD-CD1 4.3Å; M132-K165 HydrophobicContact CE-CD 4.32Å; M132-K165 HydrophobicContact SD-CB 4.07Å; M132-K165 HydrophobicContact SD-CD 3.53Å; M132-K165 VanDerWaalsContact SD-CD 3.53Å; M132-K165 HydrophobicContact SD-CG 3.61Å |
| 133 | E | 96.6 | Very high | 95.5 | Very high | 127 Ų | 127 | 66.1 Ų | 66.1 | 59% | 0.593 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -63.6 | -47.9 | 175.9 | -172.2 | -170.7 | 160.1 | 0 | 0 | 111.5 | P129 W131 G136 R137 | P129-E133 PolarHBondContact O-N 3.43Å; W131-E133 VanDerWaalsContact C-N 3.34Å; W131-E133 PolarHBondContact O-N 2.91Å; E133-G136 PolarHBondContact O-N 2.94Å; E133-R137 WeakPolarHBondContact O-CG 3.31Å; E133-R137 PolarHBondContact O-N 3.18Å |
| 134 | T | 96.2 | Very high | 95.3 | Very high | 43 Ų | 43 | 68.7 Ų | 68.7 | 26% | 0.264 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.6 | -46.9 | -178.8 | -54.7 | 0 | 0 | 0 | 0 | 111.3 | Q130 W131 R137 D138 Y176 | Q130-T134 WeakPolarHBondContact O-CB 3.27Å; Q130-T134 PolarHBondContact O-N 2.9Å; Q130-T134 VanDerWaalsContact O-N 3.08Å; Q130-T134 PolarHBondContact O-OG1 3.02Å; W131-T134 PolarHBondContact O-N 3.19Å; T134-R137 PolarHBondContact O-N 3.34Å; T134-D138 VanDerWaalsContact O-CG 3.23Å; T134-D138 PolarHBondContact O-N 2.98Å; T134-D138 VanDerWaalsContact O-OD1 3.09Å; T134-Y176 HydrophobicContact CG2-CD1 3.79Å; T134-Y176 HydrophobicContact CG2-CE1 4.06Å |
| 135 | I | 97.5 | Very high | 95.1 | Very high | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.1 | -45 | 176.9 | -64.4 | 162.2 | 0 | 0 | 0 | 109.8 | W131 R137 D138 L139 L161 L164 T168 Y176 | W131-I135 HydrophobicContact CB-CD1 4.43Å; W131-I135 WeakPolarHBondContact O-CB 3.29Å; W131-I135 WeakPolarHBondContact O-CD1 3.38Å; W131-I135 WeakPolarHBondContact O-CG1 3.38Å; W131-I135 PolarHBondContact O-N 3.15Å; I135-R137 VanDerWaalsContact C-N 3.32Å; I135-R137 PolarHBondContact O-N 3.28Å; I135-D138 CarbonylContact O-C 3.59Å; I135-D138 WeakPolarHBondContact O-CA 3.48Å; I135-D138 WeakPolarHBondContact O-CB 3.29Å; I135-D138 PolarHBondContact O-N 3.4Å; I135-L139 HydrophobicContact CG2-CD2 4Å; I135-L139 HydrophobicContact CG2-CG 4.42Å; I135-L139 WeakPolarHBondContact O-CG 3.44Å; I135-L139 PolarHBondContact O-N 3.05Å; I135-L139 VanDerWaalsContact O-N 3.08Å; I135-L161 HydrophobicContact CB-CD1 4.04Å; I135-L161 HydrophobicContact CG2-CD1 3.54Å; I135-L164 HydrophobicContact CD1-CB 3.84Å; I135-L164 HydrophobicContact CG1-CB 4.27Å; I135-L164 HydrophobicContact CG2-CB 4.06Å; I135-L164 HydrophobicContact CG2-CD1 3.78Å; I135-T168 HydrophobicContact CD1-CG2 4.2Å; I135-Y176 HydrophobicContact CD1-CD2 4.35Å; I135-Y176 HydrophobicContact CD1-CG 4.2Å; I135-Y176 HydrophobicContact CG1-CD1 3.61Å; I135-Y176 HydrophobicContact CG1-CD2 3.83Å; I135-Y176 HydrophobicContact CG1-CE1 3.89Å; I135-Y176 HydrophobicContact CG1-CE2 4.11Å; I135-Y176 HydrophobicContact CG1-CG 3.57Å |
| 136 | G | 95.9 | Very high | 95 | Very high | 35 Ų | 35 | 65 Ų | 65 | 36% | 0.361 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -57.3 | -43.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113 | M132 E133 D138 L139 | M132-G136 PolarHBondContact O-N 2.61Å; E133-G136 PolarHBondContact O-N 2.94Å; G136-D138 PolarHBondContact O-N 3.39Å; G136-L139 PolarHBondContact O-N 3.05Å |
| 137 | R | 94.3 | Very high | 94.8 | Very high | 155 Ų | 155 | 65.2 Ų | 65.2 | 59% | 0.585 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -64.2 | -20.9 | 172.1 | -76.2 | 177.6 | 51.2 | -152.2 | -10.2 | 113.3 | E133 T134 I135 H140 R141 | E133-R137 WeakPolarHBondContact O-CG 3.31Å; E133-R137 PolarHBondContact O-N 3.18Å; T134-R137 PolarHBondContact O-N 3.34Å; I135-R137 VanDerWaalsContact C-N 3.32Å; I135-R137 PolarHBondContact O-N 3.28Å; R137-H140 PolarHBondContact O-CE1 3.02Å; R137-H140 PolarHBondContact O-ND1 3.03Å; R137-R141 PolarHBondContact O-NH1 2.67Å |
| 138 | D | 94.5 | Very high | 94.7 | Very high | 5 Ų | 5 | 67.7 Ų | 67.7 | 3% | 0.027 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -91.6 | -24.4 | -176.6 | -74.2 | 18.1 | 0 | 0 | 0 | 114.3 | T134 I135 G136 H140 R141 Q142 Y176 Q178 | T134-D138 VanDerWaalsContact O-CG 3.23Å; T134-D138 PolarHBondContact O-N 2.98Å; T134-D138 VanDerWaalsContact O-OD1 3.09Å; I135-D138 CarbonylContact O-C 3.59Å; I135-D138 WeakPolarHBondContact O-CA 3.48Å; I135-D138 WeakPolarHBondContact O-CB 3.29Å; I135-D138 PolarHBondContact O-N 3.4Å; G136-D138 PolarHBondContact O-N 3.39Å; D138-H140 PolarHBondContact O-N 2.93Å; D138-R141 VanDerWaalsContact CA-NH1 3.31Å; D138-R141 VanDerWaalsContact O-CG 3.22Å; D138-R141 WeakPolarHBondContact O-CG 3.48Å; D138-R141 PolarHBondContact O-N 3.4Å; D138-R141 IonicContact OD1-CZ 3.27Å; D138-R141 IonicContact OD1-NH1 2.77Å; D138-R141 PolarHBondContact OD1-NH1 3.26Å; D138-R141 IonicContact OD1-NH2 3.79Å; D138-R141 PolarHBondContact OD1-NH2 2.78Å; D138-R141 IonicContact OD2-CZ 3Å; D138-R141 IonicContact OD2-NH2 2.69Å; D138-R141 PolarHBondContact OD2-NH2 2.71Å; D138-Q142 VanDerWaalsContact O-CG 3.31Å; D138-Q142 WeakPolarHBondContact O-CG 3.23Å; D138-Q142 PolarHBondContact O-NE2 3.49Å; D138-Y176 HydrophobicContact CB-CE1 4.24Å; D138-Y176 WeakPolarHBondContact CB-OH 3.32Å; D138-Y176 VanDerWaalsContact OD2-CE1 3.26Å; D138-Y176 WeakPolarHBondContact OD2-CE1 3.35Å; D138-Y176 PolarHBondContact OD2-OH 2.92Å; D138-Q178 WeakPolarHBondContact OD2-CB 3.34Å; D138-Q178 WeakPolarHBondContact OD2-CG 3.32Å |
| 139 | L | 94.1 | Very high | 94.7 | Very high | 17 Ų | 17 | 64.3 Ų | 64.3 | 9% | 0.089 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -58.3 | -44.9 | -173.8 | -63.3 | 176.2 | 0 | 0 | 0 | 113.1 | I135 G136 R141 Q142 L160 L161 | I135-L139 HydrophobicContact CG2-CD2 4Å; I135-L139 HydrophobicContact CG2-CG 4.42Å; I135-L139 WeakPolarHBondContact O-CG 3.44Å; I135-L139 PolarHBondContact O-N 3.05Å; I135-L139 VanDerWaalsContact O-N 3.08Å; G136-L139 PolarHBondContact O-N 3.05Å; L139-R141 PolarHBondContact O-N 3.14Å; L139-R141 VanDerWaalsContact O-N 3.1Å; L139-Q142 PolarHBondContact O-N 3.12Å; L139-L160 HydrophobicContact CD2-CB 4.07Å; L139-L160 HydrophobicContact CD2-CD2 3.83Å; L139-L160 HydrophobicContact CD2-CG 3.77Å; L139-L161 HydrophobicContact CD1-CB 3.95Å; L139-L161 HydrophobicContact CD1-CD1 4.36Å; L139-L161 HydrophobicContact CD2-CB 4.34Å |
| 140 | H | 89.6 | Confident | 94.4 | Very high | 121 Ų | 121 | 61.8 Ų | 61.8 | 56% | 0.56 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -22.7 | -172.5 | 71 | -90.9 | 0 | 0 | 0 | 114 | R137 D138 | R137-H140 PolarHBondContact O-CE1 3.02Å; R137-H140 PolarHBondContact O-ND1 3.03Å; D138-H140 PolarHBondContact O-N 2.93Å |
| 141 | R | 91.8 | Very high | 94.1 | Very high | 85 Ų | 85 | 59.5 Ų | 59.5 | 32% | 0.321 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 3 | 179 | 64.2 | 178.8 | -173.2 | -91.7 | 6.7 | 113.7 | R137 D138 L139 F143 Q178 | R137-R141 PolarHBondContact O-NH1 2.67Å; D138-R141 VanDerWaalsContact CA-NH1 3.31Å; D138-R141 VanDerWaalsContact O-CG 3.22Å; D138-R141 WeakPolarHBondContact O-CG 3.48Å; D138-R141 PolarHBondContact O-N 3.4Å; D138-R141 IonicContact OD1-CZ 3.27Å; D138-R141 IonicContact OD1-NH1 2.77Å; D138-R141 PolarHBondContact OD1-NH1 3.26Å; D138-R141 IonicContact OD1-NH2 3.79Å; D138-R141 PolarHBondContact OD1-NH2 2.78Å; D138-R141 IonicContact OD2-CZ 3Å; D138-R141 IonicContact OD2-NH2 2.69Å; D138-R141 PolarHBondContact OD2-NH2 2.71Å; L139-R141 PolarHBondContact O-N 3.14Å; L139-R141 VanDerWaalsContact O-N 3.1Å; R141-F143 PolarHBondContact O-N 2.95Å; R141-Q178 VanDerWaalsContact NH2-CG 3.35Å |
| 142 | Q | 94.3 | Very high | 93.7 | Very high | 8 Ų | 8 | 61.9 Ų | 61.9 | 4% | 0.037 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -88.6 | 97.2 | 176.7 | -50.1 | -47.5 | -40.6 | 0 | 0 | 110.2 | D138 L139 F149 L160 P182 A185 | D138-Q142 VanDerWaalsContact O-CG 3.31Å; D138-Q142 WeakPolarHBondContact O-CG 3.23Å; D138-Q142 PolarHBondContact O-NE2 3.49Å; L139-Q142 PolarHBondContact O-N 3.12Å; Q142-F149 WeakPolarHBondContact O-CB 3.3Å; Q142-L160 HydrophobicContact CB-CD2 3.77Å; Q142-L160 HydrophobicContact CG-CD2 3.84Å; Q142-P182 VanDerWaalsContact OE1-N 3.11Å; Q142-A185 HydrophobicContact CB-CB 4.39Å |
| 143 | F | 93.4 | Very high | 93.3 | Very high | 29 Ų | 29 | 66.5 Ų | 66.5 | 13% | 0.127 | 34% | 0.343 | C | S | . | . | S | Bend | trans | 51.2 | 58.3 | 179.7 | -57.9 | -80.1 | 0 | 0 | 0 | 113.4 | F42 R141 L145 H146 F149 P182 A185 V186 M189 A261 F266 | F42-F143 HydrophobicContact CE1-CB 4.23Å; F42-F143 AromaticContact CE1-CD1 3.69Å; F42-F143 HydrophobicContact CE1-CD1 3.69Å; F42-F143 HydrophobicContact CE1-CG 4.38Å; F42-F143 AromaticContact CZ-CD1 3.68Å; F42-F143 HydrophobicContact CZ-CD1 3.68Å; F42-F143 HydrophobicContact CZ-CE1 4.18Å; F42-F143 HydrophobicContact CZ-CG 4.45Å; R141-F143 PolarHBondContact O-N 2.95Å; F143-L145 PolarHBondContact O-N 2.89Å; F143-H146 HydrophobicContact CB-CB 3.92Å; F143-H146 WeakPolarHBondContact O-CB 3.43Å; F143-H146 PolarHBondContact O-N 3.47Å; F143-F149 HydrophobicContact CB-CD2 4.09Å; F143-P182 HydrophobicContact CE2-CB 4.3Å; F143-A185 HydrophobicContact CD2-CB 3.66Å; F143-A185 HydrophobicContact CE2-CB 3.81Å; F143-V186 HydrophobicContact CE2-CG2 3.8Å; F143-V186 HydrophobicContact CZ-CG2 3.59Å; F143-M189 HydrophobicContact CB-CE 3.67Å; F143-M189 HydrophobicContact CD1-CE 3.93Å; F143-M189 HydrophobicContact CD2-CE 3.44Å; F143-M189 VanDerWaalsContact CD2-CE 3.44Å; F143-M189 HydrophobicContact CE1-CE 4.39Å; F143-M189 HydrophobicContact CE2-CE 3.96Å; F143-M189 HydrophobicContact CG-CE 3.4Å; F143-M189 HydrophobicContact CZ-CE 4.39Å; F143-A261 HydrophobicContact CZ-CB 4.18Å; F143-F266 HydrophobicContact CE1-CD2 4.43Å |
| 144 | P | 92.8 | Very high | 93.1 | Very high | 70 Ų | 70 | 61.3 Ų | 61.3 | 46% | 0.455 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | -21.9 | -172.8 | 25.1 | -35.3 | 0 | 0 | 0 | 114.3 | ||
| 145 | L | 92 | Very high | 92.9 | Very high | 112 Ų | 112 | 67.5 Ų | 67.5 | 59% | 0.586 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.1 | 0.2 | 178.1 | -60 | 178.7 | 0 | 0 | 0 | 113.4 | I43 F143 | I43-L145 WeakPolarHBondContact CB-O 3.4Å; I43-L145 WeakPolarHBondContact CG1-O 3.4Å; I43-L145 PolarHBondContact N-O 3.37Å; F143-L145 PolarHBondContact O-N 2.89Å |
| 146 | H | 94.9 | Very high | 92.8 | Very high | 8 Ų | 8 | 68 Ų | 68 | 4% | 0.037 | 35% | 0.354 | C | S | . | . | B | Isolated β-bridge | trans | -89 | 134.6 | 179.4 | -174.2 | -77.3 | 0 | 0 | 0 | 110.6 | Y40 G41 F42 F143 M148 F149 V150 M189 | Y40-H146 PolarHBondContact O-CD2 2.8Å; Y40-H146 PolarHBondContact O-NE2 3Å; G41-H146 CarbonylContact O-C 3.6Å; G41-H146 VanDerWaalsContact O-CA 3.32Å; G41-H146 WeakPolarHBondContact O-CA 3.3Å; F42-H146 HydrophobicContact CD1-CB 4.04Å; F42-H146 AromaticContact CD2-CD2 3.96Å; F42-H146 HydrophobicContact CE1-CB 3.89Å; F42-H146 AromaticContact CE2-CD2 3.7Å; F42-H146 HydrophobicContact CZ-CB 4.35Å; F42-H146 AromaticContact CZ-CD2 3.81Å; F143-H146 HydrophobicContact CB-CB 3.92Å; F143-H146 WeakPolarHBondContact O-CB 3.43Å; F143-H146 PolarHBondContact O-N 3.47Å; H146-M148 VanDerWaalsContact CE1-CB 3.47Å; H146-M148 WeakPolarHBondContact CE1-CB 3.46Å; H146-M148 WeakPolarHBondContact ND1-CB 3.33Å; H146-M148 PolarHBondContact ND1-N 3.4Å; H146-M148 VanDerWaalsContact ND1-N 3.11Å; H146-M148 PolarHBondContact O-N 2.84Å; H146-F149 HydrophobicContact CB-CD2 4.16Å; H146-F149 AromaticContact ND1-CD2 3.93Å; H146-F149 CarbonylContact O-C 3.47Å; H146-F149 PolarHBondContact O-N 3.47Å; H146-V150 PolarHBondContact O-N 3.4Å; H146-M189 HydrophobicContact CB-CE 4.18Å |
| 147 | E | 94.2 | Very high | 92.8 | Very high | 122 Ų | 122 | 67.2 Ų | 67.2 | 57% | 0.57 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.4 | -32.5 | -174.6 | 66.4 | -179.7 | -169.9 | 0 | 0 | 113.7 | A37 G41 | A37-E147 WeakPolarHBondContact CB-OE2 3.41Å; G41-E147 PolarHBondContact O-N 2.76Å |
| 148 | M | 93.9 | Very high | 92.8 | Very high | 69 Ų | 69 | 64.2 Ų | 64.2 | 34% | 0.34 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -31.1 | 175.4 | -171.8 | 177.2 | -69.3 | 0 | 0 | 113.4 | H146 G156 L188 M189 | H146-M148 VanDerWaalsContact CE1-CB 3.47Å; H146-M148 WeakPolarHBondContact CE1-CB 3.46Å; H146-M148 WeakPolarHBondContact ND1-CB 3.33Å; H146-M148 PolarHBondContact ND1-N 3.4Å; H146-M148 VanDerWaalsContact ND1-N 3.11Å; H146-M148 PolarHBondContact O-N 2.84Å; M148-G156 VanDerWaalsContact O-CA 3.23Å; M148-G156 WeakPolarHBondContact O-CA 3.49Å; M148-G156 PolarHBondContact O-N 3Å; M148-L188 HydrophobicContact SD-CB 4.45Å; M148-M189 HydrophobicContact SD-CG 4.44Å |
| 149 | F | 95.1 | Very high | 93 | Very high | 2 Ų | 2 | 64.4 Ų | 64.4 | 1% | 0.009 | 34% | 0.337 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -116 | -8 | -169.9 | -57.4 | -65.1 | 0 | 0 | 0 | 114.2 | Q142 F143 H146 S151 G156 Q157 L160 A185 L188 M189 | Q142-F149 WeakPolarHBondContact O-CB 3.3Å; F143-F149 HydrophobicContact CB-CD2 4.09Å; H146-F149 HydrophobicContact CB-CD2 4.16Å; H146-F149 AromaticContact ND1-CD2 3.93Å; H146-F149 CarbonylContact O-C 3.47Å; H146-F149 PolarHBondContact O-N 3.47Å; F149-S151 VanDerWaalsContact C-N 3.32Å; F149-S151 PolarHBondContact O-N 2.79Å; F149-G156 WeakPolarHBondContact CE1-O 3.46Å; F149-Q157 PolarHBondContact O-NE2 3.38Å; F149-L160 HydrophobicContact CD1-CD2 4.45Å; F149-L160 HydrophobicContact CE1-CB 4.16Å; F149-L160 HydrophobicContact CE1-CD2 4.19Å; F149-A185 HydrophobicContact CE2-CB 4Å; F149-A185 HydrophobicContact CZ-CB 3.86Å; F149-L188 HydrophobicContact CZ-CB 4.37Å; F149-M189 HydrophobicContact CD2-CE 3.86Å; F149-M189 HydrophobicContact CE2-CE 3.46Å; F149-M189 VanDerWaalsContact CE2-CE 3.46Å; F149-M189 HydrophobicContact CE2-CG 3.79Å; F149-M189 HydrophobicContact CE2-SD 4.44Å; F149-M189 HydrophobicContact CZ-CG 4.41Å |
| 150 | V | 91.9 | Very high | 93.1 | Very high | 51 Ų | 51 | 63.6 Ų | 63.6 | 31% | 0.309 | 33% | 0.333 | S | S | . | . | S | Bend | trans | -61.7 | -36.2 | -176.5 | 69 | 0 | 0 | 0 | 0 | 113 | I43 H146 P152 | I43-V150 HydrophobicContact CD1-CB 4.11Å; I43-V150 HydrophobicContact CD1-CG1 4.11Å; I43-V150 HydrophobicContact CD1-CG2 3.93Å; H146-V150 PolarHBondContact O-N 3.4Å; V150-P152 WeakPolarHBondContact O-CD 3.16Å |
| 151 | S | 89.9 | Confident | 93.5 | Very high | 69 Ų | 69 | 59.9 Ų | 59.9 | 48% | 0.483 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -81.6 | 118.5 | -179.4 | -60.6 | 0 | 0 | 0 | 0 | 110.9 | F149 Q153 G154 | F149-S151 VanDerWaalsContact C-N 3.32Å; F149-S151 PolarHBondContact O-N 2.79Å; S151-Q153 PolarHBondContact O-N 3.22Å; S151-G154 PolarHBondContact O-N 3.19Å |
| 152 | P | 88.3 | Confident | 93.8 | Very high | 108 Ų | 108 | 59.7 Ų | 59.7 | 70% | 0.701 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | 131.6 | 172.6 | -23.6 | 34.6 | 0 | 0 | 0 | 110.6 | V150 G154 | V150-P152 WeakPolarHBondContact O-CD 3.16Å; P152-G154 PolarHBondContact O-N 3.26Å |
| 153 | Q | 88.6 | Confident | 94 | Very high | 161 Ų | 161 | 59.3 Ų | 59.3 | 75% | 0.752 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.2 | 16.1 | -175.9 | -48 | -180 | 20.5 | 0 | 0 | 114.2 | S151 Q158 | S151-Q153 PolarHBondContact O-N 3.22Å; Q153-Q158 PolarHBondContact O-NE2 3.04Å |
| 154 | G | 91.8 | Very high | 94.3 | Very high | 18 Ų | 18 | 58 Ų | 58 | 19% | 0.186 | 31% | 0.312 | C | S | . | . | trans | -70.1 | 172 | 173 | 0 | 0 | 0 | 0 | 0 | 112.4 | S151 P152 G156 Q157 Q158 | S151-G154 PolarHBondContact O-N 3.19Å; P152-G154 PolarHBondContact O-N 3.26Å; G154-G156 VanDerWaalsContact C-N 3.27Å; G154-G156 PolarHBondContact O-N 3.39Å; G154-G156 VanDerWaalsContact O-N 3.15Å; G154-Q157 PolarHBondContact O-N 2.9Å; G154-Q157 VanDerWaalsContact O-N 3.1Å; G154-Q158 WeakPolarHBondContact O-CG 3.45Å; G154-Q158 PolarHBondContact O-N 3.49Å | ||
| 155 | H | 92.9 | Very high | 94.6 | Very high | 172 Ų | 172 | 55.7 Ų | 55.7 | 80% | 0.796 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -53.9 | -38.5 | -175.3 | -70.2 | -66.3 | 0 | 0 | 0 | 114 | G159 | H155-G159 PolarHBondContact O-N 3.39Å |
| 156 | G | 94 | Very high | 94.9 | Very high | 10 Ų | 10 | 50.3 Ų | 50.3 | 10% | 0.103 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -69 | -43 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | M148 F149 G154 Q158 G159 L160 | M148-G156 VanDerWaalsContact O-CA 3.23Å; M148-G156 WeakPolarHBondContact O-CA 3.49Å; M148-G156 PolarHBondContact O-N 3Å; F149-G156 WeakPolarHBondContact CE1-O 3.46Å; G154-G156 VanDerWaalsContact C-N 3.27Å; G154-G156 PolarHBondContact O-N 3.39Å; G154-G156 VanDerWaalsContact O-N 3.15Å; G156-Q158 VanDerWaalsContact C-N 3.34Å; G156-Q158 PolarHBondContact O-N 2.92Å; G156-G159 PolarHBondContact O-N 3.35Å; G156-L160 WeakPolarHBondContact O-CB 3.37Å; G156-L160 PolarHBondContact O-N 2.79Å |
| 157 | Q | 95.5 | Very high | 95 | Very high | 20 Ų | 20 | 50 Ų | 50 | 9% | 0.093 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.5 | -39.4 | 175.4 | -69.4 | -167.3 | 3.4 | 0 | 0 | 111.6 | F149 G154 L160 L161 | F149-Q157 PolarHBondContact O-NE2 3.38Å; G154-Q157 PolarHBondContact O-N 2.9Å; G154-Q157 VanDerWaalsContact O-N 3.1Å; Q157-L160 PolarHBondContact O-N 3.33Å; Q157-L161 WeakPolarHBondContact O-CB 3.41Å; Q157-L161 PolarHBondContact O-N 3Å |
| 158 | Q | 96.1 | Very high | 95.2 | Very high | 91 Ų | 91 | 44.3 Ų | 44.3 | 43% | 0.425 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.2 | -43.8 | 174.9 | -67 | -178.6 | 12.7 | 0 | 0 | 111.9 | Q153 G154 G156 L160 L161 Q162 | Q153-Q158 PolarHBondContact O-NE2 3.04Å; G154-Q158 WeakPolarHBondContact O-CG 3.45Å; G154-Q158 PolarHBondContact O-N 3.49Å; G156-Q158 VanDerWaalsContact C-N 3.34Å; G156-Q158 PolarHBondContact O-N 2.92Å; Q158-L160 VanDerWaalsContact C-N 3.31Å; Q158-L160 PolarHBondContact O-N 3.26Å; Q158-L161 WeakPolarHBondContact O-CB 3.38Å; Q158-L161 PolarHBondContact O-N 2.9Å; Q158-Q162 WeakPolarHBondContact O-CG 3.37Å; Q158-Q162 PolarHBondContact O-N 3.19Å |
| 159 | G | 96.9 | Very high | 95.4 | Very high | 10 Ų | 10 | 43.5 Ų | 43.5 | 10% | 0.103 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.9 | -41 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | H155 G156 Q162 V163 | H155-G159 PolarHBondContact O-N 3.39Å; G156-G159 PolarHBondContact O-N 3.35Å; G159-Q162 PolarHBondContact O-N 3.07Å; G159-V163 WeakPolarHBondContact O-CG2 3.47Å; G159-V163 PolarHBondContact O-N 2.69Å |
| 160 | L | 98 | Very high | 95.5 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64 | -45.3 | 176 | -177 | 58.7 | 0 | 0 | 0 | 112.2 | L139 Q142 F149 G156 Q157 Q158 Q162 V163 L164 A184 A185 L188 | L139-L160 HydrophobicContact CD2-CB 4.07Å; L139-L160 HydrophobicContact CD2-CD2 3.83Å; L139-L160 HydrophobicContact CD2-CG 3.77Å; Q142-L160 HydrophobicContact CB-CD2 3.77Å; Q142-L160 HydrophobicContact CG-CD2 3.84Å; F149-L160 HydrophobicContact CD1-CD2 4.45Å; F149-L160 HydrophobicContact CE1-CB 4.16Å; F149-L160 HydrophobicContact CE1-CD2 4.19Å; G156-L160 WeakPolarHBondContact O-CB 3.37Å; G156-L160 PolarHBondContact O-N 2.79Å; Q157-L160 PolarHBondContact O-N 3.33Å; Q158-L160 VanDerWaalsContact C-N 3.31Å; Q158-L160 PolarHBondContact O-N 3.26Å; L160-Q162 VanDerWaalsContact C-N 3.33Å; L160-Q162 PolarHBondContact O-N 3.07Å; L160-V163 PolarHBondContact O-N 3.37Å; L160-L164 HydrophobicContact CD1-CD1 3.81Å; L160-L164 HydrophobicContact CD1-CG 4.14Å; L160-L164 HydrophobicContact CG-CD1 3.92Å; L160-L164 WeakPolarHBondContact O-CB 3.46Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.29Å; L160-L164 PolarHBondContact O-N 3.17Å; L160-A184 HydrophobicContact CD1-CB 3.54Å; L160-A185 HydrophobicContact CD1-CB 4.16Å; L160-A185 HydrophobicContact CD2-CB 4.09Å; L160-L188 HydrophobicContact CB-CD1 3.88Å; L160-L188 HydrophobicContact CD1-CD1 4.02Å |
| 161 | L | 97.9 | Very high | 95.7 | Very high | 42 Ų | 42 | 48.2 Ų | 48.2 | 22% | 0.22 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -56.6 | -47.4 | 173 | 179.7 | 64.8 | 0 | 0 | 0 | 111.2 | M132 I135 L139 Q157 Q158 L164 K165 | M132-L161 HydrophobicContact CE-CD1 4.14Å; M132-L161 HydrophobicContact CE-CD2 4.1Å; M132-L161 HydrophobicContact CE-CG 4.32Å; M132-L161 HydrophobicContact SD-CD1 4.3Å; I135-L161 HydrophobicContact CB-CD1 4.04Å; I135-L161 HydrophobicContact CG2-CD1 3.54Å; L139-L161 HydrophobicContact CD1-CB 3.95Å; L139-L161 HydrophobicContact CD1-CD1 4.36Å; L139-L161 HydrophobicContact CD2-CB 4.34Å; Q157-L161 WeakPolarHBondContact O-CB 3.41Å; Q157-L161 PolarHBondContact O-N 3Å; Q158-L161 WeakPolarHBondContact O-CB 3.38Å; Q158-L161 PolarHBondContact O-N 2.9Å; L161-L164 PolarHBondContact O-N 3.15Å; L161-K165 WeakPolarHBondContact O-CB 3.22Å; L161-K165 PolarHBondContact O-N 3.29Å |
| 162 | Q | 98.1 | Very high | 95.8 | Very high | 82 Ų | 82 | 49.1 Ų | 49.1 | 38% | 0.383 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.3 | -45.8 | -178.7 | -75.2 | 179.5 | 1.7 | 0 | 0 | 112.4 | Q158 G159 L160 K165 A166 | Q158-Q162 WeakPolarHBondContact O-CG 3.37Å; Q158-Q162 PolarHBondContact O-N 3.19Å; G159-Q162 PolarHBondContact O-N 3.07Å; L160-Q162 VanDerWaalsContact C-N 3.33Å; L160-Q162 PolarHBondContact O-N 3.07Å; Q162-K165 PolarHBondContact O-N 3.25Å; Q162-A166 VanDerWaalsContact O-CB 3.26Å; Q162-A166 WeakPolarHBondContact O-CB 3.3Å; Q162-A166 PolarHBondContact O-N 3.18Å |
| 163 | V | 98.6 | Very high | 95.9 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.8 | -45.8 | 178.4 | 168.5 | 0 | 0 | 0 | 0 | 111.3 | Y119 G159 L160 A166 Y167 A184 L188 P193 A196 F197 L200 | Y119-V163 HydrophobicContact CE2-CG2 4.3Å; G159-V163 WeakPolarHBondContact O-CG2 3.47Å; G159-V163 PolarHBondContact O-N 2.69Å; L160-V163 PolarHBondContact O-N 3.37Å; V163-A166 PolarHBondContact O-N 2.8Å; V163-Y167 PolarHBondContact O-N 2.95Å; V163-A184 HydrophobicContact CG1-CB 4.35Å; V163-L188 HydrophobicContact CB-CD1 4.44Å; V163-L188 HydrophobicContact CG2-CD1 4.15Å; V163-L188 HydrophobicContact CG2-CD2 4.03Å; V163-L188 HydrophobicContact CG2-CG 4.32Å; V163-P193 HydrophobicContact CG2-CB 4.04Å; V163-P193 WeakPolarHBondContact CG2-O 3.33Å; V163-A196 HydrophobicContact CG2-CB 4.5Å; V163-F197 HydrophobicContact CG1-CB 4.27Å; V163-L200 HydrophobicContact CG1-CD2 4.09Å |
| 164 | L | 98.5 | Very high | 95.9 | Very high | 1 Ų | 1 | 42.9 Ų | 42.9 | 1% | 0.005 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.8 | -42 | 179.6 | -69 | 170.9 | 0 | 0 | 0 | 111.7 | I135 L160 L161 Y167 T168 Y176 Q180 A184 L200 | I135-L164 HydrophobicContact CD1-CB 3.84Å; I135-L164 HydrophobicContact CG1-CB 4.27Å; I135-L164 HydrophobicContact CG2-CB 4.06Å; I135-L164 HydrophobicContact CG2-CD1 3.78Å; L160-L164 HydrophobicContact CD1-CD1 3.81Å; L160-L164 HydrophobicContact CD1-CG 4.14Å; L160-L164 HydrophobicContact CG-CD1 3.92Å; L160-L164 WeakPolarHBondContact O-CB 3.46Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.29Å; L160-L164 PolarHBondContact O-N 3.17Å; L161-L164 PolarHBondContact O-N 3.15Å; L164-Y167 WeakPolarHBondContact O-CB 3.45Å; L164-Y167 PolarHBondContact O-N 3.13Å; L164-T168 WeakPolarHBondContact O-CG2 3.46Å; L164-T168 PolarHBondContact O-N 3.43Å; L164-Y176 HydrophobicContact CD1-CE2 3.81Å; L164-Y176 HydrophobicContact CD2-CD2 4.11Å; L164-Y176 HydrophobicContact CD2-CE2 3.79Å; L164-Y176 HydrophobicContact CG-CE2 4.26Å; L164-Q180 HydrophobicContact CD2-CB 4.05Å; L164-A184 HydrophobicContact CD2-CB 3.61Å; L164-A184 HydrophobicContact CG-CB 4.03Å; L164-L200 HydrophobicContact CD2-CD2 4.2Å |
| 165 | K | 98.4 | Very high | 95.9 | Very high | 21 Ų | 21 | 42 Ų | 42 | 9% | 0.091 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.2 | -47.5 | 173.6 | -177.8 | -163 | 72.1 | 160.9 | 0 | 111.4 | L122 A123 A125 M132 L161 Q162 Y167 T168 L169 | L122-K165 WeakPolarHBondContact O-CE 3.4Å; A123-K165 PolarHBondContact O-NZ 3.25Å; A125-K165 PolarHBondContact O-NZ 2.88Å; M132-K165 HydrophobicContact CE-CD 4.32Å; M132-K165 HydrophobicContact SD-CB 4.07Å; M132-K165 HydrophobicContact SD-CD 3.53Å; M132-K165 VanDerWaalsContact SD-CD 3.53Å; M132-K165 HydrophobicContact SD-CG 3.61Å; L161-K165 WeakPolarHBondContact O-CB 3.22Å; L161-K165 PolarHBondContact O-N 3.29Å; Q162-K165 PolarHBondContact O-N 3.25Å; K165-Y167 PolarHBondContact O-N 3.35Å; K165-T168 PolarHBondContact O-N 3.34Å; K165-T168 VanDerWaalsContact O-N 3.14Å; K165-T168 PolarHBondContact O-OG1 2.96Å; K165-L169 HydrophobicContact CG-CD1 4.31Å; K165-L169 WeakPolarHBondContact O-CG 3.44Å; K165-L169 PolarHBondContact O-N 3.44Å; K165-L169 VanDerWaalsContact O-N 3.08Å |
| 166 | A | 98.6 | Very high | 96 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.3 | -37.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y119 L122 Q162 V163 L169 Y170 F197 | Y119-A166 HydrophobicContact CD2-CB 4.02Å; Y119-A166 HydrophobicContact CE2-CB 3.89Å; L122-A166 HydrophobicContact CB-CB 3.83Å; Q162-A166 VanDerWaalsContact O-CB 3.26Å; Q162-A166 WeakPolarHBondContact O-CB 3.3Å; Q162-A166 PolarHBondContact O-N 3.18Å; V163-A166 PolarHBondContact O-N 2.8Å; A166-L169 PolarHBondContact O-N 3.4Å; A166-Y170 WeakPolarHBondContact O-CB 3.37Å; A166-Y170 PolarHBondContact O-N 2.89Å; A166-F197 HydrophobicContact CB-CD2 3.84Å; A166-F197 HydrophobicContact CB-CE2 3.88Å |
| 167 | Y | 98.4 | Very high | 96 | Very high | 1 Ų | 1 | 34.7 Ų | 34.7 | 0% | 0.004 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.4 | -46.1 | 174 | -175.2 | -85.4 | 0 | 0 | 0 | 112.7 | V163 L164 K165 L169 Y170 R171 Q174 Q180 L200 V201 C204 E205 | V163-Y167 PolarHBondContact O-N 2.95Å; L164-Y167 WeakPolarHBondContact O-CB 3.45Å; L164-Y167 PolarHBondContact O-N 3.13Å; K165-Y167 PolarHBondContact O-N 3.35Å; Y167-L169 VanDerWaalsContact C-N 3.26Å; Y167-L169 PolarHBondContact O-N 3.21Å; Y167-Y170 PolarHBondContact O-N 2.94Å; Y167-Y170 VanDerWaalsContact O-N 3.13Å; Y167-R171 HydrophobicContact CE1-CB 4.08Å; Y167-R171 HydrophobicContact CE2-CG 4.49Å; Y167-R171 PolarHBondContact O-N 3.05Å; Y167-Q174 PolarHBondContact OH-OE1 3.5Å; Y167-Q180 VanDerWaalsContact CD1-NE2 3.28Å; Y167-L200 HydrophobicContact CD2-CD2 3.93Å; Y167-L200 HydrophobicContact CD2-CG 3.97Å; Y167-L200 HydrophobicContact CE2-CG 4.4Å; Y167-L200 HydrophobicContact CG-CD2 4.06Å; Y167-V201 HydrophobicContact CD2-CG2 4.02Å; Y167-V201 HydrophobicContact CE2-CG2 4.25Å; Y167-C204 HydrophobicContact CE2-CB 3.83Å; Y167-C204 WeakPolarHBondContact OH-CB 3.5Å; Y167-E205 PolarHBondContact OH-OE1 2.86Å |
| 168 | T | 97.6 | Very high | 95.9 | Very high | 3 Ų | 3 | 38.4 Ų | 38.4 | 2% | 0.018 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.9 | -31.8 | 179.8 | 65.4 | 0 | 0 | 0 | 0 | 112.6 | W131 I135 L164 K165 R171 P172 | W131-T168 HydrophobicContact CB-CG2 4.13Å; W131-T168 HydrophobicContact CG-CG2 4.05Å; I135-T168 HydrophobicContact CD1-CG2 4.2Å; L164-T168 WeakPolarHBondContact O-CG2 3.46Å; L164-T168 PolarHBondContact O-N 3.43Å; K165-T168 PolarHBondContact O-N 3.34Å; K165-T168 VanDerWaalsContact O-N 3.14Å; K165-T168 PolarHBondContact O-OG1 2.96Å; T168-R171 CarbonylContact O-C 3.49Å; T168-R171 VanDerWaalsContact O-C 3.3Å; T168-P172 WeakPolarHBondContact O-CA 3.47Å; T168-P172 VanDerWaalsContact O-N 3.1Å |
| 169 | L | 98 | Very high | 95.9 | Very high | 52 Ų | 52 | 34.3 Ų | 34.3 | 27% | 0.272 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -74.1 | -34.3 | 173.4 | -66.7 | 174.5 | 0 | 0 | 0 | 112.4 | L122 A125 K165 A166 Y167 | L122-L169 HydrophobicContact CD2-CB 3.69Å; L122-L169 WeakPolarHBondContact O-CD1 3.4Å; A125-L169 HydrophobicContact CB-CD1 3.97Å; K165-L169 HydrophobicContact CG-CD1 4.31Å; K165-L169 WeakPolarHBondContact O-CG 3.44Å; K165-L169 PolarHBondContact O-N 3.44Å; K165-L169 VanDerWaalsContact O-N 3.08Å; A166-L169 PolarHBondContact O-N 3.4Å; Y167-L169 VanDerWaalsContact C-N 3.26Å; Y167-L169 PolarHBondContact O-N 3.21Å |
| 170 | Y | 97.5 | Very high | 95.8 | Very high | 78 Ų | 78 | 33.8 Ų | 33.8 | 31% | 0.306 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -71.5 | -33.9 | 175.7 | -170.3 | -108.6 | 0 | 0 | 0 | 112.5 | T118 L122 A166 Y167 F197 W198 V201 | T118-Y170 HydrophobicContact CG2-CD2 4.49Å; T118-Y170 HydrophobicContact CG2-CE2 4.45Å; L122-Y170 HydrophobicContact CD1-CD2 3.96Å; L122-Y170 HydrophobicContact CD1-CG 4.39Å; A166-Y170 WeakPolarHBondContact O-CB 3.37Å; A166-Y170 PolarHBondContact O-N 2.89Å; Y167-Y170 PolarHBondContact O-N 2.94Å; Y167-Y170 VanDerWaalsContact O-N 3.13Å; Y170-F197 HydrophobicContact CD1-CZ 4.35Å; Y170-F197 HydrophobicContact CD2-CZ 4.14Å; Y170-F197 HydrophobicContact CG-CE2 4.47Å; Y170-F197 AromaticContact CG-CZ 3.9Å; Y170-F197 HydrophobicContact CG-CZ 3.9Å; Y170-W198 HydrophobicContact CE2-CH2 4.24Å; Y170-W198 HydrophobicContact CE2-CZ3 4.3Å; Y170-W198 AromaticContact CZ-CZ3 3.98Å; Y170-V201 HydrophobicContact CD1-CG1 4.2Å; Y170-V201 HydrophobicContact CD1-CG2 3.77Å; Y170-V201 HydrophobicContact CE1-CB 4.49Å; Y170-V201 HydrophobicContact CE1-CG1 3.61Å; Y170-V201 HydrophobicContact CE1-CG2 3.97Å |
| 171 | R | 95.3 | Very high | 95.8 | Very high | 73 Ų | 73 | 33.8 Ų | 33.8 | 28% | 0.275 | 16% | 0.164 | S | C | . | . | trans | -131 | 67.6 | -179 | -67.1 | -63.5 | -178.2 | 168.3 | 8.4 | 111.8 | Y167 T168 E173 Q174 G175 E205 | Y167-R171 HydrophobicContact CE1-CB 4.08Å; Y167-R171 HydrophobicContact CE2-CG 4.49Å; Y167-R171 PolarHBondContact O-N 3.05Å; T168-R171 CarbonylContact O-C 3.49Å; T168-R171 VanDerWaalsContact O-C 3.3Å; R171-E173 WeakPolarHBondContact CD-OE1 2.95Å; R171-E173 IonicContact CZ-OE1 2.73Å; R171-E173 IonicContact NE-OE1 3.69Å; R171-E173 IonicContact NH1-OE1 2.94Å; R171-E173 PolarHBondContact NH1-OE1 2.98Å; R171-E173 PolarHBondContact O-N 3.27Å; R171-Q174 HydrophobicContact CB-CB 4.32Å; R171-Q174 HydrophobicContact CB-CG 4.48Å; R171-Q174 PolarHBondContact O-N 3.18Å; R171-G175 PolarHBondContact O-N 3.2Å; R171-E205 IonicContact CZ-OE2 3.43Å; R171-E205 IonicContact NE-OE2 2.89Å; R171-E205 PolarHBondContact NE-OE2 3.22Å; R171-E205 IonicContact NH1-OE2 3.03Å; R171-E205 IonicContact NH2-OE2 3.9Å; R171-E205 PolarHBondContact NH2-OE2 2.91Å | ||
| 172 | P | 93.2 | Very high | 95.8 | Very high | 88 Ų | 88 | 32 Ų | 32 | 57% | 0.571 | 16% | 0.155 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61.1 | -29 | -177.5 | 25.6 | -35.1 | 0 | 0 | 0 | 113 | T168 Q174 G175 | T168-P172 WeakPolarHBondContact O-CA 3.47Å; T168-P172 VanDerWaalsContact O-N 3.1Å; P172-Q174 VanDerWaalsContact C-N 3.26Å; P172-Q174 PolarHBondContact O-N 3.31Å; P172-G175 PolarHBondContact O-N 3.48Å |
| 173 | E | 89.1 | Confident | 95.8 | Very high | 111 Ų | 111 | 28.1 Ų | 28.1 | 52% | 0.519 | 14% | 0.136 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68 | -23.9 | 177.6 | 72.1 | -78.8 | -170.3 | 0 | 0 | 113.7 | R171 | R171-E173 WeakPolarHBondContact CD-OE1 2.95Å; R171-E173 IonicContact CZ-OE1 2.73Å; R171-E173 IonicContact NE-OE1 3.69Å; R171-E173 IonicContact NH1-OE1 2.94Å; R171-E173 PolarHBondContact NH1-OE1 2.98Å; R171-E173 PolarHBondContact O-N 3.27Å |
| 174 | Q | 89.3 | Confident | 95.8 | Very high | 27 Ų | 27 | 28.1 Ų | 28.1 | 13% | 0.126 | 14% | 0.136 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | -36 | 175.2 | -63.8 | -174.6 | 29.8 | 0 | 0 | 111.6 | Y167 R171 P172 E205 | Y167-Q174 PolarHBondContact OH-OE1 3.5Å; R171-Q174 HydrophobicContact CB-CB 4.32Å; R171-Q174 HydrophobicContact CB-CG 4.48Å; R171-Q174 PolarHBondContact O-N 3.18Å; P172-Q174 VanDerWaalsContact C-N 3.26Å; P172-Q174 PolarHBondContact O-N 3.31Å; Q174-E205 VanDerWaalsContact NE2-CD 3.33Å; Q174-E205 PolarHBondContact NE2-OE1 3.14Å; Q174-E205 PolarHBondContact NE2-OE2 3.01Å; Q174-E205 PolarHBondContact OE1-OE1 3.3Å |
| 175 | G | 92.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.136 | C | C | . | . | trans | 64.7 | -144.5 | -176 | 0 | 0 | 0 | 0 | 0 | 112 | R171 P172 | R171-G175 PolarHBondContact O-N 3.2Å; P172-G175 PolarHBondContact O-N 3.48Å | ||
| 176 | Y | 95.4 | Very high | 95.8 | Very high | 14 Ų | 14 | 27 Ų | 27 | 6% | 0.055 | 13% | 0.132 | C | C | . | . | trans | -112.9 | 121.4 | 178 | 173.3 | -108.7 | 0 | 0 | 0 | 111.6 | W131 T134 I135 D138 L164 Q180 | W131-Y176 WeakPolarHBondContact CZ3-O 3.4Å; T134-Y176 HydrophobicContact CG2-CD1 3.79Å; T134-Y176 HydrophobicContact CG2-CE1 4.06Å; I135-Y176 HydrophobicContact CD1-CD2 4.35Å; I135-Y176 HydrophobicContact CD1-CG 4.2Å; I135-Y176 HydrophobicContact CG1-CD1 3.61Å; I135-Y176 HydrophobicContact CG1-CD2 3.83Å; I135-Y176 HydrophobicContact CG1-CE1 3.89Å; I135-Y176 HydrophobicContact CG1-CE2 4.11Å; I135-Y176 HydrophobicContact CG1-CG 3.57Å; D138-Y176 HydrophobicContact CB-CE1 4.24Å; D138-Y176 WeakPolarHBondContact CB-OH 3.32Å; D138-Y176 VanDerWaalsContact OD2-CE1 3.26Å; D138-Y176 WeakPolarHBondContact OD2-CE1 3.35Å; D138-Y176 PolarHBondContact OD2-OH 2.92Å; L164-Y176 HydrophobicContact CD1-CE2 3.81Å; L164-Y176 HydrophobicContact CD2-CD2 4.11Å; L164-Y176 HydrophobicContact CD2-CE2 3.79Å; L164-Y176 HydrophobicContact CG-CE2 4.26Å; Y176-Q180 HydrophobicContact CD2-CB 4.34Å; Y176-Q180 HydrophobicContact CE2-CB 4.11Å | ||
| 177 | C | 93.6 | Very high | 95.8 | Very high | 15 Ų | 15 | 27.1 Ų | 27.1 | 10% | 0.101 | 13% | 0.132 | C | C | . | . | trans | -97.4 | 128.9 | 165.6 | 179.2 | 0 | 0 | 0 | 0 | 108.9 | A179 Q180 Y212 | C177-A179 PolarHBondContact O-N 3.07Å; C177-Q180 HydrophobicContact CB-CG 4.26Å; C177-Q180 VanDerWaalsContact O-CB 3.27Å; C177-Q180 WeakPolarHBondContact O-CB 3.5Å; C177-Q180 WeakPolarHBondContact O-CG 3.14Å; C177-Q180 PolarHBondContact O-N 3.23Å; C177-Y212 HydrophobicContact CB-CD1 4.01Å | ||
| 178 | Q | 93.6 | Very high | 95.8 | Very high | 97 Ų | 97 | 27.7 Ų | 27.7 | 45% | 0.453 | 14% | 0.135 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -46.5 | -33.2 | 178.1 | 169.1 | 177.5 | -3.9 | 0 | 0 | 113.8 | D138 R141 Q180 G181 | D138-Q178 WeakPolarHBondContact OD2-CB 3.34Å; D138-Q178 WeakPolarHBondContact OD2-CG 3.32Å; R141-Q178 VanDerWaalsContact NH2-CG 3.35Å; Q178-Q180 PolarHBondContact O-N 3.03Å; Q178-G181 PolarHBondContact O-N 3.35Å |
| 179 | A | 94.5 | Very high | 95.8 | Very high | 5 Ų | 5 | 28.9 Ų | 28.9 | 4% | 0.041 | 14% | 0.141 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -13.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | C177 P182 Y212 L257 C258 | C177-A179 PolarHBondContact O-N 3.07Å; A179-P182 WeakPolarHBondContact O-CD 3.29Å; A179-Y212 HydrophobicContact CB-CE1 4.32Å; A179-L257 HydrophobicContact CB-CB 3.38Å; A179-L257 HydrophobicContact CB-CD1 4.08Å; A179-L257 HydrophobicContact CB-CG 4.27Å; A179-C258 PolarHBondContact O-SG 2.72Å |
| 180 | Q | 96.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -73.2 | -27.6 | 172 | -64.3 | 176.2 | -79 | 0 | 0 | 112.3 | L164 Y167 Y176 C177 Q178 V183 A184 Y212 | L164-Q180 HydrophobicContact CD2-CB 4.05Å; Y167-Q180 VanDerWaalsContact CD1-NE2 3.28Å; Y176-Q180 HydrophobicContact CD2-CB 4.34Å; Y176-Q180 HydrophobicContact CE2-CB 4.11Å; C177-Q180 HydrophobicContact CB-CG 4.26Å; C177-Q180 VanDerWaalsContact O-CB 3.27Å; C177-Q180 WeakPolarHBondContact O-CB 3.5Å; C177-Q180 WeakPolarHBondContact O-CG 3.14Å; C177-Q180 PolarHBondContact O-N 3.23Å; Q178-Q180 PolarHBondContact O-N 3.03Å; Q180-V183 PolarHBondContact O-N 3.15Å; Q180-V183 VanDerWaalsContact O-N 3.1Å; Q180-A184 WeakPolarHBondContact O-CB 3.46Å; Q180-A184 PolarHBondContact O-N 3.09Å; Q180-Y212 HydrophobicContact CG-CD1 3.43Å; Q180-Y212 VanDerWaalsContact CG-CD1 3.43Å; Q180-Y212 HydrophobicContact CG-CE1 3.78Å; Q180-Y212 HydrophobicContact CG-CG 3.85Å |
| 181 | G | 97.5 | Very high | 95.7 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -51.8 | -56 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q178 V183 A184 A185 | Q178-G181 PolarHBondContact O-N 3.35Å; G181-V183 VanDerWaalsContact C-N 3.28Å; G181-V183 PolarHBondContact O-N 3.05Å; G181-A184 PolarHBondContact O-N 2.91Å; G181-A185 WeakPolarHBondContact O-CB 3.47Å; G181-A185 PolarHBondContact O-N 2.9Å |
| 182 | P | 97.8 | Very high | 95.8 | Very high | 4 Ų | 4 | 24.4 Ų | 24.4 | 3% | 0.026 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.2 | -35.2 | 177 | -23.5 | 31.9 | 0 | 0 | 0 | 113.3 | Q142 F143 A179 V186 C258 A261 R262 | Q142-P182 VanDerWaalsContact OE1-N 3.11Å; F143-P182 HydrophobicContact CE2-CB 4.3Å; A179-P182 WeakPolarHBondContact O-CD 3.29Å; P182-V186 VanDerWaalsContact O-CG2 3.32Å; P182-V186 WeakPolarHBondContact O-CG2 3.34Å; P182-V186 PolarHBondContact O-N 3.44Å; P182-V186 VanDerWaalsContact O-N 3.08Å; P182-C258 HydrophobicContact CB-CB 4.37Å; P182-C258 HydrophobicContact CG-CB 4.49Å; P182-A261 HydrophobicContact CB-CB 4.26Å; P182-R262 HydrophobicContact CB-CG 4.27Å; P182-R262 HydrophobicContact CG-CG 4.07Å |
| 183 | V | 98.6 | Very high | 96.1 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -67.3 | -49.1 | 179.8 | 179.1 | 0 | 0 | 0 | 0 | 110.3 | Q180 G181 A185 V186 L187 L200 I203 L259 W273 | Q180-V183 PolarHBondContact O-N 3.15Å; Q180-V183 VanDerWaalsContact O-N 3.1Å; G181-V183 VanDerWaalsContact C-N 3.28Å; G181-V183 PolarHBondContact O-N 3.05Å; V183-A185 VanDerWaalsContact C-N 3.32Å; V183-A185 PolarHBondContact O-N 3.19Å; V183-V186 PolarHBondContact O-N 2.95Å; V183-L187 HydrophobicContact CG1-CD1 4.42Å; V183-L187 WeakPolarHBondContact O-CG 3.47Å; V183-L187 PolarHBondContact O-N 3Å; V183-L187 VanDerWaalsContact O-N 3.16Å; V183-L200 HydrophobicContact CB-CD1 4.41Å; V183-L200 HydrophobicContact CG1-CD1 3.92Å; V183-I203 HydrophobicContact CG1-CD1 4.06Å; V183-I203 HydrophobicContact CG1-CG2 4.32Å; V183-L259 HydrophobicContact CG1-CD1 4.11Å; V183-L259 HydrophobicContact CG2-CD1 4.32Å; V183-L259 HydrophobicContact CG2-CG 4.18Å; V183-W273 HydrophobicContact CB-CH2 4.36Å; V183-W273 HydrophobicContact CG1-CH2 3.81Å; V183-W273 HydrophobicContact CG1-CZ2 4.35Å; V183-W273 WeakPolarHBondContact O-CH2 2.92Å |
| 184 | A | 98.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63.5 | -37.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L160 V163 L164 Q180 G181 L187 L188 L200 | L160-A184 HydrophobicContact CD1-CB 3.54Å; V163-A184 HydrophobicContact CG1-CB 4.35Å; L164-A184 HydrophobicContact CD2-CB 3.61Å; L164-A184 HydrophobicContact CG-CB 4.03Å; Q180-A184 WeakPolarHBondContact O-CB 3.46Å; Q180-A184 PolarHBondContact O-N 3.09Å; G181-A184 PolarHBondContact O-N 2.91Å; A184-L187 PolarHBondContact O-N 3.31Å; A184-L188 PolarHBondContact O-N 3.41Å; A184-L200 HydrophobicContact CB-CD2 4.15Å |
| 185 | A | 98.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -64 | -46.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q142 F143 F149 L160 G181 V183 L187 L188 M189 | Q142-A185 HydrophobicContact CB-CB 4.39Å; F143-A185 HydrophobicContact CD2-CB 3.66Å; F143-A185 HydrophobicContact CE2-CB 3.81Å; F149-A185 HydrophobicContact CE2-CB 4Å; F149-A185 HydrophobicContact CZ-CB 3.86Å; L160-A185 HydrophobicContact CD1-CB 4.16Å; L160-A185 HydrophobicContact CD2-CB 4.09Å; G181-A185 WeakPolarHBondContact O-CB 3.47Å; G181-A185 PolarHBondContact O-N 2.9Å; V183-A185 VanDerWaalsContact C-N 3.32Å; V183-A185 PolarHBondContact O-N 3.19Å; A185-L187 VanDerWaalsContact C-N 3.28Å; A185-L187 PolarHBondContact O-N 3Å; A185-L188 PolarHBondContact O-N 2.75Å; A185-M189 VanDerWaalsContact O-CG 3.3Å; A185-M189 WeakPolarHBondContact O-CG 3.48Å; A185-M189 PolarHBondContact O-N 2.8Å |
| 186 | V | 98.4 | Very high | 97.2 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -61 | -37.7 | 176.1 | 172.9 | 0 | 0 | 0 | 0 | 111.8 | W102 F143 P182 V183 H190 A261 F266 L270 W273 | W102-V186 HydrophobicContact CH2-CG1 4.19Å; W102-V186 HydrophobicContact CZ3-CG1 4.46Å; F143-V186 HydrophobicContact CE2-CG2 3.8Å; F143-V186 HydrophobicContact CZ-CG2 3.59Å; P182-V186 VanDerWaalsContact O-CG2 3.32Å; P182-V186 WeakPolarHBondContact O-CG2 3.34Å; P182-V186 PolarHBondContact O-N 3.44Å; P182-V186 VanDerWaalsContact O-N 3.08Å; V183-V186 PolarHBondContact O-N 2.95Å; V186-H190 PolarHBondContact O-ND1 2.91Å; V186-A261 HydrophobicContact CG2-CB 4.01Å; V186-F266 HydrophobicContact CG2-CE2 4.23Å; V186-L270 HydrophobicContact CG1-CD2 4.33Å; V186-W273 HydrophobicContact CB-CH2 3.59Å; V186-W273 HydrophobicContact CB-CZ2 3.96Å; V186-W273 HydrophobicContact CB-CZ3 4.02Å; V186-W273 HydrophobicContact CG1-CD2 4.17Å; V186-W273 HydrophobicContact CG1-CE3 3.88Å; V186-W273 HydrophobicContact CG1-CH2 3.61Å; V186-W273 HydrophobicContact CG1-CZ2 3.89Å; V186-W273 HydrophobicContact CG1-CZ3 3.6Å; V186-W273 HydrophobicContact CG2-CH2 4.41Å; V186-W273 HydrophobicContact CG2-CZ2 4.31Å |
| 187 | L | 98.6 | Very high | 97.4 | Very high | 1 Ų | 1 | 20.1 Ų | 20.1 | 1% | 0.005 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -62.9 | -49.3 | 174.1 | -69.4 | 169.2 | 0 | 0 | 0 | 111 | W102 V183 A184 A185 M189 H190 L191 A196 C199 L200 I203 W273 | W102-L187 HydrophobicContact CE3-CD2 4.15Å; W102-L187 HydrophobicContact CZ3-CD2 4.32Å; V183-L187 HydrophobicContact CG1-CD1 4.42Å; V183-L187 WeakPolarHBondContact O-CG 3.47Å; V183-L187 PolarHBondContact O-N 3Å; V183-L187 VanDerWaalsContact O-N 3.16Å; A184-L187 PolarHBondContact O-N 3.31Å; A185-L187 VanDerWaalsContact C-N 3.28Å; A185-L187 PolarHBondContact O-N 3Å; L187-M189 VanDerWaalsContact C-N 3.28Å; L187-M189 PolarHBondContact O-N 3.07Å; L187-H190 CarbonylContact O-C 3.36Å; L187-H190 PolarHBondContact O-N 3.15Å; L187-L191 HydrophobicContact CB-CD1 4.28Å; L187-L191 HydrophobicContact CD2-CD1 3.8Å; L187-L191 VanDerWaalsContact O-CB 3.29Å; L187-L191 WeakPolarHBondContact O-CB 2.98Å; L187-L191 PolarHBondContact O-N 3.33Å; L187-A196 HydrophobicContact CB-CB 3.89Å; L187-C199 HydrophobicContact CD1-CB 3.99Å; L187-C199 HydrophobicContact CD2-CB 3.67Å; L187-C199 HydrophobicContact CG-CB 4.45Å; L187-L200 HydrophobicContact CD1-CB 3.92Å; L187-I203 HydrophobicContact CD1-CD1 4.26Å; L187-I203 HydrophobicContact CD2-CD1 4.47Å; L187-W273 HydrophobicContact CD2-CZ3 3.75Å; L187-W273 HydrophobicContact CG-CH2 4.33Å; L187-W273 HydrophobicContact CG-CZ3 3.87Å |
| 188 | L | 97.9 | Very high | 97.6 | Very high | 14 Ų | 14 | 19.4 Ų | 19.4 | 7% | 0.073 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -64 | -28.4 | 179.7 | -81.8 | 171.8 | 0 | 0 | 0 | 114.1 | M148 F149 L160 V163 A184 A185 H190 P193 A196 | M148-L188 HydrophobicContact SD-CB 4.45Å; F149-L188 HydrophobicContact CZ-CB 4.37Å; L160-L188 HydrophobicContact CB-CD1 3.88Å; L160-L188 HydrophobicContact CD1-CD1 4.02Å; V163-L188 HydrophobicContact CB-CD1 4.44Å; V163-L188 HydrophobicContact CG2-CD1 4.15Å; V163-L188 HydrophobicContact CG2-CD2 4.03Å; V163-L188 HydrophobicContact CG2-CG 4.32Å; A184-L188 PolarHBondContact O-N 3.41Å; A185-L188 PolarHBondContact O-N 2.75Å; L188-H190 PolarHBondContact O-N 3.02Å; L188-P193 HydrophobicContact CD2-CB 4.2Å; L188-P193 HydrophobicContact CD2-CG 4.11Å; L188-A196 HydrophobicContact CD2-CB 3.91Å; L188-A196 HydrophobicContact CG-CB 4.05Å |
| 189 | M | 97.1 | Very high | 97.9 | Very high | 28 Ų | 28 | 14.9 Ų | 14.9 | 14% | 0.138 | 8% | 0.082 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -21.5 | 171.7 | -68.4 | 167 | -179 | 0 | 0 | 112.8 | F42 F143 H146 M148 F149 A185 L187 F266 | F42-M189 HydrophobicContact CZ-CE 4.22Å; F143-M189 HydrophobicContact CB-CE 3.67Å; F143-M189 HydrophobicContact CD1-CE 3.93Å; F143-M189 HydrophobicContact CD2-CE 3.44Å; F143-M189 VanDerWaalsContact CD2-CE 3.44Å; F143-M189 HydrophobicContact CE1-CE 4.39Å; F143-M189 HydrophobicContact CE2-CE 3.96Å; F143-M189 HydrophobicContact CG-CE 3.4Å; F143-M189 HydrophobicContact CZ-CE 4.39Å; H146-M189 HydrophobicContact CB-CE 4.18Å; M148-M189 HydrophobicContact SD-CG 4.44Å; F149-M189 HydrophobicContact CD2-CE 3.86Å; F149-M189 HydrophobicContact CE2-CE 3.46Å; F149-M189 VanDerWaalsContact CE2-CE 3.46Å; F149-M189 HydrophobicContact CE2-CG 3.79Å; F149-M189 HydrophobicContact CE2-SD 4.44Å; F149-M189 HydrophobicContact CZ-CG 4.41Å; A185-M189 VanDerWaalsContact O-CG 3.3Å; A185-M189 WeakPolarHBondContact O-CG 3.48Å; A185-M189 PolarHBondContact O-N 2.8Å; L187-M189 VanDerWaalsContact C-N 3.28Å; L187-M189 PolarHBondContact O-N 3.07Å; M189-F266 HydrophobicContact CE-CE2 4.37Å; M189-F266 HydrophobicContact SD-CE2 3.54Å; M189-F266 VanDerWaalsContact SD-CE2 3.54Å; M189-F266 HydrophobicContact SD-CZ 3.44Å; M189-F266 WeakPolarHBondContact SD-CZ 3.49Å |
| 190 | H | 97.1 | Very high | 98.1 | Very high | 32 Ų | 32 | 14.6 Ų | 14.6 | 15% | 0.148 | 8% | 0.08 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -122 | -17.2 | -173.9 | -63.7 | 82.6 | 0 | 0 | 0 | 114.3 | A99 W102 V186 L187 L188 F266 L270 | A99-H190 WeakPolarHBondContact CB-O 3.44Å; W102-H190 HydrophobicContact CE3-CB 4.42Å; W102-H190 AromaticContact CH2-ND1 3.95Å; W102-H190 HydrophobicContact CZ3-CB 4.02Å; W102-H190 AromaticContact CZ3-CG 3.95Å; W102-H190 AromaticContact CZ3-ND1 3.92Å; V186-H190 PolarHBondContact O-ND1 2.91Å; L187-H190 CarbonylContact O-C 3.36Å; L187-H190 PolarHBondContact O-N 3.15Å; L188-H190 PolarHBondContact O-N 3.02Å; H190-F266 AromaticContact CE1-CZ 3.95Å; H190-L270 VanDerWaalsContact CE1-CD2 3.41Å; H190-L270 WeakPolarHBondContact CE1-CD2 3.44Å |
| 191 | L | 97.9 | Very high | 98.2 | Very high | 9 Ų | 9 | 14.9 Ų | 14.9 | 5% | 0.047 | 8% | 0.082 | C | C | . | . | S | Bend | trans | -131.9 | 147.5 | -167.5 | -63.8 | 167.6 | 0 | 0 | 0 | 110.8 | A99 W102 P103 L187 E195 A196 C199 | A99-L191 HydrophobicContact CB-CD2 4.29Å; A99-L191 VanDerWaalsContact O-CD2 3.31Å; A99-L191 WeakPolarHBondContact O-CD2 3.09Å; W102-L191 HydrophobicContact CE3-CD1 4.33Å; P103-L191 HydrophobicContact CG-CD2 3.73Å; L187-L191 HydrophobicContact CB-CD1 4.28Å; L187-L191 HydrophobicContact CD2-CD1 3.8Å; L187-L191 VanDerWaalsContact O-CB 3.29Å; L187-L191 WeakPolarHBondContact O-CB 2.98Å; L187-L191 PolarHBondContact O-N 3.33Å; L191-E195 HydrophobicContact CB-CB 4.23Å; L191-E195 HydrophobicContact CD2-CB 4.26Å; L191-E195 WeakPolarHBondContact CD2-OE2 3.26Å; L191-A196 HydrophobicContact CB-CB 4.11Å; L191-C199 HydrophobicContact CD1-CB 4.25Å |
| 192 | P | 97 | Very high | 98.2 | Very high | 68 Ų | 68 | 15.5 Ų | 15.5 | 44% | 0.442 | 8% | 0.084 | S | C | . | . | trans | -63 | 157 | 166.7 | 29.2 | -33.9 | 0 | 0 | 0 | 110.6 | E194 E195 A196 | P192-E194 PolarHBondContact O-N 3.48Å; P192-E195 HydrophobicContact CG-CB 3.98Å; P192-E195 HydrophobicContact CG-CG 3.82Å; P192-E195 PolarHBondContact O-N 3.35Å; P192-E195 VanDerWaalsContact O-N 3.13Å; P192-A196 PolarHBondContact O-N 3.02Å | ||
| 193 | P | 97.9 | Very high | 98.2 | Very high | 50 Ų | 50 | 15.3 Ų | 15.3 | 33% | 0.325 | 8% | 0.083 | S | C | . | . | H | α-helix | trans | -55.4 | -41.4 | -170.8 | -29 | 35.5 | 0 | 0 | 0 | 115.8 | Y119 V163 L188 A196 F197 | Y119-P193 HydrophobicContact CE1-CB 3.98Å; Y119-P193 VanDerWaalsContact OH-CB 3.24Å; Y119-P193 WeakPolarHBondContact OH-CB 3.31Å; V163-P193 HydrophobicContact CG2-CB 4.04Å; V163-P193 WeakPolarHBondContact CG2-O 3.33Å; L188-P193 HydrophobicContact CD2-CB 4.2Å; L188-P193 HydrophobicContact CD2-CG 4.11Å; P193-A196 PolarHBondContact O-N 2.65Å; P193-F197 WeakPolarHBondContact O-CB 3.48Å; P193-F197 PolarHBondContact O-N 3.33Å |
| 194 | E | 98.2 | Very high | 98.1 | Very high | 43 Ų | 43 | 15.3 Ų | 15.3 | 20% | 0.201 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.9 | -43.5 | 178.7 | -179.9 | 172.1 | -158.4 | 0 | 0 | 112.2 | Q112 Y119 P192 F197 W198 | Q112-E194 HydrophobicContact CG-CG 4.24Å; Q112-E194 PolarHBondContact NE2-OE2 3.25Å; Y119-E194 HydrophobicContact CD1-CB 3.54Å; Y119-E194 HydrophobicContact CD1-CG 4Å; Y119-E194 HydrophobicContact CE1-CB 4.16Å; Y119-E194 HydrophobicContact CG-CB 3.94Å; Y119-E194 HydrophobicContact CG-CG 3.99Å; P192-E194 PolarHBondContact O-N 3.48Å; E194-F197 WeakPolarHBondContact O-CB 3.17Å; E194-F197 PolarHBondContact O-N 3.1Å; E194-W198 PolarHBondContact O-N 3.19Å |
| 195 | E | 98.4 | Very high | 97.9 | Very high | 56 Ų | 56 | 16.4 Ų | 16.4 | 26% | 0.262 | 9% | 0.088 | S | C | . | . | H | α-helix | trans | -68.4 | -38.5 | 177.7 | -69.3 | -178.5 | -165.3 | 0 | 0 | 111.3 | P103 L191 P192 F197 W198 C199 | P103-E195 HydrophobicContact CG-CB 4.44Å; L191-E195 HydrophobicContact CB-CB 4.23Å; L191-E195 HydrophobicContact CD2-CB 4.26Å; L191-E195 WeakPolarHBondContact CD2-OE2 3.26Å; P192-E195 HydrophobicContact CG-CB 3.98Å; P192-E195 HydrophobicContact CG-CG 3.82Å; P192-E195 PolarHBondContact O-N 3.35Å; P192-E195 VanDerWaalsContact O-N 3.13Å; E195-F197 VanDerWaalsContact C-N 3.35Å; E195-W198 PolarHBondContact O-N 2.85Å; E195-C199 WeakPolarHBondContact O-CB 3.42Å; E195-C199 PolarHBondContact O-N 3.06Å; E195-C199 PolarHBondContact O-SG 2.93Å |
| 196 | A | 98.8 | Very high | 97.7 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -60.3 | -44.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | V163 L187 L188 L191 P192 P193 C199 L200 | V163-A196 HydrophobicContact CG2-CB 4.5Å; L187-A196 HydrophobicContact CB-CB 3.89Å; L188-A196 HydrophobicContact CD2-CB 3.91Å; L188-A196 HydrophobicContact CG-CB 4.05Å; L191-A196 HydrophobicContact CB-CB 4.11Å; P192-A196 PolarHBondContact O-N 3.02Å; P193-A196 PolarHBondContact O-N 2.65Å; A196-C199 PolarHBondContact O-N 2.89Å; A196-L200 WeakPolarHBondContact O-CB 3.28Å; A196-L200 PolarHBondContact O-N 3.36Å |
| 197 | F | 98.8 | Very high | 97.6 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -57.5 | -51.7 | 174.5 | 164.9 | -99.4 | 0 | 0 | 0 | 111.9 | Y119 L122 V163 A166 Y170 P193 E194 E195 C199 L200 V201 | Y119-F197 HydrophobicContact CD2-CB 3.48Å; Y119-F197 VanDerWaalsContact CD2-CB 3.48Å; Y119-F197 AromaticContact CD2-CD1 3.7Å; Y119-F197 HydrophobicContact CD2-CD1 3.7Å; Y119-F197 AromaticContact CD2-CD2 3.99Å; Y119-F197 HydrophobicContact CD2-CD2 3.99Å; Y119-F197 HydrophobicContact CD2-CE1 4.43Å; Y119-F197 AromaticContact CD2-CG 3.44Å; Y119-F197 HydrophobicContact CD2-CG 3.44Å; Y119-F197 VanDerWaalsContact CD2-CG 3.44Å; Y119-F197 HydrophobicContact CE2-CB 3.7Å; Y119-F197 HydrophobicContact CE2-CD2 4.4Å; Y119-F197 HydrophobicContact CE2-CG 4.03Å; Y119-F197 HydrophobicContact CG-CB 4.38Å; Y119-F197 HydrophobicContact CG-CD1 4.24Å; Y119-F197 HydrophobicContact CG-CG 4.37Å; L122-F197 HydrophobicContact CD1-CE1 4.42Å; L122-F197 HydrophobicContact CD1-CE2 4.26Å; L122-F197 HydrophobicContact CD1-CZ 3.7Å; V163-F197 HydrophobicContact CG1-CB 4.27Å; A166-F197 HydrophobicContact CB-CD2 3.84Å; A166-F197 HydrophobicContact CB-CE2 3.88Å; Y170-F197 HydrophobicContact CD1-CZ 4.35Å; Y170-F197 HydrophobicContact CD2-CZ 4.14Å; Y170-F197 HydrophobicContact CG-CE2 4.47Å; Y170-F197 AromaticContact CG-CZ 3.9Å; Y170-F197 HydrophobicContact CG-CZ 3.9Å; P193-F197 WeakPolarHBondContact O-CB 3.48Å; P193-F197 PolarHBondContact O-N 3.33Å; E194-F197 WeakPolarHBondContact O-CB 3.17Å; E194-F197 PolarHBondContact O-N 3.1Å; E195-F197 VanDerWaalsContact C-N 3.35Å; F197-C199 VanDerWaalsContact C-N 3.32Å; F197-C199 PolarHBondContact O-N 3.04Å; F197-L200 WeakPolarHBondContact O-CB 3.4Å; F197-L200 PolarHBondContact O-N 3.34Å; F197-L200 VanDerWaalsContact O-N 3.14Å; F197-V201 HydrophobicContact CD2-CG2 4.38Å; F197-V201 HydrophobicContact CE1-CG2 4.19Å; F197-V201 HydrophobicContact CE2-CG2 3.95Å; F197-V201 HydrophobicContact CZ-CG2 3.85Å; F197-V201 WeakPolarHBondContact O-CG2 3.4Å; F197-V201 PolarHBondContact O-N 3.13Å |
| 198 | W | 98.7 | Very high | 97.5 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 0% | 0.004 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -67.3 | -32.5 | -179.6 | -73.4 | 116.4 | 0 | 0 | 0 | 113.1 | A108 C111 Q112 T118 Y170 E194 E195 V201 Q202 | A108-W198 HydrophobicContact CB-CB 3.72Å; C111-W198 HydrophobicContact CB-CD2 3.91Å; C111-W198 HydrophobicContact CB-CE3 3.47Å; C111-W198 VanDerWaalsContact CB-CE3 3.47Å; C111-W198 HydrophobicContact CB-CH2 4.48Å; C111-W198 HydrophobicContact CB-CZ3 3.8Å; Q112-W198 HydrophobicContact CB-CG 4.14Å; T118-W198 HydrophobicContact CG2-CH2 4.28Å; T118-W198 HydrophobicContact CG2-CZ2 4.27Å; Y170-W198 HydrophobicContact CE2-CH2 4.24Å; Y170-W198 HydrophobicContact CE2-CZ3 4.3Å; Y170-W198 AromaticContact CZ-CZ3 3.98Å; E194-W198 PolarHBondContact O-N 3.19Å; E195-W198 PolarHBondContact O-N 2.85Å; W198-V201 HydrophobicContact CE3-CB 4.31Å; W198-V201 HydrophobicContact CE3-CG1 4.35Å; W198-V201 HydrophobicContact CE3-CG2 4.38Å; W198-V201 HydrophobicContact CZ3-CG1 4.48Å; W198-V201 PolarHBondContact O-N 2.88Å; W198-Q202 WeakPolarHBondContact O-CG 3.26Å; W198-Q202 PolarHBondContact O-N 3.37Å |
| 199 | C | 98.8 | Very high | 97.2 | Very high | 1 Ų | 1 | 17.4 Ų | 17.4 | 1% | 0.007 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.8 | -41.3 | 171.5 | -70.7 | 0 | 0 | 0 | 0 | 111.7 | C106 L187 L191 E195 A196 F197 Q202 I203 | C106-C199 VanDerWaalsContact SG-SG 3.62Å; L187-C199 HydrophobicContact CD1-CB 3.99Å; L187-C199 HydrophobicContact CD2-CB 3.67Å; L187-C199 HydrophobicContact CG-CB 4.45Å; L191-C199 HydrophobicContact CD1-CB 4.25Å; E195-C199 WeakPolarHBondContact O-CB 3.42Å; E195-C199 PolarHBondContact O-N 3.06Å; E195-C199 PolarHBondContact O-SG 2.93Å; A196-C199 PolarHBondContact O-N 2.89Å; F197-C199 VanDerWaalsContact C-N 3.32Å; F197-C199 PolarHBondContact O-N 3.04Å; C199-Q202 PolarHBondContact O-N 3.2Å; C199-I203 WeakPolarHBondContact O-CG1 3.28Å; C199-I203 PolarHBondContact O-N 2.91Å |
| 200 | L | 98.7 | Very high | 96.9 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -61.3 | -46 | 175 | -178.2 | 65.6 | 0 | 0 | 0 | 110.7 | V163 L164 Y167 V183 A184 L187 A196 F197 Q202 I203 C204 | V163-L200 HydrophobicContact CG1-CD2 4.09Å; L164-L200 HydrophobicContact CD2-CD2 4.2Å; Y167-L200 HydrophobicContact CD2-CD2 3.93Å; Y167-L200 HydrophobicContact CD2-CG 3.97Å; Y167-L200 HydrophobicContact CE2-CG 4.4Å; Y167-L200 HydrophobicContact CG-CD2 4.06Å; V183-L200 HydrophobicContact CB-CD1 4.41Å; V183-L200 HydrophobicContact CG1-CD1 3.92Å; A184-L200 HydrophobicContact CB-CD2 4.15Å; L187-L200 HydrophobicContact CD1-CB 3.92Å; A196-L200 WeakPolarHBondContact O-CB 3.28Å; A196-L200 PolarHBondContact O-N 3.36Å; F197-L200 WeakPolarHBondContact O-CB 3.4Å; F197-L200 PolarHBondContact O-N 3.34Å; F197-L200 VanDerWaalsContact O-N 3.14Å; L200-Q202 VanDerWaalsContact C-N 3.33Å; L200-Q202 PolarHBondContact O-N 2.91Å; L200-I203 PolarHBondContact O-N 3.1Å; L200-I203 VanDerWaalsContact O-N 3.16Å; L200-C204 PolarHBondContact O-N 3.16Å; L200-C204 PolarHBondContact O-SG 2.9Å; L200-C204 VanDerWaalsContact O-SG 3.36Å |
| 201 | V | 98.1 | Very high | 96.8 | Very high | 6 Ų | 6 | 16 Ų | 16 | 4% | 0.036 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -54.9 | -47.6 | 173.5 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | Y167 Y170 F197 W198 I203 C204 E205 | Y167-V201 HydrophobicContact CD2-CG2 4.02Å; Y167-V201 HydrophobicContact CE2-CG2 4.25Å; Y170-V201 HydrophobicContact CD1-CG1 4.2Å; Y170-V201 HydrophobicContact CD1-CG2 3.77Å; Y170-V201 HydrophobicContact CE1-CB 4.49Å; Y170-V201 HydrophobicContact CE1-CG1 3.61Å; Y170-V201 HydrophobicContact CE1-CG2 3.97Å; F197-V201 HydrophobicContact CD2-CG2 4.38Å; F197-V201 HydrophobicContact CE1-CG2 4.19Å; F197-V201 HydrophobicContact CE2-CG2 3.95Å; F197-V201 HydrophobicContact CZ-CG2 3.85Å; F197-V201 WeakPolarHBondContact O-CG2 3.4Å; F197-V201 PolarHBondContact O-N 3.13Å; W198-V201 HydrophobicContact CE3-CB 4.31Å; W198-V201 HydrophobicContact CE3-CG1 4.35Å; W198-V201 HydrophobicContact CE3-CG2 4.38Å; W198-V201 HydrophobicContact CZ3-CG1 4.48Å; W198-V201 PolarHBondContact O-N 2.88Å; V201-I203 PolarHBondContact O-N 2.92Å; V201-C204 PolarHBondContact O-N 3.43Å; V201-E205 HydrophobicContact CG1-CG 4.13Å; V201-E205 VanDerWaalsContact O-CB 3.23Å; V201-E205 WeakPolarHBondContact O-CB 3.49Å; V201-E205 VanDerWaalsContact O-CG 3.3Å; V201-E205 WeakPolarHBondContact O-CG 3.43Å; V201-E205 PolarHBondContact O-N 3.23Å |
| 202 | Q | 98.1 | Very high | 96.5 | Very high | 12 Ų | 12 | 15.8 Ų | 15.8 | 6% | 0.056 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -61.8 | -43.5 | 177.2 | -75.2 | -65.7 | -32.3 | 0 | 0 | 112.5 | C106 A108 C111 W198 C199 L200 V206 Y207 | C106-Q202 HydrophobicContact CB-CB 4.06Å; C106-Q202 HydrophobicContact CB-CG 4.48Å; C106-Q202 VanDerWaalsContact O-CG 3.26Å; C106-Q202 WeakPolarHBondContact O-CG 3.49Å; C106-Q202 PolarHBondContact O-OE1 3.09Å; A108-Q202 HydrophobicContact CB-CG 4.17Å; C111-Q202 PolarHBondContact SG-NE2 3.17Å; W198-Q202 WeakPolarHBondContact O-CG 3.26Å; W198-Q202 PolarHBondContact O-N 3.37Å; C199-Q202 PolarHBondContact O-N 3.2Å; L200-Q202 VanDerWaalsContact C-N 3.33Å; L200-Q202 PolarHBondContact O-N 2.91Å; Q202-V206 WeakPolarHBondContact O-CA 3.24Å; Q202-V206 VanDerWaalsContact O-CB 3.29Å; Q202-V206 WeakPolarHBondContact O-CB 3.38Å; Q202-V206 PolarHBondContact O-N 3.45Å; Q202-V206 VanDerWaalsContact OE1-CG2 3.23Å; Q202-Y207 WeakPolarHBondContact O-CD2 3.38Å; Q202-Y207 PolarHBondContact O-N 2.91Å; Q202-Y207 VanDerWaalsContact O-N 3.12Å |
| 203 | I | 98.3 | Very high | 96 | Very high | 1 Ų | 1 | 13.3 Ų | 13.3 | 1% | 0.005 | 8% | 0.082 | C | C | . | . | I | π-helix | trans | -61.7 | -49 | 179.7 | -71.9 | 171 | 0 | 0 | 0 | 110.7 | V183 L187 C199 L200 V201 Y207 L208 L259 W273 F276 L277 | V183-I203 HydrophobicContact CG1-CD1 4.06Å; V183-I203 HydrophobicContact CG1-CG2 4.32Å; L187-I203 HydrophobicContact CD1-CD1 4.26Å; L187-I203 HydrophobicContact CD2-CD1 4.47Å; C199-I203 WeakPolarHBondContact O-CG1 3.28Å; C199-I203 PolarHBondContact O-N 2.91Å; L200-I203 PolarHBondContact O-N 3.1Å; L200-I203 VanDerWaalsContact O-N 3.16Å; V201-I203 PolarHBondContact O-N 2.92Å; I203-Y207 WeakPolarHBondContact O-CB 3.08Å; I203-Y207 PolarHBondContact O-N 3.17Å; I203-L208 HydrophobicContact CG2-CD1 4.32Å; I203-L208 WeakPolarHBondContact O-CB 3.19Å; I203-L208 PolarHBondContact O-N 3.33Å; I203-L259 HydrophobicContact CD1-CD1 4.14Å; I203-L259 HydrophobicContact CG2-CD1 4Å; I203-W273 HydrophobicContact CD1-CZ3 4.46Å; I203-F276 HydrophobicContact CG1-CE1 4.27Å; I203-L277 HydrophobicContact CD1-CD2 4.49Å; I203-L277 HydrophobicContact CG1-CD2 4.33Å |
| 204 | C | 96.3 | Very high | 95.1 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 10% | 0.1 | C | C | . | . | I | π-helix | trans | -71.8 | -43.1 | -176.8 | -61.8 | 0 | 0 | 0 | 0 | 112.6 | Y167 L200 V201 L208 P209 Y212 | Y167-C204 HydrophobicContact CE2-CB 3.83Å; Y167-C204 WeakPolarHBondContact OH-CB 3.5Å; L200-C204 PolarHBondContact O-N 3.16Å; L200-C204 PolarHBondContact O-SG 2.9Å; L200-C204 VanDerWaalsContact O-SG 3.36Å; V201-C204 PolarHBondContact O-N 3.43Å; C204-L208 CarbonylContact O-C 3.59Å; C204-P209 VanDerWaalsContact O-CA 3.32Å; C204-P209 WeakPolarHBondContact O-CA 3.45Å; C204-Y212 HydrophobicContact CB-CD2 3.84Å; C204-Y212 HydrophobicContact CB-CE2 4.16Å; C204-Y212 WeakPolarHBondContact SG-CD2 3.39Å; C204-Y212 WeakPolarHBondContact SG-CE2 3.4Å |
| 205 | E | 93.4 | Very high | 94.3 | Very high | 22 Ų | 22 | 19.6 Ų | 19.6 | 10% | 0.103 | 12% | 0.116 | C | C | . | . | I | π-helix | trans | -90.1 | -30.4 | -170.7 | -60.8 | -54 | 95 | 0 | 0 | 113.9 | Y167 R171 Q174 V201 | Y167-E205 PolarHBondContact OH-OE1 2.86Å; R171-E205 IonicContact CZ-OE2 3.43Å; R171-E205 IonicContact NE-OE2 2.89Å; R171-E205 PolarHBondContact NE-OE2 3.22Å; R171-E205 IonicContact NH1-OE2 3.03Å; R171-E205 IonicContact NH2-OE2 3.9Å; R171-E205 PolarHBondContact NH2-OE2 2.91Å; Q174-E205 VanDerWaalsContact NE2-CD 3.33Å; Q174-E205 PolarHBondContact NE2-OE1 3.14Å; Q174-E205 PolarHBondContact NE2-OE2 3.01Å; Q174-E205 PolarHBondContact OE1-OE1 3.3Å; V201-E205 HydrophobicContact CG1-CG 4.13Å; V201-E205 VanDerWaalsContact O-CB 3.23Å; V201-E205 WeakPolarHBondContact O-CB 3.49Å; V201-E205 VanDerWaalsContact O-CG 3.3Å; V201-E205 WeakPolarHBondContact O-CG 3.43Å; V201-E205 PolarHBondContact O-N 3.23Å |
| 206 | V | 95.2 | Very high | 93.6 | Very high | 32 Ų | 32 | 20 Ų | 20 | 19% | 0.194 | 12% | 0.119 | C | C | . | . | I | π-helix | trans | -112.2 | -42.9 | -168.9 | 179.9 | 0 | 0 | 0 | 0 | 111.8 | Q202 R367 L368 I374 | Q202-V206 WeakPolarHBondContact O-CA 3.24Å; Q202-V206 VanDerWaalsContact O-CB 3.29Å; Q202-V206 WeakPolarHBondContact O-CB 3.38Å; Q202-V206 PolarHBondContact O-N 3.45Å; Q202-V206 VanDerWaalsContact OE1-CG2 3.23Å; V206-R367 WeakPolarHBondContact O-CA 3.33Å; V206-L368 HydrophobicContact CG1-CB 3.86Å; V206-L368 HydrophobicContact CG1-CD1 3.69Å; V206-L368 HydrophobicContact CG1-CG 3.88Å; V206-L368 PolarHBondContact O-N 2.98Å; V206-I374 HydrophobicContact CG1-CD1 3.93Å; V206-I374 HydrophobicContact CG1-CG1 3.9Å |
| 207 | Y | 96.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.134 | C | C | . | . | I | π-helix | trans | -83.6 | -41.5 | 179.3 | -76.6 | -97.9 | 0 | 0 | 0 | 112.6 | C106 Q202 I203 P209 F276 L277 R367 I374 | C106-Y207 HydrophobicContact CB-CE2 3.89Å; Q202-Y207 WeakPolarHBondContact O-CD2 3.38Å; Q202-Y207 PolarHBondContact O-N 2.91Å; Q202-Y207 VanDerWaalsContact O-N 3.12Å; I203-Y207 WeakPolarHBondContact O-CB 3.08Å; I203-Y207 PolarHBondContact O-N 3.17Å; Y207-P209 VanDerWaalsContact C-CD 3.4Å; Y207-F276 HydrophobicContact CD1-CD2 4.47Å; Y207-F276 HydrophobicContact CD1-CE1 4.15Å; Y207-F276 AromaticContact CD1-CE2 3.83Å; Y207-F276 HydrophobicContact CD1-CE2 3.83Å; Y207-F276 AromaticContact CD1-CZ 3.66Å; Y207-F276 HydrophobicContact CD1-CZ 3.66Å; Y207-F276 WeakPolarHBondContact CE1-O 3.47Å; Y207-F276 HydrophobicContact CG-CE1 4.33Å; Y207-F276 HydrophobicContact CG-CE2 4.39Å; Y207-F276 AromaticContact CG-CZ 3.84Å; Y207-F276 HydrophobicContact CG-CZ 3.84Å; Y207-L277 PolarHBondContact OH-O 3.16Å; Y207-R367 WeakPolarHBondContact O-CB 3.48Å; Y207-R367 WeakPolarHBondContact O-CD 3.41Å; Y207-I374 HydrophobicContact CD2-CD1 4.09Å; Y207-I374 HydrophobicContact CE1-CD1 4.34Å; Y207-I374 HydrophobicContact CE2-CD1 3.19Å; Y207-I374 WeakPolarHBondContact OH-CD1 3.33Å |
| 208 | L | 95.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 14% | 0.135 | C | C | . | . | S | Bend | trans | -131.7 | 48 | -171.2 | -57.4 | 179.4 | 0 | 0 | 0 | 113.3 | I203 C204 G210 Y211 Y212 L259 F276 A281 L284 | I203-L208 HydrophobicContact CG2-CD1 4.32Å; I203-L208 WeakPolarHBondContact O-CB 3.19Å; I203-L208 PolarHBondContact O-N 3.33Å; C204-L208 CarbonylContact O-C 3.59Å; L208-G210 PolarHBondContact O-N 3.38Å; L208-Y211 HydrophobicContact CB-CD1 3.98Å; L208-Y211 HydrophobicContact CB-CD2 3.81Å; L208-Y211 HydrophobicContact CB-CE1 4.37Å; L208-Y211 HydrophobicContact CB-CE2 4.24Å; L208-Y211 HydrophobicContact CB-CG 3.69Å; L208-Y211 HydrophobicContact CD1-CD1 3.95Å; L208-Y211 HydrophobicContact CD1-CE1 4.09Å; L208-Y211 HydrophobicContact CD1-CG 4.49Å; L208-Y211 HydrophobicContact CD2-CD1 4.19Å; L208-Y211 HydrophobicContact CD2-CD2 4.39Å; L208-Y211 HydrophobicContact CD2-CE1 3.72Å; L208-Y211 HydrophobicContact CD2-CE2 3.96Å; L208-Y211 HydrophobicContact CG-CD1 4.27Å; L208-Y211 HydrophobicContact CG-CE1 4.28Å; L208-Y211 HydrophobicContact CG-CG 4.44Å; L208-Y211 VanDerWaalsContact O-CB 3.29Å; L208-Y211 WeakPolarHBondContact O-CB 3.41Å; L208-Y211 WeakPolarHBondContact O-CD2 3.46Å; L208-Y211 PolarHBondContact O-N 3.29Å; L208-Y211 VanDerWaalsContact O-N 3.1Å; L208-Y212 HydrophobicContact CB-CE2 4.41Å; L208-L259 HydrophobicContact CD1-CD2 3.53Å; L208-F276 HydrophobicContact CD1-CZ 4.23Å; L208-F276 HydrophobicContact CD2-CE2 4.38Å; L208-F276 HydrophobicContact CG-CZ 4.24Å; L208-A281 HydrophobicContact CD2-CB 4.13Å; L208-L284 HydrophobicContact CD1-CD1 4.3Å; L208-L284 HydrophobicContact CD2-CD1 3.86Å |
| 209 | P | 92.9 | Very high | 92.3 | Very high | 4 Ų | 4 | 23.4 Ų | 23.4 | 3% | 0.026 | 14% | 0.135 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | 134.8 | 178.5 | 26.1 | -35.2 | 0 | 0 | 0 | 111.2 | C204 Y207 Y211 A218 Q365 R367 | C204-P209 VanDerWaalsContact O-CA 3.32Å; C204-P209 WeakPolarHBondContact O-CA 3.45Å; Y207-P209 VanDerWaalsContact C-CD 3.4Å; P209-Y211 VanDerWaalsContact C-N 3.3Å; P209-Y211 PolarHBondContact O-N 3.22Å; P209-A218 WeakPolarHBondContact O-CB 3.39Å; P209-Q365 HydrophobicContact CB-CB 3.8Å; P209-Q365 HydrophobicContact CB-CG 4.39Å; P209-Q365 HydrophobicContact CG-CB 4.12Å; P209-Q365 VanDerWaalsContact CG-O 3.32Å; P209-Q365 WeakPolarHBondContact CG-O 3.33Å; P209-R367 HydrophobicContact CG-CB 3.95Å |
| 210 | G | 90.6 | Very high | 92 | Very high | 32 Ų | 32 | 30.4 Ų | 30.4 | 33% | 0.33 | 16% | 0.162 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 79.2 | 5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | L208 A218 | L208-G210 PolarHBondContact O-N 3.38Å; G210-A218 PolarHBondContact O-N 3.25Å |
| 211 | Y | 93.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 17% | 0.165 | C | C | . | . | S | Bend | trans | -75.7 | -43.1 | 174.3 | -88.1 | -132.4 | 0 | 0 | 0 | 112.5 | L208 P209 A218 V219 D222 F256 L257 R367 | L208-Y211 HydrophobicContact CB-CD1 3.98Å; L208-Y211 HydrophobicContact CB-CD2 3.81Å; L208-Y211 HydrophobicContact CB-CE1 4.37Å; L208-Y211 HydrophobicContact CB-CE2 4.24Å; L208-Y211 HydrophobicContact CB-CG 3.69Å; L208-Y211 HydrophobicContact CD1-CD1 3.95Å; L208-Y211 HydrophobicContact CD1-CE1 4.09Å; L208-Y211 HydrophobicContact CD1-CG 4.49Å; L208-Y211 HydrophobicContact CD2-CD1 4.19Å; L208-Y211 HydrophobicContact CD2-CD2 4.39Å; L208-Y211 HydrophobicContact CD2-CE1 3.72Å; L208-Y211 HydrophobicContact CD2-CE2 3.96Å; L208-Y211 HydrophobicContact CG-CD1 4.27Å; L208-Y211 HydrophobicContact CG-CE1 4.28Å; L208-Y211 HydrophobicContact CG-CG 4.44Å; L208-Y211 VanDerWaalsContact O-CB 3.29Å; L208-Y211 WeakPolarHBondContact O-CB 3.41Å; L208-Y211 WeakPolarHBondContact O-CD2 3.46Å; L208-Y211 PolarHBondContact O-N 3.29Å; L208-Y211 VanDerWaalsContact O-N 3.1Å; P209-Y211 VanDerWaalsContact C-N 3.3Å; P209-Y211 PolarHBondContact O-N 3.22Å; Y211-A218 HydrophobicContact CD2-CB 3.47Å; Y211-A218 VanDerWaalsContact CD2-CB 3.47Å; Y211-A218 HydrophobicContact CE2-CB 3.75Å; Y211-V219 HydrophobicContact CD1-CG2 3.83Å; Y211-V219 HydrophobicContact CD2-CG2 4.4Å; Y211-V219 HydrophobicContact CE1-CG2 4.28Å; Y211-V219 HydrophobicContact CG-CG2 3.89Å; Y211-D222 PolarHBondContact OH-OD2 3.37Å; Y211-F256 HydrophobicContact CE1-CB 4.06Å; Y211-F256 HydrophobicContact CE1-CD2 4.43Å; Y211-L257 HydrophobicContact CD1-CD2 3.99Å; Y211-L257 HydrophobicContact CG-CD2 4.39Å; Y211-L257 WeakPolarHBondContact O-CD2 3.03Å; Y211-R367 PolarHBondContact OH-NH1 3.36Å |
| 212 | Y | 92.5 | Very high | 91.7 | Very high | 4 Ų | 4 | 30.9 Ų | 30.9 | 2% | 0.016 | 16% | 0.164 | C | C | . | . | S | Bend | trans | -97.4 | 1.6 | -170.8 | -57 | -73.7 | 0 | 0 | 0 | 113.8 | C177 A179 Q180 C204 L208 L257 | C177-Y212 HydrophobicContact CB-CD1 4.01Å; A179-Y212 HydrophobicContact CB-CE1 4.32Å; Q180-Y212 HydrophobicContact CG-CD1 3.43Å; Q180-Y212 VanDerWaalsContact CG-CD1 3.43Å; Q180-Y212 HydrophobicContact CG-CE1 3.78Å; Q180-Y212 HydrophobicContact CG-CG 3.85Å; C204-Y212 HydrophobicContact CB-CD2 3.84Å; C204-Y212 HydrophobicContact CB-CE2 4.16Å; C204-Y212 WeakPolarHBondContact SG-CD2 3.39Å; C204-Y212 WeakPolarHBondContact SG-CE2 3.4Å; L208-Y212 HydrophobicContact CB-CE2 4.41Å; Y212-L257 HydrophobicContact CD1-CD2 4.3Å; Y212-L257 HydrophobicContact CE1-CB 4.38Å; Y212-L257 HydrophobicContact CE1-CD2 4.22Å; Y212-L257 WeakPolarHBondContact CE1-O 3.4Å; Y212-L257 PolarHBondContact OH-O 3.46Å |
| 213 | G | 85.7 | Confident | 91.6 | Very high | 16 Ų | 16 | 30.3 Ų | 30.3 | 17% | 0.165 | 16% | 0.161 | C | C | . | . | S | Bend | trans | -74.9 | 164.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | H215 M216 | G213-H215 PolarHBondContact O-N 2.9Å; G213-M216 PolarHBondContact O-N 3.24Å; G213-M216 VanDerWaalsContact O-N 3.07Å |
| 214 | P | 80.2 | Confident | 91.5 | Very high | 108 Ų | 108 | 35 Ų | 35 | 70% | 0.701 | 18% | 0.183 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | -30.3 | -172.8 | -28.1 | 34.8 | 0 | 0 | 0 | 115.6 | ||
| 215 | H | 80.6 | Confident | 91.6 | Very high | 117 Ų | 117 | 35 Ų | 35 | 54% | 0.542 | 18% | 0.183 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -99.2 | -6.5 | -175.9 | -58.1 | -46.9 | 0 | 0 | 0 | 114.1 | G213 E217 R220 | G213-H215 PolarHBondContact O-N 2.9Å; H215-E217 HydrophobicContact CB-CG 3.82Å; H215-E217 PolarHBondContact O-N 3.35Å; H215-R220 VanDerWaalsContact O-CZ 3.31Å; H215-R220 PolarHBondContact O-NE 3Å |
| 216 | M | 84.3 | Confident | 91.8 | Very high | 65 Ų | 65 | 34 Ų | 34 | 32% | 0.32 | 18% | 0.178 | S | C | . | . | trans | 45.1 | 38.2 | -178.4 | -59.5 | -176.4 | 174.4 | 0 | 0 | 113.4 | G213 A218 V219 R220 L257 | G213-M216 PolarHBondContact O-N 3.24Å; G213-M216 VanDerWaalsContact O-N 3.07Å; M216-A218 VanDerWaalsContact C-N 3.26Å; M216-A218 PolarHBondContact O-N 3.38Å; M216-V219 HydrophobicContact CB-CB 4.25Å; M216-V219 HydrophobicContact CB-CG2 4.28Å; M216-V219 PolarHBondContact O-N 2.91Å; M216-R220 PolarHBondContact O-N 2.9Å; M216-R220 VanDerWaalsContact O-N 3.11Å; M216-L257 HydrophobicContact CE-CD1 3.98Å; M216-L257 HydrophobicContact SD-CD1 4.01Å | ||
| 217 | E | 84.9 | Confident | 91.9 | Very high | 68 Ų | 68 | 32.9 Ų | 32.9 | 32% | 0.318 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -57.2 | -41.3 | -171.6 | -65.9 | 176.8 | -175.5 | 0 | 0 | 111.9 | H215 V219 R220 L221 P362 | H215-E217 HydrophobicContact CB-CG 3.82Å; H215-E217 PolarHBondContact O-N 3.35Å; E217-V219 VanDerWaalsContact C-N 3.33Å; E217-V219 PolarHBondContact O-N 2.87Å; E217-R220 PolarHBondContact O-N 3.43Å; E217-L221 PolarHBondContact O-N 3.12Å; E217-P362 HydrophobicContact CB-CB 4.19Å; E217-P362 HydrophobicContact CG-CB 4.44Å; E217-P362 WeakPolarHBondContact OE2-CA 3.46Å; E217-P362 WeakPolarHBondContact OE2-CB 3.4Å |
| 218 | A | 90.9 | Very high | 92 | Very high | 1 Ų | 1 | 33.3 Ų | 33.3 | 1% | 0.008 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.3 | -33.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | P209 G210 Y211 M216 D222 | P209-A218 WeakPolarHBondContact O-CB 3.39Å; G210-A218 PolarHBondContact O-N 3.25Å; Y211-A218 HydrophobicContact CD2-CB 3.47Å; Y211-A218 VanDerWaalsContact CD2-CB 3.47Å; Y211-A218 HydrophobicContact CE2-CB 3.75Å; M216-A218 VanDerWaalsContact C-N 3.26Å; M216-A218 PolarHBondContact O-N 3.38Å; A218-D222 VanDerWaalsContact O-CB 3.24Å; A218-D222 WeakPolarHBondContact O-CB 3.31Å; A218-D222 VanDerWaalsContact O-CG 3.31Å; A218-D222 PolarHBondContact O-N 3.12Å |
| 219 | V | 93.2 | Very high | 92.1 | Very high | 3 Ų | 3 | 33.3 Ų | 33.3 | 2% | 0.018 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -69.7 | -40.5 | 175.8 | -177.9 | 0 | 0 | 0 | 0 | 110.9 | Y211 M216 E217 D222 A223 L249 P253 L257 | Y211-V219 HydrophobicContact CD1-CG2 3.83Å; Y211-V219 HydrophobicContact CD2-CG2 4.4Å; Y211-V219 HydrophobicContact CE1-CG2 4.28Å; Y211-V219 HydrophobicContact CG-CG2 3.89Å; M216-V219 HydrophobicContact CB-CB 4.25Å; M216-V219 HydrophobicContact CB-CG2 4.28Å; M216-V219 PolarHBondContact O-N 2.91Å; E217-V219 VanDerWaalsContact C-N 3.33Å; E217-V219 PolarHBondContact O-N 2.87Å; V219-D222 PolarHBondContact O-N 3.18Å; V219-A223 WeakPolarHBondContact O-CB 3.44Å; V219-A223 PolarHBondContact O-N 3.34Å; V219-L249 HydrophobicContact CG1-CD2 4.44Å; V219-P253 HydrophobicContact CG1-CG 4.33Å; V219-L257 HydrophobicContact CG2-CD2 3.57Å; V219-L257 HydrophobicContact CG2-CG 4.15Å |
| 220 | R | 92.8 | Very high | 92.4 | Very high | 147 Ų | 147 | 33.1 Ų | 33.1 | 56% | 0.555 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -63.7 | -46.2 | 176.5 | -66.4 | 178.1 | -176.3 | 166.5 | 2.1 | 111.2 | H215 M216 E217 D222 A223 E224 | H215-R220 VanDerWaalsContact O-CZ 3.31Å; H215-R220 PolarHBondContact O-NE 3Å; M216-R220 PolarHBondContact O-N 2.9Å; M216-R220 VanDerWaalsContact O-N 3.11Å; E217-R220 PolarHBondContact O-N 3.43Å; R220-D222 VanDerWaalsContact C-N 3.34Å; R220-D222 PolarHBondContact O-N 3.5Å; R220-A223 WeakPolarHBondContact O-CB 3.49Å; R220-A223 PolarHBondContact O-N 3.01Å; R220-E224 PolarHBondContact O-N 2.97Å |
| 221 | L | 93.3 | Very high | 92.7 | Very high | 15 Ų | 15 | 38.4 Ų | 38.4 | 8% | 0.079 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.7 | -47.1 | 173.6 | 177.1 | 62.4 | 0 | 0 | 0 | 111.4 | E217 A223 E224 V225 I346 Q349 L350 P364 | E217-L221 PolarHBondContact O-N 3.12Å; L221-A223 PolarHBondContact O-N 3.04Å; L221-E224 WeakPolarHBondContact O-CB 3.29Å; L221-E224 PolarHBondContact O-N 2.95Å; L221-E224 VanDerWaalsContact O-N 3.13Å; L221-V225 WeakPolarHBondContact O-CG2 3.21Å; L221-V225 PolarHBondContact O-N 3.33Å; L221-I346 HydrophobicContact CD2-CG2 4.24Å; L221-Q349 HydrophobicContact CD1-CB 3.72Å; L221-L350 HydrophobicContact CD1-CD2 4.12Å; L221-L350 HydrophobicContact CD1-CG 4.15Å; L221-L350 HydrophobicContact CD2-CD1 4.41Å; L221-L350 HydrophobicContact CD2-CD2 3.81Å; L221-L350 HydrophobicContact CD2-CG 4Å; L221-P364 HydrophobicContact CD2-CB 4.19Å; L221-P364 HydrophobicContact CD2-CG 3.77Å |
| 222 | D | 96.1 | Very high | 93 | Very high | 1 Ų | 1 | 44.2 Ų | 44.2 | 1% | 0.005 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -68.6 | -22.7 | -178.8 | -79.6 | 12.6 | 0 | 0 | 0 | 112.7 | Y211 A218 V219 R220 F226 F285 R367 | Y211-D222 PolarHBondContact OH-OD2 3.37Å; A218-D222 VanDerWaalsContact O-CB 3.24Å; A218-D222 WeakPolarHBondContact O-CB 3.31Å; A218-D222 VanDerWaalsContact O-CG 3.31Å; A218-D222 PolarHBondContact O-N 3.12Å; V219-D222 PolarHBondContact O-N 3.18Å; R220-D222 VanDerWaalsContact C-N 3.34Å; R220-D222 PolarHBondContact O-N 3.5Å; D222-F226 WeakPolarHBondContact O-CB 3.42Å; D222-F226 PolarHBondContact O-N 3.06Å; D222-F285 HydrophobicContact CB-CE1 4.39Å; D222-F285 HydrophobicContact CB-CZ 3.73Å; D222-F285 WeakPolarHBondContact OD2-CZ 3.48Å; D222-R367 IonicContact OD1-CZ 2.8Å; D222-R367 IonicContact OD1-NH2 3.94Å; D222-R367 PolarHBondContact OD1-NH2 2.77Å; D222-R367 IonicContact OD2-CZ 3.4Å; D222-R367 VanDerWaalsContact OD2-CZ 3.22Å; D222-R367 IonicContact OD2-NH1 2.78Å; D222-R367 PolarHBondContact OD2-NH1 2.77Å; D222-R367 IonicContact OD2-NH2 3.79Å; D222-R367 PolarHBondContact OD2-NH2 2.99Å |
| 223 | A | 96.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.5 | -41.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V219 R220 L221 F226 M227 P248 L249 L252 | V219-A223 WeakPolarHBondContact O-CB 3.44Å; V219-A223 PolarHBondContact O-N 3.34Å; R220-A223 WeakPolarHBondContact O-CB 3.49Å; R220-A223 PolarHBondContact O-N 3.01Å; L221-A223 PolarHBondContact O-N 3.04Å; A223-F226 PolarHBondContact O-N 2.89Å; A223-M227 WeakPolarHBondContact O-CG 3.18Å; A223-M227 PolarHBondContact O-N 2.85Å; A223-P248 HydrophobicContact CB-CB 4Å; A223-P248 HydrophobicContact CB-CG 3.75Å; A223-L249 HydrophobicContact CB-CD2 3.73Å; A223-L249 HydrophobicContact CB-CG 4.04Å; A223-L252 HydrophobicContact CB-CD1 3.94Å |
| 224 | E | 96.3 | Very high | 93.8 | Very high | 100 Ų | 100 | 47.2 Ų | 47.2 | 47% | 0.467 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -65.8 | -43.8 | 173 | -62.9 | -53.1 | 139.6 | 0 | 0 | 111.6 | R220 L221 F226 M227 A228 Q349 | R220-E224 PolarHBondContact O-N 2.97Å; L221-E224 WeakPolarHBondContact O-CB 3.29Å; L221-E224 PolarHBondContact O-N 2.95Å; L221-E224 VanDerWaalsContact O-N 3.13Å; E224-F226 VanDerWaalsContact C-N 3.31Å; E224-F226 PolarHBondContact O-N 2.86Å; E224-M227 PolarHBondContact O-N 3.17Å; E224-A228 PolarHBondContact O-N 3.18Å; E224-Q349 HydrophobicContact CB-CG 4.2Å |
| 225 | V | 97.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.2 | -45.1 | 173.8 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | L221 M227 A228 L229 F285 L342 E345 I346 Q349 | L221-V225 WeakPolarHBondContact O-CG2 3.21Å; L221-V225 PolarHBondContact O-N 3.33Å; V225-M227 VanDerWaalsContact C-N 3.35Å; V225-M227 PolarHBondContact O-N 2.99Å; V225-A228 PolarHBondContact O-N 3.36Å; V225-L229 HydrophobicContact CG1-CD1 4.13Å; V225-L229 VanDerWaalsContact O-CG 3.29Å; V225-L229 WeakPolarHBondContact O-CG 3.32Å; V225-L229 PolarHBondContact O-N 3.1Å; V225-F285 HydrophobicContact CB-CE1 4.13Å; V225-F285 HydrophobicContact CB-CZ 4.46Å; V225-F285 HydrophobicContact CG1-CD1 4.39Å; V225-F285 HydrophobicContact CG1-CE1 3.6Å; V225-F285 HydrophobicContact CG1-CZ 3.98Å; V225-L342 HydrophobicContact CG1-CD1 3.66Å; V225-E345 HydrophobicContact CB-CG 4.21Å; V225-E345 HydrophobicContact CG1-CB 4.02Å; V225-E345 HydrophobicContact CG1-CG 3.74Å; V225-E345 HydrophobicContact CG2-CG 4.31Å; V225-I346 HydrophobicContact CG1-CG1 4.46Å; V225-I346 HydrophobicContact CG2-CB 4.48Å; V225-I346 HydrophobicContact CG2-CG1 3.88Å; V225-Q349 HydrophobicContact CG2-CB 4.24Å; V225-Q349 HydrophobicContact CG2-CG 3.76Å |
| 226 | F | 98.4 | Very high | 95.5 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63.1 | -41 | 178.7 | -168.8 | -95.6 | 0 | 0 | 0 | 111.7 | D222 A223 E224 L229 L230 Y251 L252 W255 F256 F285 L289 V292 | D222-F226 WeakPolarHBondContact O-CB 3.42Å; D222-F226 PolarHBondContact O-N 3.06Å; A223-F226 PolarHBondContact O-N 2.89Å; E224-F226 VanDerWaalsContact C-N 3.31Å; E224-F226 PolarHBondContact O-N 2.86Å; F226-L229 PolarHBondContact O-N 3.46Å; F226-L230 HydrophobicContact CD1-CD1 3.73Å; F226-L230 HydrophobicContact CD1-CG 4.03Å; F226-L230 HydrophobicContact CE1-CD1 3.6Å; F226-L230 HydrophobicContact CE1-CD2 4.18Å; F226-L230 HydrophobicContact CE1-CG 3.84Å; F226-L230 WeakPolarHBondContact O-CG 3.24Å; F226-L230 PolarHBondContact O-N 3.35Å; F226-Y251 HydrophobicContact CD1-CE2 4.37Å; F226-Y251 AromaticContact CE1-CE2 3.81Å; F226-Y251 HydrophobicContact CE1-CE2 3.81Å; F226-L252 HydrophobicContact CB-CD1 3.67Å; F226-L252 HydrophobicContact CD1-CD1 3.97Å; F226-L252 HydrophobicContact CD1-CD2 4.15Å; F226-L252 HydrophobicContact CD1-CG 4.32Å; F226-L252 HydrophobicContact CD2-CD2 4.03Å; F226-L252 HydrophobicContact CE1-CD2 4.26Å; F226-L252 HydrophobicContact CE2-CD2 4.18Å; F226-L252 HydrophobicContact CG-CD1 3.81Å; F226-L252 HydrophobicContact CG-CD2 4.04Å; F226-L252 HydrophobicContact CG-CG 4.42Å; F226-L252 HydrophobicContact CZ-CD2 4.3Å; F226-W255 HydrophobicContact CZ-CZ3 4.47Å; F226-F256 HydrophobicContact CD2-CZ 4.06Å; F226-F256 HydrophobicContact CE2-CZ 4.36Å; F226-F285 HydrophobicContact CB-CD1 4.36Å; F226-F285 HydrophobicContact CB-CE1 4.15Å; F226-F285 AromaticContact CD2-CD1 3.8Å; F226-F285 HydrophobicContact CD2-CD1 3.8Å; F226-F285 HydrophobicContact CD2-CE1 4.35Å; F226-L289 HydrophobicContact CE2-CD2 4.24Å; F226-L289 HydrophobicContact CE2-CG 3.95Å; F226-L289 HydrophobicContact CZ-CD2 4.25Å; F226-L289 HydrophobicContact CZ-CG 4.31Å; F226-V292 HydrophobicContact CE1-CG2 4.13Å; F226-V292 HydrophobicContact CZ-CG2 4.08Å |
| 227 | M | 97.8 | Very high | 96.1 | Very high | 9 Ų | 9 | 43 Ų | 43 | 4% | 0.044 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.3 | -42 | 175 | -79.6 | -61.4 | -63 | 0 | 0 | 113 | A223 E224 V225 L229 L230 R231 H238 Q242 P248 | A223-M227 WeakPolarHBondContact O-CG 3.18Å; A223-M227 PolarHBondContact O-N 2.85Å; E224-M227 PolarHBondContact O-N 3.17Å; V225-M227 VanDerWaalsContact C-N 3.35Å; V225-M227 PolarHBondContact O-N 2.99Å; M227-L229 VanDerWaalsContact C-N 3.32Å; M227-L229 PolarHBondContact O-N 3.35Å; M227-L230 WeakPolarHBondContact O-CB 3.46Å; M227-L230 PolarHBondContact O-N 3.45Å; M227-L230 HydrophobicContact SD-CD1 3.82Å; M227-R231 PolarHBondContact O-N 3.36Å; M227-H238 VanDerWaalsContact CE-CD2 3.5Å; M227-H238 WeakPolarHBondContact CE-CD2 3.38Å; M227-H238 PolarHBondContact O-CD2 3.03Å; M227-Q242 HydrophobicContact CE-CG 4.36Å; M227-P248 HydrophobicContact CG-CB 3.91Å; M227-P248 HydrophobicContact CG-CG 3.45Å; M227-P248 VanDerWaalsContact CG-CG 3.45Å; M227-P248 HydrophobicContact SD-CB 4.3Å; M227-P248 HydrophobicContact SD-CG 4.19Å |
| 228 | A | 98 | Very high | 96.8 | Very high | 9 Ų | 9 | 40.8 Ų | 40.8 | 7% | 0.074 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.5 | -39.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E224 V225 R231 R232 E345 | E224-A228 PolarHBondContact O-N 3.18Å; V225-A228 PolarHBondContact O-N 3.36Å; A228-R231 WeakPolarHBondContact O-CB 3.23Å; A228-R231 PolarHBondContact O-N 3.09Å; A228-R232 PolarHBondContact O-N 2.99Å; A228-E345 HydrophobicContact CB-CG 3.96Å; A228-E345 WeakPolarHBondContact CB-OE1 3.13Å |
| 229 | L | 98.4 | Very high | 97.2 | Very high | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.005 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.2 | -39.9 | 174 | -70.1 | 175.5 | 0 | 0 | 0 | 112.5 | V225 F226 M227 R231 R232 L233 F285 L289 L337 L342 | V225-L229 HydrophobicContact CG1-CD1 4.13Å; V225-L229 VanDerWaalsContact O-CG 3.29Å; V225-L229 WeakPolarHBondContact O-CG 3.32Å; V225-L229 PolarHBondContact O-N 3.1Å; F226-L229 PolarHBondContact O-N 3.46Å; M227-L229 VanDerWaalsContact C-N 3.32Å; M227-L229 PolarHBondContact O-N 3.35Å; L229-R231 VanDerWaalsContact C-N 3.35Å; L229-R232 PolarHBondContact O-N 3.3Å; L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.38Å; L229-L233 PolarHBondContact O-N 3.24Å; L229-F285 HydrophobicContact CD1-CB 4.42Å; L229-F285 HydrophobicContact CD1-CD1 3.67Å; L229-F285 HydrophobicContact CD1-CE1 4.31Å; L229-F285 HydrophobicContact CD1-CG 4.31Å; L229-L289 HydrophobicContact CB-CD1 4.46Å; L229-L289 HydrophobicContact CB-CD2 4.42Å; L229-L337 HydrophobicContact CD1-CD1 3.96Å; L229-L337 HydrophobicContact CD1-CD2 4.01Å; L229-L337 HydrophobicContact CD2-CD1 3.64Å; L229-L337 HydrophobicContact CG-CD1 4.47Å; L229-L342 HydrophobicContact CD1-CD1 4.48Å |
| 230 | L | 98.4 | Very high | 97.4 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | 172.5 | -76.7 | 173.4 | 0 | 0 | 0 | 111.1 | F226 M227 R232 L233 L234 H238 L241 L289 V292 | F226-L230 HydrophobicContact CD1-CD1 3.73Å; F226-L230 HydrophobicContact CD1-CG 4.03Å; F226-L230 HydrophobicContact CE1-CD1 3.6Å; F226-L230 HydrophobicContact CE1-CD2 4.18Å; F226-L230 HydrophobicContact CE1-CG 3.84Å; F226-L230 WeakPolarHBondContact O-CG 3.24Å; F226-L230 PolarHBondContact O-N 3.35Å; M227-L230 WeakPolarHBondContact O-CB 3.46Å; M227-L230 PolarHBondContact O-N 3.45Å; M227-L230 HydrophobicContact SD-CD1 3.82Å; L230-R232 VanDerWaalsContact C-N 3.26Å; L230-R232 PolarHBondContact O-N 3.13Å; L230-L233 PolarHBondContact O-N 3.45Å; L230-L234 HydrophobicContact CD2-CB 4.35Å; L230-L234 HydrophobicContact CD2-CD1 3.94Å; L230-L234 CarbonylContact O-C 3.29Å; L230-L234 VanDerWaalsContact O-CA 3.27Å; L230-L234 WeakPolarHBondContact O-CA 3.43Å; L230-L234 PolarHBondContact O-N 2.94Å; L230-H238 HydrophobicContact CB-CB 4.16Å; L230-L241 HydrophobicContact CD1-CD1 3.79Å; L230-L289 HydrophobicContact CD2-CD2 3.69Å; L230-L289 HydrophobicContact CG-CD2 4.12Å; L230-V292 HydrophobicContact CD2-CB 4.23Å; L230-V292 HydrophobicContact CD2-CG1 3.68Å; L230-V292 HydrophobicContact CD2-CG2 4.44Å |
| 231 | R | 98.1 | Very high | 97.7 | Very high | 142 Ų | 142 | 40.5 Ų | 40.5 | 54% | 0.536 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -57.8 | -41.4 | 176.6 | -167 | -177.3 | -57.8 | 146.3 | 2.8 | 111.9 | M227 A228 L229 H238 | M227-R231 PolarHBondContact O-N 3.36Å; A228-R231 WeakPolarHBondContact O-CB 3.23Å; A228-R231 PolarHBondContact O-N 3.09Å; L229-R231 VanDerWaalsContact C-N 3.35Å; R231-H238 HydrophobicContact CB-CB 4.48Å; R231-H238 PolarHBondContact NE-CE1 2.91Å; R231-H238 PolarHBondContact NE-NE2 2.96Å; R231-H238 PolarHBondContact NH2-NE2 2.75Å |
| 232 | R | 97.7 | Very high | 97.9 | Very high | 122 Ų | 122 | 45 Ų | 45 | 46% | 0.46 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -75.8 | -42.5 | -178.2 | -172.8 | 178.4 | 69.3 | 84.8 | -2.2 | 113.3 | A228 L229 L230 | A228-R232 PolarHBondContact O-N 2.99Å; L229-R232 PolarHBondContact O-N 3.3Å; L230-R232 VanDerWaalsContact C-N 3.26Å; L230-R232 PolarHBondContact O-N 3.13Å |
| 233 | L | 97.4 | Very high | 98 | Very high | 53 Ų | 53 | 51.5 Ų | 51.5 | 28% | 0.277 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -102.1 | -27.6 | -168.7 | -65.2 | 176.2 | 0 | 0 | 0 | 113.7 | L229 L230 L289 V335 | L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.38Å; L229-L233 PolarHBondContact O-N 3.24Å; L230-L233 PolarHBondContact O-N 3.45Å; L233-L289 HydrophobicContact CD1-CD1 3.69Å; L233-V335 HydrophobicContact CD1-CG1 4.48Å |
| 234 | L | 97.9 | Very high | 98 | Very high | 31 Ų | 31 | 52.6 Ų | 52.6 | 16% | 0.162 | 24% | 0.243 | C | C | . | . | trans | -136.9 | 58.1 | -176.6 | -60.9 | 175.3 | 0 | 0 | 0 | 110.2 | L230 H236 V237 H238 L289 V292 R293 | L230-L234 HydrophobicContact CD2-CB 4.35Å; L230-L234 HydrophobicContact CD2-CD1 3.94Å; L230-L234 CarbonylContact O-C 3.29Å; L230-L234 VanDerWaalsContact O-CA 3.27Å; L230-L234 WeakPolarHBondContact O-CA 3.43Å; L230-L234 PolarHBondContact O-N 2.94Å; L234-H236 VanDerWaalsContact C-N 3.29Å; L234-H236 PolarHBondContact O-N 3.32Å; L234-V237 HydrophobicContact CB-CB 4.03Å; L234-V237 HydrophobicContact CB-CG2 4.04Å; L234-V237 WeakPolarHBondContact O-CA 3.39Å; L234-V237 WeakPolarHBondContact O-CB 3.47Å; L234-V237 PolarHBondContact O-N 3.45Å; L234-H238 PolarHBondContact O-N 2.98Å; L234-L289 HydrophobicContact CD1-CD2 4.39Å; L234-V292 HydrophobicContact CD1-CG1 4.24Å; L234-R293 HydrophobicContact CD1-CB 4.07Å; L234-R293 HydrophobicContact CD2-CB 4.32Å; L234-R293 HydrophobicContact CD2-CG 4.25Å | ||
| 235 | P | 98.3 | Very high | 98.1 | Very high | 67 Ų | 67 | 50.1 Ų | 50.1 | 44% | 0.435 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -58.6 | -36.4 | -168.5 | 21.7 | -34 | 0 | 0 | 0 | 113.8 | V237 H238 K239 | P235-V237 VanDerWaalsContact C-N 3.35Å; P235-H238 PolarHBondContact O-N 3.48Å; P235-K239 WeakPolarHBondContact O-CB 3.39Å; P235-K239 PolarHBondContact O-N 3.48Å |
| 236 | H | 98.4 | Very high | 98.1 | Very high | 130 Ų | 130 | 50.2 Ų | 50.2 | 60% | 0.602 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -66.9 | -36.2 | 176.3 | -61.5 | -62.7 | 0 | 0 | 0 | 112.6 | L234 H240 | L234-H236 VanDerWaalsContact C-N 3.29Å; L234-H236 PolarHBondContact O-N 3.32Å; H236-H240 PolarHBondContact O-N 3.3Å; H236-H240 VanDerWaalsContact O-N 3.09Å |
| 237 | V | 98.4 | Very high | 98 | Very high | 3 Ų | 3 | 51.4 Ų | 51.4 | 2% | 0.018 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -72.3 | -43.8 | 176.4 | -172.9 | 0 | 0 | 0 | 0 | 110.4 | L234 P235 K239 H240 L241 V292 L296 | L234-V237 HydrophobicContact CB-CB 4.03Å; L234-V237 HydrophobicContact CB-CG2 4.04Å; L234-V237 WeakPolarHBondContact O-CA 3.39Å; L234-V237 WeakPolarHBondContact O-CB 3.47Å; L234-V237 PolarHBondContact O-N 3.45Å; P235-V237 VanDerWaalsContact C-N 3.35Å; V237-K239 VanDerWaalsContact C-N 3.31Å; V237-K239 PolarHBondContact O-N 3.26Å; V237-H240 WeakPolarHBondContact O-CB 3.44Å; V237-H240 PolarHBondContact O-N 3.37Å; V237-L241 HydrophobicContact CG1-CD1 4.03Å; V237-L241 HydrophobicContact CG1-CG 4.23Å; V237-L241 VanDerWaalsContact O-CG 3.31Å; V237-L241 WeakPolarHBondContact O-CG 3.48Å; V237-L241 PolarHBondContact O-N 2.84Å; V237-V292 HydrophobicContact CB-CG1 4.4Å; V237-V292 HydrophobicContact CG1-CG1 3.42Å; V237-V292 VanDerWaalsContact CG1-CG1 3.42Å; V237-L296 HydrophobicContact CG1-CB 3.74Å; V237-L296 HydrophobicContact CG1-CD1 3.95Å; V237-L296 HydrophobicContact CG2-CB 4.38Å; V237-L296 WeakPolarHBondContact CG2-O 3.36Å |
| 238 | H | 98.7 | Very high | 97.9 | Very high | 23 Ų | 23 | 51.5 Ų | 51.5 | 11% | 0.106 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -54.5 | -47.5 | 172.8 | 172.5 | -81.8 | 0 | 0 | 0 | 111.4 | M227 L230 R231 L234 P235 H240 L241 Q242 | M227-H238 VanDerWaalsContact CE-CD2 3.5Å; M227-H238 WeakPolarHBondContact CE-CD2 3.38Å; M227-H238 PolarHBondContact O-CD2 3.03Å; L230-H238 HydrophobicContact CB-CB 4.16Å; R231-H238 HydrophobicContact CB-CB 4.48Å; R231-H238 PolarHBondContact NE-CE1 2.91Å; R231-H238 PolarHBondContact NE-NE2 2.96Å; R231-H238 PolarHBondContact NH2-NE2 2.75Å; L234-H238 PolarHBondContact O-N 2.98Å; P235-H238 PolarHBondContact O-N 3.48Å; H238-H240 PolarHBondContact O-N 3.34Å; H238-L241 PolarHBondContact O-N 3.27Å; H238-Q242 VanDerWaalsContact O-CG 3.28Å; H238-Q242 WeakPolarHBondContact O-CG 3.46Å; H238-Q242 PolarHBondContact O-N 3.03Å |
| 239 | K | 98.5 | Very high | 97.8 | Very high | 127 Ų | 127 | 55.2 Ų | 55.2 | 55% | 0.552 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -59.2 | -46.3 | 177.4 | -175.4 | 179.5 | 178.1 | -178.5 | 0 | 111.8 | P235 V237 Q242 Q243 | P235-K239 WeakPolarHBondContact O-CB 3.39Å; P235-K239 PolarHBondContact O-N 3.48Å; V237-K239 VanDerWaalsContact C-N 3.31Å; V237-K239 PolarHBondContact O-N 3.26Å; K239-Q242 PolarHBondContact O-N 2.94Å; K239-Q243 HydrophobicContact CG-CG 4.48Å; K239-Q243 VanDerWaalsContact O-CG 3.27Å; K239-Q243 WeakPolarHBondContact O-CG 3.31Å; K239-Q243 PolarHBondContact O-N 3.06Å |
| 240 | H | 98.5 | Very high | 97.7 | Very high | 18 Ų | 18 | 58.9 Ų | 58.9 | 8% | 0.083 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58.7 | -52.5 | 177.1 | -178.2 | 82 | 0 | 0 | 0 | 112 | H236 V237 H238 Q242 Q243 V244 R302 C305 T311 | H236-H240 PolarHBondContact O-N 3.3Å; H236-H240 VanDerWaalsContact O-N 3.09Å; V237-H240 WeakPolarHBondContact O-CB 3.44Å; V237-H240 PolarHBondContact O-N 3.37Å; H238-H240 PolarHBondContact O-N 3.34Å; H240-Q242 PolarHBondContact O-N 2.82Å; H240-Q243 WeakPolarHBondContact O-CB 3.44Å; H240-Q243 PolarHBondContact O-N 3.38Å; H240-V244 WeakPolarHBondContact O-CG2 3.48Å; H240-V244 PolarHBondContact O-N 3.47Å; H240-R302 HydrophobicContact CB-CG 4.39Å; H240-R302 PolarHBondContact CE1-O 3.32Å; H240-R302 VanDerWaalsContact CE1-O 3.27Å; H240-C305 PolarHBondContact CE1-O 2.64Å; H240-C305 PolarHBondContact NE2-O 3.34Å; H240-T311 PolarHBondContact NE2-OG1 2.91Å |
| 241 | L | 98.3 | Very high | 97.6 | Very high | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -55.9 | -40 | 179.1 | -68.9 | 171.9 | 0 | 0 | 0 | 112 | L230 V237 H238 G245 V246 L296 T311 | L230-L241 HydrophobicContact CD1-CD1 3.79Å; V237-L241 HydrophobicContact CG1-CD1 4.03Å; V237-L241 HydrophobicContact CG1-CG 4.23Å; V237-L241 VanDerWaalsContact O-CG 3.31Å; V237-L241 WeakPolarHBondContact O-CG 3.48Å; V237-L241 PolarHBondContact O-N 2.84Å; H238-L241 PolarHBondContact O-N 3.27Å; L241-G245 PolarHBondContact O-N 2.88Å; L241-G245 VanDerWaalsContact O-N 3.14Å; L241-V246 HydrophobicContact CD2-CB 3.78Å; L241-V246 HydrophobicContact CD2-CG1 3.7Å; L241-V246 PolarHBondContact O-N 3.02Å; L241-L296 HydrophobicContact CD2-CD1 3.83Å; L241-L296 HydrophobicContact CG-CD1 4.43Å; L241-T311 HydrophobicContact CD2-CG2 3.74Å |
| 242 | Q | 98.1 | Very high | 97.5 | Very high | 110 Ų | 110 | 52.5 Ų | 52.5 | 51% | 0.514 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.1 | -42.7 | 174.5 | -69.8 | -67.9 | -69.2 | 0 | 0 | 112.6 | M227 H238 K239 H240 G245 | M227-Q242 HydrophobicContact CE-CG 4.36Å; H238-Q242 VanDerWaalsContact O-CG 3.28Å; H238-Q242 WeakPolarHBondContact O-CG 3.46Å; H238-Q242 PolarHBondContact O-N 3.03Å; K239-Q242 PolarHBondContact O-N 2.94Å; H240-Q242 PolarHBondContact O-N 2.82Å; Q242-G245 PolarHBondContact O-N 3.49Å |
| 243 | Q | 97.9 | Very high | 97.4 | Very high | 136 Ų | 136 | 48.3 Ų | 48.3 | 64% | 0.636 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -64.7 | -39.5 | 179.6 | -73.6 | 172.6 | -40.1 | 0 | 0 | 112.6 | K239 H240 G245 | K239-Q243 HydrophobicContact CG-CG 4.48Å; K239-Q243 VanDerWaalsContact O-CG 3.27Å; K239-Q243 WeakPolarHBondContact O-CG 3.31Å; K239-Q243 PolarHBondContact O-N 3.06Å; H240-Q243 WeakPolarHBondContact O-CB 3.44Å; H240-Q243 PolarHBondContact O-N 3.38Å; Q243-G245 VanDerWaalsContact C-N 3.34Å |
| 244 | V | 97.8 | Very high | 97.2 | Very high | 23 Ų | 23 | 48.6 Ų | 48.6 | 14% | 0.139 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | 2.9 | -179.9 | -57 | 0 | 0 | 0 | 0 | 113.6 | H240 V246 P306 T311 | H240-V244 WeakPolarHBondContact O-CG2 3.48Å; H240-V244 PolarHBondContact O-N 3.47Å; V244-V246 HydrophobicContact CG2-CB 4.16Å; V244-V246 HydrophobicContact CG2-CG2 3.64Å; V244-V246 PolarHBondContact O-N 3.2Å; V244-P306 WeakPolarHBondContact CG1-O 3.36Å; V244-T311 HydrophobicContact CG2-CG2 4.25Å |
| 245 | G | 97.2 | Very high | 97.2 | Very high | 49 Ų | 49 | 47.5 Ų | 47.5 | 51% | 0.505 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.2 | 24.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | L241 Q242 Q243 G247 | L241-G245 PolarHBondContact O-N 2.88Å; L241-G245 VanDerWaalsContact O-N 3.14Å; Q242-G245 PolarHBondContact O-N 3.49Å; Q243-G245 VanDerWaalsContact C-N 3.34Å; G245-G247 PolarHBondContact O-N 3.39Å |
| 246 | V | 97.8 | Very high | 97.2 | Very high | 1 Ų | 1 | 44.3 Ų | 44.3 | 1% | 0.006 | 23% | 0.234 | C | C | . | . | trans | -89.8 | 99.8 | 178.8 | 176.6 | 0 | 0 | 0 | 0 | 110.2 | L241 V244 L250 Y251 L308 T311 L312 L315 | L241-V246 HydrophobicContact CD2-CB 3.78Å; L241-V246 HydrophobicContact CD2-CG1 3.7Å; L241-V246 PolarHBondContact O-N 3.02Å; V244-V246 HydrophobicContact CG2-CB 4.16Å; V244-V246 HydrophobicContact CG2-CG2 3.64Å; V244-V246 PolarHBondContact O-N 3.2Å; V246-L250 HydrophobicContact CG1-CD1 4.44Å; V246-Y251 HydrophobicContact CG1-CD1 4.29Å; V246-Y251 HydrophobicContact CG1-CE1 4.06Å; V246-L308 HydrophobicContact CG2-CB 4.31Å; V246-L308 HydrophobicContact CG2-CG 3.99Å; V246-T311 HydrophobicContact CB-CG2 4.4Å; V246-T311 HydrophobicContact CG1-CG2 4.46Å; V246-T311 HydrophobicContact CG2-CG2 3.9Å; V246-L312 HydrophobicContact CG1-CD2 3.83Å; V246-L312 HydrophobicContact CG2-CG 4.45Å; V246-L315 HydrophobicContact CG1-CD1 4.4Å | ||
| 247 | G | 96.1 | Very high | 97.1 | Very high | 25 Ų | 25 | 38.5 Ų | 38.5 | 26% | 0.258 | 21% | 0.208 | S | C | . | . | trans | -77.9 | 153 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G245 L249 L250 | G245-G247 PolarHBondContact O-N 3.39Å; G247-L249 VanDerWaalsContact C-N 3.27Å; G247-L249 PolarHBondContact O-N 3.41Å; G247-L250 WeakPolarHBondContact O-CB 3.42Å; G247-L250 PolarHBondContact O-N 3.08Å | ||
| 248 | P | 95.2 | Very high | 97.1 | Very high | 12 Ų | 12 | 38.4 Ų | 38.4 | 8% | 0.078 | 21% | 0.207 | C | C | . | . | G | 310 helix | trans | -60.9 | -31.8 | -178.7 | 28.8 | -39.7 | 0 | 0 | 0 | 113.8 | A223 M227 L250 Y251 L252 | A223-P248 HydrophobicContact CB-CB 4Å; A223-P248 HydrophobicContact CB-CG 3.75Å; M227-P248 HydrophobicContact CG-CB 3.91Å; M227-P248 HydrophobicContact CG-CG 3.45Å; M227-P248 VanDerWaalsContact CG-CG 3.45Å; M227-P248 HydrophobicContact SD-CB 4.3Å; M227-P248 HydrophobicContact SD-CG 4.19Å; P248-L250 PolarHBondContact O-N 2.91Å; P248-L250 VanDerWaalsContact O-N 3.14Å; P248-Y251 PolarHBondContact O-N 3.14Å; P248-L252 HydrophobicContact CB-CD1 3.68Å; P248-L252 HydrophobicContact CB-CG 4.25Å; P248-L252 VanDerWaalsContact O-CB 3.28Å; P248-L252 WeakPolarHBondContact O-CB 3.4Å; P248-L252 WeakPolarHBondContact O-CG 3.45Å; P248-L252 PolarHBondContact O-N 3.38Å |
| 249 | L | 96.1 | Very high | 97 | Very high | 86 Ų | 86 | 37.3 Ų | 37.3 | 45% | 0.45 | 20% | 0.202 | S | C | . | . | G | 310 helix | trans | -66.9 | -11.2 | 179.8 | -69.3 | 175.5 | 0 | 0 | 0 | 113.9 | V219 A223 G247 Y251 P253 | V219-L249 HydrophobicContact CG1-CD2 4.44Å; A223-L249 HydrophobicContact CB-CD2 3.73Å; A223-L249 HydrophobicContact CB-CG 4.04Å; G247-L249 VanDerWaalsContact C-N 3.27Å; G247-L249 PolarHBondContact O-N 3.41Å; L249-Y251 VanDerWaalsContact C-N 3.32Å; L249-P253 HydrophobicContact CD2-CG 4.4Å; L249-P253 WeakPolarHBondContact O-CD 3.34Å; L249-P253 WeakPolarHBondContact O-CG 3.16Å |
| 250 | L | 96.8 | Very high | 97 | Very high | 79 Ų | 79 | 31.2 Ų | 31.2 | 41% | 0.414 | 18% | 0.176 | S | C | . | . | G | 310 helix | trans | -78.5 | -14.9 | 176.7 | -62.8 | 173.4 | 0 | 0 | 0 | 113.5 | V246 G247 P248 L308 L312 | V246-L250 HydrophobicContact CG1-CD1 4.44Å; G247-L250 WeakPolarHBondContact O-CB 3.42Å; G247-L250 PolarHBondContact O-N 3.08Å; P248-L250 PolarHBondContact O-N 2.91Å; P248-L250 VanDerWaalsContact O-N 3.14Å; L250-L308 HydrophobicContact CD1-CD1 4.47Å; L250-L312 HydrophobicContact CB-CD1 4.49Å; L250-L312 HydrophobicContact CB-CD2 3.81Å; L250-L312 HydrophobicContact CD1-CD1 4.3Å; L250-L312 HydrophobicContact CD1-CD2 4.36Å |
| 251 | Y | 96.1 | Very high | 97 | Very high | 6 Ų | 6 | 30.7 Ų | 30.7 | 2% | 0.024 | 17% | 0.174 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -137.8 | -31.7 | -178.4 | 57.7 | -94.9 | 0 | 0 | 0 | 113.8 | F226 V246 P248 L249 E254 W255 V292 L312 L315 | F226-Y251 HydrophobicContact CD1-CE2 4.37Å; F226-Y251 AromaticContact CE1-CE2 3.81Å; F226-Y251 HydrophobicContact CE1-CE2 3.81Å; V246-Y251 HydrophobicContact CG1-CD1 4.29Å; V246-Y251 HydrophobicContact CG1-CE1 4.06Å; P248-Y251 PolarHBondContact O-N 3.14Å; L249-Y251 VanDerWaalsContact C-N 3.32Å; Y251-E254 PolarHBondContact O-N 3.03Å; Y251-W255 HydrophobicContact CD2-CD2 4.14Å; Y251-W255 AromaticContact CD2-CE3 3.69Å; Y251-W255 HydrophobicContact CD2-CE3 3.69Å; Y251-W255 AromaticContact CD2-CH2 3.62Å; Y251-W255 HydrophobicContact CD2-CH2 3.62Å; Y251-W255 HydrophobicContact CD2-CZ2 4.07Å; Y251-W255 AromaticContact CD2-CZ3 3.41Å; Y251-W255 HydrophobicContact CD2-CZ3 3.41Å; Y251-W255 VanDerWaalsContact CD2-CZ3 3.41Å; Y251-W255 HydrophobicContact CE2-CE3 4.18Å; Y251-W255 HydrophobicContact CE2-CH2 4.06Å; Y251-W255 AromaticContact CE2-CZ3 3.64Å; Y251-W255 HydrophobicContact CE2-CZ3 3.64Å; Y251-W255 HydrophobicContact CG-CH2 4.38Å; Y251-W255 PolarHBondContact O-N 2.89Å; Y251-V292 HydrophobicContact CE2-CG2 4.4Å; Y251-L312 HydrophobicContact CD1-CD2 4.48Å; Y251-L315 HydrophobicContact CD1-CD1 3.89Å; Y251-L315 HydrophobicContact CE1-CD1 4.12Å; Y251-L315 HydrophobicContact CG-CD1 4.34Å |
| 252 | L | 96.3 | Very high | 96.8 | Very high | 1 Ų | 1 | 36.5 Ų | 36.5 | 1% | 0.005 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.8 | -40.5 | -178.5 | -79.6 | -178.4 | 0 | 0 | 0 | 114.9 | A223 F226 P248 E254 W255 F256 | A223-L252 HydrophobicContact CB-CD1 3.94Å; F226-L252 HydrophobicContact CB-CD1 3.67Å; F226-L252 HydrophobicContact CD1-CD1 3.97Å; F226-L252 HydrophobicContact CD1-CD2 4.15Å; F226-L252 HydrophobicContact CD1-CG 4.32Å; F226-L252 HydrophobicContact CD2-CD2 4.03Å; F226-L252 HydrophobicContact CE1-CD2 4.26Å; F226-L252 HydrophobicContact CE2-CD2 4.18Å; F226-L252 HydrophobicContact CG-CD1 3.81Å; F226-L252 HydrophobicContact CG-CD2 4.04Å; F226-L252 HydrophobicContact CG-CG 4.42Å; F226-L252 HydrophobicContact CZ-CD2 4.3Å; P248-L252 HydrophobicContact CB-CD1 3.68Å; P248-L252 HydrophobicContact CB-CG 4.25Å; P248-L252 VanDerWaalsContact O-CB 3.28Å; P248-L252 WeakPolarHBondContact O-CB 3.4Å; P248-L252 WeakPolarHBondContact O-CG 3.45Å; P248-L252 PolarHBondContact O-N 3.38Å; L252-E254 VanDerWaalsContact C-N 3.28Å; L252-E254 PolarHBondContact O-N 3.05Å; L252-W255 HydrophobicContact CD2-CE3 4.07Å; L252-W255 PolarHBondContact O-N 3.01Å; L252-W255 VanDerWaalsContact O-N 3.14Å; L252-F256 HydrophobicContact CD2-CD1 3.86Å; L252-F256 HydrophobicContact CD2-CD2 4.41Å; L252-F256 HydrophobicContact CD2-CE1 3.5Å; L252-F256 HydrophobicContact CD2-CE2 4.12Å; L252-F256 HydrophobicContact CD2-CG 4.3Å; L252-F256 HydrophobicContact CD2-CZ 3.64Å; L252-F256 WeakPolarHBondContact O-CB 3.43Å; L252-F256 PolarHBondContact O-N 3.39Å |
| 253 | P | 95.2 | Very high | 96.6 | Very high | 34 Ų | 34 | 32.8 Ų | 32.8 | 22% | 0.221 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.3 | -40.7 | -179 | -28 | 36.9 | 0 | 0 | 0 | 112.5 | V219 L249 L257 | V219-P253 HydrophobicContact CG1-CG 4.33Å; L249-P253 HydrophobicContact CD2-CG 4.4Å; L249-P253 WeakPolarHBondContact O-CD 3.34Å; L249-P253 WeakPolarHBondContact O-CG 3.16Å; P253-L257 HydrophobicContact CB-CD1 3.94Å; P253-L257 WeakPolarHBondContact O-CB 3.09Å; P253-L257 WeakPolarHBondContact O-CG 3.46Å; P253-L257 PolarHBondContact O-N 2.92Å |
| 254 | E | 94 | Very high | 96.5 | Very high | 60 Ų | 60 | 27 Ų | 27 | 28% | 0.28 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -63.6 | -44.7 | 176.3 | -167.6 | -169.6 | 127.9 | 0 | 0 | 111.6 | Y251 L252 C258 S263 | Y251-E254 PolarHBondContact O-N 3.03Å; L252-E254 VanDerWaalsContact C-N 3.28Å; L252-E254 PolarHBondContact O-N 3.05Å; E254-C258 WeakPolarHBondContact O-CB 3.32Å; E254-S263 PolarHBondContact OE1-OG 2.84Å |
| 255 | W | 97.9 | Very high | 96.4 | Very high | 7 Ų | 7 | 27.8 Ų | 27.8 | 3% | 0.027 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -67.4 | -49 | -179.3 | -70.3 | 2 | 0 | 0 | 0 | 112.7 | F226 Y251 L252 L259 F260 L291 V292 L315 | F226-W255 HydrophobicContact CZ-CZ3 4.47Å; Y251-W255 HydrophobicContact CD2-CD2 4.14Å; Y251-W255 AromaticContact CD2-CE3 3.69Å; Y251-W255 HydrophobicContact CD2-CE3 3.69Å; Y251-W255 AromaticContact CD2-CH2 3.62Å; Y251-W255 HydrophobicContact CD2-CH2 3.62Å; Y251-W255 HydrophobicContact CD2-CZ2 4.07Å; Y251-W255 AromaticContact CD2-CZ3 3.41Å; Y251-W255 HydrophobicContact CD2-CZ3 3.41Å; Y251-W255 VanDerWaalsContact CD2-CZ3 3.41Å; Y251-W255 HydrophobicContact CE2-CE3 4.18Å; Y251-W255 HydrophobicContact CE2-CH2 4.06Å; Y251-W255 AromaticContact CE2-CZ3 3.64Å; Y251-W255 HydrophobicContact CE2-CZ3 3.64Å; Y251-W255 HydrophobicContact CG-CH2 4.38Å; Y251-W255 PolarHBondContact O-N 2.89Å; L252-W255 HydrophobicContact CD2-CE3 4.07Å; L252-W255 PolarHBondContact O-N 3.01Å; L252-W255 VanDerWaalsContact O-N 3.14Å; W255-L259 CarbonylContact O-C 3.44Å; W255-L259 PolarHBondContact O-N 3.41Å; W255-F260 HydrophobicContact CB-CD1 3.83Å; W255-F260 HydrophobicContact CB-CE1 3.43Å; W255-F260 VanDerWaalsContact CB-CE1 3.43Å; W255-F260 HydrophobicContact CB-CZ 4.01Å; W255-F260 HydrophobicContact CD2-CE1 4.04Å; W255-F260 HydrophobicContact CE3-CE1 4.24Å; W255-F260 HydrophobicContact CG-CD1 4.01Å; W255-F260 AromaticContact CG-CE1 3.71Å; W255-F260 HydrophobicContact CG-CE1 3.71Å; W255-F260 PolarHBondContact O-N 3.39Å; W255-L291 HydrophobicContact CD2-CD1 4.06Å; W255-L291 HydrophobicContact CE3-CD1 4.27Å; W255-L291 HydrophobicContact CH2-CB 3.79Å; W255-L291 HydrophobicContact CH2-CD1 4.27Å; W255-L291 HydrophobicContact CZ2-CB 4.12Å; W255-L291 HydrophobicContact CZ2-CD1 4.05Å; W255-L291 HydrophobicContact CZ3-CB 4.22Å; W255-L291 HydrophobicContact CZ3-CD1 4.38Å; W255-V292 HydrophobicContact CH2-CG2 3.92Å; W255-V292 HydrophobicContact CZ3-CG2 3.98Å; W255-L315 HydrophobicContact CH2-CD2 4.13Å; W255-L315 HydrophobicContact CZ2-CB 4.49Å |
| 256 | F | 98 | Very high | 96.3 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -89.8 | -42 | -167.1 | -81.6 | 28.2 | 0 | 0 | 0 | 112.2 | Y211 F226 L252 C258 L259 F260 L284 F285 | Y211-F256 HydrophobicContact CE1-CB 4.06Å; Y211-F256 HydrophobicContact CE1-CD2 4.43Å; F226-F256 HydrophobicContact CD2-CZ 4.06Å; F226-F256 HydrophobicContact CE2-CZ 4.36Å; L252-F256 HydrophobicContact CD2-CD1 3.86Å; L252-F256 HydrophobicContact CD2-CD2 4.41Å; L252-F256 HydrophobicContact CD2-CE1 3.5Å; L252-F256 HydrophobicContact CD2-CE2 4.12Å; L252-F256 HydrophobicContact CD2-CG 4.3Å; L252-F256 HydrophobicContact CD2-CZ 3.64Å; L252-F256 WeakPolarHBondContact O-CB 3.43Å; L252-F256 PolarHBondContact O-N 3.39Å; F256-C258 VanDerWaalsContact C-N 3.29Å; F256-C258 PolarHBondContact O-N 2.88Å; F256-L259 PolarHBondContact O-N 2.74Å; F256-F260 HydrophobicContact CD1-CE2 4.35Å; F256-F260 AromaticContact CD1-CZ 3.89Å; F256-F260 HydrophobicContact CD1-CZ 3.89Å; F256-F260 AromaticContact CE1-CZ 3.83Å; F256-F260 HydrophobicContact CE1-CZ 3.83Å; F256-L284 HydrophobicContact CD1-CB 4.16Å; F256-L284 HydrophobicContact CE1-CB 4.01Å; F256-L284 WeakPolarHBondContact CE1-O 3.35Å; F256-L284 HydrophobicContact CE2-CB 4.36Å; F256-L284 HydrophobicContact CG-CB 4.43Å; F256-L284 HydrophobicContact CZ-CB 4.11Å; F256-F285 HydrophobicContact CE2-CD1 4.24Å; F256-F285 HydrophobicContact CE2-CD2 4.21Å; F256-F285 HydrophobicContact CE2-CE1 4.05Å; F256-F285 HydrophobicContact CE2-CE2 4.02Å; F256-F285 HydrophobicContact CE2-CG 4.32Å; F256-F285 AromaticContact CE2-CZ 3.95Å; F256-F285 HydrophobicContact CE2-CZ 3.95Å; F256-F285 HydrophobicContact CZ-CD1 4.2Å; F256-F285 HydrophobicContact CZ-CD2 4.41Å; F256-F285 HydrophobicContact CZ-CE1 4.44Å; F256-F285 HydrophobicContact CZ-CG 4.19Å |
| 257 | L | 96.5 | Very high | 96.1 | Very high | 9 Ų | 9 | 28.2 Ų | 28.2 | 5% | 0.047 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -68.1 | -32.4 | -179.2 | -65.7 | 169.7 | 0 | 0 | 0 | 111.9 | A179 Y211 Y212 M216 V219 P253 | A179-L257 HydrophobicContact CB-CB 3.38Å; A179-L257 HydrophobicContact CB-CD1 4.08Å; A179-L257 HydrophobicContact CB-CG 4.27Å; Y211-L257 HydrophobicContact CD1-CD2 3.99Å; Y211-L257 HydrophobicContact CG-CD2 4.39Å; Y211-L257 WeakPolarHBondContact O-CD2 3.03Å; Y212-L257 HydrophobicContact CD1-CD2 4.3Å; Y212-L257 HydrophobicContact CE1-CB 4.38Å; Y212-L257 HydrophobicContact CE1-CD2 4.22Å; Y212-L257 WeakPolarHBondContact CE1-O 3.4Å; Y212-L257 PolarHBondContact OH-O 3.46Å; M216-L257 HydrophobicContact CE-CD1 3.98Å; M216-L257 HydrophobicContact SD-CD1 4.01Å; V219-L257 HydrophobicContact CG2-CD2 3.57Å; V219-L257 HydrophobicContact CG2-CG 4.15Å; P253-L257 HydrophobicContact CB-CD1 3.94Å; P253-L257 WeakPolarHBondContact O-CB 3.09Å; P253-L257 WeakPolarHBondContact O-CG 3.46Å; P253-L257 PolarHBondContact O-N 2.92Å |
| 258 | C | 97.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 14% | 0.141 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -99.1 | 10.4 | 178.7 | -61.7 | 0 | 0 | 0 | 0 | 113.3 | A179 P182 E254 F256 F260 A261 R262 | A179-C258 PolarHBondContact O-SG 2.72Å; P182-C258 HydrophobicContact CB-CB 4.37Å; P182-C258 HydrophobicContact CG-CB 4.49Å; E254-C258 WeakPolarHBondContact O-CB 3.32Å; F256-C258 VanDerWaalsContact C-N 3.29Å; F256-C258 PolarHBondContact O-N 2.88Å; C258-F260 PolarHBondContact O-N 3.1Å; C258-F260 VanDerWaalsContact O-N 3.12Å; C258-A261 WeakPolarHBondContact O-CB 3.35Å; C258-A261 PolarHBondContact O-N 3.35Å; C258-R262 HydrophobicContact CB-CG 4.41Å; C258-R262 VanDerWaalsContact SG-CZ 3.58Å; C258-R262 PolarHBondContact SG-NE 3.31Å; C258-R262 PolarHBondContact SG-NH2 3.34Å |
| 259 | L | 98.3 | Very high | 96.3 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 49.1 | 41.5 | -178.7 | -50.7 | -178.7 | 0 | 0 | 0 | 112.6 | V183 I203 L208 W255 F256 A261 W273 F276 L284 | V183-L259 HydrophobicContact CG1-CD1 4.11Å; V183-L259 HydrophobicContact CG2-CD1 4.32Å; V183-L259 HydrophobicContact CG2-CG 4.18Å; I203-L259 HydrophobicContact CD1-CD1 4.14Å; I203-L259 HydrophobicContact CG2-CD1 4Å; L208-L259 HydrophobicContact CD1-CD2 3.53Å; W255-L259 CarbonylContact O-C 3.44Å; W255-L259 PolarHBondContact O-N 3.41Å; F256-L259 PolarHBondContact O-N 2.74Å; L259-A261 PolarHBondContact O-N 2.85Å; L259-A261 VanDerWaalsContact O-N 3.11Å; L259-W273 HydrophobicContact CB-CZ2 3.85Å; L259-W273 VanDerWaalsContact CB-NE1 3.35Å; L259-W273 HydrophobicContact CD1-CD2 4.48Å; L259-W273 HydrophobicContact CD1-CH2 4.14Å; L259-W273 HydrophobicContact CD1-CZ2 3.69Å; L259-W273 HydrophobicContact CG-CZ2 4.29Å; L259-W273 PolarHBondContact O-NE1 3.16Å; L259-F276 HydrophobicContact CD1-CD1 4.34Å; L259-F276 HydrophobicContact CD1-CE1 3.87Å; L259-F276 HydrophobicContact CD1-CZ 4.47Å; L259-F276 HydrophobicContact CD2-CE1 4.19Å; L259-F276 HydrophobicContact CD2-CE2 4.49Å; L259-F276 HydrophobicContact CD2-CZ 4.05Å; L259-L284 HydrophobicContact CD2-CD1 3.99Å; L259-L284 HydrophobicContact CD2-CD2 4.03Å |
| 260 | F | 98.3 | Very high | 96.4 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 12% | 0.115 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 61.9 | 7.4 | -177 | -55.3 | -89.2 | 0 | 0 | 0 | 116.1 | W255 F256 C258 R262 S263 L264 V272 L284 V287 L291 | W255-F260 HydrophobicContact CB-CD1 3.83Å; W255-F260 HydrophobicContact CB-CE1 3.43Å; W255-F260 VanDerWaalsContact CB-CE1 3.43Å; W255-F260 HydrophobicContact CB-CZ 4.01Å; W255-F260 HydrophobicContact CD2-CE1 4.04Å; W255-F260 HydrophobicContact CE3-CE1 4.24Å; W255-F260 HydrophobicContact CG-CD1 4.01Å; W255-F260 AromaticContact CG-CE1 3.71Å; W255-F260 HydrophobicContact CG-CE1 3.71Å; W255-F260 PolarHBondContact O-N 3.39Å; F256-F260 HydrophobicContact CD1-CE2 4.35Å; F256-F260 AromaticContact CD1-CZ 3.89Å; F256-F260 HydrophobicContact CD1-CZ 3.89Å; F256-F260 AromaticContact CE1-CZ 3.83Å; F256-F260 HydrophobicContact CE1-CZ 3.83Å; C258-F260 PolarHBondContact O-N 3.1Å; C258-F260 VanDerWaalsContact O-N 3.12Å; F260-R262 PolarHBondContact O-N 3.48Å; F260-S263 PolarHBondContact O-N 3.45Å; F260-L264 HydrophobicContact CB-CB 4.47Å; F260-L264 HydrophobicContact CB-CD1 3.49Å; F260-L264 VanDerWaalsContact CB-CD1 3.49Å; F260-L264 HydrophobicContact CB-CG 3.85Å; F260-L264 HydrophobicContact CD1-CD1 4.2Å; F260-L264 HydrophobicContact CD1-CG 4.47Å; F260-L264 HydrophobicContact CG-CD1 3.94Å; F260-L264 HydrophobicContact CG-CG 4.49Å; F260-L264 PolarHBondContact O-N 3.04Å; F260-L264 VanDerWaalsContact O-N 3.08Å; F260-V272 HydrophobicContact CD2-CG1 4.1Å; F260-L284 HydrophobicContact CD2-CD2 4.14Å; F260-L284 HydrophobicContact CE2-CB 4.05Å; F260-L284 HydrophobicContact CE2-CD2 3.72Å; F260-L284 HydrophobicContact CE2-CG 4.48Å; F260-L284 WeakPolarHBondContact CZ-O 3.27Å; F260-V287 HydrophobicContact CD1-CG1 3.73Å; F260-V287 HydrophobicContact CD2-CB 4.44Å; F260-V287 HydrophobicContact CD2-CG1 3.94Å; F260-V287 HydrophobicContact CE1-CB 4.17Å; F260-V287 HydrophobicContact CE1-CG1 3.44Å; F260-V287 VanDerWaalsContact CE1-CG1 3.44Å; F260-V287 HydrophobicContact CE2-CB 3.82Å; F260-V287 HydrophobicContact CE2-CG1 3.7Å; F260-V287 HydrophobicContact CG-CG1 3.97Å; F260-V287 HydrophobicContact CZ-CB 3.66Å; F260-V287 HydrophobicContact CZ-CG1 3.43Å; F260-V287 VanDerWaalsContact CZ-CG1 3.43Å; F260-L291 HydrophobicContact CD1-CD1 3.9Å; F260-L291 HydrophobicContact CE1-CD1 3.69Å |
| 261 | A | 97.1 | Very high | 96.5 | Very high | 6 Ų | 6 | 19.4 Ų | 19.4 | 5% | 0.05 | 10% | 0.099 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -20.3 | -177 | 0 | 0 | 0 | 0 | 0 | 113.9 | F143 P182 V186 C258 L259 V269 | F143-A261 HydrophobicContact CZ-CB 4.18Å; P182-A261 HydrophobicContact CB-CB 4.26Å; V186-A261 HydrophobicContact CG2-CB 4.01Å; C258-A261 WeakPolarHBondContact O-CB 3.35Å; C258-A261 PolarHBondContact O-N 3.35Å; L259-A261 PolarHBondContact O-N 2.85Å; L259-A261 VanDerWaalsContact O-N 3.11Å; A261-V269 HydrophobicContact CB-CG1 4.23Å |
| 262 | R | 94 | Very high | 96.6 | Very high | 123 Ų | 123 | 19.1 Ų | 19.1 | 46% | 0.464 | 10% | 0.098 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | -9.2 | 176 | -66.7 | -167.2 | -74.3 | 152.8 | -4.7 | 114.4 | P182 C258 F260 | P182-R262 HydrophobicContact CB-CG 4.27Å; P182-R262 HydrophobicContact CG-CG 4.07Å; C258-R262 HydrophobicContact CB-CG 4.41Å; C258-R262 VanDerWaalsContact SG-CZ 3.58Å; C258-R262 PolarHBondContact SG-NE 3.31Å; C258-R262 PolarHBondContact SG-NH2 3.34Å; F260-R262 PolarHBondContact O-N 3.48Å |
| 263 | S | 94.3 | Very high | 96.7 | Very high | 32 Ų | 32 | 19.1 Ų | 19.1 | 22% | 0.224 | 10% | 0.098 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -121.9 | -13.2 | -166 | -43 | 0 | 0 | 0 | 0 | 113.7 | E254 F260 | E254-S263 PolarHBondContact OE1-OG 2.84Å; F260-S263 PolarHBondContact O-N 3.45Å |
| 264 | L | 96.5 | Very high | 96.9 | Very high | 13 Ų | 13 | 17.5 Ų | 17.5 | 7% | 0.068 | 9% | 0.087 | C | C | . | . | S | Bend | trans | -118.8 | 153.4 | 178.2 | -67.2 | 175.5 | 0 | 0 | 0 | 110.9 | F260 F266 T268 V269 V272 V287 L291 L323 F328 | F260-L264 HydrophobicContact CB-CB 4.47Å; F260-L264 HydrophobicContact CB-CD1 3.49Å; F260-L264 VanDerWaalsContact CB-CD1 3.49Å; F260-L264 HydrophobicContact CB-CG 3.85Å; F260-L264 HydrophobicContact CD1-CD1 4.2Å; F260-L264 HydrophobicContact CD1-CG 4.47Å; F260-L264 HydrophobicContact CG-CD1 3.94Å; F260-L264 HydrophobicContact CG-CG 4.49Å; F260-L264 PolarHBondContact O-N 3.04Å; F260-L264 VanDerWaalsContact O-N 3.08Å; L264-F266 PolarHBondContact O-N 3.47Å; L264-T268 HydrophobicContact CD1-CG2 4.22Å; L264-V269 HydrophobicContact CB-CG2 3.78Å; L264-V269 WeakPolarHBondContact O-CG2 3.48Å; L264-V272 HydrophobicContact CD1-CG2 3.92Å; L264-V287 HydrophobicContact CD1-CG1 4.1Å; L264-L291 HydrophobicContact CD2-CD1 4.47Å; L264-L291 HydrophobicContact CD2-CD2 3.85Å; L264-L323 HydrophobicContact CD2-CD1 4.3Å; L264-L323 HydrophobicContact CD2-CD2 3.97Å; L264-F328 HydrophobicContact CD1-CE1 4.17Å; L264-F328 HydrophobicContact CD2-CE1 4.33Å; L264-F328 HydrophobicContact CD2-CZ 4.14Å |
| 265 | P | 95.1 | Very high | 97.1 | Very high | 41 Ų | 41 | 14.7 Ų | 14.7 | 27% | 0.266 | 7% | 0.074 | S | C | . | . | trans | -52.6 | 136.1 | 165.7 | -24.4 | 34.1 | 0 | 0 | 0 | 110.5 | T268 V269 L323 | P265-T268 WeakPolarHBondContact O-CA 3.36Å; P265-T268 WeakPolarHBondContact O-CB 3.43Å; P265-T268 PolarHBondContact O-N 2.84Å; P265-V269 PolarHBondContact O-N 3.12Å; P265-L323 HydrophobicContact CG-CB 3.82Å; P265-L323 HydrophobicContact CG-CD1 4.39Å | ||
| 266 | F | 95.1 | Very high | 97.1 | Very high | 23 Ų | 23 | 14.4 Ų | 14.4 | 10% | 0.101 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -50.4 | -43.1 | -175.8 | -168.5 | -102.1 | 0 | 0 | 0 | 115.1 | Y40 F42 F143 V186 M189 H190 L264 T268 V269 L270 | Y40-F266 AromaticContact CD1-CD1 3.7Å; Y40-F266 HydrophobicContact CD1-CD1 3.7Å; Y40-F266 AromaticContact CD1-CE1 3.72Å; Y40-F266 HydrophobicContact CD1-CE1 3.72Å; Y40-F266 HydrophobicContact CD2-CD1 4.33Å; Y40-F266 HydrophobicContact CE1-CD1 4.37Å; Y40-F266 AromaticContact CG-CD1 3.63Å; Y40-F266 HydrophobicContact CG-CD1 3.63Å; Y40-F266 AromaticContact CG-CE1 3.97Å; Y40-F266 HydrophobicContact CG-CE1 3.97Å; F42-F266 HydrophobicContact CD2-CD1 4.47Å; F42-F266 HydrophobicContact CD2-CG 4.43Å; F42-F266 HydrophobicContact CE2-CB 3.88Å; F42-F266 AromaticContact CE2-CD1 3.69Å; F42-F266 HydrophobicContact CE2-CD1 3.69Å; F42-F266 AromaticContact CE2-CD2 3.63Å; F42-F266 HydrophobicContact CE2-CD2 3.63Å; F42-F266 HydrophobicContact CE2-CE1 4.02Å; F42-F266 AromaticContact CE2-CE2 3.97Å; F42-F266 HydrophobicContact CE2-CE2 3.97Å; F42-F266 AromaticContact CE2-CG 3.45Å; F42-F266 HydrophobicContact CE2-CG 3.45Å; F42-F266 VanDerWaalsContact CE2-CG 3.45Å; F42-F266 HydrophobicContact CE2-CZ 4.14Å; F42-F266 HydrophobicContact CZ-CB 4.37Å; F42-F266 AromaticContact CZ-CD2 3.71Å; F42-F266 HydrophobicContact CZ-CD2 3.71Å; F42-F266 HydrophobicContact CZ-CE2 4.04Å; F42-F266 AromaticContact CZ-CG 4Å; F42-F266 HydrophobicContact CZ-CG 4Å; F143-F266 HydrophobicContact CE1-CD2 4.43Å; V186-F266 HydrophobicContact CG2-CE2 4.23Å; M189-F266 HydrophobicContact CE-CE2 4.37Å; M189-F266 HydrophobicContact SD-CE2 3.54Å; M189-F266 VanDerWaalsContact SD-CE2 3.54Å; M189-F266 HydrophobicContact SD-CZ 3.44Å; M189-F266 WeakPolarHBondContact SD-CZ 3.49Å; H190-F266 AromaticContact CE1-CZ 3.95Å; L264-F266 PolarHBondContact O-N 3.47Å; F266-T268 PolarHBondContact O-N 2.78Å; F266-V269 WeakPolarHBondContact O-CB 3.36Å; F266-V269 PolarHBondContact O-N 3.11Å; F266-V269 VanDerWaalsContact O-N 3.11Å; F266-L270 HydrophobicContact CD1-CD1 4.12Å; F266-L270 HydrophobicContact CD1-CG 4.34Å; F266-L270 HydrophobicContact CE1-CD1 3.77Å; F266-L270 HydrophobicContact CE1-CD2 4.12Å; F266-L270 HydrophobicContact CE1-CG 4.11Å; F266-L270 HydrophobicContact CZ-CD1 4.49Å; F266-L270 HydrophobicContact CZ-CD2 4.03Å; F266-L270 HydrophobicContact CZ-CG 4.48Å; F266-L270 WeakPolarHBondContact O-CG 3.2Å; F266-L270 PolarHBondContact O-N 2.9Å; F266-L270 VanDerWaalsContact O-N 3.16Å |
| 267 | P | 94.3 | Very high | 97.2 | Very high | 35 Ų | 35 | 14.5 Ų | 14.5 | 23% | 0.227 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -55 | -40.9 | 175.6 | -19.1 | 27.5 | 0 | 0 | 0 | 112.9 | Y40 L270 R271 E325 | Y40-P267 HydrophobicContact CD2-CG 4.21Å; Y40-P267 HydrophobicContact CE2-CB 3.92Å; Y40-P267 HydrophobicContact CE2-CG 3.5Å; Y40-P267 WeakPolarHBondContact OH-CB 3.35Å; P267-L270 PolarHBondContact O-N 3.32Å; P267-R271 PolarHBondContact O-N 3.08Å; P267-E325 WeakPolarHBondContact CB-OE2 3.44Å |
| 268 | T | 97.4 | Very high | 97.3 | Very high | 1 Ų | 1 | 14.1 Ų | 14.1 | 1% | 0.006 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -73.2 | -36.4 | 179.4 | -56.2 | 0 | 0 | 0 | 0 | 111.8 | L264 P265 F266 L270 R271 V272 L323 E325 F328 | L264-T268 HydrophobicContact CD1-CG2 4.22Å; P265-T268 WeakPolarHBondContact O-CA 3.36Å; P265-T268 WeakPolarHBondContact O-CB 3.43Å; P265-T268 PolarHBondContact O-N 2.84Å; F266-T268 PolarHBondContact O-N 2.78Å; T268-L270 VanDerWaalsContact C-N 3.27Å; T268-L270 PolarHBondContact O-N 2.69Å; T268-R271 PolarHBondContact O-N 3.45Å; T268-V272 WeakPolarHBondContact O-CG2 3.4Å; T268-V272 PolarHBondContact O-N 2.95Å; T268-L323 PolarHBondContact OG1-O 3.35Å; T268-E325 WeakPolarHBondContact OG1-CA 3.49Å; T268-E325 PolarHBondContact OG1-N 2.99Å; T268-F328 HydrophobicContact CG2-CB 4.38Å; T268-F328 HydrophobicContact CG2-CD1 3.46Å; T268-F328 VanDerWaalsContact CG2-CD1 3.46Å; T268-F328 HydrophobicContact CG2-CE1 4.04Å; T268-F328 HydrophobicContact CG2-CG 4.14Å |
| 269 | V | 98.1 | Very high | 97.3 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -53.5 | -48.1 | 171.6 | 175.9 | 0 | 0 | 0 | 0 | 110.1 | A261 L264 P265 F266 R271 V272 W273 | A261-V269 HydrophobicContact CB-CG1 4.23Å; L264-V269 HydrophobicContact CB-CG2 3.78Å; L264-V269 WeakPolarHBondContact O-CG2 3.48Å; P265-V269 PolarHBondContact O-N 3.12Å; F266-V269 WeakPolarHBondContact O-CB 3.36Å; F266-V269 PolarHBondContact O-N 3.11Å; F266-V269 VanDerWaalsContact O-N 3.11Å; V269-R271 VanDerWaalsContact C-N 3.32Å; V269-R271 PolarHBondContact O-N 2.95Å; V269-V272 WeakPolarHBondContact O-CB 3.3Å; V269-V272 PolarHBondContact O-N 3.35Å; V269-V272 VanDerWaalsContact O-N 3.12Å; V269-W273 HydrophobicContact CG1-CG 4.49Å; V269-W273 PolarHBondContact O-N 3.37Å |
| 270 | L | 98 | Very high | 97.3 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -62.7 | -38.1 | -178.8 | -57 | 179.4 | 0 | 0 | 0 | 112.5 | Y40 R98 W102 V186 H190 F266 P267 T268 W273 D274 | Y40-L270 HydrophobicContact CD1-CD1 3.93Å; Y40-L270 HydrophobicContact CE1-CD1 3.56Å; R98-L270 VanDerWaalsContact NH1-CD1 3.33Å; W102-L270 HydrophobicContact CH2-CD2 3.89Å; W102-L270 HydrophobicContact CZ2-CD2 4.23Å; V186-L270 HydrophobicContact CG1-CD2 4.33Å; H190-L270 VanDerWaalsContact CE1-CD2 3.41Å; H190-L270 WeakPolarHBondContact CE1-CD2 3.44Å; F266-L270 HydrophobicContact CD1-CD1 4.12Å; F266-L270 HydrophobicContact CD1-CG 4.34Å; F266-L270 HydrophobicContact CE1-CD1 3.77Å; F266-L270 HydrophobicContact CE1-CD2 4.12Å; F266-L270 HydrophobicContact CE1-CG 4.11Å; F266-L270 HydrophobicContact CZ-CD1 4.49Å; F266-L270 HydrophobicContact CZ-CD2 4.03Å; F266-L270 HydrophobicContact CZ-CG 4.48Å; F266-L270 WeakPolarHBondContact O-CG 3.2Å; F266-L270 PolarHBondContact O-N 2.9Å; F266-L270 VanDerWaalsContact O-N 3.16Å; P267-L270 PolarHBondContact O-N 3.32Å; T268-L270 VanDerWaalsContact C-N 3.27Å; T268-L270 PolarHBondContact O-N 2.69Å; L270-W273 PolarHBondContact O-N 3.41Å; L270-D274 PolarHBondContact O-N 3.46Å |
| 271 | R | 98.1 | Very high | 97.2 | Very high | 17 Ų | 17 | 14.2 Ų | 14.2 | 6% | 0.064 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -68 | -36.9 | 175 | -64.6 | -68 | -66 | -94.9 | -2.4 | 112.7 | R90 K91 P267 T268 V269 W273 A275 E325 E326 M329 | R90-R271 PolarHBondContact O-NH2 2.75Å; K91-R271 VanDerWaalsContact C-CZ 3.49Å; K91-R271 VanDerWaalsContact O-CZ 3.27Å; K91-R271 PolarHBondContact O-NH2 3.02Å; P267-R271 PolarHBondContact O-N 3.08Å; T268-R271 PolarHBondContact O-N 3.45Å; V269-R271 VanDerWaalsContact C-N 3.32Å; V269-R271 PolarHBondContact O-N 2.95Å; R271-W273 VanDerWaalsContact C-N 3.33Å; R271-A275 PolarHBondContact O-N 2.92Å; R271-E325 HydrophobicContact CG-CB 4.06Å; R271-E326 IonicContact CZ-OE2 3.03Å; R271-E326 IonicContact NH1-OE2 2.6Å; R271-E326 PolarHBondContact NH1-OE2 3.36Å; R271-E326 IonicContact NH2-OE2 2.87Å; R271-E326 PolarHBondContact NH2-OE2 3.4Å; R271-M329 HydrophobicContact CB-CE 4.48Å; R271-M329 HydrophobicContact CB-CG 3.7Å; R271-M329 HydrophobicContact CB-SD 4.1Å; R271-M329 HydrophobicContact CG-CG 4.46Å |
| 272 | V | 98.8 | Very high | 97.2 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -62.9 | -43.6 | 173.4 | 169 | 0 | 0 | 0 | 0 | 110 | F260 L264 T268 V269 A275 F276 V283 V287 F328 M329 | F260-V272 HydrophobicContact CD2-CG1 4.1Å; L264-V272 HydrophobicContact CD1-CG2 3.92Å; T268-V272 WeakPolarHBondContact O-CG2 3.4Å; T268-V272 PolarHBondContact O-N 2.95Å; V269-V272 WeakPolarHBondContact O-CB 3.3Å; V269-V272 PolarHBondContact O-N 3.35Å; V269-V272 VanDerWaalsContact O-N 3.12Å; V272-A275 PolarHBondContact O-N 3.32Å; V272-F276 VanDerWaalsContact O-CB 3.28Å; V272-F276 WeakPolarHBondContact O-CB 3.35Å; V272-F276 PolarHBondContact O-N 3.11Å; V272-V283 HydrophobicContact CG1-CG1 4.43Å; V272-V287 HydrophobicContact CG1-CG2 4.02Å; V272-V287 HydrophobicContact CG2-CG1 4.45Å; V272-V287 HydrophobicContact CG2-CG2 3.85Å; V272-F328 HydrophobicContact CG2-CE1 4.48Å; V272-M329 HydrophobicContact CG2-SD 3.73Å |
| 273 | W | 98.8 | Very high | 97.4 | Very high | 1 Ų | 1 | 8.9 Ų | 8.9 | 0% | 0.004 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -65.8 | -43.5 | 178.9 | -78 | 43.7 | 0 | 0 | 0 | 112.5 | W102 V183 V186 L187 I203 L259 V269 L270 R271 A275 F276 L277 | W102-W273 AromaticContact CH2-CE3 3.81Å; W102-W273 HydrophobicContact CH2-CE3 3.81Å; W102-W273 HydrophobicContact CH2-CZ3 4.46Å; W102-W273 HydrophobicContact CZ2-CB 4Å; W102-W273 HydrophobicContact CZ2-CE3 4.28Å; W102-W273 AromaticContact CZ3-CE3 3.97Å; W102-W273 HydrophobicContact CZ3-CE3 3.97Å; W102-W273 HydrophobicContact CZ3-CZ3 4.27Å; V183-W273 HydrophobicContact CB-CH2 4.36Å; V183-W273 HydrophobicContact CG1-CH2 3.81Å; V183-W273 HydrophobicContact CG1-CZ2 4.35Å; V183-W273 WeakPolarHBondContact O-CH2 2.92Å; V186-W273 HydrophobicContact CB-CH2 3.59Å; V186-W273 HydrophobicContact CB-CZ2 3.96Å; V186-W273 HydrophobicContact CB-CZ3 4.02Å; V186-W273 HydrophobicContact CG1-CD2 4.17Å; V186-W273 HydrophobicContact CG1-CE3 3.88Å; V186-W273 HydrophobicContact CG1-CH2 3.61Å; V186-W273 HydrophobicContact CG1-CZ2 3.89Å; V186-W273 HydrophobicContact CG1-CZ3 3.6Å; V186-W273 HydrophobicContact CG2-CH2 4.41Å; V186-W273 HydrophobicContact CG2-CZ2 4.31Å; L187-W273 HydrophobicContact CD2-CZ3 3.75Å; L187-W273 HydrophobicContact CG-CH2 4.33Å; L187-W273 HydrophobicContact CG-CZ3 3.87Å; I203-W273 HydrophobicContact CD1-CZ3 4.46Å; L259-W273 HydrophobicContact CB-CZ2 3.85Å; L259-W273 VanDerWaalsContact CB-NE1 3.35Å; L259-W273 HydrophobicContact CD1-CD2 4.48Å; L259-W273 HydrophobicContact CD1-CH2 4.14Å; L259-W273 HydrophobicContact CD1-CZ2 3.69Å; L259-W273 HydrophobicContact CG-CZ2 4.29Å; L259-W273 PolarHBondContact O-NE1 3.16Å; V269-W273 HydrophobicContact CG1-CG 4.49Å; V269-W273 PolarHBondContact O-N 3.37Å; L270-W273 PolarHBondContact O-N 3.41Å; R271-W273 VanDerWaalsContact C-N 3.33Å; W273-A275 PolarHBondContact O-N 2.85Å; W273-F276 PolarHBondContact O-N 2.65Å; W273-L277 WeakPolarHBondContact O-CG 3.23Å; W273-L277 PolarHBondContact O-N 3.37Å |
| 274 | D | 98.7 | Very high | 97.6 | Very high | 0 Ų | 0 | 7.3 Ų | 7.3 | 0% | 0 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -53.7 | -42.9 | 174.1 | -67.2 | -21.9 | 0 | 0 | 0 | 111.2 | C89 I93 R98 W102 L270 S278 | C89-D274 WeakPolarHBondContact CB-O 3.18Å; I93-D274 HydrophobicContact CD1-CB 4.12Å; I93-D274 HydrophobicContact CG1-CB 3.99Å; I93-D274 PolarHBondContact N-OD2 3.31Å; R98-D274 IonicContact CZ-OD2 3.02Å; R98-D274 IonicContact NE-OD1 3.06Å; R98-D274 PolarHBondContact NE-OD1 3.46Å; R98-D274 IonicContact NE-OD2 3.46Å; R98-D274 IonicContact NH2-OD2 3.98Å; R98-D274 PolarHBondContact NH2-OD2 2.92Å; W102-D274 PolarHBondContact NE1-OD1 2.96Å; L270-D274 PolarHBondContact O-N 3.46Å; D274-S278 WeakPolarHBondContact O-CB 3.24Å |
| 275 | A | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 6.7 Ų | 6.7 | 0% | 0 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -74.6 | -42.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | R271 V272 W273 S278 E279 V283 M329 | R271-A275 PolarHBondContact O-N 2.92Å; V272-A275 PolarHBondContact O-N 3.32Å; W273-A275 PolarHBondContact O-N 2.85Å; A275-S278 PolarHBondContact O-N 3.02Å; A275-S278 VanDerWaalsContact O-N 3.15Å; A275-E279 WeakPolarHBondContact O-CB 3.38Å; A275-E279 PolarHBondContact O-N 2.89Å; A275-V283 HydrophobicContact CB-CG1 4Å; A275-V283 HydrophobicContact CB-CG2 4.24Å; A275-M329 HydrophobicContact CB-CE 4.04Å |
| 276 | F | 98.8 | Very high | 97.9 | Very high | 1 Ų | 1 | 5.7 Ų | 5.7 | 0% | 0.004 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -61.2 | -47.9 | 179.9 | 165.2 | -107.5 | 0 | 0 | 0 | 111.8 | I203 Y207 L208 L259 V272 W273 S278 E279 G280 V283 L284 | I203-F276 HydrophobicContact CG1-CE1 4.27Å; Y207-F276 HydrophobicContact CD1-CD2 4.47Å; Y207-F276 HydrophobicContact CD1-CE1 4.15Å; Y207-F276 AromaticContact CD1-CE2 3.83Å; Y207-F276 HydrophobicContact CD1-CE2 3.83Å; Y207-F276 AromaticContact CD1-CZ 3.66Å; Y207-F276 HydrophobicContact CD1-CZ 3.66Å; Y207-F276 WeakPolarHBondContact CE1-O 3.47Å; Y207-F276 HydrophobicContact CG-CE1 4.33Å; Y207-F276 HydrophobicContact CG-CE2 4.39Å; Y207-F276 AromaticContact CG-CZ 3.84Å; Y207-F276 HydrophobicContact CG-CZ 3.84Å; L208-F276 HydrophobicContact CD1-CZ 4.23Å; L208-F276 HydrophobicContact CD2-CE2 4.38Å; L208-F276 HydrophobicContact CG-CZ 4.24Å; L259-F276 HydrophobicContact CD1-CD1 4.34Å; L259-F276 HydrophobicContact CD1-CE1 3.87Å; L259-F276 HydrophobicContact CD1-CZ 4.47Å; L259-F276 HydrophobicContact CD2-CE1 4.19Å; L259-F276 HydrophobicContact CD2-CE2 4.49Å; L259-F276 HydrophobicContact CD2-CZ 4.05Å; V272-F276 VanDerWaalsContact O-CB 3.28Å; V272-F276 WeakPolarHBondContact O-CB 3.35Å; V272-F276 PolarHBondContact O-N 3.11Å; W273-F276 PolarHBondContact O-N 2.65Å; F276-S278 PolarHBondContact O-N 3.31Å; F276-E279 PolarHBondContact O-N 3.39Å; F276-G280 VanDerWaalsContact O-CA 3.3Å; F276-G280 WeakPolarHBondContact O-CA 3.3Å; F276-G280 PolarHBondContact O-N 3.35Å; F276-V283 HydrophobicContact CB-CB 4.35Å; F276-V283 HydrophobicContact CB-CG1 4.35Å; F276-L284 HydrophobicContact CD2-CD1 4.38Å; F276-L284 HydrophobicContact CD2-CD2 3.89Å; F276-L284 HydrophobicContact CD2-CG 3.99Å; F276-L284 HydrophobicContact CE2-CD1 4.03Å; F276-L284 HydrophobicContact CE2-CD2 4.29Å; F276-L284 HydrophobicContact CE2-CG 4.14Å; F276-L284 HydrophobicContact CG-CD2 4.36Å |
| 277 | L | 98.6 | Very high | 98.1 | Very high | 3 Ų | 3 | 4.6 Ų | 4.6 | 2% | 0.016 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -66.8 | -20.6 | 176.9 | -61.1 | 179.7 | 0 | 0 | 0 | 112.4 | W102 L105 C106 I203 Y207 W273 A371 | W102-L277 HydrophobicContact CB-CD1 3.74Å; W102-L277 HydrophobicContact CD2-CD1 3.98Å; W102-L277 HydrophobicContact CG-CD1 3.5Å; L105-L277 HydrophobicContact CB-CB 4.05Å; L105-L277 HydrophobicContact CD1-CB 4.41Å; C106-L277 HydrophobicContact CB-CD2 4.08Å; I203-L277 HydrophobicContact CD1-CD2 4.49Å; I203-L277 HydrophobicContact CG1-CD2 4.33Å; Y207-L277 PolarHBondContact OH-O 3.16Å; W273-L277 WeakPolarHBondContact O-CG 3.23Å; W273-L277 PolarHBondContact O-N 3.37Å; L277-A371 WeakPolarHBondContact O-CB 3.35Å; L277-A371 PolarHBondContact O-N 3.19Å |
| 278 | S | 98.3 | Very high | 98.3 | Very high | 0 Ų | 0 | 3 Ų | 3 | 0% | 0 | 1% | 0.013 | C | C | . | . | H | α-helix | trans | -86.9 | -40.2 | 176.2 | -165.7 | 0 | 0 | 0 | 0 | 113.5 | Y82 C89 D274 A275 F276 A371 | Y82-S278 PolarHBondContact OH-O 3.42Å; C89-S278 VanDerWaalsContact SG-CB 3.54Å; C89-S278 PolarHBondContact SG-OG 2.97Å; D274-S278 WeakPolarHBondContact O-CB 3.24Å; A275-S278 PolarHBondContact O-N 3.02Å; A275-S278 VanDerWaalsContact O-N 3.15Å; F276-S278 PolarHBondContact O-N 3.31Å; S278-A371 PolarHBondContact O-N 3.22Å; S278-A371 VanDerWaalsContact O-N 3.16Å |
| 279 | E | 98 | Very high | 98.4 | Very high | 1 Ų | 1 | 3.1 Ų | 3.1 | 1% | 0.005 | 1% | 0.014 | C | C | . | . | H | α-helix | trans | -118.3 | -4.8 | -166.8 | -66.5 | -169 | -123.6 | 0 | 0 | 114.7 | K86 R90 A275 F276 K282 V283 R286 A369 | K86-E279 HydrophobicContact CD-CG 4.16Å; K86-E279 WeakPolarHBondContact CE-OE2 3.36Å; K86-E279 HydrophobicContact CG-CG 4.07Å; K86-E279 IonicContact NZ-OE2 3.67Å; K86-E279 PolarHBondContact NZ-OE2 2.87Å; R90-E279 IonicContact CZ-OE1 2.8Å; R90-E279 VanDerWaalsContact CZ-OE1 3.27Å; R90-E279 IonicContact CZ-OE2 3.22Å; R90-E279 IonicContact NE-OE1 2.91Å; R90-E279 PolarHBondContact NE-OE1 3.45Å; R90-E279 IonicContact NE-OE2 3.91Å; R90-E279 VanDerWaalsContact NH2-CD 3.32Å; R90-E279 IonicContact NH2-OE1 3.55Å; R90-E279 PolarHBondContact NH2-OE1 2.98Å; R90-E279 IonicContact NH2-OE2 2.75Å; R90-E279 PolarHBondContact NH2-OE2 3.49Å; A275-E279 WeakPolarHBondContact O-CB 3.38Å; A275-E279 PolarHBondContact O-N 2.89Å; F276-E279 PolarHBondContact O-N 3.39Å; E279-K282 PolarHBondContact O-NZ 3.15Å; E279-V283 HydrophobicContact CB-CG2 3.76Å; E279-R286 IonicContact OE2-NH1 3.02Å; E279-R286 PolarHBondContact OE2-NH1 3.02Å; E279-A369 CarbonylContact C-O 3.57Å |
| 280 | G | 97.5 | Very high | 98.4 | Very high | 0 Ų | 0 | 3.1 Ų | 3.1 | 0% | 0 | 1% | 0.014 | C | C | . | . | trans | 79.5 | -169.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | F276 K282 V283 | F276-G280 VanDerWaalsContact O-CA 3.3Å; F276-G280 WeakPolarHBondContact O-CA 3.3Å; F276-G280 PolarHBondContact O-N 3.35Å; G280-K282 PolarHBondContact O-N 3.19Å; G280-V283 PolarHBondContact O-N 3.47Å; G280-V283 VanDerWaalsContact O-N 3.1Å | ||
| 281 | A | 96.9 | Very high | 98.4 | Very high | 2 Ų | 2 | 3.3 Ų | 3.3 | 2% | 0.017 | 1% | 0.014 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -24.1 | -169.3 | 0 | 0 | 0 | 0 | 0 | 115 | L208 V283 L284 F285 | L208-A281 HydrophobicContact CD2-CB 4.13Å; A281-V283 PolarHBondContact O-N 2.86Å; A281-L284 WeakPolarHBondContact O-CB 3.44Å; A281-L284 PolarHBondContact O-N 3.26Å; A281-F285 WeakPolarHBondContact O-CD2 3.5Å |
| 282 | K | 97.6 | Very high | 98.5 | Very high | 13 Ų | 13 | 2.5 Ų | 2.5 | 6% | 0.057 | 1% | 0.011 | C | C | . | . | H | α-helix | trans | -55.7 | -25.8 | 175.1 | 65.8 | 167.9 | 165 | -68.5 | 0 | 113.8 | E279 G280 L284 F285 R286 E339 L342 | E279-K282 PolarHBondContact O-NZ 3.15Å; G280-K282 PolarHBondContact O-N 3.19Å; K282-L284 VanDerWaalsContact C-N 3.3Å; K282-F285 PolarHBondContact O-N 2.91Å; K282-R286 WeakPolarHBondContact O-CG 3.47Å; K282-R286 PolarHBondContact O-N 2.91Å; K282-R286 VanDerWaalsContact O-N 3.09Å; K282-E339 HydrophobicContact CD-CB 4.45Å; K282-E339 WeakPolarHBondContact CD-OE2 3.48Å; K282-E339 IonicContact NZ-OE2 3.27Å; K282-E339 PolarHBondContact NZ-OE2 2.81Å; K282-L342 HydrophobicContact CB-CD2 3.83Å |
| 283 | V | 98.7 | Very high | 98.4 | Very high | 3 Ų | 3 | 6.5 Ų | 6.5 | 2% | 0.018 | 3% | 0.027 | C | C | . | . | H | α-helix | trans | -63 | -40.3 | 175.1 | 176.4 | 0 | 0 | 0 | 0 | 110.3 | V272 A275 F276 E279 G280 A281 F285 R286 V287 | V272-V283 HydrophobicContact CG1-CG1 4.43Å; A275-V283 HydrophobicContact CB-CG1 4Å; A275-V283 HydrophobicContact CB-CG2 4.24Å; F276-V283 HydrophobicContact CB-CB 4.35Å; F276-V283 HydrophobicContact CB-CG1 4.35Å; E279-V283 HydrophobicContact CB-CG2 3.76Å; G280-V283 PolarHBondContact O-N 3.47Å; G280-V283 VanDerWaalsContact O-N 3.1Å; A281-V283 PolarHBondContact O-N 2.86Å; V283-F285 VanDerWaalsContact C-N 3.32Å; V283-F285 PolarHBondContact O-N 2.84Å; V283-R286 PolarHBondContact O-N 2.92Å; V283-R286 VanDerWaalsContact O-N 3.17Å; V283-V287 HydrophobicContact CG1-CG2 4.21Å; V283-V287 VanDerWaalsContact O-CG2 3.28Å; V283-V287 WeakPolarHBondContact O-CG2 3.35Å; V283-V287 PolarHBondContact O-N 3.08Å |
| 284 | L | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 7.2 Ų | 7.2 | 0% | 0 | 3% | 0.03 | C | C | . | . | H | α-helix | trans | -60.6 | -43.4 | 178.8 | -51.5 | -178.6 | 0 | 0 | 0 | 111.4 | L208 F256 L259 F260 F276 A281 K282 V287 G288 | L208-L284 HydrophobicContact CD1-CD1 4.3Å; L208-L284 HydrophobicContact CD2-CD1 3.86Å; F256-L284 HydrophobicContact CD1-CB 4.16Å; F256-L284 HydrophobicContact CE1-CB 4.01Å; F256-L284 WeakPolarHBondContact CE1-O 3.35Å; F256-L284 HydrophobicContact CE2-CB 4.36Å; F256-L284 HydrophobicContact CG-CB 4.43Å; F256-L284 HydrophobicContact CZ-CB 4.11Å; L259-L284 HydrophobicContact CD2-CD1 3.99Å; L259-L284 HydrophobicContact CD2-CD2 4.03Å; F260-L284 HydrophobicContact CD2-CD2 4.14Å; F260-L284 HydrophobicContact CE2-CB 4.05Å; F260-L284 HydrophobicContact CE2-CD2 3.72Å; F260-L284 HydrophobicContact CE2-CG 4.48Å; F260-L284 WeakPolarHBondContact CZ-O 3.27Å; F276-L284 HydrophobicContact CD2-CD1 4.38Å; F276-L284 HydrophobicContact CD2-CD2 3.89Å; F276-L284 HydrophobicContact CD2-CG 3.99Å; F276-L284 HydrophobicContact CE2-CD1 4.03Å; F276-L284 HydrophobicContact CE2-CD2 4.29Å; F276-L284 HydrophobicContact CE2-CG 4.14Å; F276-L284 HydrophobicContact CG-CD2 4.36Å; A281-L284 WeakPolarHBondContact O-CB 3.44Å; A281-L284 PolarHBondContact O-N 3.26Å; K282-L284 VanDerWaalsContact C-N 3.3Å; L284-V287 PolarHBondContact O-N 3.43Å; L284-G288 PolarHBondContact O-N 3.47Å |
| 285 | F | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 7.6 Ų | 7.6 | 0% | 0 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -62.4 | -44.5 | 174.6 | -71.4 | -92.9 | 0 | 0 | 0 | 112.7 | D222 V225 F226 L229 F256 A281 K282 V283 V287 G288 L289 L337 L342 | D222-F285 HydrophobicContact CB-CE1 4.39Å; D222-F285 HydrophobicContact CB-CZ 3.73Å; D222-F285 WeakPolarHBondContact OD2-CZ 3.48Å; V225-F285 HydrophobicContact CB-CE1 4.13Å; V225-F285 HydrophobicContact CB-CZ 4.46Å; V225-F285 HydrophobicContact CG1-CD1 4.39Å; V225-F285 HydrophobicContact CG1-CE1 3.6Å; V225-F285 HydrophobicContact CG1-CZ 3.98Å; F226-F285 HydrophobicContact CB-CD1 4.36Å; F226-F285 HydrophobicContact CB-CE1 4.15Å; F226-F285 AromaticContact CD2-CD1 3.8Å; F226-F285 HydrophobicContact CD2-CD1 3.8Å; F226-F285 HydrophobicContact CD2-CE1 4.35Å; L229-F285 HydrophobicContact CD1-CB 4.42Å; L229-F285 HydrophobicContact CD1-CD1 3.67Å; L229-F285 HydrophobicContact CD1-CE1 4.31Å; L229-F285 HydrophobicContact CD1-CG 4.31Å; F256-F285 HydrophobicContact CE2-CD1 4.24Å; F256-F285 HydrophobicContact CE2-CD2 4.21Å; F256-F285 HydrophobicContact CE2-CE1 4.05Å; F256-F285 HydrophobicContact CE2-CE2 4.02Å; F256-F285 HydrophobicContact CE2-CG 4.32Å; F256-F285 AromaticContact CE2-CZ 3.95Å; F256-F285 HydrophobicContact CE2-CZ 3.95Å; F256-F285 HydrophobicContact CZ-CD1 4.2Å; F256-F285 HydrophobicContact CZ-CD2 4.41Å; F256-F285 HydrophobicContact CZ-CE1 4.44Å; F256-F285 HydrophobicContact CZ-CG 4.19Å; A281-F285 WeakPolarHBondContact O-CD2 3.5Å; K282-F285 PolarHBondContact O-N 2.91Å; V283-F285 VanDerWaalsContact C-N 3.32Å; V283-F285 PolarHBondContact O-N 2.84Å; F285-V287 VanDerWaalsContact C-N 3.33Å; F285-V287 PolarHBondContact O-N 2.94Å; F285-G288 PolarHBondContact O-N 3.24Å; F285-L289 WeakPolarHBondContact O-CB 3.3Å; F285-L289 VanDerWaalsContact O-CG 3.23Å; F285-L289 WeakPolarHBondContact O-CG 3.48Å; F285-L289 PolarHBondContact O-N 3.22Å; F285-L337 HydrophobicContact CB-CD2 3.48Å; F285-L337 VanDerWaalsContact CB-CD2 3.48Å; F285-L337 HydrophobicContact CG-CD2 4.38Å; F285-L342 HydrophobicContact CD1-CD1 4.21Å; F285-L342 HydrophobicContact CD2-CD1 3.84Å; F285-L342 HydrophobicContact CD2-CD2 3.98Å; F285-L342 HydrophobicContact CE1-CD1 4.05Å; F285-L342 HydrophobicContact CE2-CD1 3.67Å; F285-L342 HydrophobicContact CE2-CD2 4.01Å; F285-L342 HydrophobicContact CE2-CG 4.48Å; F285-L342 HydrophobicContact CG-CD1 4.11Å; F285-L342 HydrophobicContact CZ-CD1 3.76Å |
| 286 | R | 98.8 | Very high | 98.4 | Very high | 20 Ų | 20 | 7.6 Ų | 7.6 | 8% | 0.075 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -62.5 | -40.7 | 177.1 | -68.6 | -178.3 | 179 | 154.9 | -3.1 | 112 | E279 K282 V283 T290 V332 V335 L337 | E279-R286 IonicContact OE2-NH1 3.02Å; E279-R286 PolarHBondContact OE2-NH1 3.02Å; K282-R286 WeakPolarHBondContact O-CG 3.47Å; K282-R286 PolarHBondContact O-N 2.91Å; K282-R286 VanDerWaalsContact O-N 3.09Å; V283-R286 PolarHBondContact O-N 2.92Å; V283-R286 VanDerWaalsContact O-N 3.17Å; R286-T290 WeakPolarHBondContact O-CB 3.42Å; R286-T290 PolarHBondContact O-N 2.95Å; R286-T290 PolarHBondContact O-OG1 2.94Å; R286-V332 HydrophobicContact CB-CG1 3.84Å; R286-V335 HydrophobicContact CB-CB 4.03Å; R286-V335 HydrophobicContact CB-CG1 4.28Å; R286-V335 HydrophobicContact CB-CG2 4.39Å; R286-V335 HydrophobicContact CG-CB 3.85Å; R286-V335 HydrophobicContact CG-CG1 3.92Å; R286-V335 PolarHBondContact NE-O 3.48Å; R286-L337 HydrophobicContact CG-CB 4.16Å; R286-L337 HydrophobicContact CG-CD2 4.22Å; R286-L337 VanDerWaalsContact CZ-O 3.27Å; R286-L337 PolarHBondContact NE-O 2.9Å; R286-L337 VanDerWaalsContact NE-O 3.14Å; R286-L337 PolarHBondContact NH2-O 2.87Å |
| 287 | V | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 9 Ų | 9 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -63.8 | -51.3 | 176 | 175.1 | 0 | 0 | 0 | 0 | 110 | F260 L264 V272 V283 L284 F285 L289 T290 L291 F328 V332 | F260-V287 HydrophobicContact CD1-CG1 3.73Å; F260-V287 HydrophobicContact CD2-CB 4.44Å; F260-V287 HydrophobicContact CD2-CG1 3.94Å; F260-V287 HydrophobicContact CE1-CB 4.17Å; F260-V287 HydrophobicContact CE1-CG1 3.44Å; F260-V287 VanDerWaalsContact CE1-CG1 3.44Å; F260-V287 HydrophobicContact CE2-CB 3.82Å; F260-V287 HydrophobicContact CE2-CG1 3.7Å; F260-V287 HydrophobicContact CG-CG1 3.97Å; F260-V287 HydrophobicContact CZ-CB 3.66Å; F260-V287 HydrophobicContact CZ-CG1 3.43Å; F260-V287 VanDerWaalsContact CZ-CG1 3.43Å; L264-V287 HydrophobicContact CD1-CG1 4.1Å; V272-V287 HydrophobicContact CG1-CG2 4.02Å; V272-V287 HydrophobicContact CG2-CG1 4.45Å; V272-V287 HydrophobicContact CG2-CG2 3.85Å; V283-V287 HydrophobicContact CG1-CG2 4.21Å; V283-V287 VanDerWaalsContact O-CG2 3.28Å; V283-V287 WeakPolarHBondContact O-CG2 3.35Å; V283-V287 PolarHBondContact O-N 3.08Å; L284-V287 PolarHBondContact O-N 3.43Å; F285-V287 VanDerWaalsContact C-N 3.33Å; F285-V287 PolarHBondContact O-N 2.94Å; V287-L289 PolarHBondContact O-N 3.4Å; V287-T290 WeakPolarHBondContact O-CA 3.49Å; V287-T290 WeakPolarHBondContact O-CB 3.38Å; V287-T290 PolarHBondContact O-N 3.28Å; V287-L291 HydrophobicContact CG1-CD1 4.24Å; V287-L291 WeakPolarHBondContact O-CG 3.33Å; V287-L291 PolarHBondContact O-N 2.97Å; V287-F328 HydrophobicContact CG1-CE1 4.01Å; V287-F328 HydrophobicContact CG1-CZ 3.93Å; V287-V332 HydrophobicContact CG2-CG1 3.78Å; V287-V332 HydrophobicContact CG2-CG2 4.02Å |
| 288 | G | 98.6 | Very high | 98.3 | Very high | 0 Ų | 0 | 12.1 Ų | 12.1 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -58.4 | -44.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | L284 F285 T290 L291 V292 | L284-G288 PolarHBondContact O-N 3.47Å; F285-G288 PolarHBondContact O-N 3.24Å; G288-T290 VanDerWaalsContact C-N 3.27Å; G288-T290 PolarHBondContact O-N 3.22Å; G288-L291 PolarHBondContact O-N 3.49Å; G288-V292 WeakPolarHBondContact O-CG2 3.37Å; G288-V292 PolarHBondContact O-N 3.47Å |
| 289 | L | 98.8 | Very high | 98.3 | Very high | 5 Ų | 5 | 15.6 Ų | 15.6 | 3% | 0.026 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -62.2 | -36.1 | 175.6 | -73 | 166.8 | 0 | 0 | 0 | 112 | F226 L229 L230 L233 L234 F285 V287 R293 V335 L337 | F226-L289 HydrophobicContact CE2-CD2 4.24Å; F226-L289 HydrophobicContact CE2-CG 3.95Å; F226-L289 HydrophobicContact CZ-CD2 4.25Å; F226-L289 HydrophobicContact CZ-CG 4.31Å; L229-L289 HydrophobicContact CB-CD1 4.46Å; L229-L289 HydrophobicContact CB-CD2 4.42Å; L230-L289 HydrophobicContact CD2-CD2 3.69Å; L230-L289 HydrophobicContact CG-CD2 4.12Å; L233-L289 HydrophobicContact CD1-CD1 3.69Å; L234-L289 HydrophobicContact CD1-CD2 4.39Å; F285-L289 WeakPolarHBondContact O-CB 3.3Å; F285-L289 VanDerWaalsContact O-CG 3.23Å; F285-L289 WeakPolarHBondContact O-CG 3.48Å; F285-L289 PolarHBondContact O-N 3.22Å; V287-L289 PolarHBondContact O-N 3.4Å; L289-R293 WeakPolarHBondContact O-CB 3.28Å; L289-R293 PolarHBondContact O-N 3.05Å; L289-V335 HydrophobicContact CD1-CG1 3.98Å; L289-L337 HydrophobicContact CD1-CD2 4.46Å |
| 290 | T | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -66.6 | -45.7 | 176 | -58 | 0 | 0 | 0 | 0 | 110.5 | R286 V287 G288 V292 R293 L294 F328 Q331 V332 V335 | R286-T290 WeakPolarHBondContact O-CB 3.42Å; R286-T290 PolarHBondContact O-N 2.95Å; R286-T290 PolarHBondContact O-OG1 2.94Å; V287-T290 WeakPolarHBondContact O-CA 3.49Å; V287-T290 WeakPolarHBondContact O-CB 3.38Å; V287-T290 PolarHBondContact O-N 3.28Å; G288-T290 VanDerWaalsContact C-N 3.27Å; G288-T290 PolarHBondContact O-N 3.22Å; T290-V292 PolarHBondContact O-N 3.11Å; T290-R293 PolarHBondContact O-N 3.07Å; T290-L294 HydrophobicContact CG2-CD1 4.24Å; T290-L294 HydrophobicContact CG2-CG 4.39Å; T290-L294 VanDerWaalsContact O-CG 3.32Å; T290-L294 WeakPolarHBondContact O-CG 3.37Å; T290-L294 PolarHBondContact O-N 3.04Å; T290-F328 HydrophobicContact CG2-CD2 4.26Å; T290-F328 HydrophobicContact CG2-CE2 3.78Å; T290-F328 HydrophobicContact CG2-CZ 4.29Å; T290-Q331 HydrophobicContact CG2-CB 3.89Å; T290-V332 HydrophobicContact CG2-CG2 4.14Å; T290-V335 WeakPolarHBondContact OG1-CG2 3.38Å |
| 291 | L | 98.7 | Very high | 98.3 | Very high | 3 Ų | 3 | 26 Ų | 26 | 2% | 0.016 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.7 | -46.7 | 176.8 | -66.1 | 171.6 | 0 | 0 | 0 | 111.9 | W255 F260 L264 V287 G288 R293 L294 A295 I318 L323 F328 | W255-L291 HydrophobicContact CD2-CD1 4.06Å; W255-L291 HydrophobicContact CE3-CD1 4.27Å; W255-L291 HydrophobicContact CH2-CB 3.79Å; W255-L291 HydrophobicContact CH2-CD1 4.27Å; W255-L291 HydrophobicContact CZ2-CB 4.12Å; W255-L291 HydrophobicContact CZ2-CD1 4.05Å; W255-L291 HydrophobicContact CZ3-CB 4.22Å; W255-L291 HydrophobicContact CZ3-CD1 4.38Å; F260-L291 HydrophobicContact CD1-CD1 3.9Å; F260-L291 HydrophobicContact CE1-CD1 3.69Å; L264-L291 HydrophobicContact CD2-CD1 4.47Å; L264-L291 HydrophobicContact CD2-CD2 3.85Å; V287-L291 HydrophobicContact CG1-CD1 4.24Å; V287-L291 WeakPolarHBondContact O-CG 3.33Å; V287-L291 PolarHBondContact O-N 2.97Å; G288-L291 PolarHBondContact O-N 3.49Å; L291-R293 VanDerWaalsContact C-N 3.3Å; L291-R293 PolarHBondContact O-N 3.49Å; L291-L294 PolarHBondContact O-N 2.94Å; L291-L294 VanDerWaalsContact O-N 3.16Å; L291-A295 WeakPolarHBondContact O-CB 3.13Å; L291-A295 PolarHBondContact O-N 2.8Å; L291-I318 HydrophobicContact CB-CD1 3.79Å; L291-I318 HydrophobicContact CD2-CD1 3.53Å; L291-I318 HydrophobicContact CG-CD1 4.25Å; L291-I318 WeakPolarHBondContact O-CD1 3.47Å; L291-L323 HydrophobicContact CD2-CD2 3.69Å; L291-F328 HydrophobicContact CD2-CE2 3.68Å; L291-F328 HydrophobicContact CD2-CZ 3.77Å; L291-F328 HydrophobicContact CG-CE2 4.33Å; L291-F328 HydrophobicContact CG-CZ 4.1Å |
| 292 | V | 98.6 | Very high | 98.3 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -59.7 | -41.3 | 176 | 172 | 0 | 0 | 0 | 0 | 111.5 | F226 L230 L234 V237 Y251 W255 G288 T290 A295 L296 L315 | F226-V292 HydrophobicContact CE1-CG2 4.13Å; F226-V292 HydrophobicContact CZ-CG2 4.08Å; L230-V292 HydrophobicContact CD2-CB 4.23Å; L230-V292 HydrophobicContact CD2-CG1 3.68Å; L230-V292 HydrophobicContact CD2-CG2 4.44Å; L234-V292 HydrophobicContact CD1-CG1 4.24Å; V237-V292 HydrophobicContact CB-CG1 4.4Å; V237-V292 HydrophobicContact CG1-CG1 3.42Å; V237-V292 VanDerWaalsContact CG1-CG1 3.42Å; Y251-V292 HydrophobicContact CE2-CG2 4.4Å; W255-V292 HydrophobicContact CH2-CG2 3.92Å; W255-V292 HydrophobicContact CZ3-CG2 3.98Å; G288-V292 WeakPolarHBondContact O-CG2 3.37Å; G288-V292 PolarHBondContact O-N 3.47Å; T290-V292 PolarHBondContact O-N 3.11Å; V292-A295 PolarHBondContact O-N 3.02Å; V292-L296 PolarHBondContact O-N 3.29Å; V292-L315 HydrophobicContact CB-CD2 4.42Å; V292-L315 HydrophobicContact CG2-CD2 3.93Å |
| 293 | R | 98.4 | Very high | 98.3 | Very high | 85 Ų | 85 | 30.2 Ų | 30.2 | 32% | 0.321 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -65.5 | -40.1 | 176 | -175.2 | -179.1 | 67.7 | -163.2 | -2.4 | 112.4 | L234 L289 T290 L291 A295 G297 | L234-R293 HydrophobicContact CD1-CB 4.07Å; L234-R293 HydrophobicContact CD2-CB 4.32Å; L234-R293 HydrophobicContact CD2-CG 4.25Å; L289-R293 WeakPolarHBondContact O-CB 3.28Å; L289-R293 PolarHBondContact O-N 3.05Å; T290-R293 PolarHBondContact O-N 3.07Å; L291-R293 VanDerWaalsContact C-N 3.3Å; L291-R293 PolarHBondContact O-N 3.49Å; R293-A295 VanDerWaalsContact C-N 3.32Å; R293-G297 WeakPolarHBondContact O-CA 3.31Å; R293-G297 PolarHBondContact O-N 2.84Å |
| 294 | L | 98.1 | Very high | 98.2 | Very high | 15 Ų | 15 | 33.7 Ų | 33.7 | 8% | 0.079 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -66.8 | -36.7 | 178.4 | -68.1 | 176.6 | 0 | 0 | 0 | 111.7 | T290 L291 Q301 I318 Q322 L323 F328 | T290-L294 HydrophobicContact CG2-CD1 4.24Å; T290-L294 HydrophobicContact CG2-CG 4.39Å; T290-L294 VanDerWaalsContact O-CG 3.32Å; T290-L294 WeakPolarHBondContact O-CG 3.37Å; T290-L294 PolarHBondContact O-N 3.04Å; L291-L294 PolarHBondContact O-N 2.94Å; L291-L294 VanDerWaalsContact O-N 3.16Å; L294-Q301 PolarHBondContact O-NE2 3.14Å; L294-I318 HydrophobicContact CB-CD1 4.41Å; L294-I318 HydrophobicContact CB-CG2 4.15Å; L294-I318 HydrophobicContact CD1-CG2 4.26Å; L294-Q322 HydrophobicContact CD1-CB 4.35Å; L294-L323 HydrophobicContact CD1-CD2 4.27Å; L294-F328 HydrophobicContact CD1-CD2 3.9Å; L294-F328 HydrophobicContact CD1-CE2 3.82Å |
| 295 | A | 98 | Very high | 98.2 | Very high | 9 Ų | 9 | 34.1 Ų | 34.1 | 7% | 0.074 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -78 | -39.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | L291 V292 R293 Q301 A314 L315 I318 | L291-A295 WeakPolarHBondContact O-CB 3.13Å; L291-A295 PolarHBondContact O-N 2.8Å; V292-A295 PolarHBondContact O-N 3.02Å; R293-A295 VanDerWaalsContact C-N 3.32Å; A295-Q301 WeakPolarHBondContact O-CB 3.47Å; A295-A314 WeakPolarHBondContact CB-O 3.27Å; A295-L315 HydrophobicContact CB-CD2 3.88Å; A295-L315 HydrophobicContact CB-CG 4.45Å; A295-I318 HydrophobicContact CB-CD1 4.34Å; A295-I318 HydrophobicContact CB-CG1 4.17Å |
| 296 | L | 98.4 | Very high | 98.1 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -132.6 | 9.5 | -164.7 | -58.8 | 172.2 | 0 | 0 | 0 | 113.9 | V237 L241 V292 T298 R302 C305 T311 A314 L315 | V237-L296 HydrophobicContact CG1-CB 3.74Å; V237-L296 HydrophobicContact CG1-CD1 3.95Å; V237-L296 HydrophobicContact CG2-CB 4.38Å; V237-L296 WeakPolarHBondContact CG2-O 3.36Å; L241-L296 HydrophobicContact CD2-CD1 3.83Å; L241-L296 HydrophobicContact CG-CD1 4.43Å; V292-L296 PolarHBondContact O-N 3.29Å; L296-T298 PolarHBondContact O-N 3.4Å; L296-R302 HydrophobicContact CB-CG 4.19Å; L296-R302 WeakPolarHBondContact O-CD 3.49Å; L296-R302 WeakPolarHBondContact O-CG 3.49Å; L296-R302 PolarHBondContact O-NH1 2.81Å; L296-C305 HydrophobicContact CD2-CB 4.38Å; L296-T311 HydrophobicContact CD1-CG2 3.77Å; L296-T311 HydrophobicContact CD2-CG2 4.22Å; L296-A314 HydrophobicContact CD2-CB 4.39Å; L296-L315 HydrophobicContact CD1-CD2 4.12Å; L296-L315 HydrophobicContact CD1-CG 4.3Å |
| 297 | G | 97.4 | Very high | 98 | Very high | 31 Ų | 31 | 38.8 Ų | 38.8 | 32% | 0.32 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -65.8 | -34.8 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | R293 R302 | R293-G297 WeakPolarHBondContact O-CA 3.31Å; R293-G297 PolarHBondContact O-N 2.84Å; G297-R302 PolarHBondContact O-NH1 2.91Å |
| 298 | T | 98.1 | Very high | 97.9 | Very high | 67 Ų | 67 | 42 Ų | 42 | 41% | 0.411 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -91.6 | 158.9 | -178.8 | 76.8 | 0 | 0 | 0 | 0 | 112.3 | L296 E300 Q301 R302 | L296-T298 PolarHBondContact O-N 3.4Å; T298-E300 VanDerWaalsContact C-N 3.3Å; T298-Q301 WeakPolarHBondContact OG1-CB 3.39Å; T298-Q301 VanDerWaalsContact OG1-CG 3.23Å; T298-Q301 WeakPolarHBondContact OG1-CG 3.4Å; T298-Q301 PolarHBondContact OG1-N 2.87Å; T298-Q301 VanDerWaalsContact OG1-N 3.14Å; T298-Q301 PolarHBondContact OG1-OE1 2.85Å; T298-R302 VanDerWaalsContact O-CZ 3.3Å; T298-R302 PolarHBondContact O-N 2.98Å; T298-R302 PolarHBondContact O-NH1 3.41Å; T298-R302 VanDerWaalsContact O-NH1 3.11Å |
| 299 | A | 97.9 | Very high | 97.9 | Very high | 74 Ų | 74 | 48.4 Ų | 48.4 | 61% | 0.612 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -65.1 | -37 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | R302 G303 | A299-R302 PolarHBondContact O-N 2.93Å; A299-G303 PolarHBondContact O-N 2.94Å |
| 300 | E | 97.9 | Very high | 97.8 | Very high | 164 Ų | 164 | 52.7 Ų | 52.7 | 77% | 0.766 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -61.7 | -48.6 | 176.7 | -176.5 | -178.3 | -178 | 0 | 0 | 111.8 | T298 R302 G303 A304 | T298-E300 VanDerWaalsContact C-N 3.3Å; E300-R302 VanDerWaalsContact C-N 3.29Å; E300-R302 PolarHBondContact O-N 3.02Å; E300-G303 PolarHBondContact O-N 2.9Å; E300-G303 VanDerWaalsContact O-N 3.11Å; E300-A304 PolarHBondContact O-N 3.09Å |
| 301 | Q | 97.9 | Very high | 97.8 | Very high | 55 Ų | 55 | 52.7 Ų | 52.7 | 26% | 0.257 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -56.9 | -43 | 177.1 | -76.7 | 172.4 | -30.3 | 0 | 0 | 112.2 | L294 A295 T298 A304 C305 | L294-Q301 PolarHBondContact O-NE2 3.14Å; A295-Q301 WeakPolarHBondContact O-CB 3.47Å; T298-Q301 WeakPolarHBondContact OG1-CB 3.39Å; T298-Q301 VanDerWaalsContact OG1-CG 3.23Å; T298-Q301 WeakPolarHBondContact OG1-CG 3.4Å; T298-Q301 PolarHBondContact OG1-N 2.87Å; T298-Q301 VanDerWaalsContact OG1-N 3.14Å; T298-Q301 PolarHBondContact OG1-OE1 2.85Å; Q301-A304 PolarHBondContact O-N 3.18Å; Q301-C305 PolarHBondContact O-N 3.31Å; Q301-C305 PolarHBondContact O-SG 2.77Å |
| 302 | R | 98.1 | Very high | 97.8 | Very high | 41 Ų | 41 | 53 Ų | 53 | 16% | 0.155 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -69.8 | -38.6 | 176.9 | -66.3 | -172.7 | -60.1 | -88.2 | 0.9 | 112.3 | H240 L296 G297 T298 A299 E300 A304 C305 | H240-R302 HydrophobicContact CB-CG 4.39Å; H240-R302 PolarHBondContact CE1-O 3.32Å; H240-R302 VanDerWaalsContact CE1-O 3.27Å; L296-R302 HydrophobicContact CB-CG 4.19Å; L296-R302 WeakPolarHBondContact O-CD 3.49Å; L296-R302 WeakPolarHBondContact O-CG 3.49Å; L296-R302 PolarHBondContact O-NH1 2.81Å; G297-R302 PolarHBondContact O-NH1 2.91Å; T298-R302 VanDerWaalsContact O-CZ 3.3Å; T298-R302 PolarHBondContact O-N 2.98Å; T298-R302 PolarHBondContact O-NH1 3.41Å; T298-R302 VanDerWaalsContact O-NH1 3.11Å; A299-R302 PolarHBondContact O-N 2.93Å; E300-R302 VanDerWaalsContact C-N 3.29Å; E300-R302 PolarHBondContact O-N 3.02Å; R302-A304 PolarHBondContact O-N 3.19Å; R302-C305 CarbonylContact O-C 3.53Å; R302-C305 PolarHBondContact O-N 3Å |
| 303 | G | 97.5 | Very high | 97.7 | Very high | 63 Ų | 63 | 54.7 Ų | 54.7 | 65% | 0.649 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -61.8 | -32.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | A299 E300 C305 | A299-G303 PolarHBondContact O-N 2.94Å; E300-G303 PolarHBondContact O-N 2.9Å; E300-G303 VanDerWaalsContact O-N 3.11Å; G303-C305 VanDerWaalsContact C-N 3.25Å; G303-C305 PolarHBondContact O-N 3.37Å |
| 304 | A | 97.1 | Very high | 97.7 | Very high | 75 Ų | 75 | 51.9 Ų | 51.9 | 62% | 0.62 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.7 | -9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114 | E300 Q301 R302 P306 | E300-A304 PolarHBondContact O-N 3.09Å; Q301-A304 PolarHBondContact O-N 3.18Å; R302-A304 PolarHBondContact O-N 3.19Å; A304-P306 VanDerWaalsContact C-CD 3.43Å; A304-P306 VanDerWaalsContact O-CD 3.32Å; A304-P306 WeakPolarHBondContact O-CD 3.26Å |
| 305 | C | 97.4 | Very high | 97.7 | Very high | 9 Ų | 9 | 51.4 Ų | 51.4 | 6% | 0.061 | 33% | 0.33 | C | S | . | . | trans | -119.9 | 66.7 | -177.9 | -57.7 | 0 | 0 | 0 | 0 | 111.4 | H240 L296 Q301 R302 G303 G307 E310 T311 | H240-C305 PolarHBondContact CE1-O 2.64Å; H240-C305 PolarHBondContact NE2-O 3.34Å; L296-C305 HydrophobicContact CD2-CB 4.38Å; Q301-C305 PolarHBondContact O-N 3.31Å; Q301-C305 PolarHBondContact O-SG 2.77Å; R302-C305 CarbonylContact O-C 3.53Å; R302-C305 PolarHBondContact O-N 3Å; G303-C305 VanDerWaalsContact C-N 3.25Å; G303-C305 PolarHBondContact O-N 3.37Å; C305-G307 PolarHBondContact O-N 3.19Å; C305-E310 HydrophobicContact CB-CB 4.17Å; C305-T311 WeakPolarHBondContact CB-OG1 3.39Å; C305-T311 PolarHBondContact O-OG1 3.16Å | ||
| 306 | P | 96.3 | Very high | 97.5 | Very high | 98 Ų | 98 | 58.2 Ų | 58.2 | 64% | 0.636 | 35% | 0.354 | S | S | * | . | trans | -69.3 | -20.6 | -172.8 | 29.7 | -36.9 | 0 | 0 | 0 | 113.8 | V244 A304 | V244-P306 WeakPolarHBondContact CG1-O 3.36Å; A304-P306 VanDerWaalsContact C-CD 3.43Å; A304-P306 VanDerWaalsContact O-CD 3.32Å; A304-P306 WeakPolarHBondContact O-CD 3.26Å | ||
| 307 | G | 97 | Very high | 97.3 | Very high | 21 Ų | 21 | 61.8 Ų | 61.8 | 22% | 0.216 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -127.7 | -179.2 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | C305 E310 T311 | C305-G307 PolarHBondContact O-N 3.19Å; G307-E310 VanDerWaalsContact C-OE2 3.24Å; G307-E310 WeakPolarHBondContact CA-OE2 3.18Å; G307-E310 PolarHBondContact N-OE2 3.48Å; G307-T311 VanDerWaalsContact O-CB 3.3Å; G307-T311 WeakPolarHBondContact O-CB 3.43Å; G307-T311 PolarHBondContact O-N 2.98Å; G307-T311 PolarHBondContact O-OG1 3.22Å |
| 308 | L | 97.8 | Very high | 97.2 | Very high | 68 Ų | 68 | 61 Ų | 61 | 36% | 0.356 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.1 | -46 | -178.7 | -178.8 | 151.4 | 0 | 0 | 0 | 111.7 | V246 L250 L312 | V246-L308 HydrophobicContact CG2-CB 4.31Å; V246-L308 HydrophobicContact CG2-CG 3.99Å; L250-L308 HydrophobicContact CD1-CD1 4.47Å; L308-L312 HydrophobicContact CD2-CD1 3.56Å; L308-L312 HydrophobicContact CD2-CG 4.32Å; L308-L312 HydrophobicContact CG-CD1 4.34Å; L308-L312 WeakPolarHBondContact O-CB 3.34Å; L308-L312 WeakPolarHBondContact O-CG 3.38Å; L308-L312 PolarHBondContact O-N 3.26Å |
| 309 | L | 97.6 | Very high | 97 | Very high | 134 Ų | 134 | 60.9 Ų | 60.9 | 70% | 0.702 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -69.5 | -44.7 | -173.7 | -66.4 | 179.1 | 0 | 0 | 0 | 111.8 | T311 L312 G313 | L309-T311 VanDerWaalsContact C-N 3.33Å; L309-T311 PolarHBondContact O-N 3.45Å; L309-L312 PolarHBondContact O-N 3.28Å; L309-G313 PolarHBondContact O-N 2.82Å |
| 310 | E | 97.9 | Very high | 96.6 | Very high | 94 Ų | 94 | 61.7 Ų | 61.7 | 44% | 0.439 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.1 | -42.9 | 178 | -59.5 | 79.3 | -174.6 | 0 | 0 | 110.5 | C305 G307 G313 A314 | C305-E310 HydrophobicContact CB-CB 4.17Å; G307-E310 VanDerWaalsContact C-OE2 3.24Å; G307-E310 WeakPolarHBondContact CA-OE2 3.18Å; G307-E310 PolarHBondContact N-OE2 3.48Å; E310-G313 PolarHBondContact O-N 2.77Å; E310-A314 WeakPolarHBondContact O-CB 3.32Å; E310-A314 PolarHBondContact O-N 3.36Å |
| 311 | T | 98.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -64.2 | -42.8 | 177.8 | -59.3 | 0 | 0 | 0 | 0 | 111.7 | H240 L241 V244 V246 L296 C305 G307 L309 A314 L315 | H240-T311 PolarHBondContact NE2-OG1 2.91Å; L241-T311 HydrophobicContact CD2-CG2 3.74Å; V244-T311 HydrophobicContact CG2-CG2 4.25Å; V246-T311 HydrophobicContact CB-CG2 4.4Å; V246-T311 HydrophobicContact CG1-CG2 4.46Å; V246-T311 HydrophobicContact CG2-CG2 3.9Å; L296-T311 HydrophobicContact CD1-CG2 3.77Å; L296-T311 HydrophobicContact CD2-CG2 4.22Å; C305-T311 WeakPolarHBondContact CB-OG1 3.39Å; C305-T311 PolarHBondContact O-OG1 3.16Å; G307-T311 VanDerWaalsContact O-CB 3.3Å; G307-T311 WeakPolarHBondContact O-CB 3.43Å; G307-T311 PolarHBondContact O-N 2.98Å; G307-T311 PolarHBondContact O-OG1 3.22Å; L309-T311 VanDerWaalsContact C-N 3.33Å; L309-T311 PolarHBondContact O-N 3.45Å; T311-A314 PolarHBondContact O-N 3.15Å; T311-L315 HydrophobicContact CG2-CD1 4.45Å; T311-L315 WeakPolarHBondContact O-CG 3.47Å; T311-L315 PolarHBondContact O-N 3.33Å; T311-L315 VanDerWaalsContact O-N 3.09Å |
| 312 | L | 98 | Very high | 96.1 | Very high | 11 Ų | 11 | 58.4 Ų | 58.4 | 6% | 0.058 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -66.5 | -37.5 | 174.1 | -72.2 | 179.8 | 0 | 0 | 0 | 112.1 | V246 L250 Y251 L308 L309 L315 R316 | V246-L312 HydrophobicContact CG1-CD2 3.83Å; V246-L312 HydrophobicContact CG2-CG 4.45Å; L250-L312 HydrophobicContact CB-CD1 4.49Å; L250-L312 HydrophobicContact CB-CD2 3.81Å; L250-L312 HydrophobicContact CD1-CD1 4.3Å; L250-L312 HydrophobicContact CD1-CD2 4.36Å; Y251-L312 HydrophobicContact CD1-CD2 4.48Å; L308-L312 HydrophobicContact CD2-CD1 3.56Å; L308-L312 HydrophobicContact CD2-CG 4.32Å; L308-L312 HydrophobicContact CG-CD1 4.34Å; L308-L312 WeakPolarHBondContact O-CB 3.34Å; L308-L312 WeakPolarHBondContact O-CG 3.38Å; L308-L312 PolarHBondContact O-N 3.26Å; L309-L312 PolarHBondContact O-N 3.28Å; L312-L315 PolarHBondContact O-N 3.47Å; L312-R316 WeakPolarHBondContact O-CG 3.31Å; L312-R316 PolarHBondContact O-N 2.93Å; L312-R316 VanDerWaalsContact O-N 3.11Å |
| 313 | G | 97.5 | Very high | 96 | Very high | 34 Ų | 34 | 57 Ų | 57 | 35% | 0.351 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59 | -48.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | L309 E310 L315 R316 A317 | L309-G313 PolarHBondContact O-N 2.82Å; E310-G313 PolarHBondContact O-N 2.77Å; G313-L315 VanDerWaalsContact C-N 3.32Å; G313-L315 PolarHBondContact O-N 2.88Å; G313-R316 PolarHBondContact O-N 3.16Å; G313-R316 VanDerWaalsContact O-N 3.11Å; G313-A317 WeakPolarHBondContact O-CB 3.45Å; G313-A317 PolarHBondContact O-N 3.06Å |
| 314 | A | 97.7 | Very high | 95.8 | Very high | 26 Ų | 26 | 59 Ų | 59 | 22% | 0.215 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.9 | -38.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A295 L296 E310 T311 R316 | A295-A314 WeakPolarHBondContact CB-O 3.27Å; L296-A314 HydrophobicContact CD2-CB 4.39Å; E310-A314 WeakPolarHBondContact O-CB 3.32Å; E310-A314 PolarHBondContact O-N 3.36Å; T311-A314 PolarHBondContact O-N 3.15Å; A314-R316 VanDerWaalsContact C-N 3.31Å; A314-R316 PolarHBondContact O-N 2.97Å |
| 315 | L | 97.2 | Very high | 95.5 | Very high | 6 Ų | 6 | 57.7 Ų | 57.7 | 3% | 0.031 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.3 | -28.6 | 176.3 | -72 | 168.4 | 0 | 0 | 0 | 113.2 | V246 Y251 W255 V292 A295 L296 T311 L312 G313 | V246-L315 HydrophobicContact CG1-CD1 4.4Å; Y251-L315 HydrophobicContact CD1-CD1 3.89Å; Y251-L315 HydrophobicContact CE1-CD1 4.12Å; Y251-L315 HydrophobicContact CG-CD1 4.34Å; W255-L315 HydrophobicContact CH2-CD2 4.13Å; W255-L315 HydrophobicContact CZ2-CB 4.49Å; V292-L315 HydrophobicContact CB-CD2 4.42Å; V292-L315 HydrophobicContact CG2-CD2 3.93Å; A295-L315 HydrophobicContact CB-CD2 3.88Å; A295-L315 HydrophobicContact CB-CG 4.45Å; L296-L315 HydrophobicContact CD1-CD2 4.12Å; L296-L315 HydrophobicContact CD1-CG 4.3Å; T311-L315 HydrophobicContact CG2-CD1 4.45Å; T311-L315 WeakPolarHBondContact O-CG 3.47Å; T311-L315 PolarHBondContact O-N 3.33Å; T311-L315 VanDerWaalsContact O-N 3.09Å; L312-L315 PolarHBondContact O-N 3.47Å; G313-L315 VanDerWaalsContact C-N 3.32Å; G313-L315 PolarHBondContact O-N 2.88Å |
| 316 | R | 95.2 | Very high | 95.2 | Very high | 151 Ų | 151 | 62.5 Ų | 62.5 | 57% | 0.57 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -89.3 | -29.1 | 179.1 | -70.1 | 177.8 | -177.1 | 130.3 | 3.4 | 113.3 | L312 G313 A314 | L312-R316 WeakPolarHBondContact O-CG 3.31Å; L312-R316 PolarHBondContact O-N 2.93Å; L312-R316 VanDerWaalsContact O-N 3.11Å; G313-R316 PolarHBondContact O-N 3.16Å; G313-R316 VanDerWaalsContact O-N 3.11Å; A314-R316 VanDerWaalsContact C-N 3.31Å; A314-R316 PolarHBondContact O-N 2.97Å |
| 317 | A | 93.6 | Very high | 95.1 | Very high | 75 Ų | 75 | 60.5 Ų | 60.5 | 62% | 0.62 | 35% | 0.351 | S | S | * | . | trans | -108.1 | 43.9 | -171.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | G313 | G313-A317 WeakPolarHBondContact O-CB 3.45Å; G313-A317 PolarHBondContact O-N 3.06Å | ||
| 318 | I | 95.7 | Very high | 95.1 | Very high | 15 Ų | 15 | 59.5 Ų | 59.5 | 8% | 0.077 | 34% | 0.341 | C | S | . | . | trans | -65.9 | 128.2 | 175 | -62.7 | 167.6 | 0 | 0 | 0 | 108.8 | L291 L294 A295 Q322 L323 | L291-I318 HydrophobicContact CB-CD1 3.79Å; L291-I318 HydrophobicContact CD2-CD1 3.53Å; L291-I318 HydrophobicContact CG-CD1 4.25Å; L291-I318 WeakPolarHBondContact O-CD1 3.47Å; L294-I318 HydrophobicContact CB-CD1 4.41Å; L294-I318 HydrophobicContact CB-CG2 4.15Å; L294-I318 HydrophobicContact CD1-CG2 4.26Å; A295-I318 HydrophobicContact CB-CD1 4.34Å; A295-I318 HydrophobicContact CB-CG1 4.17Å; I318-Q322 HydrophobicContact CG2-CB 4.27Å; I318-L323 HydrophobicContact CB-CD1 4.2Å; I318-L323 HydrophobicContact CB-CD2 4.33Å; I318-L323 HydrophobicContact CB-CG 4.38Å; I318-L323 HydrophobicContact CG2-CD1 4.25Å; I318-L323 HydrophobicContact CG2-CD2 3.73Å; I318-L323 HydrophobicContact CG2-CG 3.89Å | ||
| 319 | P | 93.5 | Very high | 95.1 | Very high | 64 Ų | 64 | 56.3 Ų | 56.3 | 42% | 0.416 | 32% | 0.324 | S | S | . | . | trans | -55 | 131.8 | -176.3 | -30 | 36.5 | 0 | 0 | 0 | 113 | A321 Q322 | P319-A321 PolarHBondContact O-N 3.08Å; P319-Q322 HydrophobicContact CB-CG 4.46Å; P319-Q322 WeakPolarHBondContact O-CB 3.49Å; P319-Q322 PolarHBondContact O-N 3.47Å | ||
| 320 | P | 90 | Very high | 95.1 | Very high | 92 Ų | 92 | 53 Ų | 53 | 60% | 0.597 | 31% | 0.312 | S | S | * | . | G | 310 helix | trans | -56.2 | -28.3 | -177.2 | -29 | 35.2 | 0 | 0 | 0 | 114.9 | Q322 L323 Q324 | P320-Q322 PolarHBondContact O-N 3.12Å; P320-L323 PolarHBondContact O-N 2.92Å; P320-L323 VanDerWaalsContact O-N 3.12Å; P320-Q324 PolarHBondContact O-N 3.1Å; P320-Q324 PolarHBondContact O-NE2 2.97Å |
| 321 | A | 91.1 | Very high | 95.1 | Very high | 80 Ų | 80 | 51 Ų | 51 | 66% | 0.661 | 30% | 0.303 | S | S | * | . | G | 310 helix | trans | -61.3 | -32.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | P319 L323 Q324 | P319-A321 PolarHBondContact O-N 3.08Å; A321-L323 VanDerWaalsContact C-N 3.34Å; A321-Q324 WeakPolarHBondContact O-CG 3.47Å |
| 322 | Q | 94.1 | Very high | 95.1 | Very high | 70 Ų | 70 | 51.1 Ų | 51.1 | 33% | 0.327 | 30% | 0.304 | S | S | . | . | G | 310 helix | trans | -82.3 | -15.8 | 177.4 | -60.3 | -175.3 | 52.1 | 0 | 0 | 112.7 | L294 I318 P319 P320 | L294-Q322 HydrophobicContact CD1-CB 4.35Å; I318-Q322 HydrophobicContact CG2-CB 4.27Å; P319-Q322 HydrophobicContact CB-CG 4.46Å; P319-Q322 WeakPolarHBondContact O-CB 3.49Å; P319-Q322 PolarHBondContact O-N 3.47Å; P320-Q322 PolarHBondContact O-N 3.12Å |
| 323 | L | 95.5 | Very high | 95.1 | Very high | 11 Ų | 11 | 52.4 Ų | 52.4 | 6% | 0.058 | 31% | 0.31 | C | S | . | . | G | 310 helix | trans | -98.6 | 9.3 | -179.5 | -58.6 | -178.9 | 0 | 0 | 0 | 112.8 | L264 P265 T268 L291 L294 I318 P320 A321 E325 F328 | L264-L323 HydrophobicContact CD2-CD1 4.3Å; L264-L323 HydrophobicContact CD2-CD2 3.97Å; P265-L323 HydrophobicContact CG-CB 3.82Å; P265-L323 HydrophobicContact CG-CD1 4.39Å; T268-L323 PolarHBondContact OG1-O 3.35Å; L291-L323 HydrophobicContact CD2-CD2 3.69Å; L294-L323 HydrophobicContact CD1-CD2 4.27Å; I318-L323 HydrophobicContact CB-CD1 4.2Å; I318-L323 HydrophobicContact CB-CD2 4.33Å; I318-L323 HydrophobicContact CB-CG 4.38Å; I318-L323 HydrophobicContact CG2-CD1 4.25Å; I318-L323 HydrophobicContact CG2-CD2 3.73Å; I318-L323 HydrophobicContact CG2-CG 3.89Å; P320-L323 PolarHBondContact O-N 2.92Å; P320-L323 VanDerWaalsContact O-N 3.12Å; A321-L323 VanDerWaalsContact C-N 3.34Å; L323-E325 PolarHBondContact O-N 3.39Å; L323-F328 HydrophobicContact CD2-CD2 3.8Å; L323-F328 HydrophobicContact CD2-CE2 3.73Å |
| 324 | Q | 93.3 | Very high | 95 | Very high | 105 Ų | 105 | 56.1 Ų | 56.1 | 49% | 0.491 | 32% | 0.321 | S | S | . | . | trans | -62.7 | 132.2 | 174.6 | -68.4 | -61.2 | -46.1 | 0 | 0 | 111 | P320 A321 E326 A327 F328 | P320-Q324 PolarHBondContact O-N 3.1Å; P320-Q324 PolarHBondContact O-NE2 2.97Å; A321-Q324 WeakPolarHBondContact O-CG 3.47Å; Q324-E326 PolarHBondContact O-N 3.35Å; Q324-A327 PolarHBondContact O-N 3.18Å; Q324-F328 WeakPolarHBondContact O-CB 3.44Å; Q324-F328 PolarHBondContact O-N 3.11Å | ||
| 325 | E | 91.1 | Very high | 95 | Very high | 48 Ų | 48 | 55.6 Ų | 55.6 | 22% | 0.224 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -48.7 | -47.8 | -164.8 | 57.8 | -170.1 | -155.1 | 0 | 0 | 115.5 | P267 T268 R271 L323 M329 | P267-E325 WeakPolarHBondContact CB-OE2 3.44Å; T268-E325 WeakPolarHBondContact OG1-CA 3.49Å; T268-E325 PolarHBondContact OG1-N 2.99Å; R271-E325 HydrophobicContact CG-CB 4.06Å; L323-E325 PolarHBondContact O-N 3.39Å; E325-M329 WeakPolarHBondContact O-CB 3.36Å; E325-M329 WeakPolarHBondContact O-CG 3.32Å; E325-M329 PolarHBondContact O-N 2.75Å |
| 326 | E | 91.1 | Very high | 95 | Very high | 109 Ų | 109 | 60.7 Ų | 60.7 | 51% | 0.509 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -74.7 | -46.4 | -176 | -167.5 | 66.6 | -167.2 | 0 | 0 | 111.9 | R271 Q324 S330 | R271-E326 IonicContact CZ-OE2 3.03Å; R271-E326 IonicContact NH1-OE2 2.6Å; R271-E326 PolarHBondContact NH1-OE2 3.36Å; R271-E326 IonicContact NH2-OE2 2.87Å; R271-E326 PolarHBondContact NH2-OE2 3.4Å; Q324-E326 PolarHBondContact O-N 3.35Å; E326-S330 WeakPolarHBondContact O-CB 3.41Å; E326-S330 PolarHBondContact O-N 3.06Å |
| 327 | A | 93.3 | Very high | 95.1 | Very high | 56 Ų | 56 | 53.6 Ų | 53.6 | 46% | 0.463 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -66.2 | -44.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q324 S330 Q331 | Q324-A327 PolarHBondContact O-N 3.18Å; A327-S330 PolarHBondContact O-N 2.89Å; A327-Q331 PolarHBondContact O-N 2.93Å |
| 328 | F | 97.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 178 | -175.9 | -101.5 | 0 | 0 | 0 | 111.2 | L264 T268 V272 V287 T290 L291 L294 L323 Q324 S330 Q331 V332 | L264-F328 HydrophobicContact CD1-CE1 4.17Å; L264-F328 HydrophobicContact CD2-CE1 4.33Å; L264-F328 HydrophobicContact CD2-CZ 4.14Å; T268-F328 HydrophobicContact CG2-CB 4.38Å; T268-F328 HydrophobicContact CG2-CD1 3.46Å; T268-F328 VanDerWaalsContact CG2-CD1 3.46Å; T268-F328 HydrophobicContact CG2-CE1 4.04Å; T268-F328 HydrophobicContact CG2-CG 4.14Å; V272-F328 HydrophobicContact CG2-CE1 4.48Å; V287-F328 HydrophobicContact CG1-CE1 4.01Å; V287-F328 HydrophobicContact CG1-CZ 3.93Å; T290-F328 HydrophobicContact CG2-CD2 4.26Å; T290-F328 HydrophobicContact CG2-CE2 3.78Å; T290-F328 HydrophobicContact CG2-CZ 4.29Å; L291-F328 HydrophobicContact CD2-CE2 3.68Å; L291-F328 HydrophobicContact CD2-CZ 3.77Å; L291-F328 HydrophobicContact CG-CE2 4.33Å; L291-F328 HydrophobicContact CG-CZ 4.1Å; L294-F328 HydrophobicContact CD1-CD2 3.9Å; L294-F328 HydrophobicContact CD1-CE2 3.82Å; L323-F328 HydrophobicContact CD2-CD2 3.8Å; L323-F328 HydrophobicContact CD2-CE2 3.73Å; Q324-F328 WeakPolarHBondContact O-CB 3.44Å; Q324-F328 PolarHBondContact O-N 3.11Å; F328-S330 VanDerWaalsContact C-N 3.33Å; F328-S330 PolarHBondContact O-N 2.84Å; F328-Q331 WeakPolarHBondContact O-CB 3.48Å; F328-Q331 PolarHBondContact O-N 3.02Å; F328-Q331 VanDerWaalsContact O-N 3.12Å; F328-V332 HydrophobicContact CD1-CG2 3.97Å; F328-V332 HydrophobicContact CE1-CG2 3.64Å; F328-V332 HydrophobicContact CZ-CG2 3.99Å; F328-V332 WeakPolarHBondContact O-CG2 3.28Å; F328-V332 PolarHBondContact O-N 2.87Å |
| 329 | M | 97.9 | Very high | 95.1 | Very high | 1 Ų | 1 | 53.1 Ų | 53.1 | 1% | 0.005 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.4 | -33 | -178.9 | -69.1 | -60.5 | -61.4 | 0 | 0 | 112.8 | R271 V272 A275 E325 Q331 V332 H333 | R271-M329 HydrophobicContact CB-CE 4.48Å; R271-M329 HydrophobicContact CB-CG 3.7Å; R271-M329 HydrophobicContact CB-SD 4.1Å; R271-M329 HydrophobicContact CG-CG 4.46Å; V272-M329 HydrophobicContact CG2-SD 3.73Å; A275-M329 HydrophobicContact CB-CE 4.04Å; E325-M329 WeakPolarHBondContact O-CB 3.36Å; E325-M329 WeakPolarHBondContact O-CG 3.32Å; E325-M329 PolarHBondContact O-N 2.75Å; M329-Q331 VanDerWaalsContact C-N 3.29Å; M329-Q331 PolarHBondContact O-N 2.93Å; M329-V332 PolarHBondContact O-N 3.34Å; M329-V332 HydrophobicContact SD-CG2 4.49Å; M329-H333 PolarHBondContact O-CD2 2.85Å; M329-H333 VanDerWaalsContact O-CG 3.27Å; M329-H333 PolarHBondContact O-N 2.91Å |
| 330 | S | 97.3 | Very high | 95.2 | Very high | 64 Ų | 64 | 59.8 Ų | 59.8 | 45% | 0.448 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -56.4 | -45.7 | 171 | -178 | 0 | 0 | 0 | 0 | 111.4 | E326 A327 F328 H333 N334 | E326-S330 WeakPolarHBondContact O-CB 3.41Å; E326-S330 PolarHBondContact O-N 3.06Å; A327-S330 PolarHBondContact O-N 2.89Å; F328-S330 VanDerWaalsContact C-N 3.33Å; F328-S330 PolarHBondContact O-N 2.84Å; S330-H333 PolarHBondContact O-N 2.78Å; S330-N334 VanDerWaalsContact O-CG 3.25Å; S330-N334 PolarHBondContact O-N 2.95Å; S330-N334 PolarHBondContact O-ND2 3.04Å |
| 331 | Q | 98.1 | Very high | 95.4 | Very high | 54 Ų | 54 | 57.2 Ų | 57.2 | 25% | 0.252 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 175.3 | -73.2 | -168.9 | 62.7 | 0 | 0 | 113.1 | T290 A327 F328 M329 N334 | T290-Q331 HydrophobicContact CG2-CB 3.89Å; A327-Q331 PolarHBondContact O-N 2.93Å; F328-Q331 WeakPolarHBondContact O-CB 3.48Å; F328-Q331 PolarHBondContact O-N 3.02Å; F328-Q331 VanDerWaalsContact O-N 3.12Å; M329-Q331 VanDerWaalsContact C-N 3.29Å; M329-Q331 PolarHBondContact O-N 2.93Å; Q331-N334 PolarHBondContact O-N 3.37Å |
| 332 | V | 98.5 | Very high | 95.7 | Very high | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.006 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.6 | -43.7 | 177.1 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | R286 V287 T290 F328 M329 N334 V335 | R286-V332 HydrophobicContact CB-CG1 3.84Å; V287-V332 HydrophobicContact CG2-CG1 3.78Å; V287-V332 HydrophobicContact CG2-CG2 4.02Å; T290-V332 HydrophobicContact CG2-CG2 4.14Å; F328-V332 HydrophobicContact CD1-CG2 3.97Å; F328-V332 HydrophobicContact CE1-CG2 3.64Å; F328-V332 HydrophobicContact CZ-CG2 3.99Å; F328-V332 WeakPolarHBondContact O-CG2 3.28Å; F328-V332 PolarHBondContact O-N 2.87Å; M329-V332 PolarHBondContact O-N 3.34Å; M329-V332 HydrophobicContact SD-CG2 4.49Å; V332-N334 PolarHBondContact O-N 3.47Å; V332-V335 WeakPolarHBondContact O-CB 3.43Å; V332-V335 PolarHBondContact O-N 3.41Å |
| 333 | H | 96.9 | Very high | 95.7 | Very high | 39 Ų | 39 | 53.5 Ų | 53.5 | 18% | 0.181 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.1 | -25.1 | 179.9 | -67.5 | -42.8 | 0 | 0 | 0 | 113.2 | R90 M329 S330 V335 | R90-H333 VanDerWaalsContact CG-CE1 3.41Å; R90-H333 WeakPolarHBondContact CG-CE1 3.5Å; R90-H333 PolarHBondContact O-NE2 3.16Å; M329-H333 PolarHBondContact O-CD2 2.85Å; M329-H333 VanDerWaalsContact O-CG 3.27Å; M329-H333 PolarHBondContact O-N 2.91Å; S330-H333 PolarHBondContact O-N 2.78Å; H333-V335 VanDerWaalsContact C-N 3.33Å |
| 334 | N | 97 | Very high | 95.6 | Very high | 112 Ų | 112 | 60.8 Ų | 60.8 | 60% | 0.599 | 30% | 0.303 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -8.5 | 177.2 | -69.8 | -23.4 | 0 | 0 | 0 | 113.6 | S330 Q331 V332 V336 | S330-N334 VanDerWaalsContact O-CG 3.25Å; S330-N334 PolarHBondContact O-N 2.95Å; S330-N334 PolarHBondContact O-ND2 3.04Å; Q331-N334 PolarHBondContact O-N 3.37Å; V332-N334 PolarHBondContact O-N 3.47Å; N334-V336 PolarHBondContact O-N 3.18Å |
| 335 | V | 98 | Very high | 95.7 | Very high | 15 Ų | 15 | 57.4 Ų | 57.4 | 9% | 0.091 | 29% | 0.288 | C | S | . | . | S | Bend | trans | -68.8 | 117.6 | 175.6 | 179.7 | 0 | 0 | 0 | 0 | 110.3 | L233 R286 L289 T290 V332 H333 L337 | L233-V335 HydrophobicContact CD1-CG1 4.48Å; R286-V335 HydrophobicContact CB-CB 4.03Å; R286-V335 HydrophobicContact CB-CG1 4.28Å; R286-V335 HydrophobicContact CB-CG2 4.39Å; R286-V335 HydrophobicContact CG-CB 3.85Å; R286-V335 HydrophobicContact CG-CG1 3.92Å; R286-V335 PolarHBondContact NE-O 3.48Å; L289-V335 HydrophobicContact CD1-CG1 3.98Å; T290-V335 WeakPolarHBondContact OG1-CG2 3.38Å; V332-V335 WeakPolarHBondContact O-CB 3.43Å; V332-V335 PolarHBondContact O-N 3.41Å; H333-V335 VanDerWaalsContact C-N 3.33Å; V335-L337 VanDerWaalsContact C-N 3.28Å; V335-L337 HydrophobicContact CG1-CB 4.27Å; V335-L337 PolarHBondContact O-N 3.27Å |
| 336 | V | 95.4 | Very high | 95.8 | Very high | 113 Ų | 113 | 55.9 Ų | 55.9 | 69% | 0.685 | 28% | 0.281 | S | S | * | . | trans | -77.3 | 77.4 | -179.3 | -169.3 | 0 | 0 | 0 | 0 | 110.9 | N334 | N334-V336 PolarHBondContact O-N 3.18Š| ||
| 337 | L | 97.3 | Very high | 95.9 | Very high | 2 Ų | 2 | 58.4 Ų | 58.4 | 1% | 0.01 | 29% | 0.29 | C | S | . | . | trans | -135.8 | 104.4 | 174.8 | 178.4 | 66.6 | 0 | 0 | 0 | 109.1 | L229 F285 R286 L289 V335 D341 | L229-L337 HydrophobicContact CD1-CD1 3.96Å; L229-L337 HydrophobicContact CD1-CD2 4.01Å; L229-L337 HydrophobicContact CD2-CD1 3.64Å; L229-L337 HydrophobicContact CG-CD1 4.47Å; F285-L337 HydrophobicContact CB-CD2 3.48Å; F285-L337 VanDerWaalsContact CB-CD2 3.48Å; F285-L337 HydrophobicContact CG-CD2 4.38Å; R286-L337 HydrophobicContact CG-CB 4.16Å; R286-L337 HydrophobicContact CG-CD2 4.22Å; R286-L337 VanDerWaalsContact CZ-O 3.27Å; R286-L337 PolarHBondContact NE-O 2.9Å; R286-L337 VanDerWaalsContact NE-O 3.14Å; R286-L337 PolarHBondContact NH2-O 2.87Å; L289-L337 HydrophobicContact CD1-CD2 4.46Å; V335-L337 VanDerWaalsContact C-N 3.28Å; V335-L337 HydrophobicContact CG1-CB 4.27Å; V335-L337 PolarHBondContact O-N 3.27Å; L337-D341 HydrophobicContact CD1-CB 4Å | ||
| 338 | S | 95.9 | Very high | 96 | Very high | 45 Ų | 45 | 57.6 Ų | 57.6 | 32% | 0.315 | 28% | 0.283 | S | S | . | . | trans | -84.3 | 167.6 | 174.9 | 76.2 | 0 | 0 | 0 | 0 | 111.8 | R340 D341 L342 | S338-R340 PolarHBondContact O-N 3.08Å; S338-R340 PolarHBondContact OG-N 3.23Å; S338-D341 VanDerWaalsContact CB-OD2 3.27Å; S338-D341 WeakPolarHBondContact CB-OD2 3.31Å; S338-D341 PolarHBondContact N-OD2 2.83Å; S338-D341 PolarHBondContact O-N 3Å; S338-D341 PolarHBondContact OG-N 2.82Å; S338-D341 PolarHBondContact OG-OD2 3.43Å; S338-L342 PolarHBondContact O-N 2.87Å; S338-L342 VanDerWaalsContact O-N 3.15Å | ||
| 339 | E | 94.2 | Very high | 95.7 | Very high | 35 Ų | 35 | 58.6 Ų | 58.6 | 16% | 0.164 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.9 | -40.5 | 171.7 | -169 | 60.6 | -141.7 | 0 | 0 | 111.3 | K282 D341 L342 Q343 A369 | K282-E339 HydrophobicContact CD-CB 4.45Å; K282-E339 WeakPolarHBondContact CD-OE2 3.48Å; K282-E339 IonicContact NZ-OE2 3.27Å; K282-E339 PolarHBondContact NZ-OE2 2.81Å; E339-D341 VanDerWaalsContact C-N 3.3Å; E339-D341 PolarHBondContact O-N 3.11Å; E339-L342 PolarHBondContact O-N 3.14Å; E339-Q343 HydrophobicContact CG-CG 4.37Å; E339-Q343 VanDerWaalsContact O-CG 3.29Å; E339-Q343 WeakPolarHBondContact O-CG 3.18Å; E339-Q343 PolarHBondContact O-N 2.92Å; E339-Q343 PolarHBondContact OE1-NE2 3.4Å; E339-A369 HydrophobicContact CG-CB 3.73Å |
| 340 | R | 94.8 | Very high | 95.3 | Very high | 203 Ų | 203 | 61.3 Ų | 61.3 | 77% | 0.766 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -64.1 | -36.8 | 179.9 | -66.5 | -179.5 | 178 | 174.7 | -2.3 | 112 | S338 R344 | S338-R340 PolarHBondContact O-N 3.08Å; S338-R340 PolarHBondContact OG-N 3.23Å; R340-R344 VanDerWaalsContact O-CB 3.31Å; R340-R344 WeakPolarHBondContact O-CB 3.36Å; R340-R344 PolarHBondContact O-N 2.87Å |
| 341 | D | 95.9 | Very high | 95 | Very high | 39 Ų | 39 | 62.4 Ų | 62.4 | 21% | 0.209 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.1 | -43.9 | 176.7 | -58.5 | -45.9 | 0 | 0 | 0 | 110.8 | L337 S338 E339 R344 E345 | L337-D341 HydrophobicContact CD1-CB 4Å; S338-D341 VanDerWaalsContact CB-OD2 3.27Å; S338-D341 WeakPolarHBondContact CB-OD2 3.31Å; S338-D341 PolarHBondContact N-OD2 2.83Å; S338-D341 PolarHBondContact O-N 3Å; S338-D341 PolarHBondContact OG-N 2.82Å; S338-D341 PolarHBondContact OG-OD2 3.43Å; E339-D341 VanDerWaalsContact C-N 3.3Å; E339-D341 PolarHBondContact O-N 3.11Å; D341-R344 PolarHBondContact O-N 2.6Å; D341-R344 IonicContact OD1-NH1 3.09Å; D341-R344 PolarHBondContact OD1-NH1 3.28Å; D341-E345 PolarHBondContact O-N 3.49Å |
| 342 | L | 95.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -62 | -47.4 | 176.9 | -179 | 62.2 | 0 | 0 | 0 | 111.6 | V225 L229 K282 F285 S338 E339 R344 E345 I346 | V225-L342 HydrophobicContact CG1-CD1 3.66Å; L229-L342 HydrophobicContact CD1-CD1 4.48Å; K282-L342 HydrophobicContact CB-CD2 3.83Å; F285-L342 HydrophobicContact CD1-CD1 4.21Å; F285-L342 HydrophobicContact CD2-CD1 3.84Å; F285-L342 HydrophobicContact CD2-CD2 3.98Å; F285-L342 HydrophobicContact CE1-CD1 4.05Å; F285-L342 HydrophobicContact CE2-CD1 3.67Å; F285-L342 HydrophobicContact CE2-CD2 4.01Å; F285-L342 HydrophobicContact CE2-CG 4.48Å; F285-L342 HydrophobicContact CG-CD1 4.11Å; F285-L342 HydrophobicContact CZ-CD1 3.76Å; S338-L342 PolarHBondContact O-N 2.87Å; S338-L342 VanDerWaalsContact O-N 3.15Å; E339-L342 PolarHBondContact O-N 3.14Å; L342-R344 VanDerWaalsContact C-N 3.31Å; L342-R344 PolarHBondContact O-N 2.77Å; L342-E345 PolarHBondContact O-N 2.97Å; L342-I346 HydrophobicContact CD1-CD1 4.24Å; L342-I346 HydrophobicContact CD1-CG1 4.43Å; L342-I346 HydrophobicContact CG-CD1 3.92Å; L342-I346 WeakPolarHBondContact O-CG1 3.22Å; L342-I346 PolarHBondContact O-N 3.3Å |
| 343 | Q | 93.9 | Very high | 93.4 | Very high | 72 Ų | 72 | 69.8 Ų | 69.8 | 34% | 0.336 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.4 | -36.8 | 178.1 | -65.9 | -59.6 | -34.4 | 0 | 0 | 112.4 | E339 E345 K347 | E339-Q343 HydrophobicContact CG-CG 4.37Å; E339-Q343 VanDerWaalsContact O-CG 3.29Å; E339-Q343 WeakPolarHBondContact O-CG 3.18Å; E339-Q343 PolarHBondContact O-N 2.92Å; E339-Q343 PolarHBondContact OE1-NE2 3.4Å; Q343-E345 VanDerWaalsContact C-N 3.35Å; Q343-K347 WeakPolarHBondContact O-CB 3.35Å; Q343-K347 PolarHBondContact O-N 3.44Å |
| 344 | R | 94.8 | Very high | 91.9 | Very high | 163 Ų | 163 | 72.2 Ų | 72.2 | 62% | 0.615 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.5 | -44.4 | 174.4 | -174.1 | -172.1 | -63.5 | 137.5 | 0.7 | 110.9 | R340 D341 L342 K347 A348 | R340-R344 VanDerWaalsContact O-CB 3.31Å; R340-R344 WeakPolarHBondContact O-CB 3.36Å; R340-R344 PolarHBondContact O-N 2.87Å; D341-R344 PolarHBondContact O-N 2.6Å; D341-R344 IonicContact OD1-NH1 3.09Å; D341-R344 PolarHBondContact OD1-NH1 3.28Å; L342-R344 VanDerWaalsContact C-N 3.31Å; L342-R344 PolarHBondContact O-N 2.77Å; R344-K347 PolarHBondContact O-N 2.88Å; R344-A348 WeakPolarHBondContact O-CB 3.4Å; R344-A348 PolarHBondContact O-N 3.39Å |
| 345 | E | 95.4 | Very high | 90.1 | Very high | 35 Ų | 35 | 75.2 Ų | 75.2 | 16% | 0.164 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.1 | -45.6 | 179.6 | -164.7 | 59.2 | -127 | 0 | 0 | 111.5 | V225 A228 D341 L342 Q343 K347 A348 Q349 | V225-E345 HydrophobicContact CB-CG 4.21Å; V225-E345 HydrophobicContact CG1-CB 4.02Å; V225-E345 HydrophobicContact CG1-CG 3.74Å; V225-E345 HydrophobicContact CG2-CG 4.31Å; A228-E345 HydrophobicContact CB-CG 3.96Å; A228-E345 WeakPolarHBondContact CB-OE1 3.13Å; D341-E345 PolarHBondContact O-N 3.49Å; L342-E345 PolarHBondContact O-N 2.97Å; Q343-E345 VanDerWaalsContact C-N 3.35Å; E345-K347 VanDerWaalsContact C-N 3.29Å; E345-K347 PolarHBondContact O-N 3.14Å; E345-A348 WeakPolarHBondContact O-CB 3.48Å; E345-A348 PolarHBondContact O-N 2.79Å; E345-Q349 WeakPolarHBondContact O-CG 3.47Å; E345-Q349 PolarHBondContact O-N 2.79Å; E345-Q349 PolarHBondContact OE1-NE2 3.36Å |
| 346 | I | 93.4 | Very high | 87.7 | Confident | 16 Ų | 16 | 79.6 Ų | 79.6 | 8% | 0.082 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -53.4 | -47.9 | 173.7 | -70.8 | 166.9 | 0 | 0 | 0 | 110.7 | L221 V225 L342 A348 Q349 L350 | L221-I346 HydrophobicContact CD2-CG2 4.24Å; V225-I346 HydrophobicContact CG1-CG1 4.46Å; V225-I346 HydrophobicContact CG2-CB 4.48Å; V225-I346 HydrophobicContact CG2-CG1 3.88Å; L342-I346 HydrophobicContact CD1-CD1 4.24Å; L342-I346 HydrophobicContact CD1-CG1 4.43Å; L342-I346 HydrophobicContact CG-CD1 3.92Å; L342-I346 WeakPolarHBondContact O-CG1 3.22Å; L342-I346 PolarHBondContact O-N 3.3Å; I346-A348 VanDerWaalsContact C-N 3.33Å; I346-A348 PolarHBondContact O-N 2.97Å; I346-Q349 PolarHBondContact O-N 2.87Å; I346-L350 HydrophobicContact CG2-CD1 3.96Å; I346-L350 WeakPolarHBondContact O-CB 3.34Å; I346-L350 WeakPolarHBondContact O-CG 3.49Å; I346-L350 PolarHBondContact O-N 3.08Å |
| 347 | K | 92.7 | Very high | 85.6 | Confident | 162 Ų | 162 | 77.2 Ų | 77.2 | 70% | 0.704 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -62.8 | -39.5 | 177.9 | -174.4 | 178.4 | 179 | -179.6 | 0 | 112.2 | Q343 R344 E345 A351 | Q343-K347 WeakPolarHBondContact O-CB 3.35Å; Q343-K347 PolarHBondContact O-N 3.44Å; R344-K347 PolarHBondContact O-N 2.88Å; E345-K347 VanDerWaalsContact C-N 3.29Å; E345-K347 PolarHBondContact O-N 3.14Å; K347-A351 WeakPolarHBondContact O-CB 3.23Å; K347-A351 PolarHBondContact O-N 3.49Å; K347-A351 VanDerWaalsContact O-N 3.09Å |
| 348 | A | 94.1 | Very high | 83 | Confident | 38 Ų | 38 | 83.9 Ų | 83.9 | 31% | 0.314 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.2 | -39.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | R344 E345 I346 Q352 | R344-A348 WeakPolarHBondContact O-CB 3.4Å; R344-A348 PolarHBondContact O-N 3.39Å; E345-A348 WeakPolarHBondContact O-CB 3.48Å; E345-A348 PolarHBondContact O-N 2.79Å; I346-A348 VanDerWaalsContact C-N 3.33Å; I346-A348 PolarHBondContact O-N 2.97Å; A348-Q352 WeakPolarHBondContact O-CG 3.45Å; A348-Q352 PolarHBondContact O-N 3.37Å; A348-Q352 PolarHBondContact O-NE2 3.05Å |
| 349 | Q | 93.2 | Very high | 81.1 | Confident | 22 Ų | 22 | 84.3 Ų | 84.3 | 10% | 0.103 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -71.5 | -40.3 | 177.2 | -61.9 | -50.1 | -40.6 | 0 | 0 | 111.8 | L221 E224 V225 E345 I346 A351 Q352 L353 | L221-Q349 HydrophobicContact CD1-CB 3.72Å; E224-Q349 HydrophobicContact CB-CG 4.2Å; V225-Q349 HydrophobicContact CG2-CB 4.24Å; V225-Q349 HydrophobicContact CG2-CG 3.76Å; E345-Q349 WeakPolarHBondContact O-CG 3.47Å; E345-Q349 PolarHBondContact O-N 2.79Å; E345-Q349 PolarHBondContact OE1-NE2 3.36Å; I346-Q349 PolarHBondContact O-N 2.87Å; Q349-A351 VanDerWaalsContact C-N 3.28Å; Q349-A351 PolarHBondContact O-N 3.36Å; Q349-Q352 PolarHBondContact O-N 2.83Å; Q349-Q352 VanDerWaalsContact O-N 3.1Å; Q349-L353 PolarHBondContact O-N 2.88Å |
| 350 | L | 89.4 | Confident | 79 | Confident | 57 Ų | 57 | 87.9 Ų | 87.9 | 30% | 0.298 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.6 | -37.1 | 174 | -76.2 | 172.5 | 0 | 0 | 0 | 112.8 | L221 I346 Q352 L353 P364 | L221-L350 HydrophobicContact CD1-CD2 4.12Å; L221-L350 HydrophobicContact CD1-CG 4.15Å; L221-L350 HydrophobicContact CD2-CD1 4.41Å; L221-L350 HydrophobicContact CD2-CD2 3.81Å; L221-L350 HydrophobicContact CD2-CG 4Å; I346-L350 HydrophobicContact CG2-CD1 3.96Å; I346-L350 WeakPolarHBondContact O-CB 3.34Å; I346-L350 WeakPolarHBondContact O-CG 3.49Å; I346-L350 PolarHBondContact O-N 3.08Å; L350-Q352 PolarHBondContact O-N 3.25Å; L350-L353 HydrophobicContact CD2-CD1 3.79Å; L350-L353 PolarHBondContact O-N 3.37Å; L350-P364 HydrophobicContact CD1-CG 3.98Å; L350-P364 HydrophobicContact CD2-CG 3.94Å |
| 351 | A | 89.2 | Confident | 76.8 | Confident | 87 Ų | 87 | 82.3 Ų | 82.3 | 72% | 0.719 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | -16.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | K347 Q349 | K347-A351 WeakPolarHBondContact O-CB 3.23Å; K347-A351 PolarHBondContact O-N 3.49Å; K347-A351 VanDerWaalsContact O-N 3.09Å; Q349-A351 VanDerWaalsContact C-N 3.28Å; Q349-A351 PolarHBondContact O-N 3.36Å |
| 352 | Q | 86.6 | Confident | 74.7 | Confident | 132 Ų | 132 | 82.6 Ų | 82.6 | 62% | 0.617 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.9 | -8.7 | 177.8 | -74 | 169.1 | 68.4 | 0 | 0 | 112.8 | A348 Q349 L350 | A348-Q352 WeakPolarHBondContact O-CG 3.45Å; A348-Q352 PolarHBondContact O-N 3.37Å; A348-Q352 PolarHBondContact O-NE2 3.05Å; Q349-Q352 PolarHBondContact O-N 2.83Å; Q349-Q352 VanDerWaalsContact O-N 3.1Å; L350-Q352 PolarHBondContact O-N 3.25Å |
| 353 | L | 76.8 | Confident | 72.9 | Confident | 78 Ų | 78 | 92.6 Ų | 92.6 | 41% | 0.408 | 52% | 0.523 | S | S | . | . | S | Bend | trans | -67.9 | 126.5 | 177.3 | -72.9 | 169.5 | 0 | 0 | 0 | 109.7 | Q349 L350 P362 | Q349-L353 PolarHBondContact O-N 2.88Å; L350-L353 HydrophobicContact CD2-CD1 3.79Å; L350-L353 PolarHBondContact O-N 3.37Å; L353-P362 HydrophobicContact CD1-CG 3.53Å |
| 354 | P | 66.4 | Low | 71.2 | Confident | 90 Ų | 90 | 90.9 Ų | 90.9 | 58% | 0.584 | 52% | 0.519 | S | S | * | . | trans | -66.4 | 135.7 | 179.2 | 24.4 | -30.9 | 0 | 0 | 0 | 110.8 | S356 A357 | P354-S356 PolarHBondContact O-N 3.02Å; P354-A357 PolarHBondContact O-N 3.1Å | ||
| 355 | D | 59.4 | Low | 70.2 | Confident | 175 Ų | 175 | 89.1 Ų | 89.1 | 94% | 0.936 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -11 | 174.9 | -78.3 | -30.6 | 0 | 0 | 0 | 113.5 | ||
| 356 | S | 46 | Very low | 69.4 | Low | 108 Ų | 108 | 93.6 Ų | 93.6 | 76% | 0.755 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.1 | 7.8 | -170.1 | -41.9 | 0 | 0 | 0 | 0 | 115 | P354 P358 | P354-S356 PolarHBondContact O-N 3.02Å; S356-P358 WeakPolarHBondContact O-CD 3.5Å |
| 357 | A | 52 | Low | 69.3 | Low | 63 Ų | 63 | 93.7 Ų | 93.7 | 52% | 0.521 | 55% | 0.546 | S | S | . | . | S | Bend | trans | -63.8 | 126.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | P354 G359 | P354-A357 PolarHBondContact O-N 3.1Å; A357-G359 PolarHBondContact O-N 2.91Å |
| 358 | P | 43.7 | Very low | 69.1 | Low | 142 Ų | 142 | 88.5 Ų | 88.5 | 92% | 0.922 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -66.1 | 106.1 | 176.3 | 24.4 | -30.4 | 0 | 0 | 0 | 109.5 | S356 | S356-P358 WeakPolarHBondContact O-CD 3.5Š|
| 359 | G | 55.2 | Low | 69 | Low | 53 Ų | 53 | 88.2 Ų | 88.2 | 55% | 0.546 | 52% | 0.523 | S | S | . | . | S | Bend | trans | 148.1 | 163.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | A357 | A357-G359 PolarHBondContact O-N 2.91Š|
| 360 | P | 49.7 | Very low | 69.1 | Low | 110 Ų | 110 | 87.2 Ų | 87.2 | 71% | 0.714 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -56.8 | 136.2 | 166.7 | 24.4 | -30.4 | 0 | 0 | 0 | 108.6 | ||
| 361 | P | 49.9 | Very low | 69.4 | Low | 86 Ų | 86 | 84.6 Ų | 84.6 | 56% | 0.558 | 51% | 0.505 | S | S | * | . | trans | -56.2 | 137.7 | 176.1 | 23.4 | -32.7 | 0 | 0 | 0 | 108.3 | R363 | P361-R363 PolarHBondContact O-N 3.34Š| ||
| 362 | P | 51.9 | Low | 69.8 | Low | 46 Ų | 46 | 84 Ų | 84 | 30% | 0.299 | 49% | 0.487 | S | S | . | . | trans | -58 | 115 | 177 | 24.1 | -32 | 0 | 0 | 0 | 107 | E217 L353 P364 | E217-P362 HydrophobicContact CB-CB 4.19Å; E217-P362 HydrophobicContact CG-CB 4.44Å; E217-P362 WeakPolarHBondContact OE2-CA 3.46Å; E217-P362 WeakPolarHBondContact OE2-CB 3.4Å; L353-P362 HydrophobicContact CD1-CG 3.53Å; P362-P364 WeakPolarHBondContact O-CD 3.22Å | ||
| 363 | R | 56.1 | Low | 70.2 | Confident | 209 Ų | 209 | 78.9 Ų | 78.9 | 79% | 0.789 | 47% | 0.468 | S | S | * | . | trans | -102.6 | 74.4 | 171.7 | -69.7 | -177.9 | -175.1 | 178.1 | 2.4 | 105.9 | P361 Q365 | P361-R363 PolarHBondContact O-N 3.34Å; R363-Q365 PolarHBondContact O-N 3.05Å | ||
| 364 | P | 59.9 | Low | 71.1 | Confident | 37 Ų | 37 | 75.4 Ų | 75.4 | 24% | 0.24 | 45% | 0.45 | C | S | . | . | trans | -56.4 | 120.7 | 177.4 | 26.2 | -34.6 | 0 | 0 | 0 | 107 | L221 L350 P362 | L221-P364 HydrophobicContact CD2-CB 4.19Å; L221-P364 HydrophobicContact CD2-CG 3.77Å; L350-P364 HydrophobicContact CD1-CG 3.98Å; L350-P364 HydrophobicContact CD2-CG 3.94Å; P362-P364 WeakPolarHBondContact O-CD 3.22Å | ||
| 365 | Q | 72.6 | Confident | 72.5 | Confident | 125 Ų | 125 | 72.1 Ų | 72.1 | 58% | 0.584 | 43% | 0.426 | S | S | * | . | trans | -62.8 | 146 | 178.6 | -49.2 | 178.5 | 6.2 | 0 | 0 | 108 | P209 R363 R367 | P209-Q365 HydrophobicContact CB-CB 3.8Å; P209-Q365 HydrophobicContact CB-CG 4.39Å; P209-Q365 HydrophobicContact CG-CB 4.12Å; P209-Q365 VanDerWaalsContact CG-O 3.32Å; P209-Q365 WeakPolarHBondContact CG-O 3.33Å; R363-Q365 PolarHBondContact O-N 3.05Å; Q365-R367 PolarHBondContact O-N 3.37Å | ||
| 366 | V | 79.4 | Confident | 74.2 | Confident | 129 Ų | 129 | 68.8 Ų | 68.8 | 78% | 0.782 | 41% | 0.405 | S | S | * | . | trans | -68.4 | 113.2 | -176.1 | -179.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 367 | R | 90.5 | Very high | 76.5 | Confident | 19 Ų | 19 | 65.7 Ų | 65.7 | 7% | 0.072 | 39% | 0.386 | C | S | . | . | trans | -74.7 | 146.3 | 172.7 | 72.4 | -174.7 | 79 | 174.7 | 16.3 | 111.3 | V206 Y207 P209 Y211 D222 Q365 | V206-R367 WeakPolarHBondContact O-CA 3.33Å; Y207-R367 WeakPolarHBondContact O-CB 3.48Å; Y207-R367 WeakPolarHBondContact O-CD 3.41Å; P209-R367 HydrophobicContact CG-CB 3.95Å; Y211-R367 PolarHBondContact OH-NH1 3.36Å; D222-R367 IonicContact OD1-CZ 2.8Å; D222-R367 IonicContact OD1-NH2 3.94Å; D222-R367 PolarHBondContact OD1-NH2 2.77Å; D222-R367 IonicContact OD2-CZ 3.4Å; D222-R367 VanDerWaalsContact OD2-CZ 3.22Å; D222-R367 IonicContact OD2-NH1 2.78Å; D222-R367 PolarHBondContact OD2-NH1 2.77Å; D222-R367 IonicContact OD2-NH2 3.79Å; D222-R367 PolarHBondContact OD2-NH2 2.99Å; Q365-R367 PolarHBondContact O-N 3.37Å | ||
| 368 | L | 89.7 | Confident | 78.5 | Confident | 52 Ų | 52 | 64.2 Ų | 64.2 | 27% | 0.272 | 37% | 0.368 | S | S | . | . | trans | -85.7 | 142.1 | 176 | -65.3 | -176.3 | 0 | 0 | 0 | 111.8 | V206 G370 A373 I374 A377 | V206-L368 HydrophobicContact CG1-CB 3.86Å; V206-L368 HydrophobicContact CG1-CD1 3.69Å; V206-L368 HydrophobicContact CG1-CG 3.88Å; V206-L368 PolarHBondContact O-N 2.98Å; L368-G370 PolarHBondContact O-N 2.95Å; L368-A373 HydrophobicContact CB-CB 4.2Å; L368-A373 HydrophobicContact CD2-CB 4.48Å; L368-I374 HydrophobicContact CB-CG1 3.89Å; L368-I374 HydrophobicContact CD1-CB 4.44Å; L368-I374 HydrophobicContact CD1-CG1 3.76Å; L368-I374 HydrophobicContact CG-CG1 4.47Å; L368-A377 HydrophobicContact CD1-CB 4.06Å | ||
| 369 | A | 91 | Very high | 80.7 | Confident | 33 Ų | 33 | 61.9 Ų | 61.9 | 27% | 0.273 | 35% | 0.345 | S | S | . | . | trans | -78.4 | 32.7 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | E279 E339 A373 | E279-A369 CarbonylContact C-O 3.57Å; E339-A369 HydrophobicContact CG-CB 3.73Å; A369-A373 HydrophobicContact CB-CB 4.44Å | ||
| 370 | G | 94.8 | Very high | 82.4 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 34% | 0.343 | C | S | . | . | S | Bend | trans | 98.1 | -168.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115 | L368 Q372 A373 I374 | L368-G370 PolarHBondContact O-N 2.95Å; G370-Q372 VanDerWaalsContact C-N 3.31Å; G370-Q372 PolarHBondContact O-N 3.24Å; G370-Q372 VanDerWaalsContact O-N 3.13Å; G370-A373 PolarHBondContact O-N 3.35Å; G370-A373 VanDerWaalsContact O-N 3.1Å; G370-I374 PolarHBondContact O-N 3.36Å; G370-I374 VanDerWaalsContact O-N 3.14Å |
| 371 | A | 96.7 | Very high | 84.3 | Confident | 2 Ų | 2 | 61 Ų | 61 | 2% | 0.017 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -52.3 | -38.9 | -168.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | M78 Y82 L105 L277 S278 F375 | M78-A371 HydrophobicContact CE-CB 3.89Å; M78-A371 WeakPolarHBondContact CE-O 3.42Å; Y82-A371 HydrophobicContact CE2-CB 4.34Å; L105-A371 HydrophobicContact CB-CB 4.38Å; L105-A371 HydrophobicContact CD2-CB 3.83Å; L105-A371 VanDerWaalsContact O-CA 3.29Å; L105-A371 WeakPolarHBondContact O-CA 3.27Å; L105-A371 WeakPolarHBondContact O-CB 3.45Å; L277-A371 WeakPolarHBondContact O-CB 3.35Å; L277-A371 PolarHBondContact O-N 3.19Å; S278-A371 PolarHBondContact O-N 3.22Å; S278-A371 VanDerWaalsContact O-N 3.16Å; A371-F375 VanDerWaalsContact O-CB 3.27Å; A371-F375 WeakPolarHBondContact O-CB 3.38Å; A371-F375 PolarHBondContact O-N 3.14Å |
| 372 | Q | 96.6 | Very high | 86 | Confident | 74 Ų | 74 | 58.9 Ų | 58.9 | 35% | 0.346 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -65.3 | -48.1 | 179.5 | -176.8 | 177.9 | 8.7 | 0 | 0 | 111.7 | Y82 G370 I374 F375 E376 | Y82-Q372 HydrophobicContact CD1-CB 3.85Å; Y82-Q372 HydrophobicContact CD1-CG 4.12Å; Y82-Q372 HydrophobicContact CD2-CB 3.84Å; Y82-Q372 HydrophobicContact CE1-CB 3.7Å; Y82-Q372 HydrophobicContact CE1-CG 4.37Å; Y82-Q372 HydrophobicContact CE2-CB 3.7Å; Y82-Q372 HydrophobicContact CG-CB 3.91Å; Y82-Q372 HydrophobicContact CG-CG 4.22Å; G370-Q372 VanDerWaalsContact C-N 3.31Å; G370-Q372 PolarHBondContact O-N 3.24Å; G370-Q372 VanDerWaalsContact O-N 3.13Å; Q372-I374 VanDerWaalsContact C-N 3.3Å; Q372-I374 PolarHBondContact O-N 3.09Å; Q372-F375 PolarHBondContact O-N 2.86Å; Q372-E376 HydrophobicContact CG-CG 4.5Å; Q372-E376 VanDerWaalsContact CG-OE1 3.25Å; Q372-E376 WeakPolarHBondContact CG-OE1 3.32Å; Q372-E376 PolarHBondContact NE2-OE1 3.29Å; Q372-E376 WeakPolarHBondContact O-CG 3.4Å; Q372-E376 PolarHBondContact O-N 3.38Å |
| 373 | A | 95.9 | Very high | 87.5 | Confident | 26 Ų | 26 | 59.8 Ų | 59.8 | 22% | 0.215 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65 | -37.3 | -179 | 0 | 0 | 0 | 0 | 0 | 111.5 | L368 A369 G370 A377 | L368-A373 HydrophobicContact CB-CB 4.2Å; L368-A373 HydrophobicContact CD2-CB 4.48Å; A369-A373 HydrophobicContact CB-CB 4.44Å; G370-A373 PolarHBondContact O-N 3.35Å; G370-A373 VanDerWaalsContact O-N 3.1Å; A373-A377 VanDerWaalsContact O-CB 3.32Å; A373-A377 WeakPolarHBondContact O-CB 2.82Å; A373-A377 PolarHBondContact O-N 3.02Å |
| 374 | I | 96.1 | Very high | 88.7 | Confident | 4 Ų | 4 | 58.6 Ų | 58.6 | 2% | 0.021 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.2 | -48.5 | 175.2 | -66.1 | 172.1 | 0 | 0 | 0 | 110.8 | V206 Y207 L368 G370 Q372 E376 A377 Q378 | V206-I374 HydrophobicContact CG1-CD1 3.93Å; V206-I374 HydrophobicContact CG1-CG1 3.9Å; Y207-I374 HydrophobicContact CD2-CD1 4.09Å; Y207-I374 HydrophobicContact CE1-CD1 4.34Å; Y207-I374 HydrophobicContact CE2-CD1 3.19Å; Y207-I374 WeakPolarHBondContact OH-CD1 3.33Å; L368-I374 HydrophobicContact CB-CG1 3.89Å; L368-I374 HydrophobicContact CD1-CB 4.44Å; L368-I374 HydrophobicContact CD1-CG1 3.76Å; L368-I374 HydrophobicContact CG-CG1 4.47Å; G370-I374 PolarHBondContact O-N 3.36Å; G370-I374 VanDerWaalsContact O-N 3.14Å; Q372-I374 VanDerWaalsContact C-N 3.3Å; Q372-I374 PolarHBondContact O-N 3.09Å; I374-E376 VanDerWaalsContact C-N 3.34Å; I374-E376 PolarHBondContact O-N 3.47Å; I374-A377 PolarHBondContact O-N 3.27Å; I374-Q378 HydrophobicContact CG2-CG 4.36Å; I374-Q378 WeakPolarHBondContact O-CB 3.41Å; I374-Q378 VanDerWaalsContact O-CG 3.28Å; I374-Q378 WeakPolarHBondContact O-CG 3.3Å; I374-Q378 PolarHBondContact O-N 3.39Å |
| 375 | F | 96.3 | Very high | 89.3 | Confident | 21 Ų | 21 | 65.7 Ų | 65.7 | 9% | 0.092 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -57.1 | -48 | 177 | 176.7 | -99.3 | 0 | 0 | 0 | 111.4 | E75 M78 A371 Q372 A377 Q378 Q379 | E75-F375 HydrophobicContact CB-CE2 4.32Å; E75-F375 HydrophobicContact CB-CZ 4.24Å; E75-F375 HydrophobicContact CG-CE2 4.24Å; M78-F375 HydrophobicContact CB-CD1 3.75Å; M78-F375 HydrophobicContact CB-CD2 3.91Å; M78-F375 HydrophobicContact CB-CE1 3.84Å; M78-F375 HydrophobicContact CB-CE2 4Å; M78-F375 HydrophobicContact CB-CG 3.78Å; M78-F375 HydrophobicContact CB-CZ 3.97Å; M78-F375 HydrophobicContact CE-CB 3.88Å; M78-F375 HydrophobicContact CE-CG 4.35Å; M78-F375 HydrophobicContact CG-CD2 4.2Å; M78-F375 HydrophobicContact CG-CG 4.26Å; A371-F375 VanDerWaalsContact O-CB 3.27Å; A371-F375 WeakPolarHBondContact O-CB 3.38Å; A371-F375 PolarHBondContact O-N 3.14Å; Q372-F375 PolarHBondContact O-N 2.86Å; F375-A377 PolarHBondContact O-N 2.88Å; F375-Q378 PolarHBondContact O-N 3.32Å; F375-Q379 HydrophobicContact CD1-CG 4.28Å; F375-Q379 HydrophobicContact CE1-CG 3.86Å; F375-Q379 HydrophobicContact CE2-CG 4.11Å; F375-Q379 HydrophobicContact CZ-CG 3.76Å; F375-Q379 WeakPolarHBondContact O-CG 3.18Å; F375-Q379 PolarHBondContact O-N 3.42Å |
| 376 | E | 95.1 | Very high | 88.6 | Confident | 106 Ų | 106 | 62.9 Ų | 62.9 | 50% | 0.495 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 178 | -72 | 169.5 | -172.5 | 0 | 0 | 112.3 | Q372 I374 Q378 Q379 L380 | Q372-E376 HydrophobicContact CG-CG 4.5Å; Q372-E376 VanDerWaalsContact CG-OE1 3.25Å; Q372-E376 WeakPolarHBondContact CG-OE1 3.32Å; Q372-E376 PolarHBondContact NE2-OE1 3.29Å; Q372-E376 WeakPolarHBondContact O-CG 3.4Å; Q372-E376 PolarHBondContact O-N 3.38Å; I374-E376 VanDerWaalsContact C-N 3.34Å; I374-E376 PolarHBondContact O-N 3.47Å; E376-Q378 PolarHBondContact O-N 3.07Å; E376-Q379 PolarHBondContact O-N 3.21Å; E376-L380 PolarHBondContact O-N 3.09Å |
| 377 | A | 93.6 | Very high | 87.3 | Confident | 42 Ų | 42 | 59.9 Ų | 59.9 | 35% | 0.347 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L368 A373 I374 F375 L380 A381 | L368-A377 HydrophobicContact CD1-CB 4.06Å; A373-A377 VanDerWaalsContact O-CB 3.32Å; A373-A377 WeakPolarHBondContact O-CB 2.82Å; A373-A377 PolarHBondContact O-N 3.02Å; I374-A377 PolarHBondContact O-N 3.27Å; F375-A377 PolarHBondContact O-N 2.88Å; A377-L380 PolarHBondContact O-N 3.38Å; A377-A381 WeakPolarHBondContact O-CB 3.34Å; A377-A381 PolarHBondContact O-N 3.33Å |
| 378 | Q | 92.9 | Very high | 85.1 | Confident | 33 Ų | 33 | 68 Ų | 68 | 15% | 0.154 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 177.7 | -72.9 | 176.8 | -22.3 | 0 | 0 | 112.1 | G107 V110 I374 F375 E376 L380 A381 G382 | G107-Q378 PolarHBondContact O-NE2 3.46Å; V110-Q378 HydrophobicContact CG1-CG 4.31Å; I374-Q378 HydrophobicContact CG2-CG 4.36Å; I374-Q378 WeakPolarHBondContact O-CB 3.41Å; I374-Q378 VanDerWaalsContact O-CG 3.28Å; I374-Q378 WeakPolarHBondContact O-CG 3.3Å; I374-Q378 PolarHBondContact O-N 3.39Å; F375-Q378 PolarHBondContact O-N 3.32Å; E376-Q378 PolarHBondContact O-N 3.07Å; Q378-L380 VanDerWaalsContact C-N 3.31Å; Q378-L380 PolarHBondContact O-N 3.11Å; Q378-A381 PolarHBondContact O-N 3.43Å; Q378-G382 PolarHBondContact O-N 3.31Å |
| 379 | Q | 91.3 | Very high | 83.1 | Confident | 93 Ų | 93 | 71.1 Ų | 71.1 | 44% | 0.435 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.2 | -41.4 | 174.8 | -67.1 | -58.7 | 93.2 | 0 | 0 | 111.4 | F375 E376 G382 A383 | F375-Q379 HydrophobicContact CD1-CG 4.28Å; F375-Q379 HydrophobicContact CE1-CG 3.86Å; F375-Q379 HydrophobicContact CE2-CG 4.11Å; F375-Q379 HydrophobicContact CZ-CG 3.76Å; F375-Q379 WeakPolarHBondContact O-CG 3.18Å; F375-Q379 PolarHBondContact O-N 3.42Å; E376-Q379 PolarHBondContact O-N 3.21Å; Q379-G382 PolarHBondContact O-N 3.36Å; Q379-A383 WeakPolarHBondContact O-CB 3.49Å; Q379-A383 PolarHBondContact O-N 3.47Å |
| 380 | L | 90.5 | Very high | 81 | Confident | 97 Ų | 97 | 78.5 Ų | 78.5 | 51% | 0.508 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 176.9 | -172.5 | 68.1 | 0 | 0 | 0 | 112 | E376 A377 Q378 A383 R384 | E376-L380 PolarHBondContact O-N 3.09Å; A377-L380 PolarHBondContact O-N 3.38Å; Q378-L380 VanDerWaalsContact C-N 3.31Å; Q378-L380 PolarHBondContact O-N 3.11Å; L380-A383 PolarHBondContact O-N 3.11Å; L380-R384 WeakPolarHBondContact O-CG 3.32Å; L380-R384 PolarHBondContact O-N 2.75Å; L380-R384 VanDerWaalsContact O-N 3.11Å |
| 381 | A | 88.9 | Confident | 78.9 | Confident | 47 Ų | 47 | 84.5 Ų | 84.5 | 39% | 0.388 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.1 | -41 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A377 Q378 R384 R385 | A377-A381 WeakPolarHBondContact O-CB 3.34Å; A377-A381 PolarHBondContact O-N 3.33Å; Q378-A381 PolarHBondContact O-N 3.43Å; A381-R384 PolarHBondContact O-N 3.32Å; A381-R385 PolarHBondContact O-N 3.27Å; A381-R385 VanDerWaalsContact O-N 3.11Å |
| 382 | G | 85.3 | Confident | 76.4 | Confident | 42 Ų | 42 | 89.8 Ų | 89.8 | 43% | 0.433 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.3 | -44.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q378 Q379 R384 R385 G386 | Q378-G382 PolarHBondContact O-N 3.31Å; Q379-G382 PolarHBondContact O-N 3.36Å; G382-R384 VanDerWaalsContact C-N 3.3Å; G382-R384 PolarHBondContact O-N 3.21Å; G382-R385 PolarHBondContact O-N 2.99Å; G382-G386 PolarHBondContact O-N 2.87Å |
| 383 | A | 84.1 | Confident | 74 | Confident | 64 Ų | 64 | 97.4 Ų | 97.4 | 53% | 0.529 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.5 | -38.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q379 L380 G386 A387 | Q379-A383 WeakPolarHBondContact O-CB 3.49Å; Q379-A383 PolarHBondContact O-N 3.47Å; L380-A383 PolarHBondContact O-N 3.11Å; A383-G386 PolarHBondContact O-N 2.86Å; A383-A387 PolarHBondContact O-N 2.92Å |
| 384 | R | 80.9 | Confident | 72 | Confident | 184 Ų | 184 | 103.5 Ų | 103.5 | 69% | 0.694 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -66.9 | -37.3 | 175.8 | -71.8 | 176.3 | -179.8 | -177.2 | 0.1 | 113.1 | L380 A381 G382 G386 | L380-R384 WeakPolarHBondContact O-CG 3.32Å; L380-R384 PolarHBondContact O-N 2.75Å; L380-R384 VanDerWaalsContact O-N 3.11Å; A381-R384 PolarHBondContact O-N 3.32Å; G382-R384 VanDerWaalsContact C-N 3.3Å; G382-R384 PolarHBondContact O-N 3.21Å; R384-G386 VanDerWaalsContact C-N 3.33Å |
| 385 | R | 72.3 | Confident | 70 | Confident | 187 Ų | 187 | 109.1 Ų | 109.1 | 71% | 0.706 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -71.1 | -29.4 | 175.1 | -70.2 | -179.6 | -178.9 | -168.8 | -1.3 | 112.5 | A381 G382 | A381-R385 PolarHBondContact O-N 3.27Å; A381-R385 VanDerWaalsContact O-N 3.11Å; G382-R385 PolarHBondContact O-N 2.99Å |
| 386 | G | 59.2 | Low | 67.7 | Low | 66 Ų | 66 | 113.9 Ų | 113.9 | 68% | 0.68 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -83.9 | -16.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115 | G382 A383 R384 K388 | G382-G386 PolarHBondContact O-N 2.87Å; A383-G386 PolarHBondContact O-N 2.86Å; R384-G386 VanDerWaalsContact C-N 3.33Å; G386-K388 PolarHBondContact O-N 3.28Å |
| 387 | A | 51 | Low | 65.6 | Low | 65 Ų | 65 | 116.9 Ų | 116.9 | 54% | 0.537 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -72.6 | 118.6 | 172 | 0 | 0 | 0 | 0 | 0 | 109.4 | A383 | A383-A387 PolarHBondContact O-N 2.92Š|
| 388 | K | 44.1 | Very low | 64 | Low | 190 Ų | 190 | 120.3 Ų | 120.3 | 83% | 0.826 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 142.3 | 169.7 | -77.3 | -177.7 | 177.3 | -179.9 | 0 | 109 | G386 E390 | G386-K388 PolarHBondContact O-N 3.28Å; K388-E390 PolarHBondContact O-N 2.97Å; K388-E390 VanDerWaalsContact O-N 3.15Å |
| 389 | P | 48.4 | Very low | 61.9 | Low | 117 Ų | 117 | 124.7 Ų | 124.7 | 76% | 0.76 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 125.1 | 175.7 | 22.1 | -30.5 | 0 | 0 | 0 | 108.6 | V391 | P389-V391 PolarHBondContact O-N 3.43Š|
| 390 | E | 47.5 | Very low | 60 | Low | 188 Ų | 188 | 127.5 Ų | 127.5 | 88% | 0.879 | 70% | 0.697 | S | S | * | * | trans | -57 | 115.1 | 171.4 | -76.3 | -172.3 | 153.8 | 0 | 0 | 107.6 | K388 P392 | K388-E390 PolarHBondContact O-N 2.97Å; K388-E390 VanDerWaalsContact O-N 3.15Å; E390-P392 WeakPolarHBondContact O-CD 3.48Å | ||
| 391 | V | 49.6 | Very low | 58.2 | Low | 126 Ų | 126 | 131 Ų | 131 | 76% | 0.764 | 71% | 0.711 | S | S | * | * | trans | -56.1 | 123 | 169.8 | 179.3 | 0 | 0 | 0 | 0 | 106.3 | P389 R393 | P389-V391 PolarHBondContact O-N 3.43Å; V391-R393 PolarHBondContact O-N 3.05Å | ||
| 392 | P | 45.1 | Very low | 56.1 | Low | 114 Ų | 114 | 134.8 Ų | 134.8 | 74% | 0.74 | 73% | 0.732 | S | S | * | * | trans | -55.3 | 114.8 | 177.6 | -21.7 | 30.6 | 0 | 0 | 0 | 108.4 | E390 I394 | E390-P392 WeakPolarHBondContact O-CD 3.48Å; P392-I394 PolarHBondContact O-N 3.38Å | ||
| 393 | R | 46.6 | Very low | 54.3 | Low | 233 Ų | 233 | 142.1 Ų | 142.1 | 88% | 0.879 | 75% | 0.746 | S | S | * | * | trans | -64.4 | 109.2 | 169.8 | -81.5 | -175.7 | 174.6 | -170.5 | -1.1 | 106.5 | V391 V395 | V391-R393 PolarHBondContact O-N 3.05Å; R393-V395 PolarHBondContact O-N 2.93Å | ||
| 394 | I | 53.1 | Low | 52.6 | Low | 154 Ų | 154 | 144.3 Ų | 144.3 | 79% | 0.79 | 76% | 0.755 | S | S | * | * | trans | -59.8 | 104.6 | 165.5 | -63.5 | 171.7 | 0 | 0 | 0 | 105.9 | P392 V396 | P392-I394 PolarHBondContact O-N 3.38Å; I394-V396 HydrophobicContact CG2-CG2 4.19Å; I394-V396 PolarHBondContact O-N 3.11Å; I394-V396 VanDerWaalsContact O-N 3.09Å | ||
| 395 | V | 54.7 | Low | 51 | Low | 122 Ų | 122 | 141.6 Ų | 141.6 | 74% | 0.739 | 76% | 0.761 | S | S | * | * | trans | -74.6 | 97.5 | 169.5 | -179.8 | 0 | 0 | 0 | 0 | 106 | R393 Q397 | R393-V395 PolarHBondContact O-N 2.93Å; V395-Q397 PolarHBondContact O-N 3.48Å; V395-Q397 VanDerWaalsContact O-N 3.14Å | ||
| 396 | V | 48.6 | Very low | 49.6 | Very low | 122 Ų | 122 | 144.3 Ų | 144.3 | 74% | 0.739 | 77% | 0.771 | S | S | * | * | trans | -67.8 | 109.2 | 167 | -176.7 | 0 | 0 | 0 | 0 | 106.2 | I394 | I394-V396 HydrophobicContact CG2-CG2 4.19Å; I394-V396 PolarHBondContact O-N 3.11Å; I394-V396 VanDerWaalsContact O-N 3.09Å | ||
| 397 | Q | 50.1 | Low | 48.8 | Very low | 169 Ų | 169 | 152.8 Ų | 152.8 | 79% | 0.79 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 130.9 | 172.2 | -68.6 | -176.2 | 11.2 | 0 | 0 | 108.3 | V395 | V395-Q397 PolarHBondContact O-N 3.48Å; V395-Q397 VanDerWaalsContact O-N 3.14Å |
| 398 | P | 60.1 | Low | 48.4 | Very low | 113 Ų | 113 | 159.1 Ų | 159.1 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 148.3 | 173 | 23.6 | -30 | 0 | 0 | 0 | 109.9 | E400 | P398-E400 PolarHBondContact O-N 2.85Š|
| 399 | P | 49.1 | Very low | 48.2 | Very low | 126 Ų | 126 | 156.1 Ų | 156.1 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 132.2 | -177 | 22.7 | -30.7 | 0 | 0 | 0 | 110.5 | E401 | P399-E401 PolarHBondContact O-N 2.82Š|
| 400 | E | 50 | Low | 47.5 | Very low | 151 Ų | 151 | 159.9 Ų | 159.9 | 71% | 0.706 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 120.9 | -178.9 | -145.5 | -177.4 | 167.8 | 0 | 0 | 109.6 | P398 R403 | P398-E400 PolarHBondContact O-N 2.85Å; E400-R403 IonicContact OE1-CZ 3.05Å; E400-R403 IonicContact OE1-NE 3.5Å; E400-R403 PolarHBondContact OE1-NE 2.86Å; E400-R403 IonicContact OE1-NH2 3.61Å; E400-R403 PolarHBondContact OE1-NH2 3.24Å |
| 401 | E | 53 | Low | 47.2 | Very low | 172 Ų | 172 | 157.4 Ų | 157.4 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -62 | 142.8 | 173.5 | -79 | -176.4 | 166.3 | 0 | 0 | 110.5 | P399 R403 | P399-E401 PolarHBondContact O-N 2.82Å; E401-R403 PolarHBondContact O-N 3.19Å; E401-R403 VanDerWaalsContact O-N 3.12Å |
| 402 | P | 45.7 | Very low | 46.4 | Very low | 126 Ų | 126 | 163.5 Ų | 163.5 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 117.7 | -176.5 | 24.2 | -31.2 | 0 | 0 | 0 | 110.7 | ||
| 403 | R | 47.8 | Very low | 45.9 | Very low | 195 Ų | 195 | 161.5 Ų | 161.5 | 74% | 0.736 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 137.6 | 176.5 | -64.2 | -179.3 | -166.2 | -175.2 | 4.3 | 110.5 | E400 E401 | E400-R403 IonicContact OE1-CZ 3.05Å; E400-R403 IonicContact OE1-NE 3.5Å; E400-R403 PolarHBondContact OE1-NE 2.86Å; E400-R403 IonicContact OE1-NH2 3.61Å; E400-R403 PolarHBondContact OE1-NH2 3.24Å; E401-R403 PolarHBondContact O-N 3.19Å; E401-R403 VanDerWaalsContact O-N 3.12Å |
| 404 | P | 48.8 | Very low | 45.4 | Very low | 111 Ų | 111 | 160.5 Ų | 160.5 | 72% | 0.721 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 151.4 | 177.4 | 27 | -32.6 | 0 | 0 | 0 | 111.2 | R406 | P404-R406 PolarHBondContact O-N 2.88Š|
| 405 | P | 45.5 | Very low | 44.6 | Very low | 127 Ų | 127 | 159.4 Ų | 159.4 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -66 | 123.8 | -173.5 | 25.2 | -32 | 0 | 0 | 0 | 111 | R407 | P405-R407 PolarHBondContact O-N 3.16Š|
| 406 | R | 42.9 | Very low | 43.5 | Very low | 243 Ų | 243 | 163.7 Ų | 163.7 | 92% | 0.917 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 121.5 | 171 | -82.6 | -179.6 | 163.5 | -176.1 | -5.2 | 109.7 | P404 K408 | P404-R406 PolarHBondContact O-N 2.88Å; R406-K408 PolarHBondContact O-N 3.41Å |
| 407 | R | 42.8 | Very low | 42.7 | Very low | 244 Ų | 244 | 166.7 Ų | 166.7 | 92% | 0.921 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 128.2 | 169.3 | -78.9 | -179.6 | 167.6 | -176.2 | -3.8 | 109.7 | P405 | P405-R407 PolarHBondContact O-N 3.16Š|
| 408 | K | 42.1 | Very low | 41.8 | Very low | 199 Ų | 199 | 161.8 Ų | 161.8 | 87% | 0.865 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -67 | 132.1 | 174.8 | -67.1 | -179 | 178.8 | 179.6 | 0 | 110.2 | R406 | R406-K408 PolarHBondContact O-N 3.41Š|
| 409 | P | 40.7 | Very low | 40.4 | Very low | 126 Ų | 126 | 163.6 Ų | 163.6 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 135.9 | 163.7 | -11.5 | 27.4 | 0 | 0 | 0 | 110.4 | ||
| 410 | Q | 34.4 | Very low | 39.6 | Very low | 196 Ų | 196 | 164.6 Ų | 164.6 | 92% | 0.916 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 150.9 | 173.5 | -86.8 | 176.4 | -16 | 0 | 0 | 112.3 | ||
| 411 | T | 41.5 | Very low | 38.9 | Very low | 136 Ų | 136 | 163.8 Ų | 163.8 | 83% | 0.834 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 147.3 | -170.4 | 46.1 | 0 | 0 | 0 | 0 | 116.8 | ||
| 412 | R | 32.4 | Very low | 37.9 | Very low | 254 Ų | 254 | 166.8 Ų | 166.8 | 96% | 0.958 | 84% | 0.836 | S | S | * | * | trans | -149 | 121.2 | 137.1 | -133.5 | 175.8 | 174.9 | -176.1 | -2 | 109.6 | ||||
| 413 | G | 34 | Very low | 37.3 | Very low | 73 Ų | 73 | 165.9 Ų | 165.9 | 75% | 0.753 | 84% | 0.839 | S | S | * | * | trans | -80 | 172.3 | -162 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 414 | K | 36.6 | Very low | 36.7 | Very low | 212 Ų | 212 | 168.5 Ų | 168.5 | 92% | 0.922 | 85% | 0.848 | S | S | * | * | trans | -165.2 | 130.5 | 140 | -100.1 | 167.2 | -173.7 | -174.3 | 0 | 108.3 | ||||
| 415 | T | 35.7 | Very low | 36 | Very low | 130 Ų | 130 | 166.7 Ų | 166.7 | 80% | 0.798 | 85% | 0.85 | S | S | * | * | trans | -63.3 | 147 | 178.5 | -3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 416 | F | 31.5 | Very low | 36.1 | Very low | 212 Ų | 212 | 166.8 Ų | 166.8 | 93% | 0.93 | 85% | 0.851 | S | S | * | * | trans | -166.3 | 138.4 | 134.3 | -123 | -92 | 0 | 0 | 0 | 111.8 | ||||
| 417 | H | 32.7 | Very low | 36.3 | Very low | 185 Ų | 185 | 161 Ų | 161 | 86% | 0.856 | 85% | 0.845 | S | S | * | * | trans | -76.8 | 156.1 | -176.6 | -98 | -97.2 | 0 | 0 | 0 | 113.7 | ||||
| 418 | G | 30.7 | Very low | 36.2 | Very low | 67 Ų | 67 | 157.5 Ų | 157.5 | 69% | 0.691 | 84% | 0.843 | S | S | * | * | trans | 167.6 | 87.1 | 158.7 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 419 | L | 31.3 | Very low | 35.9 | Very low | 151 Ų | 151 | 156.9 Ų | 156.9 | 79% | 0.791 | 84% | 0.843 | S | S | * | * | trans | 41.4 | 118.8 | 145.3 | -78.6 | 86 | 0 | 0 | 0 | 122.8 | ||||
| 420 | L | 32.5 | Very low | 35.7 | Very low | 147 Ų | 147 | 154.2 Ų | 154.2 | 77% | 0.77 | 84% | 0.839 | S | S | * | * | 68.8 | 133 | 107.2 | -64.3 | 173 | 0 | 0 | 0 | 115.3 | |||||
| 421 | T | 33.4 | Very low | 36.3 | Very low | 134 Ų | 134 | 150.9 Ų | 150.9 | 82% | 0.822 | 83% | 0.834 | S | S | * | * | cis | -168.4 | 160 | 41.3 | -17.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 422 | R | 32.5 | Very low | 36.8 | Very low | 235 Ų | 235 | 149.9 Ų | 149.9 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | trans | -65 | 157.1 | 178.6 | -79.5 | 169 | 146.5 | 178.5 | -5.6 | 116.2 | ||||
| 423 | A | 33.8 | Very low | 37.3 | Very low | 107 Ų | 107 | 149.5 Ų | 149.5 | 88% | 0.884 | 83% | 0.828 | S | S | * | * | -169.3 | 147.3 | 116.3 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 424 | R | 34.3 | Very low | 38 | Very low | 249 Ų | 249 | 152.3 Ų | 152.3 | 94% | 0.94 | 83% | 0.833 | S | S | * | * | trans | -110.1 | 158.9 | -174.5 | -80.3 | 177.4 | 168.3 | 178.1 | -5.4 | 111.5 | ||||
| 425 | G | 33.7 | Very low | 37.9 | Very low | 74 Ų | 74 | 151.4 Ų | 151.4 | 76% | 0.763 | 83% | 0.832 | S | S | * | * | trans | -167.3 | 151.1 | 157.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 426 | P | 48.5 | Very low | 37.8 | Very low | 128 Ų | 128 | 157.4 Ų | 157.4 | 83% | 0.831 | 84% | 0.84 | S | S | * | * | trans | -111 | 176.9 | -138.4 | 39.9 | -31.4 | 0 | 0 | 0 | 117.1 | ||||
| 427 | P | 46.5 | Very low | 37.8 | Very low | 123 Ų | 123 | 151.1 Ų | 151.1 | 80% | 0.799 | 84% | 0.835 | S | S | * | * | trans | -102.6 | 161.8 | -179.4 | 39 | -29.9 | 0 | 0 | 0 | 113.7 | ||||
| 428 | I | 41 | Very low | 37.8 | Very low | 170 Ų | 170 | 147.3 Ų | 147.3 | 87% | 0.872 | 83% | 0.829 | S | S | * | * | trans | -135.6 | 146.2 | 174 | -59.7 | -177.9 | 0 | 0 | 0 | 111.2 | ||||
| 429 | E | 35.3 | Very low | 38 | Very low | 185 Ų | 185 | 150.2 Ų | 150.2 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | trans | -80.8 | 169.5 | -157.1 | -61.8 | 165.9 | 129.7 | 0 | 0 | 117.5 | ||||
| 430 | G | 37.2 | Very low | 38.2 | Very low | 71 Ų | 71 | 147.6 Ų | 147.6 | 73% | 0.732 | 83% | 0.828 | S | S | * | * | trans | -73.2 | -150 | 166.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 431 | P | 47.6 | Very low | 38.3 | Very low | 125 Ų | 125 | 149.5 Ų | 149.5 | 81% | 0.812 | 83% | 0.831 | S | S | * | * | cis | -141.2 | -137.8 | 10.4 | 42.6 | -19.2 | 0 | 0 | 0 | 111.3 | ||||
| 432 | P | 52 | Low | 38.4 | Very low | 116 Ų | 116 | 150 Ų | 150 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | cis | -123 | 177.2 | -45.2 | 31.8 | -12.8 | 0 | 0 | 0 | 114.4 | ||||
| 433 | R | 43.3 | Very low | 38.4 | Very low | 245 Ų | 245 | 144.7 Ų | 144.7 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | trans | -87.6 | 156.2 | 165.2 | -74 | 177.8 | 172.6 | 175.4 | -2.9 | 112.2 | ||||
| 434 | P | 47.3 | Very low | 38.6 | Very low | 132 Ų | 132 | 144.1 Ų | 144.1 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | trans | -111.8 | 167.6 | 158.4 | 35.8 | -24.1 | 0 | 0 | 0 | 114.4 | ||||
| 435 | Q | 34.8 | Very low | 38.7 | Very low | 194 Ų | 194 | 142.9 Ų | 142.9 | 91% | 0.907 | 80% | 0.798 | S | S | * | * | trans | -93.9 | 168.4 | -162.3 | -67 | 175.3 | -10.3 | 0 | 0 | 115.3 | ||||
| 436 | R | 34.8 | Very low | 38.9 | Very low | 255 Ų | 255 | 152.8 Ų | 152.8 | 96% | 0.962 | 82% | 0.82 | S | S | * | * | trans | -21.8 | 146.2 | 166.1 | -69.2 | 174.2 | 172.2 | 175.9 | -3.3 | 119.6 | ||||
| 437 | G | 31.8 | Very low | 38.5 | Very low | 80 Ų | 80 | 154 Ų | 154 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | -159.4 | 133.5 | 151.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 438 | S | 32.3 | Very low | 38.1 | Very low | 105 Ų | 105 | 155.6 Ų | 155.6 | 73% | 0.734 | 82% | 0.821 | S | S | * | * | trans | -100.1 | -178.3 | -170 | 77.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 439 | T | 35.1 | Very low | 37.9 | Very low | 129 Ų | 129 | 154.8 Ų | 154.8 | 79% | 0.791 | 82% | 0.818 | S | S | * | * | trans | 82 | 147.2 | 172 | 76.7 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 440 | S | 33.9 | Very low | 38 | Very low | 95 Ų | 95 | 153.1 Ų | 153.1 | 66% | 0.664 | 82% | 0.815 | S | S | * | * | cis | -174.8 | 139.3 | -28.2 | 50.1 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 441 | F | 34.7 | Very low | 38.1 | Very low | 187 Ų | 187 | 158.2 Ų | 158.2 | 82% | 0.82 | 82% | 0.821 | S | S | * | * | trans | 69.9 | 136.4 | 143.9 | -91.4 | -95.4 | 0 | 0 | 0 | 122 | ||||
| 442 | L | 37.1 | Very low | 37.5 | Very low | 145 Ų | 145 | 160.4 Ų | 160.4 | 76% | 0.759 | 82% | 0.821 | S | S | * | * | trans | 75.5 | 140.5 | 152 | -64.1 | 174.4 | 0 | 0 | 0 | 117.5 | ||||
| 443 | D | 32.7 | Very low | 36.4 | Very low | 123 Ų | 123 | 163.6 Ų | 163.6 | 66% | 0.658 | 83% | 0.826 | S | S | * | * | cis | -170 | 158 | -7.9 | -156.8 | -6 | 0 | 0 | 0 | 107 | ||||
| 444 | T | 36.1 | Very low | 35.9 | Very low | 96 Ų | 96 | 157.3 Ų | 157.3 | 59% | 0.589 | 82% | 0.819 | S | S | * | * | trans | 51.5 | 121.6 | 149.5 | 42.5 | 0 | 0 | 0 | 0 | 124 | ||||
| 445 | R | 37.9 | Very low | 35 | Very low | 223 Ų | 223 | 159.4 Ų | 159.4 | 84% | 0.842 | 82% | 0.815 | S | S | * | * | 65.4 | 113.1 | 129.7 | -62.7 | -178.4 | -172.2 | -173.2 | 3.7 | 119.3 | |||||
| 446 | F | 38.3 | Very low | 35 | Very low | 281 Ų | 281 | 156.3 Ų | 156.3 | 100% | 1.232 | 81% | 0.807 | S | S | * | * | -149.4 | 0 | 90.4 | -103.3 | -81.8 | 0 | 0 | 0 | 110 |
Retrieved 446 of 446 residues in 188.6 ms
(Link to these results)