| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.1 | Very low | 34 | Very low | 241 Ų | 241 | 131.5 Ų | 131.5 | 100% | 1.187 | 84% | 0.836 | S | S | * | * | 0 | 104.8 | 0 | -84.6 | 168.9 | 169.8 | 0 | 0 | 108.3 | |||||
| 2 | N | 32.9 | Very low | 33.6 | Very low | 157 Ų | 157 | 136.6 Ų | 136.6 | 84% | 0.84 | 84% | 0.841 | S | S | * | * | trans | 43.7 | 110.2 | 151.5 | -60 | 4.7 | 0 | 0 | 0 | 121.8 | ||||
| 3 | T | 38 | Very low | 33.4 | Very low | 123 Ų | 123 | 141.4 Ų | 141.4 | 76% | 0.755 | 85% | 0.848 | S | S | * | * | trans | -7.2 | 151.2 | 138.2 | 47.9 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 4 | P | 40.1 | Very low | 33 | Very low | 129 Ų | 129 | 144.1 Ų | 144.1 | 84% | 0.838 | 85% | 0.847 | S | S | * | * | trans | -84.5 | 144.8 | 168.6 | 36 | -30.2 | 0 | 0 | 0 | 111 | ||||
| 5 | S | 33.3 | Very low | 32.5 | Very low | 118 Ų | 118 | 145.3 Ų | 145.3 | 83% | 0.825 | 85% | 0.847 | S | S | * | * | trans | -137.7 | 135.5 | 173.6 | 34.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 6 | T | 32.9 | Very low | 32.3 | Very low | 128 Ų | 128 | 147.1 Ų | 147.1 | 79% | 0.785 | 85% | 0.845 | S | S | * | * | trans | -83.7 | 170.2 | -170.1 | 42.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 7 | L | 30.6 | Very low | 32 | Very low | 159 Ų | 159 | 146.2 Ų | 146.2 | 83% | 0.832 | 84% | 0.843 | S | S | * | * | trans | 108 | 152.6 | 157.6 | -67.6 | 146.9 | 0 | 0 | 0 | 116.4 | ||||
| 8 | P | 37.5 | Very low | 31.7 | Very low | 102 Ų | 102 | 143.7 Ų | 143.7 | 66% | 0.662 | 84% | 0.842 | S | S | * | * | cis | -130.2 | 173.6 | -48.9 | 34 | -17 | 0 | 0 | 0 | 111.8 | ||||
| 9 | P | 33.1 | Very low | 31.3 | Very low | 136 Ų | 136 | 148.3 Ų | 148.3 | 88% | 0.883 | 84% | 0.844 | S | S | * | * | trans | -77.2 | 121.6 | 163.2 | 31.5 | -27.8 | 0 | 0 | 0 | 108.9 | ||||
| 10 | G | 29.9 | Very low | 31.4 | Very low | 77 Ų | 77 | 145.9 Ų | 145.9 | 79% | 0.794 | 84% | 0.835 | S | S | * | * | trans | -107.3 | 133.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 11 | G | 27.4 | Very low | 31.4 | Very low | 77 Ų | 77 | 144.4 Ų | 144.4 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | 92.6 | 73.2 | 149.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 12 | E | 29.9 | Very low | 31.2 | Very low | 192 Ų | 192 | 137.7 Ų | 137.7 | 90% | 0.897 | 81% | 0.813 | S | S | * | * | trans | -68.4 | 120.1 | 143.8 | -70.8 | 178.2 | 140.3 | 0 | 0 | 107 | E14 | E12-E14 PolarHBondContact O-N 3.18Å; E12-E14 VanDerWaalsContact O-N 3.09Å | ||
| 13 | E | 31 | Very low | 31 | Very low | 199 Ų | 199 | 134.8 Ų | 134.8 | 93% | 0.93 | 81% | 0.811 | S | S | * | * | trans | -68.9 | 101.5 | 168 | -84.5 | -179.9 | 125.6 | 0 | 0 | 108.6 | L15 | E13-L15 PolarHBondContact O-N 3.38Š| ||
| 14 | E | 27.4 | Very low | 30.5 | Very low | 180 Ų | 180 | 136.3 Ų | 136.3 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | trans | -59.4 | 114.6 | 157.8 | -84.2 | 176.1 | 112.8 | 0 | 0 | 109.2 | E12 | E12-E14 PolarHBondContact O-N 3.18Å; E12-E14 VanDerWaalsContact O-N 3.09Å | ||
| 15 | L | 26 | Very low | 30.7 | Very low | 162 Ų | 162 | 135.3 Ų | 135.3 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | trans | -103.1 | 91.4 | 157.6 | -161.9 | 74.4 | 0 | 0 | 0 | 108.1 | E13 T17 | E13-L15 PolarHBondContact O-N 3.38Å; L15-T17 PolarHBondContact O-N 3.05Å | ||
| 16 | E | 28.3 | Very low | 30.9 | Very low | 173 Ų | 173 | 134.3 Ų | 134.3 | 81% | 0.808 | 81% | 0.81 | S | S | * | * | trans | -50.1 | 122.3 | 165.5 | -75.9 | -171 | 100.6 | 0 | 0 | 110.8 | ||||
| 17 | T | 27.9 | Very low | 31.4 | Very low | 133 Ų | 133 | 134.1 Ų | 134.1 | 82% | 0.816 | 81% | 0.814 | S | S | * | * | trans | -140.1 | 90.1 | 146.7 | 36.9 | 0 | 0 | 0 | 0 | 109.9 | L15 | L15-T17 PolarHBondContact O-N 3.05Š| ||
| 18 | A | 26.6 | Very low | 31.6 | Very low | 100 Ų | 100 | 130 Ų | 130 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | trans | 9.5 | 108.5 | 153.1 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 19 | W | 24.4 | Very low | 31.6 | Very low | 232 Ų | 232 | 129.8 Ų | 129.8 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 133.3 | 152.9 | -178.1 | -87.3 | 0 | 0 | 0 | 109.3 | ||
| 20 | P | 32.1 | Very low | 32.3 | Very low | 100 Ų | 100 | 126.5 Ų | 126.5 | 65% | 0.649 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 141.6 | 170.9 | 31 | -29.5 | 0 | 0 | 0 | 110.6 | ||
| 21 | P | 31.4 | Very low | 32.8 | Very low | 115 Ų | 115 | 130.1 Ų | 130.1 | 75% | 0.747 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 150.6 | -173.8 | 28.8 | -33.4 | 0 | 0 | 0 | 111.6 | A23 | P21-A23 PolarHBondContact O-N 2.99Å; P21-A23 VanDerWaalsContact O-N 3.13Å |
| 22 | A | 33.4 | Very low | 33.3 | Very low | 99 Ų | 99 | 133 Ų | 133 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -53 | 115.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 23 | A | 29.4 | Very low | 33.7 | Very low | 97 Ų | 97 | 131.1 Ų | 131.1 | 80% | 0.802 | 77% | 0.766 | S | S | * | * | trans | -86.2 | 132.6 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | P21 | P21-A23 PolarHBondContact O-N 2.99Å; P21-A23 VanDerWaalsContact O-N 3.13Å | ||
| 24 | N | 27.8 | Very low | 34.2 | Very low | 155 Ų | 155 | 128.8 Ų | 128.8 | 83% | 0.829 | 76% | 0.755 | S | S | * | * | trans | -46.8 | 137.4 | -178.2 | -79.1 | -26.8 | 0 | 0 | 0 | 114.2 | S26 | N24-S26 PolarHBondContact O-N 3.45Š| ||
| 25 | A | 44.4 | Very low | 34.9 | Very low | 107 Ų | 107 | 123.2 Ų | 123.2 | 88% | 0.884 | 74% | 0.74 | S | S | * | * | trans | -68.5 | 106.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 26 | S | 37.1 | Very low | 35.8 | Very low | 98 Ų | 98 | 120.5 Ų | 120.5 | 69% | 0.685 | 73% | 0.73 | S | S | * | * | trans | -163.2 | 113.4 | 152.7 | 53.7 | 0 | 0 | 0 | 0 | 110.4 | N24 | N24-S26 PolarHBondContact O-N 3.45Š| ||
| 27 | S | 44.5 | Very low | 36.7 | Very low | 123 Ų | 123 | 114.8 Ų | 114.8 | 86% | 0.86 | 71% | 0.712 | S | S | * | * | trans | 53.2 | 90.1 | 164.1 | 61.4 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 28 | A | 34.3 | Very low | 37.5 | Very low | 74 Ų | 74 | 110.5 Ų | 110.5 | 61% | 0.612 | 69% | 0.694 | S | S | * | * | trans | -98.5 | 135.6 | 152.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 29 | P | 38.3 | Very low | 38.6 | Very low | 97 Ų | 97 | 115.9 Ų | 115.9 | 63% | 0.63 | 69% | 0.693 | S | S | * | * | trans | -81.2 | 161.8 | -173 | 33.6 | -34 | 0 | 0 | 0 | 112.3 | E31 E32 | P29-E31 PolarHBondContact O-N 3.18Å; P29-E32 PolarHBondContact O-N 3.29Å | ||
| 30 | A | 47 | Very low | 40.1 | Very low | 66 Ų | 66 | 106.9 Ų | 106.9 | 55% | 0.545 | 67% | 0.672 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -46.7 | -9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | E33 E34 | A30-E33 PolarHBondContact O-N 3.27Å; A30-E34 PolarHBondContact O-N 3.11Å |
| 31 | E | 40.3 | Very low | 41.4 | Very low | 154 Ų | 154 | 107.8 Ų | 107.8 | 72% | 0.72 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -70.4 | -31.5 | 179.4 | -65.1 | -178.2 | 163.6 | 0 | 0 | 113.1 | P29 A35 | P29-E31 PolarHBondContact O-N 3.18Å; E31-A35 WeakPolarHBondContact O-CB 3.49Å; E31-A35 PolarHBondContact O-N 3.27Å |
| 32 | E | 37.9 | Very low | 42.8 | Very low | 138 Ų | 138 | 105.5 Ų | 105.5 | 65% | 0.645 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -76 | -31 | 177.1 | -143.4 | 170.4 | -163.7 | 0 | 0 | 111.2 | P29 V36 | P29-E32 PolarHBondContact O-N 3.29Å; E32-V36 WeakPolarHBondContact O-CB 3.26Å; E32-V36 WeakPolarHBondContact O-CG2 3.09Å; E32-V36 PolarHBondContact O-N 3.39Å |
| 33 | E | 37.8 | Very low | 44.6 | Very low | 151 Ų | 151 | 102.9 Ų | 102.9 | 71% | 0.706 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -73.6 | -38.1 | 174.4 | -151.2 | 172.9 | -172.2 | 0 | 0 | 111.3 | A30 V36 A37 | A30-E33 PolarHBondContact O-N 3.27Å; E33-V36 PolarHBondContact O-N 2.92Å; E33-A37 WeakPolarHBondContact O-CB 3.25Å; E33-A37 PolarHBondContact O-N 3.42Å |
| 34 | E | 41.6 | Very low | 46.9 | Very low | 150 Ų | 150 | 100.7 Ų | 100.7 | 70% | 0.701 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68 | -36.3 | 171.1 | -78.9 | -162.2 | 162.4 | 0 | 0 | 113.1 | A30 A37 G38 | A30-E34 PolarHBondContact O-N 3.11Å; E34-A37 PolarHBondContact O-N 3.07Å; E34-G38 PolarHBondContact O-N 3.47Å |
| 35 | A | 41.4 | Very low | 49.5 | Very low | 64 Ų | 64 | 96.2 Ų | 96.2 | 53% | 0.529 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -70.1 | -35 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | E31 R39 | E31-A35 WeakPolarHBondContact O-CB 3.49Å; E31-A35 PolarHBondContact O-N 3.27Å; A35-R39 WeakPolarHBondContact O-CB 3.39Å; A35-R39 PolarHBondContact O-N 3.01Å |
| 36 | V | 46 | Very low | 51.4 | Low | 104 Ų | 104 | 92.7 Ų | 92.7 | 63% | 0.63 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.5 | -39.5 | 173.3 | 172 | 0 | 0 | 0 | 0 | 111.2 | E32 E33 R39 G40 | E32-V36 WeakPolarHBondContact O-CB 3.26Å; E32-V36 WeakPolarHBondContact O-CG2 3.09Å; E32-V36 PolarHBondContact O-N 3.39Å; E33-V36 PolarHBondContact O-N 2.92Å; V36-R39 PolarHBondContact O-N 3.33Å; V36-G40 PolarHBondContact O-N 2.95Å |
| 37 | A | 47.8 | Very low | 53.7 | Low | 54 Ų | 54 | 91 Ų | 91 | 45% | 0.446 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.9 | -45 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | E33 E34 R39 G40 D41 | E33-A37 WeakPolarHBondContact O-CB 3.25Å; E33-A37 PolarHBondContact O-N 3.42Å; E34-A37 PolarHBondContact O-N 3.07Å; A37-R39 VanDerWaalsContact C-N 3.31Å; A37-R39 PolarHBondContact O-N 3.32Å; A37-G40 PolarHBondContact O-N 2.97Å; A37-D41 PolarHBondContact O-N 3.45Å |
| 38 | G | 43.3 | Very low | 55.8 | Low | 42 Ų | 42 | 89.6 Ų | 89.6 | 43% | 0.433 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.3 | -31.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | E34 A42 | E34-G38 PolarHBondContact O-N 3.47Å; G38-A42 WeakPolarHBondContact O-CB 3.39Å; G38-A42 PolarHBondContact O-N 3.35Å |
| 39 | R | 49.6 | Very low | 58.5 | Low | 214 Ų | 214 | 88.3 Ų | 88.3 | 81% | 0.808 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -78 | -30.2 | 173.5 | -161.1 | 165.8 | -174.7 | -171.2 | 0.5 | 112.4 | A35 V36 A37 G43 | A35-R39 WeakPolarHBondContact O-CB 3.39Å; A35-R39 PolarHBondContact O-N 3.01Å; V36-R39 PolarHBondContact O-N 3.33Å; A37-R39 VanDerWaalsContact C-N 3.31Å; A37-R39 PolarHBondContact O-N 3.32Å; R39-G43 PolarHBondContact O-N 3.08Å; R39-G43 VanDerWaalsContact O-N 3.1Å |
| 40 | G | 56.4 | Low | 61 | Low | 43 Ų | 43 | 84.7 Ų | 84.7 | 44% | 0.443 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.6 | -46.8 | 170 | 0 | 0 | 0 | 0 | 0 | 112.6 | V36 A37 G43 A44 | V36-G40 PolarHBondContact O-N 2.95Å; A37-G40 PolarHBondContact O-N 2.97Å; G40-G43 PolarHBondContact O-N 3.25Å; G40-A44 WeakPolarHBondContact O-CB 3.19Å; G40-A44 PolarHBondContact O-N 3.48Å |
| 41 | D | 60.3 | Low | 63.2 | Low | 119 Ų | 119 | 83.8 Ų | 83.8 | 64% | 0.636 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.6 | -40.9 | 177.2 | -87.4 | -3.9 | 0 | 0 | 0 | 112.3 | A37 G43 A44 A45 | A37-D41 PolarHBondContact O-N 3.45Å; D41-G43 VanDerWaalsContact C-N 3.32Å; D41-G43 PolarHBondContact O-N 3.08Å; D41-A44 PolarHBondContact O-N 3.42Å; D41-A45 VanDerWaalsContact O-CB 3.3Å; D41-A45 WeakPolarHBondContact O-CB 3.4Å; D41-A45 PolarHBondContact O-N 3.36Å |
| 42 | A | 60.3 | Low | 65.8 | Low | 67 Ų | 67 | 80.2 Ų | 80.2 | 55% | 0.554 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.7 | -37.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G38 G46 | G38-A42 WeakPolarHBondContact O-CB 3.39Å; G38-A42 PolarHBondContact O-N 3.35Å; A42-G46 PolarHBondContact O-N 3.01Å |
| 43 | G | 71.3 | Confident | 68.4 | Low | 44 Ų | 44 | 77.4 Ų | 77.4 | 45% | 0.454 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68.4 | -39.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | R39 G40 D41 M47 | R39-G43 PolarHBondContact O-N 3.08Å; R39-G43 VanDerWaalsContact O-N 3.1Å; G40-G43 PolarHBondContact O-N 3.25Å; D41-G43 VanDerWaalsContact C-N 3.32Å; D41-G43 PolarHBondContact O-N 3.08Å; G43-M47 PolarHBondContact O-N 2.94Å; G43-M47 VanDerWaalsContact O-N 3.08Å |
| 44 | A | 77.6 | Confident | 71.1 | Confident | 50 Ų | 50 | 70.3 Ų | 70.3 | 41% | 0.413 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -67.4 | -46.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | G40 D41 G46 M47 V48 | G40-A44 WeakPolarHBondContact O-CB 3.19Å; G40-A44 PolarHBondContact O-N 3.48Å; D41-A44 PolarHBondContact O-N 3.42Å; A44-G46 VanDerWaalsContact C-N 3.32Å; A44-G46 PolarHBondContact O-N 3.5Å; A44-M47 PolarHBondContact O-N 3.38Å; A44-V48 WeakPolarHBondContact O-CG2 3.32Å; A44-V48 PolarHBondContact O-N 2.91Å |
| 45 | A | 82.9 | Confident | 73.6 | Confident | 61 Ų | 61 | 66.2 Ų | 66.2 | 50% | 0.504 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -59.9 | -41.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | D41 V48 A49 | D41-A45 VanDerWaalsContact O-CB 3.3Å; D41-A45 WeakPolarHBondContact O-CB 3.4Å; D41-A45 PolarHBondContact O-N 3.36Å; A45-V48 PolarHBondContact O-N 2.9Å; A45-A49 WeakPolarHBondContact O-CB 3.46Å; A45-A49 PolarHBondContact O-N 3.21Å |
| 46 | G | 84.6 | Confident | 76.2 | Confident | 33 Ų | 33 | 68.2 Ų | 68.2 | 34% | 0.34 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A42 A44 A49 I50 | A42-G46 PolarHBondContact O-N 3.01Å; A44-G46 VanDerWaalsContact C-N 3.32Å; A44-G46 PolarHBondContact O-N 3.5Å; G46-A49 PolarHBondContact O-N 3.07Å; G46-I50 VanDerWaalsContact O-CG1 3.28Å; G46-I50 WeakPolarHBondContact O-CG1 3.49Å; G46-I50 PolarHBondContact O-N 2.88Å |
| 47 | M | 84.3 | Confident | 78.5 | Confident | 64 Ų | 64 | 64 Ų | 64 | 32% | 0.315 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 176.6 | -171.8 | 179.2 | -68.8 | 0 | 0 | 111.9 | G43 A44 A49 I50 Q51 | G43-M47 PolarHBondContact O-N 2.94Å; G43-M47 VanDerWaalsContact O-N 3.08Å; A44-M47 PolarHBondContact O-N 3.38Å; M47-A49 VanDerWaalsContact C-N 3.34Å; M47-A49 PolarHBondContact O-N 3.34Å; M47-I50 PolarHBondContact O-N 3.35Å; M47-Q51 WeakPolarHBondContact O-CG 3.32Å; M47-Q51 PolarHBondContact O-N 3.17Å |
| 48 | V | 89.2 | Confident | 80.7 | Confident | 92 Ų | 92 | 62.1 Ų | 62.1 | 56% | 0.558 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -59.3 | -46.6 | 176 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | A44 A45 I50 Q51 C52 | A44-V48 WeakPolarHBondContact O-CG2 3.32Å; A44-V48 PolarHBondContact O-N 2.91Å; A45-V48 PolarHBondContact O-N 2.9Å; V48-I50 PolarHBondContact O-N 3.1Å; V48-Q51 PolarHBondContact O-N 3.5Å; V48-C52 PolarHBondContact O-N 2.92Å; V48-C52 PolarHBondContact O-SG 2.84Å; V48-C52 VanDerWaalsContact O-SG 3.33Å |
| 49 | A | 90.8 | Very high | 83.2 | Confident | 48 Ų | 48 | 65.3 Ų | 65.3 | 40% | 0.397 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -58.6 | -45.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A45 G46 M47 Q51 C52 I53 | A45-A49 WeakPolarHBondContact O-CB 3.46Å; A45-A49 PolarHBondContact O-N 3.21Å; G46-A49 PolarHBondContact O-N 3.07Å; M47-A49 VanDerWaalsContact C-N 3.34Å; M47-A49 PolarHBondContact O-N 3.34Å; A49-Q51 VanDerWaalsContact C-N 3.33Å; A49-Q51 PolarHBondContact O-N 2.67Å; A49-C52 PolarHBondContact O-N 3.45Å; A49-I53 WeakPolarHBondContact O-CD1 3.49Å; A49-I53 VanDerWaalsContact O-CG1 3.23Å; A49-I53 WeakPolarHBondContact O-CG1 3.47Å; A49-I53 PolarHBondContact O-N 3.18Å |
| 50 | I | 90.8 | Very high | 85.2 | Confident | 21 Ų | 21 | 58.2 Ų | 58.2 | 11% | 0.108 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -57.3 | -45.5 | 176.3 | -73.2 | 170 | 0 | 0 | 0 | 111.2 | G46 M47 V48 I53 Y54 T291 H294 I298 | G46-I50 VanDerWaalsContact O-CG1 3.28Å; G46-I50 WeakPolarHBondContact O-CG1 3.49Å; G46-I50 PolarHBondContact O-N 2.88Å; M47-I50 PolarHBondContact O-N 3.35Å; V48-I50 PolarHBondContact O-N 3.1Å; I50-I53 PolarHBondContact O-N 3.06Å; I50-Y54 HydrophobicContact CG2-CD2 3.81Å; I50-Y54 HydrophobicContact CG2-CE2 3.63Å; I50-Y54 WeakPolarHBondContact O-CD2 3.4Å; I50-Y54 PolarHBondContact O-N 3.08Å; I50-T291 HydrophobicContact CD1-CG2 4.3Å; I50-H294 HydrophobicContact CD1-CB 4.27Å; I50-H294 HydrophobicContact CG2-CB 4.29Å; I50-I298 HydrophobicContact CG2-CD1 3.99Å |
| 51 | Q | 93 | Very high | 86.9 | Confident | 47 Ų | 47 | 56.1 Ų | 56.1 | 22% | 0.22 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -67.1 | -40.2 | 179.3 | -63.1 | -52.4 | -39.1 | 0 | 0 | 112.5 | M47 V48 A49 I53 Y54 A55 A104 A108 | M47-Q51 WeakPolarHBondContact O-CG 3.32Å; M47-Q51 PolarHBondContact O-N 3.17Å; V48-Q51 PolarHBondContact O-N 3.5Å; A49-Q51 VanDerWaalsContact C-N 3.33Å; A49-Q51 PolarHBondContact O-N 2.67Å; Q51-I53 VanDerWaalsContact C-N 3.27Å; Q51-I53 PolarHBondContact O-N 3.11Å; Q51-Y54 PolarHBondContact O-N 3.18Å; Q51-A55 PolarHBondContact O-N 3.21Å; Q51-A104 PolarHBondContact NE2-O 2.78Å; Q51-A104 PolarHBondContact OE1-O 3.29Å; Q51-A108 HydrophobicContact CG-CB 4.4Å |
| 52 | C | 94.3 | Very high | 88.6 | Confident | 79 Ų | 79 | 52.6 Ų | 52.6 | 53% | 0.534 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59.7 | -39.6 | 173.1 | -69.1 | 0 | 0 | 0 | 0 | 111.8 | V48 A49 A55 L56 | V48-C52 PolarHBondContact O-N 2.92Å; V48-C52 PolarHBondContact O-SG 2.84Å; V48-C52 VanDerWaalsContact O-SG 3.33Å; A49-C52 PolarHBondContact O-N 3.45Å; C52-A55 PolarHBondContact O-N 3.18Å; C52-L56 WeakPolarHBondContact O-CB 3.31Å; C52-L56 PolarHBondContact O-N 2.91Å |
| 53 | I | 93.8 | Very high | 90.1 | Very high | 78 Ų | 78 | 53.6 Ų | 53.6 | 40% | 0.4 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -69 | -43.2 | 177.9 | -61.7 | 161.1 | 0 | 0 | 0 | 110.9 | A49 I50 Q51 A55 L56 V57 I298 | A49-I53 WeakPolarHBondContact O-CD1 3.49Å; A49-I53 VanDerWaalsContact O-CG1 3.23Å; A49-I53 WeakPolarHBondContact O-CG1 3.47Å; A49-I53 PolarHBondContact O-N 3.18Å; I50-I53 PolarHBondContact O-N 3.06Å; Q51-I53 VanDerWaalsContact C-N 3.27Å; Q51-I53 PolarHBondContact O-N 3.11Å; I53-A55 VanDerWaalsContact C-N 3.32Å; I53-A55 PolarHBondContact O-N 3.47Å; I53-L56 PolarHBondContact O-N 2.85Å; I53-V57 HydrophobicContact CG2-CG2 4.22Å; I53-V57 WeakPolarHBondContact O-CB 3.43Å; I53-V57 WeakPolarHBondContact O-CG2 3.19Å; I53-V57 PolarHBondContact O-N 3.02Å; I53-I298 HydrophobicContact CB-CD1 4.4Å; I53-I298 HydrophobicContact CG2-CD1 4.3Å; I53-I298 HydrophobicContact CG2-CG2 3.42Å; I53-I298 VanDerWaalsContact CG2-CG2 3.42Å |
| 54 | Y | 93.7 | Very high | 91 | Very high | 3 Ų | 3 | 52.1 Ų | 52.1 | 1% | 0.012 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -56.2 | -46.3 | 173.2 | -86.3 | -61.6 | 0 | 0 | 0 | 111.9 | I50 Q51 V57 C58 V100 V103 A104 I298 Y301 | I50-Y54 HydrophobicContact CG2-CD2 3.81Å; I50-Y54 HydrophobicContact CG2-CE2 3.63Å; I50-Y54 WeakPolarHBondContact O-CD2 3.4Å; I50-Y54 PolarHBondContact O-N 3.08Å; Q51-Y54 PolarHBondContact O-N 3.18Å; Y54-V57 PolarHBondContact O-N 2.8Å; Y54-C58 VanDerWaalsContact O-CB 3.23Å; Y54-C58 WeakPolarHBondContact O-CB 3.42Å; Y54-C58 PolarHBondContact O-N 3.2Å; Y54-V100 HydrophobicContact CD1-CG1 3.75Å; Y54-V100 HydrophobicContact CG-CG1 4.48Å; Y54-V103 HydrophobicContact CE1-CG1 4.47Å; Y54-A104 HydrophobicContact CD1-CB 4.35Å; Y54-A104 HydrophobicContact CD2-CB 4.02Å; Y54-A104 HydrophobicContact CG-CB 3.84Å; Y54-I298 HydrophobicContact CD1-CD1 4.35Å; Y54-I298 HydrophobicContact CD1-CG1 3.72Å; Y54-I298 HydrophobicContact CD2-CD1 3.88Å; Y54-I298 HydrophobicContact CD2-CG1 4.12Å; Y54-I298 HydrophobicContact CE1-CD1 4.2Å; Y54-I298 HydrophobicContact CE1-CG1 3.38Å; Y54-I298 HydrophobicContact CE2-CD1 3.7Å; Y54-I298 HydrophobicContact CE2-CG1 3.8Å; Y54-I298 HydrophobicContact CG-CD1 4.2Å; Y54-I298 HydrophobicContact CG-CG1 4.08Å; Y54-I298 VanDerWaalsContact CZ-CG1 3.41Å; Y54-Y301 HydrophobicContact CE1-CD2 4.01Å; Y54-Y301 AromaticContact CE1-CE2 3.98Å; Y54-Y301 HydrophobicContact CE1-CE2 3.98Å |
| 55 | A | 94.9 | Very high | 91.7 | Very high | 63 Ų | 63 | 49.9 Ų | 49.9 | 52% | 0.521 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q51 C52 I53 C58 L59 | Q51-A55 PolarHBondContact O-N 3.21Å; C52-A55 PolarHBondContact O-N 3.18Å; I53-A55 VanDerWaalsContact C-N 3.32Å; I53-A55 PolarHBondContact O-N 3.47Å; A55-C58 PolarHBondContact O-N 3.4Å; A55-L59 WeakPolarHBondContact O-CB 3.36Å; A55-L59 PolarHBondContact O-N 2.87Å |
| 56 | L | 95 | Very high | 92.1 | Very high | 107 Ų | 107 | 49 Ų | 49 | 56% | 0.56 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -62.2 | -49.1 | 177.5 | 178 | 63.7 | 0 | 0 | 0 | 111.7 | C52 I53 C58 L59 V60 | C52-L56 WeakPolarHBondContact O-CB 3.31Å; C52-L56 PolarHBondContact O-N 2.91Å; I53-L56 PolarHBondContact O-N 2.85Å; L56-C58 VanDerWaalsContact C-N 3.35Å; L56-L59 PolarHBondContact O-N 3.33Å; L56-V60 HydrophobicContact CD1-CG2 3.99Å; L56-V60 HydrophobicContact CG-CG2 4.47Å; L56-V60 WeakPolarHBondContact O-CB 3.21Å; L56-V60 VanDerWaalsContact O-CG2 3.28Å; L56-V60 WeakPolarHBondContact O-CG2 3.17Å; L56-V60 PolarHBondContact O-N 3.25Å |
| 57 | V | 94 | Very high | 92.2 | Very high | 14 Ų | 14 | 49.7 Ų | 49.7 | 9% | 0.085 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 179.1 | 170.6 | 0 | 0 | 0 | 0 | 110.5 | I53 Y54 L59 G61 M97 I298 C305 | I53-V57 HydrophobicContact CG2-CG2 4.22Å; I53-V57 WeakPolarHBondContact O-CB 3.43Å; I53-V57 WeakPolarHBondContact O-CG2 3.19Å; I53-V57 PolarHBondContact O-N 3.02Å; Y54-V57 PolarHBondContact O-N 2.8Å; V57-L59 PolarHBondContact O-N 3.1Å; V57-G61 PolarHBondContact O-N 2.82Å; V57-M97 HydrophobicContact CG1-CE 4.09Å; V57-M97 HydrophobicContact CG1-SD 4.35Å; V57-I298 HydrophobicContact CG2-CG2 4.36Å; V57-C305 PolarHBondContact O-SG 3.18Å |
| 58 | C | 95.3 | Very high | 92.4 | Very high | 15 Ų | 15 | 46.7 Ų | 46.7 | 10% | 0.101 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.7 | -49.8 | 176.2 | -175.1 | 0 | 0 | 0 | 0 | 111.8 | Y54 A55 L56 G61 L62 V100 | Y54-C58 VanDerWaalsContact O-CB 3.23Å; Y54-C58 WeakPolarHBondContact O-CB 3.42Å; Y54-C58 PolarHBondContact O-N 3.2Å; A55-C58 PolarHBondContact O-N 3.4Å; L56-C58 VanDerWaalsContact C-N 3.35Å; C58-G61 PolarHBondContact O-N 2.79Å; C58-L62 WeakPolarHBondContact O-CB 3.42Å; C58-L62 VanDerWaalsContact O-CG 3.29Å; C58-L62 WeakPolarHBondContact O-CG 3.26Å; C58-L62 PolarHBondContact O-N 3.37Å; C58-V100 HydrophobicContact CB-CB 4.2Å; C58-V100 HydrophobicContact CB-CG1 3.9Å |
| 59 | L | 94.6 | Very high | 92.4 | Very high | 109 Ų | 109 | 44 Ų | 44 | 57% | 0.571 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -62.3 | -48.7 | -179.2 | -179.8 | 65.9 | 0 | 0 | 0 | 112.1 | A55 L56 V57 G61 V63 | A55-L59 WeakPolarHBondContact O-CB 3.36Å; A55-L59 PolarHBondContact O-N 2.87Å; L56-L59 PolarHBondContact O-N 3.33Å; V57-L59 PolarHBondContact O-N 3.1Å; L59-G61 VanDerWaalsContact C-N 3.31Å; L59-G61 PolarHBondContact O-N 3.38Å; L59-V63 HydrophobicContact CD1-CG2 3.98Å; L59-V63 WeakPolarHBondContact O-CB 3.32Å; L59-V63 VanDerWaalsContact O-CG2 3.27Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 3.04Å |
| 60 | V | 92.6 | Very high | 92.2 | Very high | 65 Ų | 65 | 46.6 Ų | 46.6 | 39% | 0.394 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 179.4 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | L56 G64 C305 | L56-V60 HydrophobicContact CD1-CG2 3.99Å; L56-V60 HydrophobicContact CG-CG2 4.47Å; L56-V60 WeakPolarHBondContact O-CB 3.21Å; L56-V60 VanDerWaalsContact O-CG2 3.28Å; L56-V60 WeakPolarHBondContact O-CG2 3.17Å; L56-V60 PolarHBondContact O-N 3.25Å; V60-G64 WeakPolarHBondContact O-CA 3.23Å; V60-G64 PolarHBondContact O-N 3.31Å; V60-C305 HydrophobicContact CG1-CB 3.9Å |
| 61 | G | 92.9 | Very high | 91.8 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.2 | -53.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V57 C58 L59 G64 N65 C305 | V57-G61 PolarHBondContact O-N 2.82Å; C58-G61 PolarHBondContact O-N 2.79Å; L59-G61 VanDerWaalsContact C-N 3.31Å; L59-G61 PolarHBondContact O-N 3.38Å; G61-G64 PolarHBondContact O-N 3.37Å; G61-N65 VanDerWaalsContact O-CB 3.32Å; G61-N65 WeakPolarHBondContact O-CB 3.37Å; G61-N65 PolarHBondContact O-N 3.08Å; G61-N65 PolarHBondContact O-ND2 3.02Å; G61-C305 PolarHBondContact N-SG 3.11Å |
| 62 | L | 94.1 | Very high | 91.3 | Very high | 44 Ų | 44 | 44.1 Ų | 44.1 | 23% | 0.23 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61 | -51.6 | 179.6 | -68.8 | 172.8 | 0 | 0 | 0 | 111.5 | C58 G64 A66 E94 M97 L98 | C58-L62 WeakPolarHBondContact O-CB 3.42Å; C58-L62 VanDerWaalsContact O-CG 3.29Å; C58-L62 WeakPolarHBondContact O-CG 3.26Å; C58-L62 PolarHBondContact O-N 3.37Å; L62-G64 VanDerWaalsContact C-N 3.34Å; L62-G64 PolarHBondContact O-N 3.1Å; L62-A66 WeakPolarHBondContact O-CB 3.42Å; L62-A66 PolarHBondContact O-N 3.1Å; L62-E94 HydrophobicContact CD2-CG 4.47Å; L62-E94 VanDerWaalsContact CD2-OE1 3.32Å; L62-E94 WeakPolarHBondContact CD2-OE1 3.23Å; L62-M97 HydrophobicContact CD2-CB 3.56Å; L62-M97 HydrophobicContact CG-CB 3.86Å; L62-L98 HydrophobicContact CD2-CD2 3.94Å; L62-L98 HydrophobicContact CD2-CG 4.2Å |
| 63 | V | 92.1 | Very high | 90.8 | Very high | 88 Ų | 88 | 45.9 Ų | 45.9 | 53% | 0.533 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -63.5 | -43 | -178.2 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | L59 L67 | L59-V63 HydrophobicContact CD1-CG2 3.98Å; L59-V63 WeakPolarHBondContact O-CB 3.32Å; L59-V63 VanDerWaalsContact O-CG2 3.27Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 3.04Å; V63-L67 VanDerWaalsContact O-CB 3.23Å; V63-L67 WeakPolarHBondContact O-CB 3.49Å; V63-L67 PolarHBondContact O-N 2.85Å; V63-L67 VanDerWaalsContact O-N 3.1Å |
| 64 | G | 89.9 | Confident | 90.1 | Very high | 14 Ų | 14 | 49.4 Ų | 49.4 | 14% | 0.144 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.8 | -49.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V60 G61 L62 L67 V68 | V60-G64 WeakPolarHBondContact O-CA 3.23Å; V60-G64 PolarHBondContact O-N 3.31Å; G61-G64 PolarHBondContact O-N 3.37Å; L62-G64 VanDerWaalsContact C-N 3.34Å; L62-G64 PolarHBondContact O-N 3.1Å; G64-L67 PolarHBondContact O-N 3.37Å; G64-V68 WeakPolarHBondContact O-CG2 3.43Å; G64-V68 PolarHBondContact O-N 3.43Å; G64-V68 VanDerWaalsContact O-N 3.08Å |
| 65 | N | 92.3 | Very high | 89.2 | Confident | 2 Ų | 2 | 50.7 Ų | 50.7 | 1% | 0.011 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -73.1 | -39.9 | -177.3 | -71.6 | -59.7 | 0 | 0 | 0 | 111.9 | G61 L67 V68 I69 A90 E94 S304 P308 | G61-N65 VanDerWaalsContact O-CB 3.32Å; G61-N65 WeakPolarHBondContact O-CB 3.37Å; G61-N65 PolarHBondContact O-N 3.08Å; G61-N65 PolarHBondContact O-ND2 3.02Å; N65-L67 VanDerWaalsContact C-N 3.26Å; N65-L67 PolarHBondContact O-N 3.27Å; N65-V68 WeakPolarHBondContact O-CB 3.41Å; N65-V68 PolarHBondContact O-N 2.97Å; N65-V68 VanDerWaalsContact O-N 3.1Å; N65-I69 WeakPolarHBondContact O-CG1 3.33Å; N65-I69 PolarHBondContact O-N 2.92Å; N65-A90 HydrophobicContact CB-CB 4.45Å; N65-E94 VanDerWaalsContact CB-OE2 3.3Å; N65-E94 WeakPolarHBondContact CB-OE2 3.49Å; N65-S304 PolarHBondContact ND2-O 3.42Å; N65-S304 PolarHBondContact ND2-OG 3.3Å; N65-S304 VanDerWaalsContact ND2-OG 3.13Å; N65-P308 WeakPolarHBondContact OD1-CG 3.47Å |
| 66 | A | 91.9 | Very high | 87.2 | Confident | 42 Ų | 42 | 51.2 Ų | 51.2 | 35% | 0.347 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -56.7 | -40.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L62 I69 F70 E94 | L62-A66 WeakPolarHBondContact O-CB 3.42Å; L62-A66 PolarHBondContact O-N 3.1Å; A66-I69 PolarHBondContact O-N 3.45Å; A66-F70 WeakPolarHBondContact O-CB 3.4Å; A66-F70 PolarHBondContact O-N 2.74Å; A66-E94 PolarHBondContact N-OE2 3.2Å |
| 67 | L | 87.8 | Confident | 85.5 | Confident | 48 Ų | 48 | 55.4 Ų | 55.4 | 25% | 0.251 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67 | -38.6 | 176.5 | -177.1 | 54.8 | 0 | 0 | 0 | 112.3 | V63 G64 N65 F70 V71 F322 | V63-L67 VanDerWaalsContact O-CB 3.23Å; V63-L67 WeakPolarHBondContact O-CB 3.49Å; V63-L67 PolarHBondContact O-N 2.85Å; V63-L67 VanDerWaalsContact O-N 3.1Å; G64-L67 PolarHBondContact O-N 3.37Å; N65-L67 VanDerWaalsContact C-N 3.26Å; N65-L67 PolarHBondContact O-N 3.27Å; L67-F70 HydrophobicContact CD1-CD1 4.39Å; L67-F70 PolarHBondContact O-N 3.02Å; L67-V71 HydrophobicContact CD1-CG2 4.05Å; L67-V71 WeakPolarHBondContact O-CB 3.23Å; L67-V71 VanDerWaalsContact O-CG2 3.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.33Å; L67-V71 PolarHBondContact O-N 3.4Å; L67-F322 HydrophobicContact CB-CE1 4.42Å; L67-F322 HydrophobicContact CB-CZ 4.39Å; L67-F322 HydrophobicContact CD1-CE1 4.49Å; L67-F322 HydrophobicContact CD2-CD1 3.61Å; L67-F322 HydrophobicContact CD2-CE1 3.1Å; L67-F322 HydrophobicContact CD2-CZ 3.83Å; L67-F322 HydrophobicContact CG-CD1 4.09Å; L67-F322 HydrophobicContact CG-CE1 3.44Å; L67-F322 VanDerWaalsContact CG-CE1 3.44Å; L67-F322 HydrophobicContact CG-CE2 4.44Å; L67-F322 HydrophobicContact CG-CZ 3.62Å |
| 68 | V | 86.9 | Confident | 84 | Confident | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.006 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.8 | -47.8 | 172.7 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | G64 N65 V71 I72 A90 P308 F322 | G64-V68 WeakPolarHBondContact O-CG2 3.43Å; G64-V68 PolarHBondContact O-N 3.43Å; G64-V68 VanDerWaalsContact O-N 3.08Å; N65-V68 WeakPolarHBondContact O-CB 3.41Å; N65-V68 PolarHBondContact O-N 2.97Å; N65-V68 VanDerWaalsContact O-N 3.1Å; V68-V71 PolarHBondContact O-N 3.39Å; V68-I72 HydrophobicContact CG1-CD1 3.69Å; V68-I72 HydrophobicContact CG1-CG1 4.5Å; V68-I72 VanDerWaalsContact O-CG1 3.29Å; V68-I72 WeakPolarHBondContact O-CG1 3.27Å; V68-I72 PolarHBondContact O-N 3.46Å; V68-A90 HydrophobicContact CB-CB 4.12Å; V68-A90 HydrophobicContact CG1-CB 3.77Å; V68-P308 HydrophobicContact CG2-CB 3.95Å; V68-P308 HydrophobicContact CG2-CG 4.11Å; V68-F322 HydrophobicContact CG2-CZ 4.36Å |
| 69 | I | 89.6 | Confident | 82.7 | Confident | 35 Ų | 35 | 62.7 Ų | 62.7 | 18% | 0.179 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -57.5 | -52.5 | 176.6 | -66.4 | 167.1 | 0 | 0 | 0 | 109.8 | N65 A66 V71 I72 L73 L87 A90 V91 E94 | N65-I69 WeakPolarHBondContact O-CG1 3.33Å; N65-I69 PolarHBondContact O-N 2.92Å; A66-I69 PolarHBondContact O-N 3.45Å; I69-V71 PolarHBondContact O-N 3.34Å; I69-I72 PolarHBondContact O-N 3.3Å; I69-L73 HydrophobicContact CG2-CD1 3.67Å; I69-L73 HydrophobicContact CG2-CG 4.29Å; I69-L73 WeakPolarHBondContact O-CB 3.35Å; I69-L73 VanDerWaalsContact O-CG 3.29Å; I69-L73 WeakPolarHBondContact O-CG 3.47Å; I69-L73 PolarHBondContact O-N 3.08Å; I69-L87 HydrophobicContact CB-CD1 4.27Å; I69-L87 HydrophobicContact CG1-CD1 4.09Å; I69-L87 HydrophobicContact CG2-CD1 4.08Å; I69-A90 HydrophobicContact CD1-CB 4.34Å; I69-A90 HydrophobicContact CG1-CB 3.77Å; I69-V91 HydrophobicContact CD1-CG2 4.04Å; I69-V91 HydrophobicContact CG1-CG2 4.33Å; I69-E94 HydrophobicContact CD1-CB 4.45Å |
| 70 | F | 87.1 | Confident | 82 | Confident | 103 Ų | 103 | 60.4 Ų | 60.4 | 45% | 0.452 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -56 | -49.4 | 179.9 | 175.6 | -100.6 | 0 | 0 | 0 | 112.3 | A66 L67 I72 L73 R74 V325 | A66-F70 WeakPolarHBondContact O-CB 3.4Å; A66-F70 PolarHBondContact O-N 2.74Å; L67-F70 HydrophobicContact CD1-CD1 4.39Å; L67-F70 PolarHBondContact O-N 3.02Å; F70-I72 PolarHBondContact O-N 3.3Å; F70-L73 PolarHBondContact O-N 2.81Å; F70-R74 HydrophobicContact CZ-CB 4.5Å; F70-R74 HydrophobicContact CZ-CG 4.39Å; F70-R74 WeakPolarHBondContact O-CB 3.29Å; F70-R74 PolarHBondContact O-N 3.03Å; F70-V325 HydrophobicContact CE1-CG1 4.05Å; F70-V325 HydrophobicContact CE1-CG2 3.98Å |
| 71 | V | 81.6 | Confident | 81.5 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.4 | -44 | -179.6 | 166.6 | 0 | 0 | 0 | 0 | 111.1 | L67 V68 I69 Y75 M78 F318 F322 V325 | L67-V71 HydrophobicContact CD1-CG2 4.05Å; L67-V71 WeakPolarHBondContact O-CB 3.23Å; L67-V71 VanDerWaalsContact O-CG2 3.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.33Å; L67-V71 PolarHBondContact O-N 3.4Å; V68-V71 PolarHBondContact O-N 3.39Å; I69-V71 PolarHBondContact O-N 3.34Å; V71-Y75 HydrophobicContact CG1-CD2 3.96Å; V71-Y75 HydrophobicContact CG1-CE2 4.29Å; V71-Y75 WeakPolarHBondContact O-CD2 3.46Å; V71-Y75 PolarHBondContact O-N 3.47Å; V71-M78 HydrophobicContact CG1-CE 3.84Å; V71-F318 HydrophobicContact CG1-CD1 4.1Å; V71-F318 HydrophobicContact CG1-CE1 4.26Å; V71-F322 HydrophobicContact CB-CE2 4.46Å; V71-F322 HydrophobicContact CG1-CD2 4.47Å; V71-F322 HydrophobicContact CG2-CD2 4.07Å; V71-F322 HydrophobicContact CG2-CE2 4.05Å; V71-V325 HydrophobicContact CG2-CG2 4.35Å |
| 72 | I | 82.2 | Confident | 80.9 | Confident | 16 Ų | 16 | 58.3 Ų | 58.3 | 8% | 0.082 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.7 | -42 | -179.4 | -66 | 169 | 0 | 0 | 0 | 111.2 | V68 I69 F70 M78 N83 L86 L87 F318 | V68-I72 HydrophobicContact CG1-CD1 3.69Å; V68-I72 HydrophobicContact CG1-CG1 4.5Å; V68-I72 VanDerWaalsContact O-CG1 3.29Å; V68-I72 WeakPolarHBondContact O-CG1 3.27Å; V68-I72 PolarHBondContact O-N 3.46Å; I69-I72 PolarHBondContact O-N 3.3Å; F70-I72 PolarHBondContact O-N 3.3Å; I72-M78 HydrophobicContact CB-CE 4.46Å; I72-M78 HydrophobicContact CG1-CE 3.91Å; I72-N83 HydrophobicContact CG2-CB 4.41Å; I72-L86 HydrophobicContact CD1-CB 3.93Å; I72-L87 HydrophobicContact CD1-CB 4.11Å; I72-L87 HydrophobicContact CG2-CB 4.23Å; I72-L87 HydrophobicContact CG2-CD1 4.49Å; I72-L87 HydrophobicContact CG2-CD2 4.44Å; I72-F318 HydrophobicContact CD1-CE1 4.08Å; I72-F318 HydrophobicContact CD1-CZ 3.91Å; I72-F318 HydrophobicContact CG1-CE1 3.74Å; I72-F318 HydrophobicContact CG1-CZ 3.75Å |
| 73 | L | 83.8 | Confident | 80.3 | Confident | 116 Ų | 116 | 57 Ų | 57 | 61% | 0.607 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -71.7 | -40.2 | -179.2 | -66.1 | 179.8 | 0 | 0 | 0 | 112.4 | I69 F70 L87 | I69-L73 HydrophobicContact CG2-CD1 3.67Å; I69-L73 HydrophobicContact CG2-CG 4.29Å; I69-L73 WeakPolarHBondContact O-CB 3.35Å; I69-L73 VanDerWaalsContact O-CG 3.29Å; I69-L73 WeakPolarHBondContact O-CG 3.47Å; I69-L73 PolarHBondContact O-N 3.08Å; F70-L73 PolarHBondContact O-N 2.81Å; L73-L87 HydrophobicContact CD2-CD1 4.47Å; L73-L87 HydrophobicContact CD2-CD2 4.07Å; L73-L87 HydrophobicContact CG-CD1 4.45Å |
| 74 | R | 80.1 | Confident | 80.1 | Confident | 152 Ų | 152 | 54 Ų | 54 | 57% | 0.574 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -69.9 | -36.9 | -177.9 | -176.3 | 60 | 175.2 | 155 | -1 | 112.7 | F70 A76 | F70-R74 HydrophobicContact CZ-CB 4.5Å; F70-R74 HydrophobicContact CZ-CG 4.39Å; F70-R74 WeakPolarHBondContact O-CB 3.29Å; F70-R74 PolarHBondContact O-N 3.03Å; R74-A76 PolarHBondContact O-N 2.94Å |
| 75 | Y | 73.6 | Confident | 79.9 | Confident | 30 Ų | 30 | 53.6 Ų | 53.6 | 12% | 0.118 | 27% | 0.268 | C | S | . | . | trans | -94.6 | 86.1 | -177.7 | -66.7 | -68.4 | 0 | 0 | 0 | 111.5 | V71 K77 M78 V325 | V71-Y75 HydrophobicContact CG1-CD2 3.96Å; V71-Y75 HydrophobicContact CG1-CE2 4.29Å; V71-Y75 WeakPolarHBondContact O-CD2 3.46Å; V71-Y75 PolarHBondContact O-N 3.47Å; Y75-K77 PolarHBondContact O-N 3.21Å; Y75-M78 VanDerWaalsContact O-CB 3.23Å; Y75-M78 WeakPolarHBondContact O-CB 3.07Å; Y75-M78 PolarHBondContact O-N 2.93Å; Y75-V325 HydrophobicContact CE2-CG2 4.29Å | ||
| 76 | A | 54.2 | Low | 79.6 | Confident | 74 Ų | 74 | 53.9 Ų | 53.9 | 61% | 0.612 | 27% | 0.27 | S | S | * | . | G | 310 helix | trans | -53.9 | -19.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | R74 M78 | R74-A76 PolarHBondContact O-N 2.94Å; A76-M78 PolarHBondContact O-N 3.38Å |
| 77 | K | 58.4 | Low | 79.4 | Confident | 196 Ų | 196 | 53.8 Ų | 53.8 | 85% | 0.852 | 26% | 0.263 | S | S | * | . | G | 310 helix | trans | -72.9 | -6.4 | 173.1 | -67.8 | -173.5 | 179.6 | -179.9 | 0 | 113.7 | Y75 | Y75-K77 PolarHBondContact O-N 3.21Š|
| 78 | M | 63.8 | Low | 79.5 | Confident | 19 Ų | 19 | 53 Ų | 53 | 9% | 0.094 | 26% | 0.259 | C | S | . | . | G | 310 helix | trans | -92.5 | 19.9 | -177.7 | -68.1 | -124.8 | -65.2 | 0 | 0 | 113.9 | V71 I72 Y75 A76 T80 N83 F318 | V71-M78 HydrophobicContact CG1-CE 3.84Å; I72-M78 HydrophobicContact CB-CE 4.46Å; I72-M78 HydrophobicContact CG1-CE 3.91Å; Y75-M78 VanDerWaalsContact O-CB 3.23Å; Y75-M78 WeakPolarHBondContact O-CB 3.07Å; Y75-M78 PolarHBondContact O-N 2.93Å; A76-M78 PolarHBondContact O-N 3.38Å; M78-T80 PolarHBondContact O-N 2.87Å; M78-N83 WeakPolarHBondContact CA-ND2 3.29Å; M78-N83 VanDerWaalsContact CB-ND2 3.32Å; M78-N83 WeakPolarHBondContact CB-ND2 3.42Å; M78-N83 WeakPolarHBondContact O-CB 3.28Å; M78-N83 PolarHBondContact O-ND2 3.18Å; M78-F318 HydrophobicContact CE-CD1 4.34Å; M78-F318 HydrophobicContact CE-CE1 3.83Å; M78-F318 HydrophobicContact CE-CE2 4.27Å; M78-F318 HydrophobicContact CE-CZ 3.79Å |
| 79 | K | 67.1 | Low | 79.6 | Confident | 163 Ų | 163 | 53.1 Ų | 53.1 | 71% | 0.709 | 26% | 0.26 | S | S | * | . | trans | -75.6 | 48.1 | 177 | -64.4 | -176.3 | -177.6 | 179.1 | 0 | 113.8 | P160 | K79-P160 WeakPolarHBondContact O-CG 3.27Š| ||
| 80 | T | 80.4 | Confident | 79.7 | Confident | 61 Ų | 61 | 51.6 Ų | 51.6 | 37% | 0.374 | 25% | 0.252 | S | S | . | . | trans | -88.5 | 153.1 | 173.7 | 70.9 | 0 | 0 | 0 | 0 | 110.2 | M78 T82 N83 I84 | M78-T80 PolarHBondContact O-N 2.87Å; T80-T82 PolarHBondContact O-N 3.22Å; T80-N83 PolarHBondContact O-N 2.92Å; T80-N83 PolarHBondContact OG1-N 3.15Å; T80-N83 PolarHBondContact OG1-ND2 3.3Å; T80-N83 VanDerWaalsContact OG1-ND2 3.08Å; T80-I84 PolarHBondContact O-N 3.48Å; T80-I84 VanDerWaalsContact O-N 3.16Å | ||
| 81 | A | 81.2 | Confident | 79.9 | Confident | 3 Ų | 3 | 49.4 Ų | 49.4 | 3% | 0.025 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -50.2 | -42.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | N83 I84 Y85 R158 A163 | A81-N83 PolarHBondContact O-N 3.09Å; A81-I84 WeakPolarHBondContact O-CB 3.24Å; A81-I84 PolarHBondContact O-N 3.02Å; A81-Y85 HydrophobicContact CB-CE2 4.39Å; A81-Y85 WeakPolarHBondContact O-CD2 3.29Å; A81-Y85 PolarHBondContact O-N 3.39Å; A81-R158 HydrophobicContact CB-CB 4.28Å; A81-R158 VanDerWaalsContact CB-O 3.25Å; A81-R158 WeakPolarHBondContact CB-O 3.3Å; A81-A163 HydrophobicContact CB-CB 3.62Å |
| 82 | T | 80.6 | Confident | 80.5 | Confident | 17 Ų | 17 | 49.5 Ų | 49.5 | 10% | 0.104 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59 | -46.6 | 177.3 | -52.2 | 0 | 0 | 0 | 0 | 112.6 | T80 I84 Y85 L86 L140 D143 R144 R158 | T80-T82 PolarHBondContact O-N 3.22Å; T82-I84 PolarHBondContact O-N 2.91Å; T82-Y85 WeakPolarHBondContact O-CB 3.27Å; T82-Y85 PolarHBondContact O-N 3.31Å; T82-Y85 VanDerWaalsContact O-N 3.13Å; T82-L86 HydrophobicContact CG2-CD1 4.41Å; T82-L86 WeakPolarHBondContact O-CG 3.43Å; T82-L86 PolarHBondContact O-N 3.25Å; T82-L140 HydrophobicContact CG2-CD1 3.85Å; T82-D143 PolarHBondContact OG1-OD2 3.03Å; T82-R144 VanDerWaalsContact CG2-NH2 3.31Å; T82-R144 PolarHBondContact OG1-NH2 2.97Å; T82-R158 PolarHBondContact OG1-NH2 2.96Å |
| 83 | N | 82.8 | Confident | 81 | Confident | 16 Ų | 16 | 48.8 Ų | 48.8 | 9% | 0.086 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -69.4 | -24.5 | -179.2 | -64.3 | -19.7 | 0 | 0 | 0 | 112.4 | I72 M78 T80 A81 L87 | I72-N83 HydrophobicContact CG2-CB 4.41Å; M78-N83 WeakPolarHBondContact CA-ND2 3.29Å; M78-N83 VanDerWaalsContact CB-ND2 3.32Å; M78-N83 WeakPolarHBondContact CB-ND2 3.42Å; M78-N83 WeakPolarHBondContact O-CB 3.28Å; M78-N83 PolarHBondContact O-ND2 3.18Å; T80-N83 PolarHBondContact O-N 2.92Å; T80-N83 PolarHBondContact OG1-N 3.15Å; T80-N83 PolarHBondContact OG1-ND2 3.3Å; T80-N83 VanDerWaalsContact OG1-ND2 3.08Å; A81-N83 PolarHBondContact O-N 3.09Å; N83-L87 WeakPolarHBondContact O-CB 3.41Å; N83-L87 PolarHBondContact O-N 3.23Å |
| 84 | I | 87.3 | Confident | 81.5 | Confident | 27 Ų | 27 | 45.2 Ų | 45.2 | 14% | 0.138 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.2 | -45.4 | 170.4 | -62.4 | 171.6 | 0 | 0 | 0 | 109.9 | T80 A81 T82 L86 L87 N88 P160 A163 K164 N167 | T80-I84 PolarHBondContact O-N 3.48Å; T80-I84 VanDerWaalsContact O-N 3.16Å; A81-I84 WeakPolarHBondContact O-CB 3.24Å; A81-I84 PolarHBondContact O-N 3.02Å; T82-I84 PolarHBondContact O-N 2.91Å; I84-L86 VanDerWaalsContact C-N 3.35Å; I84-L86 PolarHBondContact O-N 3.43Å; I84-L87 PolarHBondContact O-N 2.84Å; I84-N88 PolarHBondContact O-N 2.93Å; I84-N88 PolarHBondContact O-ND2 3.48Å; I84-P160 HydrophobicContact CD1-CB 3.86Å; I84-A163 HydrophobicContact CB-CB 4.46Å; I84-A163 HydrophobicContact CD1-CB 4.23Å; I84-K164 HydrophobicContact CD1-CG 4.23Å; I84-K164 HydrophobicContact CG2-CG 4.45Å; I84-N167 WeakPolarHBondContact CG2-ND2 3.44Å |
| 85 | Y | 86.4 | Confident | 82.2 | Confident | 4 Ų | 4 | 41.7 Ų | 41.7 | 2% | 0.016 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.7 | -42.5 | 174.7 | -60.3 | -59.5 | 0 | 0 | 0 | 112 | A81 T82 L87 N88 L89 V139 A163 I166 N167 | A81-Y85 HydrophobicContact CB-CE2 4.39Å; A81-Y85 WeakPolarHBondContact O-CD2 3.29Å; A81-Y85 PolarHBondContact O-N 3.39Å; T82-Y85 WeakPolarHBondContact O-CB 3.27Å; T82-Y85 PolarHBondContact O-N 3.31Å; T82-Y85 VanDerWaalsContact O-N 3.13Å; Y85-L87 VanDerWaalsContact C-N 3.34Å; Y85-L87 PolarHBondContact O-N 2.94Å; Y85-N88 PolarHBondContact O-N 2.88Å; Y85-L89 WeakPolarHBondContact O-CB 3.47Å; Y85-L89 PolarHBondContact O-N 2.97Å; Y85-V139 HydrophobicContact CD1-CG1 3.84Å; Y85-V139 HydrophobicContact CD2-CG1 4.49Å; Y85-V139 HydrophobicContact CE1-CG1 3.34Å; Y85-V139 HydrophobicContact CE2-CG1 4.06Å; Y85-V139 HydrophobicContact CG-CG1 4.41Å; Y85-V139 VanDerWaalsContact CZ-CG1 3.45Å; Y85-A163 HydrophobicContact CE1-CB 4.37Å; Y85-A163 HydrophobicContact CE2-CB 4.09Å; Y85-A163 WeakPolarHBondContact OH-CA 3.48Å; Y85-I166 HydrophobicContact CE1-CB 4.24Å; Y85-I166 HydrophobicContact CE1-CG2 3.97Å; Y85-I166 VanDerWaalsContact OH-CD1 3.27Å; Y85-I166 WeakPolarHBondContact OH-CD1 3.35Å; Y85-N167 WeakPolarHBondContact CD1-ND2 3.5Å; Y85-N167 WeakPolarHBondContact CD1-OD1 3.39Å; Y85-N167 WeakPolarHBondContact CE1-ND2 3.35Å |
| 86 | L | 85.2 | Confident | 83.2 | Confident | 8 Ų | 8 | 40.4 Ų | 40.4 | 4% | 0.042 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.4 | -38.8 | 177.4 | -63.9 | -179.1 | 0 | 0 | 0 | 112.6 | I72 T82 I84 A90 L140 Y311 F318 | I72-L86 HydrophobicContact CD1-CB 3.93Å; T82-L86 HydrophobicContact CG2-CD1 4.41Å; T82-L86 WeakPolarHBondContact O-CG 3.43Å; T82-L86 PolarHBondContact O-N 3.25Å; I84-L86 VanDerWaalsContact C-N 3.35Å; I84-L86 PolarHBondContact O-N 3.43Å; L86-A90 WeakPolarHBondContact O-CB 3.48Å; L86-A90 PolarHBondContact O-N 3.01Å; L86-L140 HydrophobicContact CD2-CD2 4.32Å; L86-Y311 HydrophobicContact CD1-CD1 4.44Å; L86-Y311 HydrophobicContact CD2-CD1 3.83Å; L86-Y311 HydrophobicContact CD2-CD2 3.95Å; L86-Y311 HydrophobicContact CD2-CE1 3.38Å; L86-Y311 HydrophobicContact CD2-CE2 3.5Å; L86-Y311 HydrophobicContact CD2-CG 4.12Å; L86-F318 HydrophobicContact CD1-CE2 3.51Å; L86-F318 HydrophobicContact CD1-CZ 3.61Å |
| 87 | L | 87.6 | Confident | 85.1 | Confident | 40 Ų | 40 | 36.9 Ų | 36.9 | 21% | 0.209 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65.5 | -44.5 | 175.6 | -179.7 | 64.9 | 0 | 0 | 0 | 111.5 | I69 I72 L73 N83 I84 Y85 L89 A90 V91 | I69-L87 HydrophobicContact CB-CD1 4.27Å; I69-L87 HydrophobicContact CG1-CD1 4.09Å; I69-L87 HydrophobicContact CG2-CD1 4.08Å; I72-L87 HydrophobicContact CD1-CB 4.11Å; I72-L87 HydrophobicContact CG2-CB 4.23Å; I72-L87 HydrophobicContact CG2-CD1 4.49Å; I72-L87 HydrophobicContact CG2-CD2 4.44Å; L73-L87 HydrophobicContact CD2-CD1 4.47Å; L73-L87 HydrophobicContact CD2-CD2 4.07Å; L73-L87 HydrophobicContact CG-CD1 4.45Å; N83-L87 WeakPolarHBondContact O-CB 3.41Å; N83-L87 PolarHBondContact O-N 3.23Å; I84-L87 PolarHBondContact O-N 2.84Å; Y85-L87 VanDerWaalsContact C-N 3.34Å; Y85-L87 PolarHBondContact O-N 2.94Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-A90 PolarHBondContact O-N 3.28Å; L87-V91 HydrophobicContact CD1-CG2 4.49Å; L87-V91 VanDerWaalsContact O-CG2 3.32Å; L87-V91 WeakPolarHBondContact O-CG2 3.36Å; L87-V91 PolarHBondContact O-N 2.93Å |
| 88 | N | 89 | Confident | 86.9 | Confident | 32 Ų | 32 | 31.9 Ų | 31.9 | 17% | 0.171 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.6 | -42.9 | 177.8 | -80.7 | -87.2 | 0 | 0 | 0 | 111.5 | I84 Y85 V91 A92 N167 W171 | I84-N88 PolarHBondContact O-N 2.93Å; I84-N88 PolarHBondContact O-ND2 3.48Å; Y85-N88 PolarHBondContact O-N 2.88Å; N88-V91 PolarHBondContact O-N 3.35Å; N88-A92 PolarHBondContact O-N 3.46Å; N88-N167 VanDerWaalsContact CB-OD1 3.3Å; N88-N167 WeakPolarHBondContact CB-OD1 3.39Å; N88-N167 VanDerWaalsContact CG-OD1 3.24Å; N88-N167 VanDerWaalsContact ND2-CG 3.29Å; N88-N167 PolarHBondContact ND2-OD1 2.87Å; N88-W171 PolarHBondContact OD1-NE1 2.72Å |
| 89 | L | 89 | Confident | 88.4 | Confident | 4 Ų | 4 | 31.2 Ų | 31.2 | 2% | 0.021 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.9 | -48.7 | 175.4 | -177.2 | 62.8 | 0 | 0 | 0 | 111.3 | Y85 L87 V91 A92 D93 S133 C136 L137 Y311 | Y85-L89 WeakPolarHBondContact O-CB 3.47Å; Y85-L89 PolarHBondContact O-N 2.97Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L89-V91 VanDerWaalsContact C-N 3.31Å; L89-V91 PolarHBondContact O-N 2.93Å; L89-A92 PolarHBondContact O-N 3.34Å; L89-D93 WeakPolarHBondContact O-CB 2.9Å; L89-D93 PolarHBondContact O-N 3.49Å; L89-S133 WeakPolarHBondContact CD1-OG 3.27Å; L89-C136 HydrophobicContact CD1-CB 4.28Å; L89-L137 HydrophobicContact CD2-CD2 4.31Å; L89-Y311 HydrophobicContact CD2-CE2 4.19Å; L89-Y311 VanDerWaalsContact CD2-OH 3.27Å; L89-Y311 WeakPolarHBondContact CD2-OH 3.18Å |
| 90 | A | 91.6 | Very high | 89.7 | Confident | 2 Ų | 2 | 23.5 Ų | 23.5 | 2% | 0.017 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.6 | -36.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | N65 V68 I69 L86 L87 E94 | N65-A90 HydrophobicContact CB-CB 4.45Å; V68-A90 HydrophobicContact CB-CB 4.12Å; V68-A90 HydrophobicContact CG1-CB 3.77Å; I69-A90 HydrophobicContact CD1-CB 4.34Å; I69-A90 HydrophobicContact CG1-CB 3.77Å; L86-A90 WeakPolarHBondContact O-CB 3.48Å; L86-A90 PolarHBondContact O-N 3.01Å; L87-A90 PolarHBondContact O-N 3.28Å; A90-E94 WeakPolarHBondContact O-CB 3.36Å; A90-E94 PolarHBondContact O-N 3.19Å |
| 91 | V | 92.2 | Very high | 90.4 | Very high | 57 Ų | 57 | 23.4 Ų | 23.4 | 35% | 0.345 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -66.4 | -43.6 | 174.8 | 169.4 | 0 | 0 | 0 | 0 | 111.4 | I69 L87 N88 L89 E94 L95 | I69-V91 HydrophobicContact CD1-CG2 4.04Å; I69-V91 HydrophobicContact CG1-CG2 4.33Å; L87-V91 HydrophobicContact CD1-CG2 4.49Å; L87-V91 VanDerWaalsContact O-CG2 3.32Å; L87-V91 WeakPolarHBondContact O-CG2 3.36Å; L87-V91 PolarHBondContact O-N 2.93Å; N88-V91 PolarHBondContact O-N 3.35Å; L89-V91 VanDerWaalsContact C-N 3.31Å; L89-V91 PolarHBondContact O-N 2.93Å; V91-E94 PolarHBondContact O-N 3.16Å; V91-L95 WeakPolarHBondContact O-CG 3.39Å; V91-L95 PolarHBondContact O-N 2.84Å |
| 92 | A | 93.6 | Very high | 91.2 | Very high | 3 Ų | 3 | 26.4 Ų | 26.4 | 3% | 0.025 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.2 | -43.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | N88 L89 E94 L95 F96 N129 T132 W171 | N88-A92 PolarHBondContact O-N 3.46Å; L89-A92 PolarHBondContact O-N 3.34Å; A92-E94 VanDerWaalsContact C-N 3.34Å; A92-E94 PolarHBondContact O-N 3.46Å; A92-L95 PolarHBondContact O-N 2.75Å; A92-F96 PolarHBondContact O-N 3.22Å; A92-N129 VanDerWaalsContact CB-OD1 3.27Å; A92-N129 WeakPolarHBondContact CB-OD1 3.34Å; A92-N129 PolarHBondContact O-OD1 2.98Å; A92-T132 HydrophobicContact CB-CG2 3.93Å; A92-W171 HydrophobicContact CB-CH2 4.06Å; A92-W171 HydrophobicContact CB-CZ2 4.32Å |
| 93 | D | 94.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.1 | -34.2 | 177.6 | -80.5 | -22 | 0 | 0 | 0 | 112.8 | L89 F96 M97 N129 S304 N307 | L89-D93 WeakPolarHBondContact O-CB 2.9Å; L89-D93 PolarHBondContact O-N 3.49Å; D93-F96 WeakPolarHBondContact O-CB 3.3Å; D93-F96 PolarHBondContact O-N 3.13Å; D93-M97 VanDerWaalsContact O-CG 3.27Å; D93-M97 WeakPolarHBondContact O-CG 3.08Å; D93-M97 PolarHBondContact O-N 3.21Å; D93-N129 PolarHBondContact N-OD1 2.98Å; D93-N129 PolarHBondContact OD1-ND2 3.44Å; D93-N129 PolarHBondContact OD1-OD1 3.34Å; D93-S304 VanDerWaalsContact CB-OG 3.29Å; D93-S304 WeakPolarHBondContact CB-OG 3.49Å; D93-S304 WeakPolarHBondContact OD1-CB 3.24Å; D93-N307 PolarHBondContact OD2-ND2 2.81Å |
| 94 | E | 94.1 | Very high | 92.4 | Very high | 41 Ų | 41 | 26.4 Ų | 26.4 | 19% | 0.192 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.6 | -47.4 | 174.1 | -165.7 | 73.2 | -171.3 | 0 | 0 | 110.9 | L62 N65 A66 I69 A90 V91 A92 F96 M97 L98 | L62-E94 HydrophobicContact CD2-CG 4.47Å; L62-E94 VanDerWaalsContact CD2-OE1 3.32Å; L62-E94 WeakPolarHBondContact CD2-OE1 3.23Å; N65-E94 VanDerWaalsContact CB-OE2 3.3Å; N65-E94 WeakPolarHBondContact CB-OE2 3.49Å; A66-E94 PolarHBondContact N-OE2 3.2Å; I69-E94 HydrophobicContact CD1-CB 4.45Å; A90-E94 WeakPolarHBondContact O-CB 3.36Å; A90-E94 PolarHBondContact O-N 3.19Å; V91-E94 PolarHBondContact O-N 3.16Å; A92-E94 VanDerWaalsContact C-N 3.34Å; A92-E94 PolarHBondContact O-N 3.46Å; E94-F96 PolarHBondContact O-N 3.06Å; E94-M97 PolarHBondContact O-N 3.01Å; E94-M97 VanDerWaalsContact O-N 3.11Å; E94-L98 WeakPolarHBondContact O-CG 3.37Å; E94-L98 PolarHBondContact O-N 2.79Å |
| 95 | L | 93.7 | Very high | 92.7 | Very high | 78 Ų | 78 | 27.3 Ų | 27.3 | 41% | 0.408 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -59.2 | -39.5 | 176.3 | -67.2 | 173.5 | 0 | 0 | 0 | 111.4 | V91 A92 L98 V125 | V91-L95 WeakPolarHBondContact O-CG 3.39Å; V91-L95 PolarHBondContact O-N 2.84Å; A92-L95 PolarHBondContact O-N 2.75Å; L95-L98 PolarHBondContact O-N 3.05Å; L95-V125 HydrophobicContact CB-CG1 4.04Å; L95-V125 VanDerWaalsContact O-CG1 3.29Å; L95-V125 WeakPolarHBondContact O-CG1 3.4Å |
| 96 | F | 94.4 | Very high | 92.9 | Very high | 3 Ų | 3 | 28.5 Ų | 28.5 | 1% | 0.013 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.2 | -39.3 | 175 | -172.9 | -133.8 | 0 | 0 | 0 | 112.9 | A92 D93 E94 L98 S99 D126 N129 Y301 | A92-F96 PolarHBondContact O-N 3.22Å; D93-F96 WeakPolarHBondContact O-CB 3.3Å; D93-F96 PolarHBondContact O-N 3.13Å; E94-F96 PolarHBondContact O-N 3.06Å; F96-L98 VanDerWaalsContact C-N 3.29Å; F96-L98 PolarHBondContact O-N 3.17Å; F96-S99 PolarHBondContact O-N 3.4Å; F96-S99 PolarHBondContact O-OG 3.11Å; F96-D126 HydrophobicContact CD2-CB 4.22Å; F96-D126 WeakPolarHBondContact CD2-OD1 3.46Å; F96-D126 HydrophobicContact CE2-CB 3.88Å; F96-N129 HydrophobicContact CB-CB 3.66Å; F96-N129 VanDerWaalsContact CB-CG 3.49Å; F96-N129 VanDerWaalsContact CB-ND2 3.33Å; F96-N129 WeakPolarHBondContact CB-ND2 3.47Å; F96-N129 WeakPolarHBondContact CD1-ND2 3.45Å; F96-N129 HydrophobicContact CD2-CB 3.9Å; F96-N129 HydrophobicContact CG-CB 3.82Å; F96-N129 WeakPolarHBondContact CG-ND2 3.37Å; F96-Y301 AromaticContact CD1-CD1 3.83Å; F96-Y301 HydrophobicContact CD1-CD1 3.83Å; F96-Y301 HydrophobicContact CD1-CE1 4.32Å; F96-Y301 HydrophobicContact CD2-CD1 4.1Å; F96-Y301 AromaticContact CD2-CE1 3.74Å; F96-Y301 HydrophobicContact CD2-CE1 3.74Å; F96-Y301 AromaticContact CE1-CD1 3.3Å; F96-Y301 HydrophobicContact CE1-CD1 3.3Å; F96-Y301 AromaticContact CE1-CE1 3.89Å; F96-Y301 HydrophobicContact CE1-CE1 3.89Å; F96-Y301 HydrophobicContact CE1-CG 4.17Å; F96-Y301 AromaticContact CE2-CD1 3.58Å; F96-Y301 HydrophobicContact CE2-CD1 3.58Å; F96-Y301 AromaticContact CE2-CE1 3.19Å; F96-Y301 HydrophobicContact CE2-CE1 3.19Å; F96-Y301 HydrophobicContact CG-CD1 4.22Å; F96-Y301 HydrophobicContact CG-CE1 4.29Å; F96-Y301 AromaticContact CZ-CD1 3.14Å; F96-Y301 HydrophobicContact CZ-CD1 3.14Å; F96-Y301 AromaticContact CZ-CE1 3.28Å; F96-Y301 HydrophobicContact CZ-CE1 3.28Å; F96-Y301 HydrophobicContact CZ-CG 4.07Å |
| 97 | M | 95.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -69.3 | -29.5 | 177.7 | -73.2 | -67.3 | 145.7 | 0 | 0 | 112.7 | V57 L62 D93 E94 S99 V100 P101 Y301 S304 | V57-M97 HydrophobicContact CG1-CE 4.09Å; V57-M97 HydrophobicContact CG1-SD 4.35Å; L62-M97 HydrophobicContact CD2-CB 3.56Å; L62-M97 HydrophobicContact CG-CB 3.86Å; D93-M97 VanDerWaalsContact O-CG 3.27Å; D93-M97 WeakPolarHBondContact O-CG 3.08Å; D93-M97 PolarHBondContact O-N 3.21Å; E94-M97 PolarHBondContact O-N 3.01Å; E94-M97 VanDerWaalsContact O-N 3.11Å; M97-S99 PolarHBondContact O-N 3.13Å; M97-V100 WeakPolarHBondContact O-CB 3.32Å; M97-V100 PolarHBondContact O-N 3.31Å; M97-V100 HydrophobicContact SD-CG2 4.17Å; M97-P101 WeakPolarHBondContact O-CD 3.36Å; M97-Y301 WeakPolarHBondContact CE-O 3.44Å; M97-S304 VanDerWaalsContact CE-OG 3.29Å; M97-S304 WeakPolarHBondContact CE-OG 3.3Å |
| 98 | L | 95.1 | Very high | 93.3 | Very high | 92 Ų | 92 | 28.9 Ų | 28.9 | 48% | 0.482 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -66.9 | -19.1 | 174.3 | -67.8 | 173.3 | 0 | 0 | 0 | 113.5 | L62 E94 L95 F96 P101 F102 | L62-L98 HydrophobicContact CD2-CD2 3.94Å; L62-L98 HydrophobicContact CD2-CG 4.2Å; E94-L98 WeakPolarHBondContact O-CG 3.37Å; E94-L98 PolarHBondContact O-N 2.79Å; L95-L98 PolarHBondContact O-N 3.05Å; F96-L98 VanDerWaalsContact C-N 3.29Å; F96-L98 PolarHBondContact O-N 3.17Å; L98-P101 WeakPolarHBondContact O-CD 3.35Å; L98-F102 WeakPolarHBondContact O-CE2 3.32Å |
| 99 | S | 95.3 | Very high | 93.3 | Very high | 5 Ų | 5 | 32.4 Ų | 32.4 | 4% | 0.035 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -81.1 | -27.1 | 176.7 | 79.3 | 0 | 0 | 0 | 0 | 112.7 | F96 M97 P101 F102 V103 D126 | F96-S99 PolarHBondContact O-N 3.4Å; F96-S99 PolarHBondContact O-OG 3.11Å; M97-S99 PolarHBondContact O-N 3.13Å; S99-P101 VanDerWaalsContact C-CD 3.49Å; S99-F102 WeakPolarHBondContact O-CB 3.45Å; S99-F102 PolarHBondContact O-N 3.27Å; S99-V103 PolarHBondContact O-N 3.21Å; S99-D126 WeakPolarHBondContact CB-OD1 3.47Å; S99-D126 PolarHBondContact OG-OD1 3.03Å |
| 100 | V | 95.3 | Very high | 93.3 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.006 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -53.4 | -44.3 | -174.9 | 177.4 | 0 | 0 | 0 | 0 | 113.5 | Y54 C58 M97 F102 V103 A104 Y301 | Y54-V100 HydrophobicContact CD1-CG1 3.75Å; Y54-V100 HydrophobicContact CG-CG1 4.48Å; C58-V100 HydrophobicContact CB-CB 4.2Å; C58-V100 HydrophobicContact CB-CG1 3.9Å; M97-V100 WeakPolarHBondContact O-CB 3.32Å; M97-V100 PolarHBondContact O-N 3.31Å; M97-V100 HydrophobicContact SD-CG2 4.17Å; V100-F102 VanDerWaalsContact C-N 3.27Å; V100-F102 PolarHBondContact O-N 3.02Å; V100-V103 PolarHBondContact O-N 3.09Å; V100-A104 VanDerWaalsContact O-CB 3.26Å; V100-A104 WeakPolarHBondContact O-CB 3.5Å; V100-A104 PolarHBondContact O-N 3.27Å; V100-Y301 HydrophobicContact CG2-CD1 3.46Å; V100-Y301 VanDerWaalsContact CG2-CD1 3.46Å; V100-Y301 HydrophobicContact CG2-CD2 4.29Å; V100-Y301 HydrophobicContact CG2-CE1 3.62Å; V100-Y301 HydrophobicContact CG2-CE2 4.39Å; V100-Y301 HydrophobicContact CG2-CG 3.86Å |
| 101 | P | 95.8 | Very high | 93.3 | Very high | 58 Ų | 58 | 44.2 Ų | 44.2 | 38% | 0.377 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -59.3 | -36 | 178.7 | -25.4 | 35.8 | 0 | 0 | 0 | 113.6 | M97 L98 S99 S105 | M97-P101 WeakPolarHBondContact O-CD 3.36Å; L98-P101 WeakPolarHBondContact O-CD 3.35Å; S99-P101 VanDerWaalsContact C-CD 3.49Å; P101-S105 VanDerWaalsContact O-CB 3.27Å; P101-S105 WeakPolarHBondContact O-CB 3.43Å; P101-S105 PolarHBondContact O-N 3.47Å; P101-S105 PolarHBondContact O-OG 2.89Å |
| 102 | F | 96 | Very high | 93.4 | Very high | 66 Ų | 66 | 42 Ų | 42 | 29% | 0.289 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -71 | -41.8 | 178.4 | -58.7 | -74.3 | 0 | 0 | 0 | 111.2 | L98 S99 V100 S105 S106 W112 F114 L118 V122 | L98-F102 WeakPolarHBondContact O-CE2 3.32Å; S99-F102 WeakPolarHBondContact O-CB 3.45Å; S99-F102 PolarHBondContact O-N 3.27Å; V100-F102 VanDerWaalsContact C-N 3.27Å; V100-F102 PolarHBondContact O-N 3.02Å; F102-S105 PolarHBondContact O-N 3.36Å; F102-S106 WeakPolarHBondContact O-CB 3.41Å; F102-S106 PolarHBondContact O-N 3.31Å; F102-W112 HydrophobicContact CB-CH2 3.9Å; F102-W112 HydrophobicContact CB-CZ3 4.32Å; F102-F114 HydrophobicContact CB-CD2 4.36Å; F102-F114 HydrophobicContact CB-CE2 4.11Å; F102-F114 AromaticContact CD1-CD1 3.93Å; F102-F114 HydrophobicContact CD1-CD1 3.93Å; F102-F114 HydrophobicContact CD1-CD2 4.04Å; F102-F114 AromaticContact CD1-CE1 3.84Å; F102-F114 HydrophobicContact CD1-CE1 3.84Å; F102-F114 AromaticContact CD1-CE2 3.95Å; F102-F114 HydrophobicContact CD1-CE2 3.95Å; F102-F114 HydrophobicContact CD1-CG 4.03Å; F102-F114 AromaticContact CD1-CZ 3.85Å; F102-F114 HydrophobicContact CD1-CZ 3.85Å; F102-F114 HydrophobicContact CE1-CD1 4.25Å; F102-F114 HydrophobicContact CE1-CE1 4.24Å; F102-L118 HydrophobicContact CD1-CD2 3.38Å; F102-L118 HydrophobicContact CD1-CG 4.37Å; F102-L118 HydrophobicContact CE1-CD2 3.3Å; F102-L118 HydrophobicContact CE1-CG 4.46Å; F102-L118 HydrophobicContact CE2-CD2 4.48Å; F102-L118 HydrophobicContact CG-CD2 4.04Å; F102-L118 HydrophobicContact CZ-CD2 3.88Å; F102-V122 HydrophobicContact CB-CG2 4.06Å; F102-V122 HydrophobicContact CD2-CG2 4.04Å; F102-V122 HydrophobicContact CG-CG2 4.21Å |
| 103 | V | 94.3 | Very high | 93.4 | Very high | 23 Ų | 23 | 44.9 Ų | 44.9 | 14% | 0.139 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66 | -45.2 | 176.7 | 176.1 | 0 | 0 | 0 | 0 | 111.2 | Y54 S99 V100 S106 A107 V122 L297 Y301 | Y54-V103 HydrophobicContact CE1-CG1 4.47Å; S99-V103 PolarHBondContact O-N 3.21Å; V100-V103 PolarHBondContact O-N 3.09Å; V103-S106 PolarHBondContact O-N 3.33Å; V103-A107 WeakPolarHBondContact O-CB 3.43Å; V103-A107 PolarHBondContact O-N 2.96Å; V103-V122 HydrophobicContact CG2-CG1 3.73Å; V103-L297 HydrophobicContact CG1-CD2 3.88Å; V103-Y301 HydrophobicContact CG1-CE2 4.42Å; V103-Y301 WeakPolarHBondContact CG2-OH 3.35Å |
| 104 | A | 94.4 | Very high | 93.5 | Very high | 10 Ų | 10 | 48.1 Ų | 48.1 | 8% | 0.083 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.3 | -46.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q51 Y54 V100 S106 A107 A108 | Q51-A104 PolarHBondContact NE2-O 2.78Å; Q51-A104 PolarHBondContact OE1-O 3.29Å; Y54-A104 HydrophobicContact CD1-CB 4.35Å; Y54-A104 HydrophobicContact CD2-CB 4.02Å; Y54-A104 HydrophobicContact CG-CB 3.84Å; V100-A104 VanDerWaalsContact O-CB 3.26Å; V100-A104 WeakPolarHBondContact O-CB 3.5Å; V100-A104 PolarHBondContact O-N 3.27Å; A104-S106 PolarHBondContact O-N 3.45Å; A104-A107 WeakPolarHBondContact O-CB 3.31Å; A104-A107 PolarHBondContact O-N 2.92Å; A104-A108 PolarHBondContact O-N 3.4Å |
| 105 | S | 93.9 | Very high | 93.6 | Very high | 47 Ų | 47 | 47.9 Ų | 47.9 | 33% | 0.329 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 175.6 | -60 | 0 | 0 | 0 | 0 | 111.7 | P101 F102 A107 A108 L109 | P101-S105 VanDerWaalsContact O-CB 3.27Å; P101-S105 WeakPolarHBondContact O-CB 3.43Å; P101-S105 PolarHBondContact O-N 3.47Å; P101-S105 PolarHBondContact O-OG 2.89Å; F102-S105 PolarHBondContact O-N 3.36Å; S105-A107 VanDerWaalsContact C-N 3.3Å; S105-A107 PolarHBondContact O-N 2.94Å; S105-A108 PolarHBondContact O-N 3.16Å; S105-L109 WeakPolarHBondContact O-CB 3.09Å; S105-L109 WeakPolarHBondContact O-CG 3.41Å; S105-L109 PolarHBondContact O-N 3.4Å |
| 106 | S | 91.6 | Very high | 93.7 | Very high | 28 Ų | 28 | 45.7 Ų | 45.7 | 20% | 0.196 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.5 | -35.8 | 177.1 | -173.4 | 0 | 0 | 0 | 0 | 112.5 | F102 V103 A104 R110 H111 | F102-S106 WeakPolarHBondContact O-CB 3.41Å; F102-S106 PolarHBondContact O-N 3.31Å; V103-S106 PolarHBondContact O-N 3.33Å; A104-S106 PolarHBondContact O-N 3.45Å; S106-R110 WeakPolarHBondContact O-CA 3.31Å; S106-R110 PolarHBondContact O-N 3.17Å; S106-H111 WeakPolarHBondContact CA-O 3.5Å; S106-H111 PolarHBondContact O-N 3.01Å; S106-H111 PolarHBondContact OG-O 2.98Å |
| 107 | A | 89.9 | Confident | 93.8 | Very high | 15 Ų | 15 | 51.5 Ų | 51.5 | 12% | 0.124 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.9 | -42.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V103 A104 S105 H294 | V103-A107 WeakPolarHBondContact O-CB 3.43Å; V103-A107 PolarHBondContact O-N 2.96Å; A104-A107 WeakPolarHBondContact O-CB 3.31Å; A104-A107 PolarHBondContact O-N 2.92Å; S105-A107 VanDerWaalsContact C-N 3.3Å; S105-A107 PolarHBondContact O-N 2.94Å; A107-H294 VanDerWaalsContact CB-CE1 3.4Å; A107-H294 WeakPolarHBondContact CB-CE1 3.24Å |
| 108 | A | 90.6 | Very high | 93.9 | Very high | 42 Ų | 42 | 53.9 Ų | 53.9 | 35% | 0.347 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66.1 | -44.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q51 A104 S105 R110 | Q51-A108 HydrophobicContact CG-CB 4.4Å; A104-A108 PolarHBondContact O-N 3.4Å; S105-A108 PolarHBondContact O-N 3.16Å; A108-R110 VanDerWaalsContact C-N 3.31Å; A108-R110 PolarHBondContact O-N 3.02Å |
| 109 | L | 89.8 | Confident | 94 | Very high | 106 Ų | 106 | 49.5 Ų | 49.5 | 56% | 0.555 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -79.6 | -13.3 | -178.4 | -65.1 | 173.8 | 0 | 0 | 0 | 113.4 | S105 H111 P113 | S105-L109 WeakPolarHBondContact O-CB 3.09Å; S105-L109 WeakPolarHBondContact O-CG 3.41Å; S105-L109 PolarHBondContact O-N 3.4Å; L109-H111 HydrophobicContact CB-CB 4.38Å; L109-H111 PolarHBondContact O-N 3.45Å; L109-H111 VanDerWaalsContact O-N 3.08Å; L109-P113 HydrophobicContact CD1-CG 3.89Å |
| 110 | R | 88.4 | Confident | 94.1 | Very high | 196 Ų | 196 | 54.1 Ų | 54.1 | 74% | 0.74 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 28.2 | -167.9 | -57.9 | -176.4 | 174 | -138.6 | -0.2 | 112.8 | S106 A108 | S106-R110 WeakPolarHBondContact O-CA 3.31Å; S106-R110 PolarHBondContact O-N 3.17Å; A108-R110 VanDerWaalsContact C-N 3.31Å; A108-R110 PolarHBondContact O-N 3.02Å |
| 111 | H | 91.2 | Very high | 94.1 | Very high | 58 Ų | 58 | 56.1 Ų | 56.1 | 27% | 0.269 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -155.5 | 146.4 | -174.7 | 168.1 | 47.4 | 0 | 0 | 0 | 109.2 | S106 L109 P113 A195 V196 | S106-H111 WeakPolarHBondContact CA-O 3.5Å; S106-H111 PolarHBondContact O-N 3.01Å; S106-H111 PolarHBondContact OG-O 2.98Å; L109-H111 HydrophobicContact CB-CB 4.38Å; L109-H111 PolarHBondContact O-N 3.45Å; L109-H111 VanDerWaalsContact O-N 3.08Å; H111-P113 WeakPolarHBondContact O-CD 3.28Å; H111-A195 HydrophobicContact CB-CB 4.28Å; H111-V196 WeakPolarHBondContact CA-O 3.42Å; H111-V196 VanDerWaalsContact CE1-CB 3.41Å; H111-V196 WeakPolarHBondContact CE1-CB 3.25Å; H111-V196 PolarHBondContact CE1-N 2.93Å; H111-V196 WeakPolarHBondContact ND1-CA 3.34Å; H111-V196 PolarHBondContact ND1-N 3.13Å; H111-V196 PolarHBondContact ND1-O 3.41Å |
| 112 | W | 94.6 | Very high | 94.2 | Very high | 10 Ų | 10 | 53.7 Ų | 53.7 | 4% | 0.038 | 30% | 0.296 | C | S | . | . | trans | -96.5 | 101.7 | 172.6 | -175 | -91.2 | 0 | 0 | 0 | 111.9 | F102 F114 G115 L118 C119 V122 T187 V196 C198 | F102-W112 HydrophobicContact CB-CH2 3.9Å; F102-W112 HydrophobicContact CB-CZ3 4.32Å; W112-F114 AromaticContact CD2-CD2 3.95Å; W112-F114 HydrophobicContact CD2-CD2 3.95Å; W112-F114 AromaticContact CE2-CD2 3.77Å; W112-F114 HydrophobicContact CE3-CD2 4.14Å; W112-F114 AromaticContact CH2-CD2 3.97Å; W112-F114 HydrophobicContact CH2-CD2 3.97Å; W112-F114 HydrophobicContact CZ2-CB 3.9Å; W112-F114 AromaticContact CZ2-CD2 3.77Å; W112-F114 HydrophobicContact CZ2-CD2 3.77Å; W112-F114 HydrophobicContact CZ2-CG 4.28Å; W112-F114 HydrophobicContact CZ3-CD2 4.15Å; W112-G115 PolarHBondContact NE1-O 3.12Å; W112-L118 HydrophobicContact CZ2-CB 4.16Å; W112-L118 HydrophobicContact CZ2-CG 4.22Å; W112-C119 VanDerWaalsContact CZ2-CA 3.49Å; W112-C119 HydrophobicContact CZ2-CB 4.11Å; W112-V122 HydrophobicContact CH2-CB 4.01Å; W112-V122 HydrophobicContact CH2-CG1 4.09Å; W112-V122 HydrophobicContact CH2-CG2 4Å; W112-T187 VanDerWaalsContact CD1-CG2 3.48Å; W112-T187 HydrophobicContact CG-CG2 4.27Å; W112-V196 PolarHBondContact N-O 3.45Å; W112-C198 HydrophobicContact CB-CB 3.79Å; W112-C198 HydrophobicContact CD2-CB 3.44Å; W112-C198 VanDerWaalsContact CD2-CB 3.44Å; W112-C198 HydrophobicContact CE3-CB 3.71Å; W112-C198 HydrophobicContact CG-CB 3.47Å; W112-C198 VanDerWaalsContact CG-CB 3.47Å; W112-C198 HydrophobicContact CZ3-CB 4.5Å | ||
| 113 | P | 94.5 | Very high | 94.2 | Very high | 63 Ų | 63 | 52.4 Ų | 52.4 | 41% | 0.409 | 29% | 0.292 | S | S | . | . | trans | -87 | -6.5 | -177.5 | 35.4 | -38.7 | 0 | 0 | 0 | 114.1 | L109 H111 G115 | L109-P113 HydrophobicContact CD1-CG 3.89Å; H111-P113 WeakPolarHBondContact O-CD 3.28Å; P113-G115 PolarHBondContact O-N 3.4Å | ||
| 114 | F | 96.2 | Very high | 94.2 | Very high | 69 Ų | 69 | 52.3 Ų | 52.3 | 30% | 0.303 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -91.9 | 3.1 | -165.7 | -48.2 | -74.4 | 0 | 0 | 0 | 115.2 | F102 W112 L118 | F102-F114 HydrophobicContact CB-CD2 4.36Å; F102-F114 HydrophobicContact CB-CE2 4.11Å; F102-F114 AromaticContact CD1-CD1 3.93Å; F102-F114 HydrophobicContact CD1-CD1 3.93Å; F102-F114 HydrophobicContact CD1-CD2 4.04Å; F102-F114 AromaticContact CD1-CE1 3.84Å; F102-F114 HydrophobicContact CD1-CE1 3.84Å; F102-F114 AromaticContact CD1-CE2 3.95Å; F102-F114 HydrophobicContact CD1-CE2 3.95Å; F102-F114 HydrophobicContact CD1-CG 4.03Å; F102-F114 AromaticContact CD1-CZ 3.85Å; F102-F114 HydrophobicContact CD1-CZ 3.85Å; F102-F114 HydrophobicContact CE1-CD1 4.25Å; F102-F114 HydrophobicContact CE1-CE1 4.24Å; W112-F114 AromaticContact CD2-CD2 3.95Å; W112-F114 HydrophobicContact CD2-CD2 3.95Å; W112-F114 AromaticContact CE2-CD2 3.77Å; W112-F114 HydrophobicContact CE3-CD2 4.14Å; W112-F114 AromaticContact CH2-CD2 3.97Å; W112-F114 HydrophobicContact CH2-CD2 3.97Å; W112-F114 HydrophobicContact CZ2-CB 3.9Å; W112-F114 AromaticContact CZ2-CD2 3.77Å; W112-F114 HydrophobicContact CZ2-CD2 3.77Å; W112-F114 HydrophobicContact CZ2-CG 4.28Å; W112-F114 HydrophobicContact CZ3-CD2 4.15Å; F114-L118 HydrophobicContact CB-CB 3.96Å; F114-L118 HydrophobicContact CB-CD2 3.45Å; F114-L118 VanDerWaalsContact CB-CD2 3.45Å; F114-L118 HydrophobicContact CB-CG 4.2Å; F114-L118 HydrophobicContact CD1-CD2 4.16Å; F114-L118 HydrophobicContact CG-CD2 3.83Å |
| 115 | G | 95.4 | Very high | 94.3 | Very high | 35 Ų | 35 | 53.9 Ų | 53.9 | 36% | 0.361 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | 74.4 | 174.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | W112 P113 C119 | W112-G115 PolarHBondContact NE1-O 3.12Å; P113-G115 PolarHBondContact O-N 3.4Å; G115-C119 PolarHBondContact O-N 3.48Å |
| 116 | S | 95.9 | Very high | 94.3 | Very high | 33 Ų | 33 | 52.9 Ų | 52.9 | 23% | 0.231 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65.7 | -39.6 | -172 | 175.5 | 0 | 0 | 0 | 0 | 113.8 | L118 C119 R120 D186 | S116-L118 PolarHBondContact O-N 3.47Å; S116-C119 WeakPolarHBondContact O-CB 3.36Å; S116-C119 PolarHBondContact O-N 3.37Å; S116-R120 PolarHBondContact O-N 3.5Å; S116-D186 VanDerWaalsContact CB-OD1 3.31Å; S116-D186 WeakPolarHBondContact CB-OD1 3.02Å; S116-D186 PolarHBondContact OG-OD1 3.45Å |
| 117 | V | 96.6 | Very high | 94.4 | Very high | 124 Ų | 124 | 51.9 Ų | 51.9 | 75% | 0.752 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -60.4 | -48 | -178.3 | 176 | 0 | 0 | 0 | 0 | 111 | C119 R120 A121 | V117-C119 VanDerWaalsContact C-N 3.34Å; V117-R120 PolarHBondContact O-N 3.41Å; V117-A121 WeakPolarHBondContact O-CB 3.37Å; V117-A121 PolarHBondContact O-N 2.95Å |
| 118 | L | 96.6 | Very high | 94.6 | Very high | 51 Ų | 51 | 52.4 Ų | 52.4 | 27% | 0.267 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -72.5 | -31.3 | -179.6 | -162.5 | 60.9 | 0 | 0 | 0 | 111.8 | F102 W112 F114 S116 A121 V122 | F102-L118 HydrophobicContact CD1-CD2 3.38Å; F102-L118 HydrophobicContact CD1-CG 4.37Å; F102-L118 HydrophobicContact CE1-CD2 3.3Å; F102-L118 HydrophobicContact CE1-CG 4.46Å; F102-L118 HydrophobicContact CE2-CD2 4.48Å; F102-L118 HydrophobicContact CG-CD2 4.04Å; F102-L118 HydrophobicContact CZ-CD2 3.88Å; W112-L118 HydrophobicContact CZ2-CB 4.16Å; W112-L118 HydrophobicContact CZ2-CG 4.22Å; F114-L118 HydrophobicContact CB-CB 3.96Å; F114-L118 HydrophobicContact CB-CD2 3.45Å; F114-L118 VanDerWaalsContact CB-CD2 3.45Å; F114-L118 HydrophobicContact CB-CG 4.2Å; F114-L118 HydrophobicContact CD1-CD2 4.16Å; F114-L118 HydrophobicContact CG-CD2 3.83Å; S116-L118 PolarHBondContact O-N 3.47Å; L118-A121 HydrophobicContact CD1-CB 4.41Å; L118-A121 PolarHBondContact O-N 2.88Å; L118-V122 HydrophobicContact CD1-CG2 4.33Å; L118-V122 HydrophobicContact CG-CG2 4.18Å; L118-V122 VanDerWaalsContact O-CB 3.32Å; L118-V122 WeakPolarHBondContact O-CB 3.3Å; L118-V122 WeakPolarHBondContact O-CG2 3.42Å; L118-V122 PolarHBondContact O-N 3.3Å |
| 119 | C | 97.2 | Very high | 94.8 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.3 | -52 | 171.7 | 175.8 | 0 | 0 | 0 | 0 | 111 | W112 G115 S116 V117 A121 V122 L123 D186 T187 C198 | W112-C119 VanDerWaalsContact CZ2-CA 3.49Å; W112-C119 HydrophobicContact CZ2-CB 4.11Å; G115-C119 PolarHBondContact O-N 3.48Å; S116-C119 WeakPolarHBondContact O-CB 3.36Å; S116-C119 PolarHBondContact O-N 3.37Å; V117-C119 VanDerWaalsContact C-N 3.34Å; C119-A121 PolarHBondContact O-N 3.46Å; C119-V122 PolarHBondContact O-N 2.98Å; C119-L123 WeakPolarHBondContact O-CD1 3.36Å; C119-L123 PolarHBondContact O-N 3.36Å; C119-L123 VanDerWaalsContact O-N 3.07Å; C119-D186 PolarHBondContact SG-O 2.9Å; C119-T187 HydrophobicContact CB-CG2 3.76Å; C119-C198 WeakPolarHBondContact CA-SG 3.46Å; C119-C198 HydrophobicContact CB-CB 3.84Å; C119-C198 WeakPolarHBondContact CB-SG 3.43Å; C119-C198 WeakPolarHBondContact SG-CA 3.45Å; C119-C198 WeakPolarHBondContact SG-CB 3.49Å; C119-C198 CovalentContact SG-SG 2.02Å; C119-C198 PolarHBondContact SG-SG 3.05Å |
| 120 | R | 97.3 | Very high | 94.9 | Very high | 102 Ų | 102 | 46.2 Ų | 46.2 | 39% | 0.385 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.5 | -45.8 | 176.6 | -73.5 | 177.6 | -174.8 | 175.9 | 8.1 | 111.8 | S116 V117 S124 A185 D186 | S116-R120 PolarHBondContact O-N 3.5Å; V117-R120 PolarHBondContact O-N 3.41Å; R120-S124 WeakPolarHBondContact O-CB 3.41Å; R120-S124 PolarHBondContact O-N 3.47Å; R120-S124 PolarHBondContact O-OG 2.87Å; R120-A185 HydrophobicContact CG-CB 4.13Å; R120-A185 WeakPolarHBondContact CG-O 3.29Å; R120-A185 PolarHBondContact NE-O 3.49Å; R120-D186 IonicContact CZ-OD2 3.81Å; R120-D186 IonicContact NH2-OD1 3.92Å; R120-D186 IonicContact NH2-OD2 2.79Å; R120-D186 PolarHBondContact NH2-OD2 3.26Å |
| 121 | A | 96.4 | Very high | 95.1 | Very high | 43 Ų | 43 | 36.9 Ų | 36.9 | 36% | 0.355 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -62.5 | -48.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V117 L118 C119 S124 V125 | V117-A121 WeakPolarHBondContact O-CB 3.37Å; V117-A121 PolarHBondContact O-N 2.95Å; L118-A121 HydrophobicContact CD1-CB 4.41Å; L118-A121 PolarHBondContact O-N 2.88Å; C119-A121 PolarHBondContact O-N 3.46Å; A121-S124 PolarHBondContact O-N 3.35Å; A121-V125 WeakPolarHBondContact O-CB 3.24Å; A121-V125 VanDerWaalsContact O-CG2 3.26Å; A121-V125 WeakPolarHBondContact O-CG2 3.45Å; A121-V125 PolarHBondContact O-N 3.48Å |
| 122 | V | 96.7 | Very high | 95.2 | Very high | 7 Ų | 7 | 34.1 Ų | 34.1 | 4% | 0.042 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.9 | -51.8 | -178.2 | 161.7 | 0 | 0 | 0 | 0 | 111.3 | F102 V103 W112 L118 C119 S124 V125 D126 | F102-V122 HydrophobicContact CB-CG2 4.06Å; F102-V122 HydrophobicContact CD2-CG2 4.04Å; F102-V122 HydrophobicContact CG-CG2 4.21Å; V103-V122 HydrophobicContact CG2-CG1 3.73Å; W112-V122 HydrophobicContact CH2-CB 4.01Å; W112-V122 HydrophobicContact CH2-CG1 4.09Å; W112-V122 HydrophobicContact CH2-CG2 4Å; L118-V122 HydrophobicContact CD1-CG2 4.33Å; L118-V122 HydrophobicContact CG-CG2 4.18Å; L118-V122 VanDerWaalsContact O-CB 3.32Å; L118-V122 WeakPolarHBondContact O-CB 3.3Å; L118-V122 WeakPolarHBondContact O-CG2 3.42Å; L118-V122 PolarHBondContact O-N 3.3Å; C119-V122 PolarHBondContact O-N 2.98Å; V122-S124 VanDerWaalsContact C-N 3.29Å; V122-S124 PolarHBondContact O-N 2.94Å; V122-V125 PolarHBondContact O-N 3.5Å; V122-D126 WeakPolarHBondContact O-CB 3.31Å; V122-D126 PolarHBondContact O-N 2.9Å |
| 123 | L | 96 | Very high | 95 | Very high | 38 Ų | 38 | 33.7 Ų | 33.7 | 20% | 0.199 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.8 | -37.9 | 177.7 | -82 | 92.9 | 0 | 0 | 0 | 112 | C119 D126 G127 I181 A185 C198 L200 | C119-L123 WeakPolarHBondContact O-CD1 3.36Å; C119-L123 PolarHBondContact O-N 3.36Å; C119-L123 VanDerWaalsContact O-N 3.07Å; L123-D126 PolarHBondContact O-N 2.92Å; L123-G127 PolarHBondContact O-N 3.12Å; L123-I181 VanDerWaalsContact C-CG2 3.5Å; L123-I181 HydrophobicContact CB-CG2 3.66Å; L123-I181 WeakPolarHBondContact O-CG2 3.45Å; L123-A185 HydrophobicContact CB-CB 4.22Å; L123-A185 HydrophobicContact CD2-CB 4.4Å; L123-C198 WeakPolarHBondContact CD1-SG 3.49Å; L123-L200 HydrophobicContact CD2-CD2 4.44Å; L123-L200 HydrophobicContact CD2-CG 4.05Å |
| 124 | S | 95.7 | Very high | 94.9 | Very high | 21 Ų | 21 | 30.7 Ų | 30.7 | 15% | 0.147 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -68.4 | -40.9 | 179.5 | -60.1 | 0 | 0 | 0 | 0 | 112.2 | R120 A121 V122 D126 G127 L128 T178 A182 | R120-S124 WeakPolarHBondContact O-CB 3.41Å; R120-S124 PolarHBondContact O-N 3.47Å; R120-S124 PolarHBondContact O-OG 2.87Å; A121-S124 PolarHBondContact O-N 3.35Å; V122-S124 VanDerWaalsContact C-N 3.29Å; V122-S124 PolarHBondContact O-N 2.94Å; S124-D126 VanDerWaalsContact C-N 3.33Å; S124-G127 PolarHBondContact O-N 3.47Å; S124-L128 WeakPolarHBondContact O-CB 3.36Å; S124-L128 PolarHBondContact O-N 3.37Å; S124-T178 WeakPolarHBondContact O-CG2 3.16Å; S124-A182 WeakPolarHBondContact OG-CA 3.47Å |
| 125 | V | 95.5 | Very high | 94.7 | Very high | 44 Ų | 44 | 29.3 Ų | 29.3 | 27% | 0.267 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -64.5 | -41.3 | 176 | 166.8 | 0 | 0 | 0 | 0 | 110.4 | L95 A121 V122 L128 N129 | L95-V125 HydrophobicContact CB-CG1 4.04Å; L95-V125 VanDerWaalsContact O-CG1 3.29Å; L95-V125 WeakPolarHBondContact O-CG1 3.4Å; A121-V125 WeakPolarHBondContact O-CB 3.24Å; A121-V125 VanDerWaalsContact O-CG2 3.26Å; A121-V125 WeakPolarHBondContact O-CG2 3.45Å; A121-V125 PolarHBondContact O-N 3.48Å; V122-V125 PolarHBondContact O-N 3.5Å; V125-L128 PolarHBondContact O-N 3.46Å; V125-N129 PolarHBondContact O-N 3.4Å |
| 126 | D | 94.1 | Very high | 94.5 | Very high | 26 Ų | 26 | 27.8 Ų | 27.8 | 14% | 0.139 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.2 | -47.6 | 176.9 | -75 | 12.4 | 0 | 0 | 0 | 111.9 | F96 S99 V122 L123 S124 N129 M130 Y301 | F96-D126 HydrophobicContact CD2-CB 4.22Å; F96-D126 WeakPolarHBondContact CD2-OD1 3.46Å; F96-D126 HydrophobicContact CE2-CB 3.88Å; S99-D126 WeakPolarHBondContact CB-OD1 3.47Å; S99-D126 PolarHBondContact OG-OD1 3.03Å; V122-D126 WeakPolarHBondContact O-CB 3.31Å; V122-D126 PolarHBondContact O-N 2.9Å; L123-D126 PolarHBondContact O-N 2.92Å; S124-D126 VanDerWaalsContact C-N 3.33Å; D126-N129 PolarHBondContact O-N 3.26Å; D126-M130 WeakPolarHBondContact O-CB 3.46Å; D126-M130 PolarHBondContact O-N 3.39Å; D126-Y301 PolarHBondContact OD2-OH 3.19Å |
| 127 | G | 94 | Very high | 94.1 | Very high | 6 Ų | 6 | 26.6 Ų | 26.6 | 6% | 0.062 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61.9 | -42.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L123 S124 N129 M130 F131 | L123-G127 PolarHBondContact O-N 3.12Å; S124-G127 PolarHBondContact O-N 3.47Å; G127-N129 PolarHBondContact O-N 3.06Å; G127-M130 WeakPolarHBondContact O-CB 3.39Å; G127-M130 PolarHBondContact O-N 3.06Å; G127-F131 WeakPolarHBondContact O-CD2 3.36Å; G127-F131 PolarHBondContact O-N 3.45Å |
| 128 | L | 94.7 | Very high | 93.8 | Very high | 27 Ų | 27 | 22.1 Ų | 22.1 | 14% | 0.141 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -63.8 | -43.9 | 179.1 | -177.8 | 60.4 | 0 | 0 | 0 | 111.2 | S124 V125 F131 T132 W171 L175 T178 | S124-L128 WeakPolarHBondContact O-CB 3.36Å; S124-L128 PolarHBondContact O-N 3.37Å; V125-L128 PolarHBondContact O-N 3.46Å; L128-F131 PolarHBondContact O-N 2.97Å; L128-T132 WeakPolarHBondContact O-CB 3.23Å; L128-T132 PolarHBondContact O-N 3.04Å; L128-T132 PolarHBondContact O-OG1 3.42Å; L128-W171 HydrophobicContact CD1-CE3 4.45Å; L128-W171 HydrophobicContact CD2-CE3 4.36Å; L128-W171 HydrophobicContact CD2-CZ3 3.86Å; L128-W171 HydrophobicContact CG-CZ3 4.18Å; L128-L175 HydrophobicContact CD1-CD2 3.84Å; L128-L175 HydrophobicContact CD1-CG 3.93Å; L128-L175 HydrophobicContact CD2-CD2 4.01Å; L128-T178 HydrophobicContact CB-CG2 4.29Å |
| 129 | N | 93.3 | Very high | 93.6 | Very high | 3 Ų | 3 | 20.7 Ų | 20.7 | 2% | 0.016 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -65.1 | -42.1 | 176.8 | -172.5 | 53.4 | 0 | 0 | 0 | 111.6 | A92 D93 F96 V125 D126 G127 F131 T132 S133 | A92-N129 VanDerWaalsContact CB-OD1 3.27Å; A92-N129 WeakPolarHBondContact CB-OD1 3.34Å; A92-N129 PolarHBondContact O-OD1 2.98Å; D93-N129 PolarHBondContact N-OD1 2.98Å; D93-N129 PolarHBondContact OD1-ND2 3.44Å; D93-N129 PolarHBondContact OD1-OD1 3.34Å; F96-N129 HydrophobicContact CB-CB 3.66Å; F96-N129 VanDerWaalsContact CB-CG 3.49Å; F96-N129 VanDerWaalsContact CB-ND2 3.33Å; F96-N129 WeakPolarHBondContact CB-ND2 3.47Å; F96-N129 WeakPolarHBondContact CD1-ND2 3.45Å; F96-N129 HydrophobicContact CD2-CB 3.9Å; F96-N129 HydrophobicContact CG-CB 3.82Å; F96-N129 WeakPolarHBondContact CG-ND2 3.37Å; V125-N129 PolarHBondContact O-N 3.4Å; D126-N129 PolarHBondContact O-N 3.26Å; G127-N129 PolarHBondContact O-N 3.06Å; N129-F131 VanDerWaalsContact C-N 3.31Å; N129-F131 PolarHBondContact O-N 2.7Å; N129-T132 PolarHBondContact O-N 3.39Å; N129-S133 WeakPolarHBondContact O-CB 3.45Å; N129-S133 PolarHBondContact O-N 3.06Å |
| 130 | M | 91.9 | Very high | 93 | Very high | 15 Ų | 15 | 21.4 Ų | 21.4 | 7% | 0.074 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -50.1 | -50.9 | 176.5 | 179.2 | 171.5 | 118.9 | 0 | 0 | 111.9 | D126 G127 V134 T215 W272 F275 Y276 | D126-M130 WeakPolarHBondContact O-CB 3.46Å; D126-M130 PolarHBondContact O-N 3.39Å; G127-M130 WeakPolarHBondContact O-CB 3.39Å; G127-M130 PolarHBondContact O-N 3.06Å; M130-V134 WeakPolarHBondContact O-CG1 3.49Å; M130-V134 PolarHBondContact O-N 3.13Å; M130-T215 HydrophobicContact CE-CG2 4.48Å; M130-W272 HydrophobicContact CB-CH2 3.53Å; M130-W272 HydrophobicContact CB-CZ2 4.17Å; M130-W272 HydrophobicContact CB-CZ3 4.1Å; M130-W272 HydrophobicContact CG-CE3 4.25Å; M130-W272 HydrophobicContact CG-CH2 3.42Å; M130-W272 VanDerWaalsContact CG-CH2 3.42Å; M130-W272 HydrophobicContact CG-CZ2 4.1Å; M130-W272 HydrophobicContact CG-CZ3 3.51Å; M130-W272 HydrophobicContact SD-CE3 4.26Å; M130-W272 HydrophobicContact SD-CH2 3.92Å; M130-W272 HydrophobicContact SD-CZ3 3.45Å; M130-W272 WeakPolarHBondContact SD-CZ3 3.21Å; M130-F275 HydrophobicContact SD-CE1 4.47Å; M130-Y276 HydrophobicContact CE-CE1 3.87Å; M130-Y276 WeakPolarHBondContact CE-OH 3.3Å; M130-Y276 HydrophobicContact SD-CE1 4.4Å; M130-Y276 PolarHBondContact SD-OH 3.08Å |
| 131 | F | 93.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -76.4 | -42.2 | -180 | -67 | -63.5 | 0 | 0 | 0 | 113.3 | G127 L128 N129 S133 V134 F135 V177 T215 L218 | G127-F131 WeakPolarHBondContact O-CD2 3.36Å; G127-F131 PolarHBondContact O-N 3.45Å; L128-F131 PolarHBondContact O-N 2.97Å; N129-F131 VanDerWaalsContact C-N 3.31Å; N129-F131 PolarHBondContact O-N 2.7Å; F131-S133 VanDerWaalsContact C-N 3.33Å; F131-S133 PolarHBondContact O-N 3.4Å; F131-V134 WeakPolarHBondContact O-CG1 3.16Å; F131-V134 PolarHBondContact O-N 3.23Å; F131-F135 HydrophobicContact CB-CD2 4.41Å; F131-F135 HydrophobicContact CB-CE2 4.05Å; F131-F135 HydrophobicContact CB-CZ 4.39Å; F131-F135 HydrophobicContact CD1-CZ 4.15Å; F131-F135 VanDerWaalsContact O-CB 3.28Å; F131-F135 WeakPolarHBondContact O-CB 3.4Å; F131-F135 WeakPolarHBondContact O-CD2 3.45Å; F131-F135 WeakPolarHBondContact O-CG 3.41Å; F131-F135 PolarHBondContact O-N 3.47Å; F131-V177 HydrophobicContact CD1-CG1 3.9Å; F131-V177 HydrophobicContact CD2-CB 4.2Å; F131-V177 HydrophobicContact CD2-CG1 3.84Å; F131-V177 HydrophobicContact CE1-CG1 3.57Å; F131-V177 HydrophobicContact CE2-CB 4.3Å; F131-V177 HydrophobicContact CE2-CG1 3.51Å; F131-V177 HydrophobicContact CG-CB 4.33Å; F131-V177 HydrophobicContact CG-CG1 4.03Å; F131-V177 HydrophobicContact CZ-CG1 3.36Å; F131-T215 HydrophobicContact CZ-CG2 3.96Å; F131-L218 HydrophobicContact CE1-CB 4.11Å |
| 132 | T | 93.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63.3 | -43 | -178.8 | -55.8 | 0 | 0 | 0 | 0 | 110.6 | A92 L128 N129 C136 V170 W171 S174 | A92-T132 HydrophobicContact CB-CG2 3.93Å; L128-T132 WeakPolarHBondContact O-CB 3.23Å; L128-T132 PolarHBondContact O-N 3.04Å; L128-T132 PolarHBondContact O-OG1 3.42Å; N129-T132 PolarHBondContact O-N 3.39Å; T132-C136 WeakPolarHBondContact O-CB 3.46Å; T132-C136 PolarHBondContact O-N 2.86Å; T132-C136 PolarHBondContact O-SG 2.84Å; T132-V170 HydrophobicContact CG2-CG1 4.19Å; T132-W171 HydrophobicContact CG2-CD2 4.3Å; T132-W171 HydrophobicContact CG2-CE3 4.46Å; T132-W171 HydrophobicContact CG2-CH2 4.37Å; T132-W171 HydrophobicContact CG2-CZ2 4.2Å; T132-S174 VanDerWaalsContact CA-OG 3.31Å; T132-S174 WeakPolarHBondContact CA-OG 3.34Å; T132-S174 PolarHBondContact N-OG 3.33Å; T132-S174 WeakPolarHBondContact OG1-CB 3.29Å; T132-S174 PolarHBondContact OG1-OG 3.3Å |
| 133 | S | 90.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -62.8 | -50.5 | -179.6 | -168.6 | 0 | 0 | 0 | 0 | 110.9 | L89 N129 F131 C136 L137 | L89-S133 WeakPolarHBondContact CD1-OG 3.27Å; N129-S133 WeakPolarHBondContact O-CB 3.45Å; N129-S133 PolarHBondContact O-N 3.06Å; F131-S133 VanDerWaalsContact C-N 3.33Å; F131-S133 PolarHBondContact O-N 3.4Å; S133-C136 PolarHBondContact O-N 3.42Å; S133-L137 WeakPolarHBondContact O-CG 3.32Å; S133-L137 PolarHBondContact O-N 3.11Å |
| 134 | V | 91.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -69.4 | -37.2 | -178.9 | 74 | 0 | 0 | 0 | 0 | 113.2 | M130 F131 L137 T138 P223 F268 | M130-V134 WeakPolarHBondContact O-CG1 3.49Å; M130-V134 PolarHBondContact O-N 3.13Å; F131-V134 WeakPolarHBondContact O-CG1 3.16Å; F131-V134 PolarHBondContact O-N 3.23Å; V134-L137 PolarHBondContact O-N 2.92Å; V134-T138 WeakPolarHBondContact O-CB 2.8Å; V134-T138 PolarHBondContact O-N 3.31Å; V134-T138 PolarHBondContact O-OG1 3.05Å; V134-P223 HydrophobicContact CG1-CG 4.23Å; V134-P223 HydrophobicContact CG2-CB 3.25Å; V134-P223 HydrophobicContact CG2-CG 3.54Å; V134-F268 HydrophobicContact CB-CE2 3.8Å; V134-F268 HydrophobicContact CB-CZ 3.73Å; V134-F268 HydrophobicContact CG2-CE1 3.89Å; V134-F268 HydrophobicContact CG2-CE2 3.74Å; V134-F268 HydrophobicContact CG2-CZ 3.26Å |
| 135 | F | 93.4 | Very high | 90.7 | Very high | 41 Ų | 41 | 18.4 Ų | 18.4 | 18% | 0.18 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -67.1 | -41.1 | 174.6 | -67 | -14.6 | 0 | 0 | 0 | 111.3 | F131 L137 T138 V139 V170 A173 S174 | F131-F135 HydrophobicContact CB-CD2 4.41Å; F131-F135 HydrophobicContact CB-CE2 4.05Å; F131-F135 HydrophobicContact CB-CZ 4.39Å; F131-F135 HydrophobicContact CD1-CZ 4.15Å; F131-F135 VanDerWaalsContact O-CB 3.28Å; F131-F135 WeakPolarHBondContact O-CB 3.4Å; F131-F135 WeakPolarHBondContact O-CD2 3.45Å; F131-F135 WeakPolarHBondContact O-CG 3.41Å; F131-F135 PolarHBondContact O-N 3.47Å; F135-L137 PolarHBondContact O-N 3.02Å; F135-T138 WeakPolarHBondContact O-CB 3.29Å; F135-T138 PolarHBondContact O-N 3.41Å; F135-V139 WeakPolarHBondContact O-CG2 3.34Å; F135-V139 PolarHBondContact O-N 3.39Å; F135-V170 HydrophobicContact CB-CG1 3.71Å; F135-V170 HydrophobicContact CB-CG2 4.27Å; F135-A173 HydrophobicContact CD2-CB 4.38Å; F135-A173 HydrophobicContact CE2-CB 4.12Å; F135-S174 WeakPolarHBondContact CD2-OG 3.2Å |
| 136 | C | 89.9 | Confident | 90.4 | Very high | 3 Ų | 3 | 17.1 Ų | 17.1 | 2% | 0.02 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -59.8 | -44.1 | 172.1 | -81.6 | 0 | 0 | 0 | 0 | 112.1 | L89 T132 S133 T138 V139 L140 | L89-C136 HydrophobicContact CD1-CB 4.28Å; T132-C136 WeakPolarHBondContact O-CB 3.46Å; T132-C136 PolarHBondContact O-N 2.86Å; T132-C136 PolarHBondContact O-SG 2.84Å; S133-C136 PolarHBondContact O-N 3.42Å; C136-T138 VanDerWaalsContact C-N 3.32Å; C136-T138 PolarHBondContact O-N 2.93Å; C136-V139 PolarHBondContact O-N 2.89Å; C136-L140 VanDerWaalsContact O-CB 3.3Å; C136-L140 WeakPolarHBondContact O-CB 3.32Å; C136-L140 PolarHBondContact O-N 3.21Å |
| 137 | L | 86.9 | Confident | 90 | Very high | 7 Ų | 7 | 17.3 Ų | 17.3 | 4% | 0.037 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -63.4 | -37.4 | 176.1 | -72.6 | 178.4 | 0 | 0 | 0 | 112.7 | L89 S133 V134 F135 L140 S141 I227 V264 F268 | L89-L137 HydrophobicContact CD2-CD2 4.31Å; S133-L137 WeakPolarHBondContact O-CG 3.32Å; S133-L137 PolarHBondContact O-N 3.11Å; V134-L137 PolarHBondContact O-N 2.92Å; F135-L137 PolarHBondContact O-N 3.02Å; L137-L140 PolarHBondContact O-N 3.34Å; L137-S141 WeakPolarHBondContact O-CB 3.27Å; L137-S141 PolarHBondContact O-N 3.18Å; L137-S141 PolarHBondContact O-OG 2.95Å; L137-I227 HydrophobicContact CB-CD1 4.37Å; L137-V264 HydrophobicContact CD1-CG1 4.48Å; L137-V264 HydrophobicContact CD2-CG1 3.55Å; L137-F268 HydrophobicContact CD1-CB 4.27Å; L137-F268 HydrophobicContact CD1-CD2 3.64Å; L137-F268 HydrophobicContact CD1-CE2 4.34Å; L137-F268 HydrophobicContact CD1-CG 4.14Å |
| 138 | T | 91.9 | Very high | 89.4 | Confident | 30 Ų | 30 | 19 Ų | 19 | 18% | 0.184 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64.4 | -49.6 | 174.8 | -56.3 | 0 | 0 | 0 | 0 | 110.6 | V134 F135 C136 L140 S141 V142 A226 I227 | V134-T138 WeakPolarHBondContact O-CB 2.8Å; V134-T138 PolarHBondContact O-N 3.31Å; V134-T138 PolarHBondContact O-OG1 3.05Å; F135-T138 WeakPolarHBondContact O-CB 3.29Å; F135-T138 PolarHBondContact O-N 3.41Å; C136-T138 VanDerWaalsContact C-N 3.32Å; C136-T138 PolarHBondContact O-N 2.93Å; T138-L140 VanDerWaalsContact C-N 3.33Å; T138-L140 PolarHBondContact O-N 3.45Å; T138-S141 WeakPolarHBondContact O-CB 3.3Å; T138-S141 PolarHBondContact O-N 3.37Å; T138-S141 VanDerWaalsContact O-N 3.13Å; T138-V142 WeakPolarHBondContact O-CG2 3.49Å; T138-V142 PolarHBondContact O-N 3.32Å; T138-A226 HydrophobicContact CG2-CB 4.3Å; T138-I227 HydrophobicContact CG2-CG1 4.41Å |
| 139 | V | 91.4 | Very high | 89 | Confident | 22 Ų | 22 | 18.7 Ų | 18.7 | 13% | 0.133 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -60.8 | -41.7 | 176.4 | 170.4 | 0 | 0 | 0 | 0 | 111.4 | Y85 F135 C136 S141 V142 D143 I166 V170 | Y85-V139 HydrophobicContact CD1-CG1 3.84Å; Y85-V139 HydrophobicContact CD2-CG1 4.49Å; Y85-V139 HydrophobicContact CE1-CG1 3.34Å; Y85-V139 HydrophobicContact CE2-CG1 4.06Å; Y85-V139 HydrophobicContact CG-CG1 4.41Å; Y85-V139 VanDerWaalsContact CZ-CG1 3.45Å; F135-V139 WeakPolarHBondContact O-CG2 3.34Å; F135-V139 PolarHBondContact O-N 3.39Å; C136-V139 PolarHBondContact O-N 2.89Å; V139-S141 VanDerWaalsContact C-N 3.29Å; V139-S141 PolarHBondContact O-N 3.36Å; V139-V142 PolarHBondContact O-N 3.03Å; V139-D143 WeakPolarHBondContact O-CB 3.47Å; V139-D143 PolarHBondContact O-N 2.8Å; V139-I166 HydrophobicContact CB-CG2 4.44Å; V139-I166 HydrophobicContact CG1-CG2 3.67Å; V139-I166 HydrophobicContact CG2-CG2 3.85Å; V139-V170 HydrophobicContact CG2-CG2 4.02Å |
| 140 | L | 85.7 | Confident | 88.6 | Confident | 15 Ų | 15 | 21.7 Ų | 21.7 | 8% | 0.079 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -61.7 | -39.1 | 176.2 | -173.2 | 67.3 | 0 | 0 | 0 | 111.3 | T82 L86 C136 L137 T138 D143 R144 Y311 | T82-L140 HydrophobicContact CG2-CD1 3.85Å; L86-L140 HydrophobicContact CD2-CD2 4.32Å; C136-L140 VanDerWaalsContact O-CB 3.3Å; C136-L140 WeakPolarHBondContact O-CB 3.32Å; C136-L140 PolarHBondContact O-N 3.21Å; L137-L140 PolarHBondContact O-N 3.34Å; T138-L140 VanDerWaalsContact C-N 3.33Å; T138-L140 PolarHBondContact O-N 3.45Å; L140-D143 WeakPolarHBondContact O-CB 3.27Å; L140-D143 PolarHBondContact O-N 3.03Å; L140-R144 WeakPolarHBondContact O-CG 3.5Å; L140-R144 PolarHBondContact O-N 3.31Å; L140-Y311 HydrophobicContact CD2-CE1 4.44Å |
| 141 | S | 85.5 | Confident | 88.3 | Confident | 2 Ų | 2 | 24.9 Ų | 24.9 | 1% | 0.014 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -68.4 | -38.1 | 176.3 | -61.6 | 0 | 0 | 0 | 0 | 112.3 | L137 T138 V139 R144 Y145 I227 Y231 | L137-S141 WeakPolarHBondContact O-CB 3.27Å; L137-S141 PolarHBondContact O-N 3.18Å; L137-S141 PolarHBondContact O-OG 2.95Å; T138-S141 WeakPolarHBondContact O-CB 3.3Å; T138-S141 PolarHBondContact O-N 3.37Å; T138-S141 VanDerWaalsContact O-N 3.13Å; V139-S141 VanDerWaalsContact C-N 3.29Å; V139-S141 PolarHBondContact O-N 3.36Å; S141-R144 PolarHBondContact O-N 3Å; S141-Y145 WeakPolarHBondContact O-CB 3.38Å; S141-Y145 PolarHBondContact O-N 3.46Å; S141-I227 WeakPolarHBondContact OG-CG2 3.27Å; S141-Y231 WeakPolarHBondContact CA-OH 3.31Å; S141-Y231 WeakPolarHBondContact CB-OH 3.4Å; S141-Y231 PolarHBondContact OG-OH 2.81Å; S141-Y231 VanDerWaalsContact OG-OH 3.06Å |
| 142 | V | 90 | Very high | 87.9 | Confident | 44 Ų | 44 | 32.5 Ų | 32.5 | 27% | 0.267 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -66.6 | -42.9 | 172.2 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | T138 V139 R144 Y145 V146 | T138-V142 WeakPolarHBondContact O-CG2 3.49Å; T138-V142 PolarHBondContact O-N 3.32Å; V139-V142 PolarHBondContact O-N 3.03Å; V142-R144 VanDerWaalsContact C-N 3.26Å; V142-R144 PolarHBondContact O-N 2.8Å; V142-Y145 WeakPolarHBondContact O-CB 3.36Å; V142-Y145 PolarHBondContact O-N 3.49Å; V142-Y145 VanDerWaalsContact O-N 3.11Å; V142-V146 HydrophobicContact CG1-CG2 4.24Å; V142-V146 WeakPolarHBondContact O-CG2 3.42Å; V142-V146 PolarHBondContact O-N 2.96Å |
| 143 | D | 86.9 | Confident | 87.7 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -54.3 | -44.1 | 173.7 | 169.1 | 79.7 | 0 | 0 | 0 | 111 | T82 V139 L140 A147 R158 | T82-D143 PolarHBondContact OG1-OD2 3.03Å; V139-D143 WeakPolarHBondContact O-CB 3.47Å; V139-D143 PolarHBondContact O-N 2.8Å; L140-D143 WeakPolarHBondContact O-CB 3.27Å; L140-D143 PolarHBondContact O-N 3.03Å; D143-A147 WeakPolarHBondContact O-CB 3.43Å; D143-A147 PolarHBondContact O-N 3.23Å; D143-R158 VanDerWaalsContact OD1-CD 3.31Å; D143-R158 WeakPolarHBondContact OD1-CD 3.42Å; D143-R158 VanDerWaalsContact OD1-CG 3.31Å; D143-R158 WeakPolarHBondContact OD1-CG 3.17Å; D143-R158 IonicContact OD1-CZ 3.51Å; D143-R158 IonicContact OD1-NE 3.59Å; D143-R158 PolarHBondContact OD1-NE 3.31Å; D143-R158 IonicContact OD2-NE 3.84Å; D143-R158 IonicContact OD2-NH2 3.78Å |
| 144 | R | 83.2 | Confident | 87.5 | Confident | 47 Ų | 47 | 41.7 Ų | 41.7 | 18% | 0.177 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.1 | -46.5 | 174.2 | -69.5 | -56.1 | 101.1 | 162.6 | 14.6 | 112.4 | T82 L140 S141 V142 V146 A147 V148 I234 V261 | T82-R144 VanDerWaalsContact CG2-NH2 3.31Å; T82-R144 PolarHBondContact OG1-NH2 2.97Å; L140-R144 WeakPolarHBondContact O-CG 3.5Å; L140-R144 PolarHBondContact O-N 3.31Å; S141-R144 PolarHBondContact O-N 3Å; V142-R144 VanDerWaalsContact C-N 3.26Å; V142-R144 PolarHBondContact O-N 2.8Å; R144-V146 PolarHBondContact O-N 3.09Å; R144-A147 PolarHBondContact O-N 3.5Å; R144-V148 WeakPolarHBondContact O-CG2 3.05Å; R144-V148 PolarHBondContact O-N 3.3Å; R144-I234 HydrophobicContact CB-CD1 4.36Å; R144-V261 HydrophobicContact CG-CG2 4.35Å |
| 145 | Y | 87.4 | Confident | 87.2 | Confident | 54 Ų | 54 | 45.2 Ų | 45.2 | 21% | 0.212 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -57.2 | -49.2 | 178.4 | 165.1 | -104.5 | 0 | 0 | 0 | 111.3 | S141 V142 A147 V148 V149 H150 L233 I234 | S141-Y145 WeakPolarHBondContact O-CB 3.38Å; S141-Y145 PolarHBondContact O-N 3.46Å; V142-Y145 WeakPolarHBondContact O-CB 3.36Å; V142-Y145 PolarHBondContact O-N 3.49Å; V142-Y145 VanDerWaalsContact O-N 3.11Å; Y145-A147 VanDerWaalsContact C-N 3.33Å; Y145-A147 PolarHBondContact O-N 2.94Å; Y145-V148 PolarHBondContact O-N 3.42Å; Y145-V149 HydrophobicContact CD2-CB 4.01Å; Y145-V149 HydrophobicContact CD2-CG2 3.53Å; Y145-V149 HydrophobicContact CE2-CB 3.69Å; Y145-V149 HydrophobicContact CE2-CG1 3.86Å; Y145-V149 HydrophobicContact CE2-CG2 3.5Å; Y145-V149 WeakPolarHBondContact O-CB 3.4Å; Y145-V149 WeakPolarHBondContact O-CG2 3.38Å; Y145-V149 PolarHBondContact O-N 3.43Å; Y145-H150 AromaticContact CE1-CD2 3.83Å; Y145-H150 AromaticContact CE1-NE2 3.96Å; Y145-H150 AromaticContact CZ-CD2 3.82Å; Y145-H150 AromaticContact CZ-NE2 3.59Å; Y145-H150 PolarHBondContact OH-NE2 3.41Å; Y145-L233 HydrophobicContact CD2-CB 4.11Å; Y145-L233 HydrophobicContact CE2-CB 3.73Å; Y145-L233 HydrophobicContact CE2-CD1 3.83Å; Y145-L233 HydrophobicContact CE2-CG 4.45Å; Y145-I234 HydrophobicContact CD2-CG1 4.15Å |
| 146 | V | 89.4 | Confident | 87 | Confident | 18 Ų | 18 | 47.2 Ų | 47.2 | 11% | 0.109 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.5 | -42.1 | 177.9 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | V142 R144 V148 H150 R153 A154 Y157 | V142-V146 HydrophobicContact CG1-CG2 4.24Å; V142-V146 WeakPolarHBondContact O-CG2 3.42Å; V142-V146 PolarHBondContact O-N 2.96Å; R144-V146 PolarHBondContact O-N 3.09Å; V146-V148 VanDerWaalsContact C-N 3.34Å; V146-V148 PolarHBondContact O-N 2.92Å; V146-H150 CarbonylContact O-C 3.55Å; V146-H150 WeakPolarHBondContact O-CA 3.5Å; V146-H150 PolarHBondContact O-N 3.47Å; V146-H150 VanDerWaalsContact O-O 3.11Å; V146-R153 HydrophobicContact CG1-CB 4.42Å; V146-A154 HydrophobicContact CG1-CB 4.03Å; V146-Y157 HydrophobicContact CG1-CD1 4.39Å |
| 147 | A | 84.8 | Confident | 86.9 | Confident | 30 Ų | 30 | 50.8 Ų | 50.8 | 25% | 0.248 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.9 | -37.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | D143 R144 Y145 | D143-A147 WeakPolarHBondContact O-CB 3.43Å; D143-A147 PolarHBondContact O-N 3.23Å; R144-A147 PolarHBondContact O-N 3.5Å; Y145-A147 VanDerWaalsContact C-N 3.33Å; Y145-A147 PolarHBondContact O-N 2.94Å |
| 148 | V | 82.1 | Confident | 87 | Confident | 40 Ų | 40 | 54.3 Ų | 54.3 | 24% | 0.242 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -88.7 | -46.7 | -176.7 | 176.3 | 0 | 0 | 0 | 0 | 111.9 | R144 Y145 V146 I234 M238 | R144-V148 WeakPolarHBondContact O-CG2 3.05Å; R144-V148 PolarHBondContact O-N 3.3Å; Y145-V148 PolarHBondContact O-N 3.42Å; V146-V148 VanDerWaalsContact C-N 3.34Å; V146-V148 PolarHBondContact O-N 2.92Å; V148-I234 HydrophobicContact CG1-CG2 4.29Å; V148-M238 HydrophobicContact CB-CE 4.5Å; V148-M238 HydrophobicContact CG1-CE 3.71Å; V148-M238 HydrophobicContact CG1-CG 4.15Å; V148-M238 HydrophobicContact CG2-CE 3.95Å |
| 149 | V | 85.3 | Confident | 86.9 | Confident | 21 Ų | 21 | 59.4 Ų | 59.4 | 13% | 0.127 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -87.6 | -31.4 | -169.8 | -174.4 | 0 | 0 | 0 | 0 | 111.7 | Y145 I234 K237 | Y145-V149 HydrophobicContact CD2-CB 4.01Å; Y145-V149 HydrophobicContact CD2-CG2 3.53Å; Y145-V149 HydrophobicContact CE2-CB 3.69Å; Y145-V149 HydrophobicContact CE2-CG1 3.86Å; Y145-V149 HydrophobicContact CE2-CG2 3.5Å; Y145-V149 WeakPolarHBondContact O-CB 3.4Å; Y145-V149 WeakPolarHBondContact O-CG2 3.38Å; Y145-V149 PolarHBondContact O-N 3.43Å; V149-I234 HydrophobicContact CG2-CG1 4.38Å; V149-K237 HydrophobicContact CG1-CD 4.48Å; V149-K237 HydrophobicContact CG1-CG 4.36Å; V149-K237 HydrophobicContact CG2-CB 4.03Å; V149-K237 HydrophobicContact CG2-CG 4.22Å |
| 150 | H | 86.6 | Confident | 86.8 | Confident | 66 Ų | 66 | 61.1 Ų | 61.1 | 31% | 0.306 | 31% | 0.313 | S | S | . | . | trans | -130.8 | 63.3 | -173.6 | -59.6 | -70.1 | 0 | 0 | 0 | 112.7 | Y145 V146 L152 R153 A154 | Y145-H150 AromaticContact CE1-CD2 3.83Å; Y145-H150 AromaticContact CE1-NE2 3.96Å; Y145-H150 AromaticContact CZ-CD2 3.82Å; Y145-H150 AromaticContact CZ-NE2 3.59Å; Y145-H150 PolarHBondContact OH-NE2 3.41Å; V146-H150 CarbonylContact O-C 3.55Å; V146-H150 WeakPolarHBondContact O-CA 3.5Å; V146-H150 PolarHBondContact O-N 3.47Å; V146-H150 VanDerWaalsContact O-O 3.11Å; H150-L152 VanDerWaalsContact C-N 3.27Å; H150-L152 PolarHBondContact O-N 2.94Å; H150-L152 VanDerWaalsContact O-N 3.13Å; H150-R153 HydrophobicContact CB-CB 4.18Å; H150-R153 PolarHBondContact O-N 3.2Å; H150-A154 PolarHBondContact O-N 3.42Å | ||
| 151 | P | 83.8 | Confident | 87 | Confident | 83 Ų | 83 | 64.2 Ų | 64.2 | 54% | 0.539 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -58.9 | -32.1 | -170.8 | 22.9 | -34.4 | 0 | 0 | 0 | 114.4 | A154 | P151-A154 WeakPolarHBondContact O-CB 3.44Å; P151-A154 PolarHBondContact O-N 2.97Å |
| 152 | L | 86.8 | Confident | 87.4 | Confident | 159 Ų | 159 | 66.2 Ų | 66.2 | 83% | 0.832 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -68.5 | -40 | 176.8 | -62.1 | 177.4 | 0 | 0 | 0 | 112.2 | H150 A154 | H150-L152 VanDerWaalsContact C-N 3.27Å; H150-L152 PolarHBondContact O-N 2.94Å; H150-L152 VanDerWaalsContact O-N 3.13Å; L152-A154 VanDerWaalsContact C-N 3.34Å |
| 153 | R | 88.6 | Confident | 87.5 | Confident | 181 Ų | 181 | 64.1 Ų | 64.1 | 68% | 0.683 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -71.8 | -31.1 | 175.1 | -68.4 | -173.5 | 175.9 | -178.2 | -0.8 | 111.8 | V146 H150 A155 T156 Y157 | V146-R153 HydrophobicContact CG1-CB 4.42Å; H150-R153 HydrophobicContact CB-CB 4.18Å; H150-R153 PolarHBondContact O-N 3.2Å; R153-A155 PolarHBondContact O-N 3.41Å; R153-T156 PolarHBondContact O-N 3.23Å; R153-T156 VanDerWaalsContact O-N 3.09Å; R153-Y157 PolarHBondContact O-N 3.41Å |
| 154 | A | 86.9 | Confident | 87.7 | Confident | 12 Ų | 12 | 70.7 Ų | 70.7 | 10% | 0.099 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.3 | -34.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V146 H150 P151 L152 T156 R158 | V146-A154 HydrophobicContact CG1-CB 4.03Å; H150-A154 PolarHBondContact O-N 3.42Å; P151-A154 WeakPolarHBondContact O-CB 3.44Å; P151-A154 PolarHBondContact O-N 2.97Å; L152-A154 VanDerWaalsContact C-N 3.34Å; A154-T156 PolarHBondContact O-N 3.28Å; A154-R158 VanDerWaalsContact O-CB 3.28Å; A154-R158 WeakPolarHBondContact O-CB 3.37Å; A154-R158 WeakPolarHBondContact O-CG 3.44Å; A154-R158 PolarHBondContact O-N 2.97Å |
| 155 | A | 85.2 | Confident | 88.2 | Confident | 74 Ų | 74 | 74.3 Ų | 74.3 | 61% | 0.612 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -62.2 | -29.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | R153 | R153-A155 PolarHBondContact O-N 3.41Å |
| 156 | T | 88.4 | Confident | 88.6 | Confident | 84 Ų | 84 | 73.3 Ų | 73.3 | 52% | 0.515 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -93.2 | -43.8 | 178.4 | -50.6 | 0 | 0 | 0 | 0 | 111.6 | R153 A154 R159 | R153-T156 PolarHBondContact O-N 3.23Å; R153-T156 VanDerWaalsContact O-N 3.09Å; A154-T156 PolarHBondContact O-N 3.28Å; T156-R159 WeakPolarHBondContact O-CD 3.35Å; T156-R159 VanDerWaalsContact O-CG 3.29Å; T156-R159 WeakPolarHBondContact O-CG 3.27Å |
| 157 | Y | 88.2 | Confident | 88.8 | Confident | 78 Ų | 78 | 72.7 Ų | 72.7 | 31% | 0.306 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -71.7 | -35.9 | -174.8 | -173.5 | -103.3 | 0 | 0 | 0 | 113.2 | V146 R153 R159 V162 I166 | V146-Y157 HydrophobicContact CG1-CD1 4.39Å; R153-Y157 PolarHBondContact O-N 3.41Å; Y157-R159 PolarHBondContact O-N 3.39Å; Y157-R159 VanDerWaalsContact O-N 3.11Å; Y157-V162 HydrophobicContact CD2-CG1 4.24Å; Y157-V162 HydrophobicContact CE2-CG1 4.37Å; Y157-V162 WeakPolarHBondContact O-CG1 3.38Å; Y157-I166 HydrophobicContact CE1-CD1 4.3Å; Y157-I166 HydrophobicContact CE2-CD1 3.84Å; Y157-I166 VanDerWaalsContact OH-CD1 3.26Å; Y157-I166 WeakPolarHBondContact OH-CD1 3.49Å |
| 158 | R | 88.9 | Confident | 89.3 | Confident | 81 Ų | 81 | 76 Ų | 76 | 31% | 0.306 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | 24.3 | -176.4 | -58.1 | -174.4 | 65.2 | -133 | -5.3 | 113.5 | A81 T82 D143 A154 | A81-R158 HydrophobicContact CB-CB 4.28Å; A81-R158 VanDerWaalsContact CB-O 3.25Å; A81-R158 WeakPolarHBondContact CB-O 3.3Å; T82-R158 PolarHBondContact OG1-NH2 2.96Å; D143-R158 VanDerWaalsContact OD1-CD 3.31Å; D143-R158 WeakPolarHBondContact OD1-CD 3.42Å; D143-R158 VanDerWaalsContact OD1-CG 3.31Å; D143-R158 WeakPolarHBondContact OD1-CG 3.17Å; D143-R158 IonicContact OD1-CZ 3.51Å; D143-R158 IonicContact OD1-NE 3.59Å; D143-R158 PolarHBondContact OD1-NE 3.31Å; D143-R158 IonicContact OD2-NE 3.84Å; D143-R158 IonicContact OD2-NH2 3.78Å; A154-R158 VanDerWaalsContact O-CB 3.28Å; A154-R158 WeakPolarHBondContact O-CB 3.37Å; A154-R158 WeakPolarHBondContact O-CG 3.44Å; A154-R158 PolarHBondContact O-N 2.97Å |
| 159 | R | 90.3 | Very high | 89.9 | Confident | 137 Ų | 137 | 76 Ų | 76 | 52% | 0.517 | 40% | 0.4 | S | S | . | . | trans | -73.5 | 142.2 | 173.9 | -72.4 | 178.4 | -177.9 | -171.5 | 1.3 | 110.1 | T156 Y157 S161 V162 A163 | T156-R159 WeakPolarHBondContact O-CD 3.35Å; T156-R159 VanDerWaalsContact O-CG 3.29Å; T156-R159 WeakPolarHBondContact O-CG 3.27Å; Y157-R159 PolarHBondContact O-N 3.39Å; Y157-R159 VanDerWaalsContact O-N 3.11Å; R159-S161 VanDerWaalsContact C-N 3.25Å; R159-S161 PolarHBondContact O-N 3.26Å; R159-V162 HydrophobicContact CB-CG2 4.18Å; R159-V162 PolarHBondContact O-N 3.33Å; R159-V162 VanDerWaalsContact O-N 3.17Å; R159-A163 PolarHBondContact O-N 3.16Å | ||
| 160 | P | 88.6 | Confident | 90.4 | Very high | 58 Ų | 58 | 75.5 Ų | 75.5 | 38% | 0.377 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -56.9 | -34.1 | 179.1 | -29.1 | 37.1 | 0 | 0 | 0 | 114.5 | K79 I84 A163 K164 | K79-P160 WeakPolarHBondContact O-CG 3.27Å; I84-P160 HydrophobicContact CD1-CB 3.86Å; P160-A163 PolarHBondContact O-N 3.16Å; P160-K164 WeakPolarHBondContact O-CG 3.23Å; P160-K164 PolarHBondContact O-N 3.3Å |
| 161 | S | 90.8 | Very high | 90.9 | Very high | 80 Ų | 80 | 74.9 Ų | 74.9 | 56% | 0.559 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -64.6 | -45.4 | 177 | 49 | 0 | 0 | 0 | 0 | 112.3 | R159 A163 K164 L165 | R159-S161 VanDerWaalsContact C-N 3.25Å; R159-S161 PolarHBondContact O-N 3.26Å; S161-A163 VanDerWaalsContact C-N 3.32Å; S161-A163 PolarHBondContact O-N 2.91Å; S161-K164 PolarHBondContact O-N 2.83Å; S161-L165 PolarHBondContact O-N 2.93Å; S161-L165 VanDerWaalsContact O-N 3.09Å |
| 162 | V | 93.4 | Very high | 91.5 | Very high | 43 Ų | 43 | 76 Ų | 76 | 26% | 0.261 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.2 | -42 | 176.2 | 179.9 | 0 | 0 | 0 | 0 | 110.2 | Y157 R159 K164 L165 I166 | Y157-V162 HydrophobicContact CD2-CG1 4.24Å; Y157-V162 HydrophobicContact CE2-CG1 4.37Å; Y157-V162 WeakPolarHBondContact O-CG1 3.38Å; R159-V162 HydrophobicContact CB-CG2 4.18Å; R159-V162 PolarHBondContact O-N 3.33Å; R159-V162 VanDerWaalsContact O-N 3.17Å; V162-K164 VanDerWaalsContact C-N 3.35Å; V162-K164 PolarHBondContact O-N 3.22Å; V162-L165 PolarHBondContact O-N 3.46Å; V162-I166 HydrophobicContact CG1-CD1 3.76Å; V162-I166 HydrophobicContact CG1-CG1 4.41Å; V162-I166 WeakPolarHBondContact O-CG1 3.35Å; V162-I166 PolarHBondContact O-N 3.43Å |
| 163 | A | 91.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 70.2 Ų | 70.2 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62 | -39.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | A81 I84 Y85 R159 P160 S161 I166 N167 | A81-A163 HydrophobicContact CB-CB 3.62Å; I84-A163 HydrophobicContact CB-CB 4.46Å; I84-A163 HydrophobicContact CD1-CB 4.23Å; Y85-A163 HydrophobicContact CE1-CB 4.37Å; Y85-A163 HydrophobicContact CE2-CB 4.09Å; Y85-A163 WeakPolarHBondContact OH-CA 3.48Å; R159-A163 PolarHBondContact O-N 3.16Å; P160-A163 PolarHBondContact O-N 3.16Å; S161-A163 VanDerWaalsContact C-N 3.32Å; S161-A163 PolarHBondContact O-N 2.91Å; A163-I166 PolarHBondContact O-N 3.35Å; A163-N167 PolarHBondContact O-N 3.49Å; A163-N167 PolarHBondContact O-ND2 3.44Å |
| 164 | K | 91.5 | Very high | 92.3 | Very high | 139 Ų | 139 | 61.6 Ų | 61.6 | 60% | 0.604 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -62.9 | -44.6 | 174 | -72.6 | 176.7 | -179.3 | -172.1 | 0 | 111.9 | I84 P160 S161 V162 I166 N167 L168 | I84-K164 HydrophobicContact CD1-CG 4.23Å; I84-K164 HydrophobicContact CG2-CG 4.45Å; P160-K164 WeakPolarHBondContact O-CG 3.23Å; P160-K164 PolarHBondContact O-N 3.3Å; S161-K164 PolarHBondContact O-N 2.83Å; V162-K164 VanDerWaalsContact C-N 3.35Å; V162-K164 PolarHBondContact O-N 3.22Å; K164-I166 PolarHBondContact O-N 3.34Å; K164-N167 PolarHBondContact O-N 2.91Å; K164-L168 PolarHBondContact O-N 3.27Å |
| 165 | L | 94.9 | Very high | 92.7 | Very high | 122 Ų | 122 | 65.1 Ų | 65.1 | 64% | 0.639 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61.8 | -43.8 | 177.6 | -179.7 | 62.6 | 0 | 0 | 0 | 111.7 | S161 V162 L168 G169 | S161-L165 PolarHBondContact O-N 2.93Å; S161-L165 VanDerWaalsContact O-N 3.09Å; V162-L165 PolarHBondContact O-N 3.46Å; L165-L168 PolarHBondContact O-N 3.45Å; L165-G169 PolarHBondContact O-N 2.9Å |
| 166 | I | 95.1 | Very high | 93.2 | Very high | 34 Ų | 34 | 67.2 Ų | 67.2 | 17% | 0.174 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 176.7 | -67.2 | 163.7 | 0 | 0 | 0 | 110.8 | Y85 V139 Y157 V162 A163 K164 L168 G169 V170 | Y85-I166 HydrophobicContact CE1-CB 4.24Å; Y85-I166 HydrophobicContact CE1-CG2 3.97Å; Y85-I166 VanDerWaalsContact OH-CD1 3.27Å; Y85-I166 WeakPolarHBondContact OH-CD1 3.35Å; V139-I166 HydrophobicContact CB-CG2 4.44Å; V139-I166 HydrophobicContact CG1-CG2 3.67Å; V139-I166 HydrophobicContact CG2-CG2 3.85Å; Y157-I166 HydrophobicContact CE1-CD1 4.3Å; Y157-I166 HydrophobicContact CE2-CD1 3.84Å; Y157-I166 VanDerWaalsContact OH-CD1 3.26Å; Y157-I166 WeakPolarHBondContact OH-CD1 3.49Å; V162-I166 HydrophobicContact CG1-CD1 3.76Å; V162-I166 HydrophobicContact CG1-CG1 4.41Å; V162-I166 WeakPolarHBondContact O-CG1 3.35Å; V162-I166 PolarHBondContact O-N 3.43Å; A163-I166 PolarHBondContact O-N 3.35Å; K164-I166 PolarHBondContact O-N 3.34Å; I166-L168 VanDerWaalsContact C-N 3.35Å; I166-L168 PolarHBondContact O-N 2.88Å; I166-G169 WeakPolarHBondContact O-CA 3.37Å; I166-G169 PolarHBondContact O-N 3.36Å; I166-G169 VanDerWaalsContact O-N 3.15Å; I166-V170 HydrophobicContact CG2-CG2 4.44Å; I166-V170 WeakPolarHBondContact O-CG2 3.3Å; I166-V170 PolarHBondContact O-N 3.4Å |
| 167 | N | 93.1 | Very high | 93.5 | Very high | 4 Ų | 4 | 64.4 Ų | 64.4 | 2% | 0.021 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.6 | -82.3 | -73.6 | 0 | 0 | 0 | 111.8 | I84 Y85 N88 A163 K164 G169 V170 W171 | I84-N167 WeakPolarHBondContact CG2-ND2 3.44Å; Y85-N167 WeakPolarHBondContact CD1-ND2 3.5Å; Y85-N167 WeakPolarHBondContact CD1-OD1 3.39Å; Y85-N167 WeakPolarHBondContact CE1-ND2 3.35Å; N88-N167 VanDerWaalsContact CB-OD1 3.3Å; N88-N167 WeakPolarHBondContact CB-OD1 3.39Å; N88-N167 VanDerWaalsContact CG-OD1 3.24Å; N88-N167 VanDerWaalsContact ND2-CG 3.29Å; N88-N167 PolarHBondContact ND2-OD1 2.87Å; A163-N167 PolarHBondContact O-N 3.49Å; A163-N167 PolarHBondContact O-ND2 3.44Å; K164-N167 PolarHBondContact O-N 2.91Å; N167-G169 VanDerWaalsContact C-N 3.26Å; N167-G169 PolarHBondContact O-N 2.93Å; N167-V170 WeakPolarHBondContact O-CB 3.45Å; N167-V170 PolarHBondContact O-N 2.95Å; N167-V170 VanDerWaalsContact O-N 3.08Å; N167-W171 PolarHBondContact O-N 2.89Å |
| 168 | L | 95.1 | Very high | 93.8 | Very high | 101 Ų | 101 | 61 Ų | 61 | 53% | 0.529 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -56.7 | -44.5 | 174.3 | 179.6 | 62.4 | 0 | 0 | 0 | 111 | K164 L165 I166 V170 W171 L172 | K164-L168 PolarHBondContact O-N 3.27Å; L165-L168 PolarHBondContact O-N 3.45Å; I166-L168 VanDerWaalsContact C-N 3.35Å; I166-L168 PolarHBondContact O-N 2.88Å; L168-V170 PolarHBondContact O-N 3.32Å; L168-W171 PolarHBondContact O-N 3.42Å; L168-L172 HydrophobicContact CD1-CD1 4.34Å; L168-L172 HydrophobicContact CD1-CG 4.37Å; L168-L172 HydrophobicContact CG-CD1 4.13Å; L168-L172 VanDerWaalsContact O-CG 3.29Å; L168-L172 WeakPolarHBondContact O-CG 3.49Å; L168-L172 PolarHBondContact O-N 3.25Å |
| 169 | G | 96.4 | Very high | 94.1 | Very high | 38 Ų | 38 | 61.3 Ų | 61.3 | 39% | 0.392 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | L165 I166 N167 L172 A173 | L165-G169 PolarHBondContact O-N 2.9Å; I166-G169 WeakPolarHBondContact O-CA 3.37Å; I166-G169 PolarHBondContact O-N 3.36Å; I166-G169 VanDerWaalsContact O-N 3.15Å; N167-G169 VanDerWaalsContact C-N 3.26Å; N167-G169 PolarHBondContact O-N 2.93Å; G169-L172 PolarHBondContact O-N 3.26Å; G169-A173 VanDerWaalsContact O-CB 3.28Å; G169-A173 WeakPolarHBondContact O-CB 3.46Å; G169-A173 PolarHBondContact O-N 3.23Å |
| 170 | V | 95.8 | Very high | 94.3 | Very high | 12 Ų | 12 | 56.4 Ų | 56.4 | 7% | 0.073 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 176.1 | 168.4 | 0 | 0 | 0 | 0 | 111.4 | T132 F135 V139 I166 N167 L168 A173 S174 | T132-V170 HydrophobicContact CG2-CG1 4.19Å; F135-V170 HydrophobicContact CB-CG1 3.71Å; F135-V170 HydrophobicContact CB-CG2 4.27Å; V139-V170 HydrophobicContact CG2-CG2 4.02Å; I166-V170 HydrophobicContact CG2-CG2 4.44Å; I166-V170 WeakPolarHBondContact O-CG2 3.3Å; I166-V170 PolarHBondContact O-N 3.4Å; N167-V170 WeakPolarHBondContact O-CB 3.45Å; N167-V170 PolarHBondContact O-N 2.95Å; N167-V170 VanDerWaalsContact O-N 3.08Å; L168-V170 PolarHBondContact O-N 3.32Å; V170-A173 PolarHBondContact O-N 3.45Å; V170-S174 WeakPolarHBondContact O-CB 3.26Å; V170-S174 PolarHBondContact O-N 3.42Å; V170-S174 PolarHBondContact O-OG 3.21Å |
| 171 | W | 95.4 | Very high | 94.6 | Very high | 53 Ų | 53 | 54.1 Ų | 54.1 | 20% | 0.201 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.5 | -46.8 | 177 | -79.8 | 103 | 0 | 0 | 0 | 111.7 | N88 A92 L128 T132 N167 L168 A173 S174 L175 | N88-W171 PolarHBondContact OD1-NE1 2.72Å; A92-W171 HydrophobicContact CB-CH2 4.06Å; A92-W171 HydrophobicContact CB-CZ2 4.32Å; L128-W171 HydrophobicContact CD1-CE3 4.45Å; L128-W171 HydrophobicContact CD2-CE3 4.36Å; L128-W171 HydrophobicContact CD2-CZ3 3.86Å; L128-W171 HydrophobicContact CG-CZ3 4.18Å; T132-W171 HydrophobicContact CG2-CD2 4.3Å; T132-W171 HydrophobicContact CG2-CE3 4.46Å; T132-W171 HydrophobicContact CG2-CH2 4.37Å; T132-W171 HydrophobicContact CG2-CZ2 4.2Å; N167-W171 PolarHBondContact O-N 2.89Å; L168-W171 PolarHBondContact O-N 3.42Å; W171-A173 PolarHBondContact O-N 3.48Å; W171-S174 PolarHBondContact O-N 3.05Å; W171-L175 WeakPolarHBondContact O-CB 3.25Å; W171-L175 VanDerWaalsContact O-CG 3.28Å; W171-L175 WeakPolarHBondContact O-CG 3.37Å; W171-L175 PolarHBondContact O-N 3.04Å |
| 172 | L | 96.6 | Very high | 94.8 | Very high | 105 Ų | 105 | 52.4 Ų | 52.4 | 55% | 0.55 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 178.3 | -68.3 | 174.1 | 0 | 0 | 0 | 112 | L168 G169 L175 L176 | L168-L172 HydrophobicContact CD1-CD1 4.34Å; L168-L172 HydrophobicContact CD1-CG 4.37Å; L168-L172 HydrophobicContact CG-CD1 4.13Å; L168-L172 VanDerWaalsContact O-CG 3.29Å; L168-L172 WeakPolarHBondContact O-CG 3.49Å; L168-L172 PolarHBondContact O-N 3.25Å; G169-L172 PolarHBondContact O-N 3.26Å; L172-L175 PolarHBondContact O-N 2.98Å; L172-L176 WeakPolarHBondContact O-CB 3.32Å; L172-L176 PolarHBondContact O-N 3.05Å |
| 173 | A | 96.1 | Very high | 94.9 | Very high | 39 Ų | 39 | 55.6 Ų | 55.6 | 32% | 0.322 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | F135 G169 V170 W171 L176 V177 | F135-A173 HydrophobicContact CD2-CB 4.38Å; F135-A173 HydrophobicContact CE2-CB 4.12Å; G169-A173 VanDerWaalsContact O-CB 3.28Å; G169-A173 WeakPolarHBondContact O-CB 3.46Å; G169-A173 PolarHBondContact O-N 3.23Å; V170-A173 PolarHBondContact O-N 3.45Å; W171-A173 PolarHBondContact O-N 3.48Å; A173-L176 PolarHBondContact O-N 3.29Å; A173-V177 VanDerWaalsContact O-CG2 3.25Å; A173-V177 WeakPolarHBondContact O-CG2 3.43Å; A173-V177 PolarHBondContact O-N 3.47Å |
| 174 | S | 96.3 | Very high | 95.1 | Very high | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -66.5 | -41.7 | 179.6 | -53.5 | 0 | 0 | 0 | 0 | 111.5 | T132 F135 V170 W171 V177 T178 | T132-S174 VanDerWaalsContact CA-OG 3.31Å; T132-S174 WeakPolarHBondContact CA-OG 3.34Å; T132-S174 PolarHBondContact N-OG 3.33Å; T132-S174 WeakPolarHBondContact OG1-CB 3.29Å; T132-S174 PolarHBondContact OG1-OG 3.3Å; F135-S174 WeakPolarHBondContact CD2-OG 3.2Å; V170-S174 WeakPolarHBondContact O-CB 3.26Å; V170-S174 PolarHBondContact O-N 3.42Å; V170-S174 PolarHBondContact O-OG 3.21Å; W171-S174 PolarHBondContact O-N 3.05Å; S174-V177 PolarHBondContact O-N 3Å; S174-T178 VanDerWaalsContact O-CB 3.24Å; S174-T178 WeakPolarHBondContact O-CB 3.43Å; S174-T178 PolarHBondContact O-N 3.18Å; S174-T178 PolarHBondContact O-OG1 3.22Å |
| 175 | L | 95.3 | Very high | 95.4 | Very high | 85 Ų | 85 | 52.1 Ų | 52.1 | 45% | 0.445 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.6 | -47 | 173.3 | -75 | 167.4 | 0 | 0 | 0 | 111.2 | L128 W171 L172 V177 T178 L179 | L128-L175 HydrophobicContact CD1-CD2 3.84Å; L128-L175 HydrophobicContact CD1-CG 3.93Å; L128-L175 HydrophobicContact CD2-CD2 4.01Å; W171-L175 WeakPolarHBondContact O-CB 3.25Å; W171-L175 VanDerWaalsContact O-CG 3.28Å; W171-L175 WeakPolarHBondContact O-CG 3.37Å; W171-L175 PolarHBondContact O-N 3.04Å; L172-L175 PolarHBondContact O-N 2.98Å; L175-V177 PolarHBondContact O-N 3.28Å; L175-T178 PolarHBondContact O-N 2.7Å; L175-L179 WeakPolarHBondContact O-CG 3.04Å; L175-L179 PolarHBondContact O-N 3.3Å |
| 176 | L | 95.8 | Very high | 95.4 | Very high | 118 Ų | 118 | 48.5 Ų | 48.5 | 62% | 0.618 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -57.5 | -47.4 | 178.4 | 179.2 | 63.8 | 0 | 0 | 0 | 112 | L172 A173 T178 L179 | L172-L176 WeakPolarHBondContact O-CB 3.32Å; L172-L176 PolarHBondContact O-N 3.05Å; A173-L176 PolarHBondContact O-N 3.29Å; L176-T178 VanDerWaalsContact C-N 3.28Å; L176-T178 PolarHBondContact O-N 3.28Å; L176-L179 HydrophobicContact CD1-CD1 3.93Å; L176-L179 WeakPolarHBondContact O-CB 3.15Å; L176-L179 WeakPolarHBondContact O-CG 3.29Å; L176-L179 PolarHBondContact O-N 3.24Å |
| 177 | V | 95 | Very high | 95.5 | Very high | 26 Ų | 26 | 48.5 Ų | 48.5 | 16% | 0.158 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -70.2 | -27.3 | -179.1 | -178.8 | 0 | 0 | 0 | 0 | 111.9 | F131 A173 S174 L175 P180 Y214 L218 | F131-V177 HydrophobicContact CD1-CG1 3.9Å; F131-V177 HydrophobicContact CD2-CB 4.2Å; F131-V177 HydrophobicContact CD2-CG1 3.84Å; F131-V177 HydrophobicContact CE1-CG1 3.57Å; F131-V177 HydrophobicContact CE2-CB 4.3Å; F131-V177 HydrophobicContact CE2-CG1 3.51Å; F131-V177 HydrophobicContact CG-CB 4.33Å; F131-V177 HydrophobicContact CG-CG1 4.03Å; F131-V177 HydrophobicContact CZ-CG1 3.36Å; A173-V177 VanDerWaalsContact O-CG2 3.25Å; A173-V177 WeakPolarHBondContact O-CG2 3.43Å; A173-V177 PolarHBondContact O-N 3.47Å; S174-V177 PolarHBondContact O-N 3Å; L175-V177 PolarHBondContact O-N 3.28Å; V177-P180 WeakPolarHBondContact O-CD 3.47Å; V177-Y214 HydrophobicContact CG1-CD2 4.45Å; V177-Y214 HydrophobicContact CG1-CE2 3.79Å; V177-Y214 PolarHBondContact O-OH 3.07Å; V177-L218 HydrophobicContact CG1-CD1 4.01Å; V177-L218 HydrophobicContact CG2-CD1 4.2Å |
| 178 | T | 95 | Very high | 95.4 | Very high | 6 Ų | 6 | 55.2 Ų | 55.2 | 4% | 0.037 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -84.4 | -13 | 179.5 | -55 | 0 | 0 | 0 | 0 | 112.9 | S124 L128 S174 L175 L176 P180 I181 A182 | S124-T178 WeakPolarHBondContact O-CG2 3.16Å; L128-T178 HydrophobicContact CB-CG2 4.29Å; S174-T178 VanDerWaalsContact O-CB 3.24Å; S174-T178 WeakPolarHBondContact O-CB 3.43Å; S174-T178 PolarHBondContact O-N 3.18Å; S174-T178 PolarHBondContact O-OG1 3.22Å; L175-T178 PolarHBondContact O-N 2.7Å; L176-T178 VanDerWaalsContact C-N 3.28Å; L176-T178 PolarHBondContact O-N 3.28Å; T178-P180 VanDerWaalsContact C-CD 3.41Å; T178-P180 VanDerWaalsContact C-N 3.33Å; T178-P180 VanDerWaalsContact O-N 3.15Å; T178-I181 HydrophobicContact CG2-CB 4.26Å; T178-I181 HydrophobicContact CG2-CD1 4.13Å; T178-I181 WeakPolarHBondContact O-CB 3.49Å; T178-I181 PolarHBondContact O-N 3.05Å; T178-A182 PolarHBondContact O-N 2.54Å |
| 179 | L | 94.8 | Very high | 95.2 | Very high | 87 Ų | 87 | 55.2 Ų | 55.2 | 46% | 0.455 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -49 | -43.2 | -177.6 | -72.4 | -179.6 | 0 | 0 | 0 | 114.8 | L175 L176 I181 A182 I183 | L175-L179 WeakPolarHBondContact O-CG 3.04Å; L175-L179 PolarHBondContact O-N 3.3Å; L176-L179 HydrophobicContact CD1-CD1 3.93Å; L176-L179 WeakPolarHBondContact O-CB 3.15Å; L176-L179 WeakPolarHBondContact O-CG 3.29Å; L176-L179 PolarHBondContact O-N 3.24Å; L179-I181 PolarHBondContact O-N 2.8Å; L179-A182 PolarHBondContact O-N 3.31Å; L179-A182 VanDerWaalsContact O-N 3.13Å; L179-I183 WeakPolarHBondContact O-CG1 3.13Å; L179-I183 PolarHBondContact O-N 3.11Å |
| 180 | P | 94.9 | Very high | 94.4 | Very high | 34 Ų | 34 | 55.1 Ų | 55.1 | 22% | 0.221 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.7 | -34.5 | 178 | -26.2 | 37.6 | 0 | 0 | 0 | 112.8 | V177 T178 I183 F184 W202 | V177-P180 WeakPolarHBondContact O-CD 3.47Å; T178-P180 VanDerWaalsContact C-CD 3.41Å; T178-P180 VanDerWaalsContact C-N 3.33Å; T178-P180 VanDerWaalsContact O-N 3.15Å; P180-I183 PolarHBondContact O-N 3.24Å; P180-F184 HydrophobicContact CB-CD2 4.26Å; P180-F184 WeakPolarHBondContact O-CB 3.44Å; P180-F184 VanDerWaalsContact O-CD2 3.22Å; P180-F184 WeakPolarHBondContact O-CD2 3.27Å; P180-F184 PolarHBondContact O-N 3.45Å; P180-W202 HydrophobicContact CB-CH2 4.02Å; P180-W202 HydrophobicContact CB-CZ3 4.23Å |
| 181 | I | 95.2 | Very high | 93.2 | Very high | 11 Ų | 11 | 67 Ų | 67 | 6% | 0.056 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -65 | -47.6 | 176.9 | -61.2 | 169.7 | 0 | 0 | 0 | 110 | L123 T178 L179 I183 F184 A185 L200 F211 | L123-I181 VanDerWaalsContact C-CG2 3.5Å; L123-I181 HydrophobicContact CB-CG2 3.66Å; L123-I181 WeakPolarHBondContact O-CG2 3.45Å; T178-I181 HydrophobicContact CG2-CB 4.26Å; T178-I181 HydrophobicContact CG2-CD1 4.13Å; T178-I181 WeakPolarHBondContact O-CB 3.49Å; T178-I181 PolarHBondContact O-N 3.05Å; L179-I181 PolarHBondContact O-N 2.8Å; I181-I183 PolarHBondContact O-N 3.4Å; I181-F184 PolarHBondContact O-N 2.93Å; I181-A185 WeakPolarHBondContact O-CB 3.41Å; I181-A185 PolarHBondContact O-N 3.37Å; I181-L200 HydrophobicContact CB-CD2 4.29Å; I181-L200 HydrophobicContact CG1-CD2 4.31Å; I181-L200 HydrophobicContact CG2-CD2 4.18Å; I181-F211 HydrophobicContact CD1-CE2 4.15Å; I181-F211 HydrophobicContact CD1-CZ 3.78Å; I181-F211 HydrophobicContact CG1-CE2 3.66Å; I181-F211 HydrophobicContact CG1-CZ 3.55Å |
| 182 | A | 94.2 | Very high | 91.9 | Very high | 44 Ų | 44 | 68 Ų | 68 | 36% | 0.364 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -63 | -30.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S124 T178 L179 | S124-A182 WeakPolarHBondContact OG-CA 3.47Å; T178-A182 PolarHBondContact O-N 2.54Å; L179-A182 PolarHBondContact O-N 3.31Å; L179-A182 VanDerWaalsContact O-N 3.13Å |
| 183 | I | 95.1 | Very high | 90.9 | Very high | 109 Ų | 109 | 65.8 Ų | 65.8 | 56% | 0.559 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -83.1 | -44.6 | -179 | -64.9 | 166.5 | 0 | 0 | 0 | 111.6 | L179 P180 I181 | L179-I183 WeakPolarHBondContact O-CG1 3.13Å; L179-I183 PolarHBondContact O-N 3.11Å; P180-I183 PolarHBondContact O-N 3.24Å; I181-I183 PolarHBondContact O-N 3.4Å |
| 184 | F | 96 | Very high | 90.1 | Very high | 67 Ų | 67 | 73.2 Ų | 73.2 | 29% | 0.294 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -102.3 | -7.2 | -168.8 | -63.4 | -67.7 | 0 | 0 | 0 | 114.5 | P180 I181 D186 H201 W202 P203 | P180-F184 HydrophobicContact CB-CD2 4.26Å; P180-F184 WeakPolarHBondContact O-CB 3.44Å; P180-F184 VanDerWaalsContact O-CD2 3.22Å; P180-F184 WeakPolarHBondContact O-CD2 3.27Å; P180-F184 PolarHBondContact O-N 3.45Å; I181-F184 PolarHBondContact O-N 2.93Å; F184-D186 PolarHBondContact O-N 3.34Å; F184-H201 PolarHBondContact O-N 3.42Å; F184-W202 HydrophobicContact CB-CE3 4.45Å; F184-W202 HydrophobicContact CB-CZ3 4.31Å; F184-W202 AromaticContact CD2-CE3 3.99Å; F184-W202 HydrophobicContact CD2-CE3 3.99Å; F184-W202 HydrophobicContact CD2-CH2 4.32Å; F184-W202 AromaticContact CD2-CZ3 3.49Å; F184-W202 HydrophobicContact CD2-CZ3 3.49Å; F184-W202 VanDerWaalsContact CD2-CZ3 3.49Å; F184-W202 HydrophobicContact CE2-CE3 4.49Å; F184-W202 HydrophobicContact CE2-CZ3 4.06Å; F184-W202 HydrophobicContact CG-CE3 4.19Å; F184-W202 HydrophobicContact CG-CZ3 4.06Å; F184-P203 HydrophobicContact CD1-CG 4.34Å; F184-P203 HydrophobicContact CE1-CG 3.68Å; F184-P203 HydrophobicContact CZ-CG 4.3Å |
| 185 | A | 96.6 | Very high | 89.7 | Confident | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.4 | 128.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | R120 L123 I181 L200 | R120-A185 HydrophobicContact CG-CB 4.13Å; R120-A185 WeakPolarHBondContact CG-O 3.29Å; R120-A185 PolarHBondContact NE-O 3.49Å; L123-A185 HydrophobicContact CB-CB 4.22Å; L123-A185 HydrophobicContact CD2-CB 4.4Å; I181-A185 WeakPolarHBondContact O-CB 3.41Å; I181-A185 PolarHBondContact O-N 3.37Å; A185-L200 HydrophobicContact CB-CD2 4.22Å |
| 186 | D | 96.4 | Very high | 89.6 | Confident | 46 Ų | 46 | 72.8 Ų | 72.8 | 25% | 0.246 | 41% | 0.405 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -156.9 | 172.4 | 172.7 | -142 | -28.2 | 0 | 0 | 0 | 111.5 | S116 C119 R120 F184 N199 H201 | S116-D186 VanDerWaalsContact CB-OD1 3.31Å; S116-D186 WeakPolarHBondContact CB-OD1 3.02Å; S116-D186 PolarHBondContact OG-OD1 3.45Å; C119-D186 PolarHBondContact SG-O 2.9Å; R120-D186 IonicContact CZ-OD2 3.81Å; R120-D186 IonicContact NH2-OD1 3.92Å; R120-D186 IonicContact NH2-OD2 2.79Å; R120-D186 PolarHBondContact NH2-OD2 3.26Å; F184-D186 PolarHBondContact O-N 3.34Å; D186-N199 PolarHBondContact N-O 3.2Å; D186-N199 PolarHBondContact O-N 3.01Å; D186-N199 VanDerWaalsContact O-O 3.11Å; D186-H201 PolarHBondContact O-NE2 2.89Å |
| 187 | T | 95.7 | Very high | 89.4 | Confident | 34 Ų | 34 | 69.2 Ų | 69.2 | 21% | 0.209 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 132 | 171.2 | 50.2 | 0 | 0 | 0 | 0 | 111 | W112 C119 V196 A197 C198 | W112-T187 VanDerWaalsContact CD1-CG2 3.48Å; W112-T187 HydrophobicContact CG-CG2 4.27Å; C119-T187 HydrophobicContact CB-CG2 3.76Å; T187-V196 HydrophobicContact CG2-CG1 4.15Å; T187-A197 CarbonylContact C-O 3.12Å; T187-A197 VanDerWaalsContact CA-O 3.26Å; T187-A197 WeakPolarHBondContact CA-O 3.43Å; T187-C198 HydrophobicContact CG2-CB 4.28Å |
| 188 | R | 92.1 | Very high | 89.4 | Confident | 145 Ų | 145 | 69.1 Ų | 69.1 | 55% | 0.547 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 151.6 | 170.8 | -71.7 | -167.4 | -173.6 | -165.5 | 0.3 | 111.9 | A190 A197 H201 | R188-A190 PolarHBondContact O-N 2.94Å; R188-A197 PolarHBondContact N-O 3.2Å; R188-A197 PolarHBondContact O-N 3.42Å; R188-H201 VanDerWaalsContact CD-CE1 3.49Å; R188-H201 WeakPolarHBondContact CD-CE1 3.33Å; R188-H201 WeakPolarHBondContact CG-NE2 3.15Å |
| 189 | P | 89.9 | Confident | 89.2 | Confident | 100 Ų | 100 | 73.3 Ų | 73.3 | 65% | 0.649 | 42% | 0.415 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -57.2 | 131 | 170.2 | -20.5 | 32 | 0 | 0 | 0 | 110.7 | A195 | P189-A195 CarbonylContact C-O 3.39Å; P189-A195 WeakPolarHBondContact CA-O 3.34Å |
| 190 | A | 81.3 | Confident | 89.1 | Confident | 36 Ų | 36 | 70.5 Ų | 70.5 | 30% | 0.298 | 40% | 0.4 | S | S | . | . | P | Polyproline II helix | trans | -68.7 | 163.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | R188 G192 G193 A195 | R188-A190 PolarHBondContact O-N 2.94Å; A190-G192 PolarHBondContact O-N 3.48Å; A190-G192 VanDerWaalsContact O-N 3.12Å; A190-G193 PolarHBondContact O-N 2.96Å; A190-A195 HydrophobicContact CB-CB 4.13Å; A190-A195 VanDerWaalsContact CB-O 3.31Å; A190-A195 WeakPolarHBondContact CB-O 3.04Å; A190-A195 PolarHBondContact N-O 3.24Å |
| 191 | R | 69.6 | Low | 89 | Confident | 261 Ų | 261 | 71 Ų | 71 | 99% | 0.985 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | 119.6 | 176.3 | -69.7 | -176.5 | 175.8 | -178.2 | -1.6 | 109.2 | ||
| 192 | G | 68.9 | Low | 88.9 | Confident | 74 Ų | 74 | 73.1 Ų | 73.1 | 76% | 0.763 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 104.8 | -4.9 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | A190 Q194 | A190-G192 PolarHBondContact O-N 3.48Å; A190-G192 VanDerWaalsContact O-N 3.12Å; G192-Q194 PolarHBondContact O-N 2.92Å |
| 193 | G | 75.9 | Confident | 88.7 | Confident | 60 Ų | 60 | 75.7 Ų | 75.7 | 62% | 0.619 | 42% | 0.42 | S | S | * | . | S | Bend | trans | 74.6 | -13.7 | 166.7 | 0 | 0 | 0 | 0 | 0 | 117 | A190 | A190-G193 PolarHBondContact O-N 2.96Š|
| 194 | Q | 78.4 | Confident | 88.5 | Confident | 194 Ų | 194 | 75.8 Ų | 75.8 | 91% | 0.907 | 42% | 0.418 | S | S | * | . | S | Bend | trans | -85 | -22.3 | -177.2 | -71.1 | -174.9 | -31.3 | 0 | 0 | 114.7 | G192 | G192-Q194 PolarHBondContact O-N 2.92Š|
| 195 | A | 87.4 | Confident | 87.9 | Confident | 28 Ų | 28 | 77.5 Ų | 77.5 | 23% | 0.231 | 44% | 0.436 | C | S | . | . | trans | -118 | 145.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | H111 P189 A190 | H111-A195 HydrophobicContact CB-CB 4.28Å; P189-A195 CarbonylContact C-O 3.39Å; P189-A195 WeakPolarHBondContact CA-O 3.34Å; A190-A195 HydrophobicContact CB-CB 4.13Å; A190-A195 VanDerWaalsContact CB-O 3.31Å; A190-A195 WeakPolarHBondContact CB-O 3.04Å; A190-A195 PolarHBondContact N-O 3.24Å | ||
| 196 | V | 92.9 | Very high | 87.6 | Confident | 49 Ų | 49 | 80 Ų | 80 | 30% | 0.297 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 133.7 | 167.5 | -174.5 | 0 | 0 | 0 | 0 | 109.5 | H111 W112 T187 | H111-V196 WeakPolarHBondContact CA-O 3.42Å; H111-V196 VanDerWaalsContact CE1-CB 3.41Å; H111-V196 WeakPolarHBondContact CE1-CB 3.25Å; H111-V196 PolarHBondContact CE1-N 2.93Å; H111-V196 WeakPolarHBondContact ND1-CA 3.34Å; H111-V196 PolarHBondContact ND1-N 3.13Å; H111-V196 PolarHBondContact ND1-O 3.41Å; W112-V196 PolarHBondContact N-O 3.45Å; T187-V196 HydrophobicContact CG2-CG1 4.15Å |
| 197 | A | 91.7 | Very high | 87.4 | Confident | 42 Ų | 42 | 84.4 Ų | 84.4 | 35% | 0.347 | 47% | 0.47 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 145.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | T187 R188 | T187-A197 CarbonylContact C-O 3.12Å; T187-A197 VanDerWaalsContact CA-O 3.26Å; T187-A197 WeakPolarHBondContact CA-O 3.43Å; R188-A197 PolarHBondContact N-O 3.2Å; R188-A197 PolarHBondContact O-N 3.42Å |
| 198 | C | 94.6 | Very high | 87.2 | Confident | 25 Ų | 25 | 84.7 Ų | 84.7 | 17% | 0.169 | 47% | 0.473 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 115.8 | 172.1 | 167.8 | 0 | 0 | 0 | 0 | 108.5 | W112 C119 L123 T187 | W112-C198 HydrophobicContact CB-CB 3.79Å; W112-C198 HydrophobicContact CD2-CB 3.44Å; W112-C198 VanDerWaalsContact CD2-CB 3.44Å; W112-C198 HydrophobicContact CE3-CB 3.71Å; W112-C198 HydrophobicContact CG-CB 3.47Å; W112-C198 VanDerWaalsContact CG-CB 3.47Å; W112-C198 HydrophobicContact CZ3-CB 4.5Å; C119-C198 WeakPolarHBondContact CA-SG 3.46Å; C119-C198 HydrophobicContact CB-CB 3.84Å; C119-C198 WeakPolarHBondContact CB-SG 3.43Å; C119-C198 WeakPolarHBondContact SG-CA 3.45Å; C119-C198 WeakPolarHBondContact SG-CB 3.49Å; C119-C198 CovalentContact SG-SG 2.02Å; C119-C198 PolarHBondContact SG-SG 3.05Å; L123-C198 WeakPolarHBondContact CD1-SG 3.49Å; T187-C198 HydrophobicContact CG2-CB 4.28Å |
| 199 | N | 92.3 | Very high | 87.2 | Confident | 93 Ų | 93 | 79.6 Ų | 79.6 | 50% | 0.497 | 46% | 0.462 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -156 | 173.5 | -174.9 | -149.9 | -26.6 | 0 | 0 | 0 | 112.2 | D186 H201 | D186-N199 PolarHBondContact N-O 3.2Å; D186-N199 PolarHBondContact O-N 3.01Å; D186-N199 VanDerWaalsContact O-O 3.11Å; N199-H201 PolarHBondContact O-CD2 2.81Å |
| 200 | L | 92.9 | Very high | 87.4 | Confident | 29 Ų | 29 | 78.3 Ų | 78.3 | 15% | 0.152 | 45% | 0.452 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 119.4 | 171.5 | -68.7 | 164.4 | 0 | 0 | 0 | 110.1 | L123 I181 A185 W202 F211 | L123-L200 HydrophobicContact CD2-CD2 4.44Å; L123-L200 HydrophobicContact CD2-CG 4.05Å; I181-L200 HydrophobicContact CB-CD2 4.29Å; I181-L200 HydrophobicContact CG1-CD2 4.31Å; I181-L200 HydrophobicContact CG2-CD2 4.18Å; A185-L200 HydrophobicContact CB-CD2 4.22Å; L200-W202 HydrophobicContact CB-CZ2 4.07Å; L200-W202 HydrophobicContact CD1-CZ2 3.97Å; L200-W202 HydrophobicContact CD2-CZ2 4.37Å; L200-W202 HydrophobicContact CG-CZ2 4.36Å; L200-F211 HydrophobicContact CD1-CD1 4.25Å; L200-F211 HydrophobicContact CD1-CE1 3.6Å; L200-F211 HydrophobicContact CD1-CZ 3.8Å |
| 201 | H | 92.7 | Very high | 88 | Confident | 44 Ų | 44 | 77.8 Ų | 77.8 | 20% | 0.204 | 44% | 0.443 | C | S | . | . | trans | -105.2 | 92.3 | -179.1 | -65.6 | -60.9 | 0 | 0 | 0 | 110.8 | F184 D186 R188 N199 | F184-H201 PolarHBondContact O-N 3.42Å; D186-H201 PolarHBondContact O-NE2 2.89Å; R188-H201 VanDerWaalsContact CD-CE1 3.49Å; R188-H201 WeakPolarHBondContact CD-CE1 3.33Å; R188-H201 WeakPolarHBondContact CG-NE2 3.15Å; N199-H201 PolarHBondContact O-CD2 2.81Å | ||
| 202 | W | 91.9 | Very high | 89.1 | Confident | 55 Ų | 55 | 65.5 Ų | 65.5 | 21% | 0.208 | 40% | 0.397 | C | S | . | . | trans | -75.6 | 137.3 | 179.6 | -59.7 | 108.5 | 0 | 0 | 0 | 112.3 | P180 F184 L200 H204 W207 F211 | P180-W202 HydrophobicContact CB-CH2 4.02Å; P180-W202 HydrophobicContact CB-CZ3 4.23Å; F184-W202 HydrophobicContact CB-CE3 4.45Å; F184-W202 HydrophobicContact CB-CZ3 4.31Å; F184-W202 AromaticContact CD2-CE3 3.99Å; F184-W202 HydrophobicContact CD2-CE3 3.99Å; F184-W202 HydrophobicContact CD2-CH2 4.32Å; F184-W202 AromaticContact CD2-CZ3 3.49Å; F184-W202 HydrophobicContact CD2-CZ3 3.49Å; F184-W202 VanDerWaalsContact CD2-CZ3 3.49Å; F184-W202 HydrophobicContact CE2-CE3 4.49Å; F184-W202 HydrophobicContact CE2-CZ3 4.06Å; F184-W202 HydrophobicContact CG-CE3 4.19Å; F184-W202 HydrophobicContact CG-CZ3 4.06Å; L200-W202 HydrophobicContact CB-CZ2 4.07Å; L200-W202 HydrophobicContact CD1-CZ2 3.97Å; L200-W202 HydrophobicContact CD2-CZ2 4.37Å; L200-W202 HydrophobicContact CG-CZ2 4.36Å; W202-H204 PolarHBondContact O-N 3.28Å; W202-W207 HydrophobicContact CB-CB 4.05Å; W202-W207 HydrophobicContact CD2-CB 4Å; W202-W207 HydrophobicContact CE3-CB 3.76Å; W202-W207 HydrophobicContact CG-CB 4.14Å; W202-F211 HydrophobicContact CH2-CB 3.78Å; W202-F211 HydrophobicContact CH2-CD1 4.42Å; W202-F211 AromaticContact CH2-CD2 3.35Å; W202-F211 HydrophobicContact CH2-CD2 3.35Å; W202-F211 HydrophobicContact CH2-CE2 4Å; W202-F211 AromaticContact CH2-CG 3.6Å; W202-F211 HydrophobicContact CH2-CG 3.6Å; W202-F211 HydrophobicContact CZ2-CB 3.47Å; W202-F211 VanDerWaalsContact CZ2-CB 3.47Å; W202-F211 AromaticContact CZ2-CD1 3.7Å; W202-F211 HydrophobicContact CZ2-CD1 3.7Å; W202-F211 AromaticContact CZ2-CD2 3.49Å; W202-F211 HydrophobicContact CZ2-CD2 3.49Å; W202-F211 VanDerWaalsContact CZ2-CD2 3.49Å; W202-F211 HydrophobicContact CZ2-CE1 4.28Å; W202-F211 HydrophobicContact CZ2-CE2 4.11Å; W202-F211 AromaticContact CZ2-CG 3.25Å; W202-F211 HydrophobicContact CZ2-CG 3.25Å; W202-F211 HydrophobicContact CZ2-CZ 4.46Å | ||
| 203 | P | 90.7 | Very high | 90.3 | Very high | 98 Ų | 98 | 65.1 Ų | 65.1 | 64% | 0.636 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -63.4 | -29.5 | 175.9 | -23.5 | 33.4 | 0 | 0 | 0 | 113.9 | F184 | F184-P203 HydrophobicContact CD1-CG 4.34Å; F184-P203 HydrophobicContact CE1-CG 3.68Å; F184-P203 HydrophobicContact CZ-CG 4.3Å |
| 204 | H | 90.5 | Very high | 91.2 | Very high | 111 Ų | 111 | 64.9 Ų | 64.9 | 51% | 0.514 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -139.3 | 140.2 | -179.4 | -173 | -86.6 | 0 | 0 | 0 | 109.7 | W202 A206 W207 | W202-H204 PolarHBondContact O-N 3.28Å; H204-A206 VanDerWaalsContact C-N 3.26Å; H204-A206 WeakPolarHBondContact ND1-CB 3.45Å; H204-A206 PolarHBondContact ND1-N 2.9Å; H204-A206 PolarHBondContact O-N 3.35Å; H204-A206 VanDerWaalsContact O-N 3.15Å; H204-W207 WeakPolarHBondContact O-CB 3.21Å; H204-W207 PolarHBondContact O-N 3.34Å |
| 205 | P | 84.1 | Confident | 92 | Very high | 103 Ų | 103 | 56 Ų | 56 | 67% | 0.669 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -54.3 | -37.6 | -175.1 | -28.7 | 35.3 | 0 | 0 | 0 | 114.4 | W207 S208 | P205-W207 PolarHBondContact O-N 2.89Å; P205-W207 VanDerWaalsContact O-N 3.15Å; P205-S208 WeakPolarHBondContact O-CB 3.27Å; P205-S208 PolarHBondContact O-N 2.82Å; P205-S208 VanDerWaalsContact O-N 3.08Å; P205-S208 PolarHBondContact O-OG 3.36Å |
| 206 | A | 90.2 | Very high | 92.4 | Very high | 53 Ų | 53 | 56.9 Ų | 56.9 | 44% | 0.438 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -57.4 | -29.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | H204 S208 A209 V210 | H204-A206 VanDerWaalsContact C-N 3.26Å; H204-A206 WeakPolarHBondContact ND1-CB 3.45Å; H204-A206 PolarHBondContact ND1-N 2.9Å; H204-A206 PolarHBondContact O-N 3.35Å; H204-A206 VanDerWaalsContact O-N 3.15Å; A206-S208 VanDerWaalsContact C-N 3.26Å; A206-S208 PolarHBondContact O-N 2.93Å; A206-A209 PolarHBondContact O-N 3.31Å; A206-V210 WeakPolarHBondContact O-CG2 3.29Å; A206-V210 PolarHBondContact O-N 3.47Å |
| 207 | W | 92.4 | Very high | 92.5 | Very high | 139 Ų | 139 | 57.7 Ų | 57.7 | 53% | 0.527 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -66.4 | -28.3 | 178.9 | -69.2 | 113.8 | 0 | 0 | 0 | 112.8 | W202 H204 P205 V210 F211 | W202-W207 HydrophobicContact CB-CB 4.05Å; W202-W207 HydrophobicContact CD2-CB 4Å; W202-W207 HydrophobicContact CE3-CB 3.76Å; W202-W207 HydrophobicContact CG-CB 4.14Å; H204-W207 WeakPolarHBondContact O-CB 3.21Å; H204-W207 PolarHBondContact O-N 3.34Å; P205-W207 PolarHBondContact O-N 2.89Å; P205-W207 VanDerWaalsContact O-N 3.15Å; W207-V210 HydrophobicContact CE3-CB 4.5Å; W207-V210 HydrophobicContact CE3-CG1 4.42Å; W207-F211 WeakPolarHBondContact O-CB 3.44Å; W207-F211 PolarHBondContact O-N 3.08Å |
| 208 | S | 90.3 | Very high | 92.7 | Very high | 40 Ų | 40 | 58.7 Ų | 58.7 | 28% | 0.28 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.8 | -45 | 173.9 | 68.6 | 0 | 0 | 0 | 0 | 111.3 | P205 A206 F211 V212 | P205-S208 WeakPolarHBondContact O-CB 3.27Å; P205-S208 PolarHBondContact O-N 2.82Å; P205-S208 VanDerWaalsContact O-N 3.08Å; P205-S208 PolarHBondContact O-OG 3.36Å; A206-S208 VanDerWaalsContact C-N 3.26Å; A206-S208 PolarHBondContact O-N 2.93Å; S208-F211 PolarHBondContact O-N 3.47Å; S208-V212 VanDerWaalsContact O-CG2 3.31Å; S208-V212 WeakPolarHBondContact O-CG2 3.29Å; S208-V212 PolarHBondContact O-N 2.88Å |
| 209 | A | 91.8 | Very high | 92.5 | Very high | 37 Ų | 37 | 57.5 Ų | 57.5 | 31% | 0.306 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -65.9 | -45.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A206 F211 V212 V213 L283 | A206-A209 PolarHBondContact O-N 3.31Å; A209-F211 VanDerWaalsContact C-N 3.26Å; A209-F211 PolarHBondContact O-N 3.15Å; A209-V212 PolarHBondContact O-N 2.85Å; A209-V213 WeakPolarHBondContact O-CB 3.19Å; A209-V213 VanDerWaalsContact O-CG2 3.26Å; A209-V213 WeakPolarHBondContact O-CG2 3.39Å; A209-V213 PolarHBondContact O-N 3.34Å; A209-L283 HydrophobicContact CB-CD1 4.12Å; A209-L283 HydrophobicContact CB-CD2 4.19Å |
| 210 | V | 94.5 | Very high | 92.6 | Very high | 74 Ų | 74 | 54 Ų | 54 | 45% | 0.448 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -56.2 | -45.8 | 174.7 | 172.6 | 0 | 0 | 0 | 0 | 110.3 | A206 W207 V213 Y214 | A206-V210 WeakPolarHBondContact O-CG2 3.29Å; A206-V210 PolarHBondContact O-N 3.47Å; W207-V210 HydrophobicContact CE3-CB 4.5Å; W207-V210 HydrophobicContact CE3-CG1 4.42Å; V210-V213 PolarHBondContact O-N 3.46Å; V210-Y214 HydrophobicContact CG1-CD1 4.43Å; V210-Y214 WeakPolarHBondContact O-CD1 3.34Å; V210-Y214 PolarHBondContact O-N 2.99Å |
| 211 | F | 93.8 | Very high | 92.6 | Very high | 24 Ų | 24 | 55.6 Ų | 55.6 | 11% | 0.105 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.8 | -53.8 | 178.5 | 178.4 | -97.4 | 0 | 0 | 0 | 112.4 | I181 L200 W202 W207 S208 A209 V213 Y214 T215 | I181-F211 HydrophobicContact CD1-CE2 4.15Å; I181-F211 HydrophobicContact CD1-CZ 3.78Å; I181-F211 HydrophobicContact CG1-CE2 3.66Å; I181-F211 HydrophobicContact CG1-CZ 3.55Å; L200-F211 HydrophobicContact CD1-CD1 4.25Å; L200-F211 HydrophobicContact CD1-CE1 3.6Å; L200-F211 HydrophobicContact CD1-CZ 3.8Å; W202-F211 HydrophobicContact CH2-CB 3.78Å; W202-F211 HydrophobicContact CH2-CD1 4.42Å; W202-F211 AromaticContact CH2-CD2 3.35Å; W202-F211 HydrophobicContact CH2-CD2 3.35Å; W202-F211 HydrophobicContact CH2-CE2 4Å; W202-F211 AromaticContact CH2-CG 3.6Å; W202-F211 HydrophobicContact CH2-CG 3.6Å; W202-F211 HydrophobicContact CZ2-CB 3.47Å; W202-F211 VanDerWaalsContact CZ2-CB 3.47Å; W202-F211 AromaticContact CZ2-CD1 3.7Å; W202-F211 HydrophobicContact CZ2-CD1 3.7Å; W202-F211 AromaticContact CZ2-CD2 3.49Å; W202-F211 HydrophobicContact CZ2-CD2 3.49Å; W202-F211 VanDerWaalsContact CZ2-CD2 3.49Å; W202-F211 HydrophobicContact CZ2-CE1 4.28Å; W202-F211 HydrophobicContact CZ2-CE2 4.11Å; W202-F211 AromaticContact CZ2-CG 3.25Å; W202-F211 HydrophobicContact CZ2-CG 3.25Å; W202-F211 HydrophobicContact CZ2-CZ 4.46Å; W207-F211 WeakPolarHBondContact O-CB 3.44Å; W207-F211 PolarHBondContact O-N 3.08Å; S208-F211 PolarHBondContact O-N 3.47Å; A209-F211 VanDerWaalsContact C-N 3.26Å; A209-F211 PolarHBondContact O-N 3.15Å; F211-V213 VanDerWaalsContact C-N 3.32Å; F211-V213 PolarHBondContact O-N 3.35Å; F211-Y214 VanDerWaalsContact CA-CD1 3.45Å; F211-Y214 VanDerWaalsContact CA-CE1 3.45Å; F211-Y214 HydrophobicContact CB-CE1 4.07Å; F211-Y214 AromaticContact CD2-CE1 3.47Å; F211-Y214 HydrophobicContact CD2-CE1 3.47Å; F211-Y214 VanDerWaalsContact CD2-CE1 3.47Å; F211-Y214 AromaticContact CD2-CZ 3.57Å; F211-Y214 WeakPolarHBondContact CD2-OH 3.26Å; F211-Y214 HydrophobicContact CE2-CE1 4.28Å; F211-Y214 AromaticContact CE2-CZ 3.91Å; F211-Y214 WeakPolarHBondContact CE2-OH 3.34Å; F211-Y214 HydrophobicContact CG-CE1 4.09Å; F211-Y214 WeakPolarHBondContact O-CD1 3.42Å; F211-Y214 PolarHBondContact O-N 3.01Å; F211-T215 HydrophobicContact CD1-CG2 4.22Å; F211-T215 HydrophobicContact CD2-CG2 3.94Å; F211-T215 HydrophobicContact CE1-CG2 3.99Å; F211-T215 HydrophobicContact CE2-CG2 3.69Å; F211-T215 HydrophobicContact CG-CG2 4.2Å; F211-T215 HydrophobicContact CZ-CG2 3.71Å; F211-T215 VanDerWaalsContact O-CB 3.28Å; F211-T215 WeakPolarHBondContact O-CB 3.37Å; F211-T215 WeakPolarHBondContact O-CG2 3.49Å; F211-T215 PolarHBondContact O-N 3.41Å; F211-T215 PolarHBondContact O-OG1 2.94Å |
| 212 | V | 93.1 | Very high | 92.7 | Very high | 4 Ų | 4 | 57.9 Ų | 57.9 | 2% | 0.024 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 179.1 | 170.1 | 0 | 0 | 0 | 0 | 111.8 | S208 A209 T215 F216 Q279 L280 L283 | S208-V212 VanDerWaalsContact O-CG2 3.31Å; S208-V212 WeakPolarHBondContact O-CG2 3.29Å; S208-V212 PolarHBondContact O-N 2.88Å; A209-V212 PolarHBondContact O-N 2.85Å; V212-T215 WeakPolarHBondContact CA-OG1 3.28Å; V212-T215 PolarHBondContact O-OG1 2.92Å; V212-F216 VanDerWaalsContact O-CB 3.24Å; V212-F216 WeakPolarHBondContact O-CB 3.29Å; V212-F216 PolarHBondContact O-N 3.2Å; V212-Q279 HydrophobicContact CB-CG 4.2Å; V212-Q279 HydrophobicContact CG1-CB 4.34Å; V212-Q279 HydrophobicContact CG1-CG 3.7Å; V212-Q279 HydrophobicContact CG2-CG 3.51Å; V212-L280 HydrophobicContact CG1-CD2 3.79Å; V212-L280 HydrophobicContact CG1-CG 4.04Å; V212-L283 HydrophobicContact CB-CD1 4Å; V212-L283 HydrophobicContact CB-CD2 4.36Å; V212-L283 HydrophobicContact CB-CG 4.45Å; V212-L283 HydrophobicContact CG1-CD1 3.87Å; V212-L283 HydrophobicContact CG1-CG 4.34Å; V212-L283 HydrophobicContact CG2-CD2 4.1Å |
| 213 | V | 94.4 | Very high | 92.8 | Very high | 65 Ų | 65 | 55.6 Ų | 55.6 | 39% | 0.394 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68.1 | -48.9 | -179.1 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | A209 V210 F211 T215 F216 L217 L280 | A209-V213 WeakPolarHBondContact O-CB 3.19Å; A209-V213 VanDerWaalsContact O-CG2 3.26Å; A209-V213 WeakPolarHBondContact O-CG2 3.39Å; A209-V213 PolarHBondContact O-N 3.34Å; V210-V213 PolarHBondContact O-N 3.46Å; F211-V213 VanDerWaalsContact C-N 3.32Å; F211-V213 PolarHBondContact O-N 3.35Å; V213-T215 VanDerWaalsContact C-N 3.34Å; V213-T215 PolarHBondContact O-N 3.42Å; V213-F216 PolarHBondContact O-N 3.05Å; V213-L217 HydrophobicContact CG1-CD1 4.06Å; V213-L217 HydrophobicContact CG1-CG 4.43Å; V213-L217 VanDerWaalsContact O-CG 3.28Å; V213-L217 WeakPolarHBondContact O-CG 3.47Å; V213-L217 PolarHBondContact O-N 3.28Å; V213-L280 HydrophobicContact CG2-CD2 4.46Å |
| 214 | Y | 95.4 | Very high | 92.8 | Very high | 55 Ų | 55 | 52.5 Ų | 52.5 | 22% | 0.216 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67.4 | -38.5 | -178.7 | 89.8 | -110.8 | 0 | 0 | 0 | 111.3 | V177 V210 F211 F216 L217 L218 | V177-Y214 HydrophobicContact CG1-CD2 4.45Å; V177-Y214 HydrophobicContact CG1-CE2 3.79Å; V177-Y214 PolarHBondContact O-OH 3.07Å; V210-Y214 HydrophobicContact CG1-CD1 4.43Å; V210-Y214 WeakPolarHBondContact O-CD1 3.34Å; V210-Y214 PolarHBondContact O-N 2.99Å; F211-Y214 VanDerWaalsContact CA-CD1 3.45Å; F211-Y214 VanDerWaalsContact CA-CE1 3.45Å; F211-Y214 HydrophobicContact CB-CE1 4.07Å; F211-Y214 AromaticContact CD2-CE1 3.47Å; F211-Y214 HydrophobicContact CD2-CE1 3.47Å; F211-Y214 VanDerWaalsContact CD2-CE1 3.47Å; F211-Y214 AromaticContact CD2-CZ 3.57Å; F211-Y214 WeakPolarHBondContact CD2-OH 3.26Å; F211-Y214 HydrophobicContact CE2-CE1 4.28Å; F211-Y214 AromaticContact CE2-CZ 3.91Å; F211-Y214 WeakPolarHBondContact CE2-OH 3.34Å; F211-Y214 HydrophobicContact CG-CE1 4.09Å; F211-Y214 WeakPolarHBondContact O-CD1 3.42Å; F211-Y214 PolarHBondContact O-N 3.01Å; Y214-F216 VanDerWaalsContact C-N 3.33Å; Y214-L217 PolarHBondContact O-N 3.08Å; Y214-L218 HydrophobicContact CD2-CD1 4.05Å; Y214-L218 WeakPolarHBondContact O-CB 3.3Å; Y214-L218 WeakPolarHBondContact O-CG 3.4Å; Y214-L218 PolarHBondContact O-N 3.02Å |
| 215 | T | 94.3 | Very high | 92.9 | Very high | 8 Ų | 8 | 52.1 Ų | 52.1 | 5% | 0.049 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 178.2 | 56.1 | 0 | 0 | 0 | 0 | 110.6 | M130 F131 F211 V212 V213 G219 | M130-T215 HydrophobicContact CE-CG2 4.48Å; F131-T215 HydrophobicContact CZ-CG2 3.96Å; F211-T215 HydrophobicContact CD1-CG2 4.22Å; F211-T215 HydrophobicContact CD2-CG2 3.94Å; F211-T215 HydrophobicContact CE1-CG2 3.99Å; F211-T215 HydrophobicContact CE2-CG2 3.69Å; F211-T215 HydrophobicContact CG-CG2 4.2Å; F211-T215 HydrophobicContact CZ-CG2 3.71Å; F211-T215 VanDerWaalsContact O-CB 3.28Å; F211-T215 WeakPolarHBondContact O-CB 3.37Å; F211-T215 WeakPolarHBondContact O-CG2 3.49Å; F211-T215 PolarHBondContact O-N 3.41Å; F211-T215 PolarHBondContact O-OG1 2.94Å; V212-T215 WeakPolarHBondContact CA-OG1 3.28Å; V212-T215 PolarHBondContact O-OG1 2.92Å; V213-T215 VanDerWaalsContact C-N 3.34Å; V213-T215 PolarHBondContact O-N 3.42Å; T215-G219 WeakPolarHBondContact O-CA 3.18Å; T215-G219 PolarHBondContact O-N 3.33Å |
| 216 | F | 95.1 | Very high | 93.3 | Very high | 46 Ų | 46 | 49.1 Ų | 49.1 | 20% | 0.202 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.6 | -46.5 | 170.2 | 170 | -108.3 | 0 | 0 | 0 | 112.8 | V212 V213 Y214 F220 L221 Y276 L280 | V212-F216 VanDerWaalsContact O-CB 3.24Å; V212-F216 WeakPolarHBondContact O-CB 3.29Å; V212-F216 PolarHBondContact O-N 3.2Å; V213-F216 PolarHBondContact O-N 3.05Å; Y214-F216 VanDerWaalsContact C-N 3.33Å; F216-F220 HydrophobicContact CD2-CB 4.16Å; F216-F220 HydrophobicContact CD2-CD1 4.11Å; F216-F220 HydrophobicContact CD2-CG 4.46Å; F216-F220 HydrophobicContact CE2-CB 4.41Å; F216-F220 AromaticContact CE2-CD1 3.51Å; F216-F220 HydrophobicContact CE2-CD1 3.51Å; F216-F220 HydrophobicContact CE2-CE1 4.17Å; F216-F220 HydrophobicContact CE2-CG 4.28Å; F216-F220 HydrophobicContact CZ-CD1 4.26Å; F216-F220 WeakPolarHBondContact O-CA 3.26Å; F216-F220 VanDerWaalsContact O-CB 3.31Å; F216-F220 WeakPolarHBondContact O-CB 3.41Å; F216-F220 PolarHBondContact O-N 3.37Å; F216-L221 HydrophobicContact CE1-CB 4.18Å; F216-L221 HydrophobicContact CE1-CD2 4.25Å; F216-L221 HydrophobicContact CZ-CB 4.26Å; F216-L221 PolarHBondContact O-N 2.82Å; F216-Y276 HydrophobicContact CB-CD1 3.86Å; F216-Y276 HydrophobicContact CB-CE1 4.25Å; F216-Y276 AromaticContact CD2-CD1 3.95Å; F216-Y276 HydrophobicContact CD2-CD1 3.95Å; F216-Y276 HydrophobicContact CD2-CD2 4.46Å; F216-Y276 AromaticContact CD2-CG 3.78Å; F216-Y276 HydrophobicContact CD2-CG 3.78Å; F216-Y276 HydrophobicContact CG-CD1 4.43Å; F216-L280 HydrophobicContact CD1-CD1 4.41Å; F216-L280 HydrophobicContact CD2-CD1 4.26Å; F216-L280 HydrophobicContact CE2-CD1 4.39Å; F216-L280 HydrophobicContact CG-CD1 4.24Å |
| 217 | L | 95.9 | Very high | 93.3 | Very high | 66 Ų | 66 | 46.8 Ų | 46.8 | 35% | 0.346 | 25% | 0.251 | S | S | . | . | I | π-helix | trans | -64.1 | -50.6 | -179 | -69.8 | 175.8 | 0 | 0 | 0 | 111.8 | V213 Y214 L221 L222 | V213-L217 HydrophobicContact CG1-CD1 4.06Å; V213-L217 HydrophobicContact CG1-CG 4.43Å; V213-L217 VanDerWaalsContact O-CG 3.28Å; V213-L217 WeakPolarHBondContact O-CG 3.47Å; V213-L217 PolarHBondContact O-N 3.28Å; Y214-L217 PolarHBondContact O-N 3.08Å; L217-L221 HydrophobicContact CD2-CB 4.39Å; L217-L221 HydrophobicContact CD2-CD2 3.67Å; L217-L221 PolarHBondContact O-N 3.42Å; L217-L222 WeakPolarHBondContact O-CB 3.39Å; L217-L222 WeakPolarHBondContact O-CG 3.33Å; L217-L222 PolarHBondContact O-N 2.95Å |
| 218 | L | 94.9 | Very high | 93.1 | Very high | 63 Ų | 63 | 41.5 Ų | 41.5 | 33% | 0.33 | 24% | 0.239 | S | C | . | . | I | π-helix | trans | -78.5 | -34.9 | -176.5 | -65.8 | -178.7 | 0 | 0 | 0 | 113 | F131 V177 Y214 L222 P223 | F131-L218 HydrophobicContact CE1-CB 4.11Å; V177-L218 HydrophobicContact CG1-CD1 4.01Å; V177-L218 HydrophobicContact CG2-CD1 4.2Å; Y214-L218 HydrophobicContact CD2-CD1 4.05Å; Y214-L218 WeakPolarHBondContact O-CB 3.3Å; Y214-L218 WeakPolarHBondContact O-CG 3.4Å; Y214-L218 PolarHBondContact O-N 3.02Å; L218-L222 HydrophobicContact CD2-CD1 4.08Å; L218-P223 VanDerWaalsContact O-CD 3.3Å; L218-P223 WeakPolarHBondContact O-CD 3.37Å; L218-P223 WeakPolarHBondContact O-CG 3.43Å |
| 219 | G | 92.2 | Very high | 93 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | I | π-helix | trans | -91 | -12.5 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | T215 Y276 | T215-G219 WeakPolarHBondContact O-CA 3.18Å; T215-G219 PolarHBondContact O-N 3.33Å; G219-Y276 VanDerWaalsContact C-OH 3.27Å; G219-Y276 WeakPolarHBondContact CA-OH 3.07Å; G219-Y276 PolarHBondContact O-OH 3.33Å |
| 220 | F | 92.8 | Very high | 92.9 | Very high | 19 Ų | 19 | 43.4 Ų | 43.4 | 8% | 0.083 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -140.4 | -65.3 | -178.1 | -173.5 | -97.4 | 0 | 0 | 0 | 113.8 | F216 P223 V224 F268 V269 W272 M273 Y276 | F216-F220 HydrophobicContact CD2-CB 4.16Å; F216-F220 HydrophobicContact CD2-CD1 4.11Å; F216-F220 HydrophobicContact CD2-CG 4.46Å; F216-F220 HydrophobicContact CE2-CB 4.41Å; F216-F220 AromaticContact CE2-CD1 3.51Å; F216-F220 HydrophobicContact CE2-CD1 3.51Å; F216-F220 HydrophobicContact CE2-CE1 4.17Å; F216-F220 HydrophobicContact CE2-CG 4.28Å; F216-F220 HydrophobicContact CZ-CD1 4.26Å; F216-F220 WeakPolarHBondContact O-CA 3.26Å; F216-F220 VanDerWaalsContact O-CB 3.31Å; F216-F220 WeakPolarHBondContact O-CB 3.41Å; F216-F220 PolarHBondContact O-N 3.37Å; F220-P223 WeakPolarHBondContact O-CD 3.28Å; F220-V224 HydrophobicContact CD2-CG2 4.38Å; F220-V224 HydrophobicContact CE2-CG2 4.33Å; F220-V224 HydrophobicContact CZ-CG2 4.44Å; F220-V224 VanDerWaalsContact O-CB 3.29Å; F220-V224 WeakPolarHBondContact O-CB 3.46Å; F220-V224 WeakPolarHBondContact O-CG2 3.46Å; F220-V224 PolarHBondContact O-N 3.37Å; F220-F268 AromaticContact CD2-CE1 3.96Å; F220-F268 HydrophobicContact CD2-CE1 3.96Å; F220-F268 HydrophobicContact CE2-CE1 4.41Å; F220-V269 HydrophobicContact CE2-CG2 4.5Å; F220-V269 HydrophobicContact CZ-CG1 4.21Å; F220-V269 HydrophobicContact CZ-CG2 4.47Å; F220-W272 HydrophobicContact CD2-CB 3.92Å; F220-W272 HydrophobicContact CE2-CB 4.14Å; F220-M273 HydrophobicContact CE2-CB 3.92Å; F220-M273 HydrophobicContact CZ-CB 3.67Å; F220-M273 HydrophobicContact CZ-CG 4.13Å; F220-Y276 HydrophobicContact CB-CD2 3.68Å; F220-Y276 HydrophobicContact CB-CE2 3.47Å; F220-Y276 VanDerWaalsContact CB-CE2 3.47Å; F220-Y276 HydrophobicContact CB-CG 4.38Å; F220-Y276 AromaticContact CD2-CD2 3.84Å; F220-Y276 HydrophobicContact CD2-CD2 3.84Å; F220-Y276 AromaticContact CD2-CE2 3.97Å; F220-Y276 HydrophobicContact CD2-CE2 3.97Å; F220-Y276 AromaticContact CG-CD2 3.85Å; F220-Y276 HydrophobicContact CG-CD2 3.85Å; F220-Y276 HydrophobicContact CG-CE2 4.02Å |
| 221 | L | 94.3 | Very high | 92.3 | Very high | 63 Ų | 63 | 40.3 Ų | 40.3 | 33% | 0.33 | 22% | 0.222 | S | C | . | . | I | π-helix | trans | -64.4 | -54.6 | -166.9 | -177.4 | 63.5 | 0 | 0 | 0 | 112.7 | F216 L217 V224 L225 | F216-L221 HydrophobicContact CE1-CB 4.18Å; F216-L221 HydrophobicContact CE1-CD2 4.25Å; F216-L221 HydrophobicContact CZ-CB 4.26Å; F216-L221 PolarHBondContact O-N 2.82Å; L217-L221 HydrophobicContact CD2-CB 4.39Å; L217-L221 HydrophobicContact CD2-CD2 3.67Å; L217-L221 PolarHBondContact O-N 3.42Å; L221-V224 PolarHBondContact O-N 3.4Å; L221-L225 HydrophobicContact CD1-CD1 4.08Å; L221-L225 HydrophobicContact CD1-CG 4.26Å; L221-L225 HydrophobicContact CG-CD1 4.02Å; L221-L225 WeakPolarHBondContact O-CB 3.23Å; L221-L225 VanDerWaalsContact O-CG 3.26Å; L221-L225 WeakPolarHBondContact O-CG 2.98Å; L221-L225 PolarHBondContact O-N 3.33Å |
| 222 | L | 94.9 | Very high | 91.9 | Very high | 92 Ų | 92 | 45.2 Ų | 45.2 | 48% | 0.482 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.4 | -44.8 | -178.1 | -67.2 | 171.7 | 0 | 0 | 0 | 112.1 | L217 L218 L225 A226 | L217-L222 WeakPolarHBondContact O-CB 3.39Å; L217-L222 WeakPolarHBondContact O-CG 3.33Å; L217-L222 PolarHBondContact O-N 2.95Å; L218-L222 HydrophobicContact CD2-CD1 4.08Å; L222-L225 PolarHBondContact O-N 3.5Å; L222-A226 WeakPolarHBondContact O-CB 3.17Å; L222-A226 PolarHBondContact O-N 2.96Å |
| 223 | P | 92.8 | Very high | 91.7 | Very high | 7 Ų | 7 | 48.9 Ų | 48.9 | 5% | 0.045 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60 | -45.5 | 172.9 | -26.4 | 34.6 | 0 | 0 | 0 | 114.1 | V134 L218 F220 L225 A226 I227 | V134-P223 HydrophobicContact CG1-CG 4.23Å; V134-P223 HydrophobicContact CG2-CB 3.25Å; V134-P223 HydrophobicContact CG2-CG 3.54Å; L218-P223 VanDerWaalsContact O-CD 3.3Å; L218-P223 WeakPolarHBondContact O-CD 3.37Å; L218-P223 WeakPolarHBondContact O-CG 3.43Å; F220-P223 WeakPolarHBondContact O-CD 3.28Å; P223-L225 VanDerWaalsContact C-N 3.31Å; P223-L225 PolarHBondContact O-N 3.28Å; P223-A226 PolarHBondContact O-N 3.23Å; P223-I227 HydrophobicContact CB-CD1 4.49Å; P223-I227 VanDerWaalsContact O-CB 3.27Å; P223-I227 WeakPolarHBondContact O-CB 3.45Å; P223-I227 WeakPolarHBondContact O-CD1 3.16Å; P223-I227 WeakPolarHBondContact O-CG1 3.32Å; P223-I227 PolarHBondContact O-N 3.2Å |
| 224 | V | 91.1 | Very high | 91.2 | Very high | 33 Ų | 33 | 45.9 Ų | 45.9 | 20% | 0.2 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.2 | -41.4 | 179.3 | 168.5 | 0 | 0 | 0 | 0 | 110.9 | F220 L221 G228 F268 V269 | F220-V224 HydrophobicContact CD2-CG2 4.38Å; F220-V224 HydrophobicContact CE2-CG2 4.33Å; F220-V224 HydrophobicContact CZ-CG2 4.44Å; F220-V224 VanDerWaalsContact O-CB 3.29Å; F220-V224 WeakPolarHBondContact O-CB 3.46Å; F220-V224 WeakPolarHBondContact O-CG2 3.46Å; F220-V224 PolarHBondContact O-N 3.37Å; L221-V224 PolarHBondContact O-N 3.4Å; V224-G228 PolarHBondContact O-N 3.31Å; V224-F268 HydrophobicContact CG2-CD1 4.05Å; V224-F268 HydrophobicContact CG2-CE1 3.89Å; V224-V269 HydrophobicContact CG1-CG2 4.17Å; V224-V269 HydrophobicContact CG2-CG2 3.85Å |
| 225 | L | 92.7 | Very high | 90.5 | Very high | 103 Ų | 103 | 45.3 Ų | 45.3 | 54% | 0.539 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.9 | -46.5 | 175.3 | -69.3 | 174.3 | 0 | 0 | 0 | 112.1 | L221 L222 P223 I227 G228 L229 | L221-L225 HydrophobicContact CD1-CD1 4.08Å; L221-L225 HydrophobicContact CD1-CG 4.26Å; L221-L225 HydrophobicContact CG-CD1 4.02Å; L221-L225 WeakPolarHBondContact O-CB 3.23Å; L221-L225 VanDerWaalsContact O-CG 3.26Å; L221-L225 WeakPolarHBondContact O-CG 2.98Å; L221-L225 PolarHBondContact O-N 3.33Å; L222-L225 PolarHBondContact O-N 3.5Å; P223-L225 VanDerWaalsContact C-N 3.31Å; P223-L225 PolarHBondContact O-N 3.28Å; L225-I227 PolarHBondContact O-N 3.37Å; L225-G228 PolarHBondContact O-N 2.92Å; L225-L229 WeakPolarHBondContact O-CB 3.38Å; L225-L229 PolarHBondContact O-N 3.43Å |
| 226 | A | 92.8 | Very high | 90 | Very high | 41 Ų | 41 | 46.7 Ų | 46.7 | 34% | 0.339 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.2 | -44.7 | 179 | 0 | 0 | 0 | 0 | 0 | 111.6 | T138 L222 P223 L229 C230 | T138-A226 HydrophobicContact CG2-CB 4.3Å; L222-A226 WeakPolarHBondContact O-CB 3.17Å; L222-A226 PolarHBondContact O-N 2.96Å; P223-A226 PolarHBondContact O-N 3.23Å; A226-L229 PolarHBondContact O-N 3.5Å; A226-C230 PolarHBondContact O-N 2.96Å; A226-C230 PolarHBondContact O-SG 3.46Å |
| 227 | I | 89.6 | Confident | 89.4 | Confident | 4 Ų | 4 | 48.9 Ų | 48.9 | 2% | 0.021 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.5 | -46.7 | 177.1 | -66.2 | 166.2 | 0 | 0 | 0 | 110.4 | L137 T138 S141 P223 L225 L229 C230 Y231 V265 | L137-I227 HydrophobicContact CB-CD1 4.37Å; T138-I227 HydrophobicContact CG2-CG1 4.41Å; S141-I227 WeakPolarHBondContact OG-CG2 3.27Å; P223-I227 HydrophobicContact CB-CD1 4.49Å; P223-I227 VanDerWaalsContact O-CB 3.27Å; P223-I227 WeakPolarHBondContact O-CB 3.45Å; P223-I227 WeakPolarHBondContact O-CD1 3.16Å; P223-I227 WeakPolarHBondContact O-CG1 3.32Å; P223-I227 PolarHBondContact O-N 3.2Å; L225-I227 PolarHBondContact O-N 3.37Å; I227-L229 VanDerWaalsContact C-N 3.35Å; I227-L229 PolarHBondContact O-N 3.4Å; I227-C230 WeakPolarHBondContact O-CB 3.43Å; I227-C230 PolarHBondContact O-N 2.88Å; I227-Y231 HydrophobicContact CG2-CD2 3.62Å; I227-Y231 HydrophobicContact CG2-CE2 3.38Å; I227-Y231 WeakPolarHBondContact O-CD2 3.36Å; I227-Y231 PolarHBondContact O-N 2.92Å; I227-V265 HydrophobicContact CG2-CG1 4.47Å; I227-V265 HydrophobicContact CG2-CG2 3.29Å |
| 228 | G | 87.6 | Confident | 88.5 | Confident | 27 Ų | 27 | 47.1 Ų | 47.1 | 28% | 0.278 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -55.7 | -47.8 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | V224 L225 C230 Y231 L232 | V224-G228 PolarHBondContact O-N 3.31Å; L225-G228 PolarHBondContact O-N 2.92Å; G228-C230 PolarHBondContact O-N 3.21Å; G228-Y231 PolarHBondContact O-N 2.82Å; G228-L232 WeakPolarHBondContact O-CG 3.49Å; G228-L232 PolarHBondContact O-N 3.34Å |
| 229 | L | 89.9 | Confident | 87.7 | Confident | 101 Ų | 101 | 52.6 Ų | 52.6 | 53% | 0.529 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.9 | -46.6 | 176 | 179.2 | 61.5 | 0 | 0 | 0 | 111.9 | L225 A226 I227 Y231 L232 L233 | L225-L229 WeakPolarHBondContact O-CB 3.38Å; L225-L229 PolarHBondContact O-N 3.43Å; A226-L229 PolarHBondContact O-N 3.5Å; I227-L229 VanDerWaalsContact C-N 3.35Å; I227-L229 PolarHBondContact O-N 3.4Å; L229-Y231 PolarHBondContact O-N 2.91Å; L229-L232 PolarHBondContact O-N 2.93Å; L229-L233 HydrophobicContact CD1-CD1 4.31Å; L229-L233 HydrophobicContact CD1-CG 4.24Å; L229-L233 HydrophobicContact CG-CD1 4.21Å; L229-L233 VanDerWaalsContact O-CG 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.12Å; L229-L233 PolarHBondContact O-N 3.39Å |
| 230 | C | 88.8 | Confident | 87.2 | Confident | 17 Ų | 17 | 54.4 Ų | 54.4 | 12% | 0.115 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -54.3 | -43.3 | 175.9 | -71.3 | 0 | 0 | 0 | 0 | 111.3 | A226 I227 G228 L233 I234 | A226-C230 PolarHBondContact O-N 2.96Å; A226-C230 PolarHBondContact O-SG 3.46Å; I227-C230 WeakPolarHBondContact O-CB 3.43Å; I227-C230 PolarHBondContact O-N 2.88Å; G228-C230 PolarHBondContact O-N 3.21Å; C230-L233 PolarHBondContact O-N 3.25Å; C230-I234 WeakPolarHBondContact O-CD1 3.47Å; C230-I234 WeakPolarHBondContact O-CG1 3.21Å; C230-I234 PolarHBondContact O-N 2.81Å |
| 231 | Y | 82.4 | Confident | 86.4 | Confident | 9 Ų | 9 | 56.9 Ų | 56.9 | 4% | 0.035 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -72.3 | -38.8 | 179.3 | -76.2 | -61.2 | 0 | 0 | 0 | 114.1 | S141 I227 G228 L229 L233 I234 V235 V261 L262 V265 | S141-Y231 WeakPolarHBondContact CA-OH 3.31Å; S141-Y231 WeakPolarHBondContact CB-OH 3.4Å; S141-Y231 PolarHBondContact OG-OH 2.81Å; S141-Y231 VanDerWaalsContact OG-OH 3.06Å; I227-Y231 HydrophobicContact CG2-CD2 3.62Å; I227-Y231 HydrophobicContact CG2-CE2 3.38Å; I227-Y231 WeakPolarHBondContact O-CD2 3.36Å; I227-Y231 PolarHBondContact O-N 2.92Å; G228-Y231 PolarHBondContact O-N 2.82Å; L229-Y231 PolarHBondContact O-N 2.91Å; Y231-L233 VanDerWaalsContact C-N 3.26Å; Y231-L233 PolarHBondContact O-N 3.27Å; Y231-I234 HydrophobicContact CD1-CD1 3.81Å; Y231-I234 HydrophobicContact CE1-CD1 3.74Å; Y231-I234 PolarHBondContact O-N 3.14Å; Y231-V235 WeakPolarHBondContact O-CB 3.35Å; Y231-V235 WeakPolarHBondContact O-CG2 3.39Å; Y231-V235 PolarHBondContact O-N 2.86Å; Y231-V261 HydrophobicContact CE1-CB 3.72Å; Y231-V261 HydrophobicContact CE1-CG1 4.17Å; Y231-V261 HydrophobicContact CE1-CG2 4.33Å; Y231-V261 HydrophobicContact CE2-CB 4.1Å; Y231-V261 HydrophobicContact CE2-CG1 3.7Å; Y231-V261 WeakPolarHBondContact OH-CB 3.17Å; Y231-V261 WeakPolarHBondContact OH-CG1 3.4Å; Y231-L262 HydrophobicContact CG-CD2 4.44Å; Y231-V265 HydrophobicContact CD2-CG2 4.25Å; Y231-V265 HydrophobicContact CE2-CG2 3.96Å |
| 232 | L | 85.4 | Confident | 85.3 | Confident | 127 Ų | 127 | 55.3 Ų | 55.3 | 67% | 0.665 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -57.9 | -43.5 | 173.5 | -70 | 174.6 | 0 | 0 | 0 | 110.7 | G228 L229 V235 G236 | G228-L232 WeakPolarHBondContact O-CG 3.49Å; G228-L232 PolarHBondContact O-N 3.34Å; L229-L232 PolarHBondContact O-N 2.93Å; L232-V235 PolarHBondContact O-N 3.49Å; L232-G236 PolarHBondContact O-N 2.81Å |
| 233 | L | 88.6 | Confident | 84.2 | Confident | 80 Ų | 80 | 58.3 Ų | 58.3 | 42% | 0.419 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -66.6 | -42.1 | 176.7 | -64.7 | 175 | 0 | 0 | 0 | 112.6 | Y145 L229 C230 Y231 G236 K237 | Y145-L233 HydrophobicContact CD2-CB 4.11Å; Y145-L233 HydrophobicContact CE2-CB 3.73Å; Y145-L233 HydrophobicContact CE2-CD1 3.83Å; Y145-L233 HydrophobicContact CE2-CG 4.45Å; L229-L233 HydrophobicContact CD1-CD1 4.31Å; L229-L233 HydrophobicContact CD1-CG 4.24Å; L229-L233 HydrophobicContact CG-CD1 4.21Å; L229-L233 VanDerWaalsContact O-CG 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.12Å; L229-L233 PolarHBondContact O-N 3.39Å; C230-L233 PolarHBondContact O-N 3.25Å; Y231-L233 VanDerWaalsContact C-N 3.26Å; Y231-L233 PolarHBondContact O-N 3.27Å; L233-G236 PolarHBondContact O-N 3.49Å; L233-K237 WeakPolarHBondContact O-CB 3.47Å; L233-K237 PolarHBondContact O-N 3.01Å |
| 234 | I | 84.1 | Confident | 83.2 | Confident | 3 Ų | 3 | 68.4 Ų | 68.4 | 2% | 0.015 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -58.1 | -50.9 | 174.5 | -72.1 | 163.4 | 0 | 0 | 0 | 110.3 | R144 Y145 V148 V149 C230 Y231 G236 K237 M238 | R144-I234 HydrophobicContact CB-CD1 4.36Å; Y145-I234 HydrophobicContact CD2-CG1 4.15Å; V148-I234 HydrophobicContact CG1-CG2 4.29Å; V149-I234 HydrophobicContact CG2-CG1 4.38Å; C230-I234 WeakPolarHBondContact O-CD1 3.47Å; C230-I234 WeakPolarHBondContact O-CG1 3.21Å; C230-I234 PolarHBondContact O-N 2.81Å; Y231-I234 HydrophobicContact CD1-CD1 3.81Å; Y231-I234 HydrophobicContact CE1-CD1 3.74Å; Y231-I234 PolarHBondContact O-N 3.14Å; I234-G236 PolarHBondContact O-N 3.49Å; I234-K237 PolarHBondContact O-N 2.91Å; I234-M238 HydrophobicContact CG2-CE 3.75Å; I234-M238 HydrophobicContact CG2-CG 4.42Å; I234-M238 HydrophobicContact CG2-SD 4.08Å; I234-M238 WeakPolarHBondContact O-CB 3.49Å; I234-M238 WeakPolarHBondContact O-CG 3.48Å; I234-M238 PolarHBondContact O-N 2.61Å |
| 235 | V | 80.8 | Confident | 81.9 | Confident | 42 Ų | 42 | 69.4 Ų | 69.4 | 26% | 0.255 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.2 | -43.1 | -179.1 | 171 | 0 | 0 | 0 | 0 | 110.7 | Y231 L232 K237 M238 R239 T258 | Y231-V235 WeakPolarHBondContact O-CB 3.35Å; Y231-V235 WeakPolarHBondContact O-CG2 3.39Å; Y231-V235 PolarHBondContact O-N 2.86Å; L232-V235 PolarHBondContact O-N 3.49Å; V235-K237 PolarHBondContact O-N 3.37Å; V235-M238 PolarHBondContact O-N 3.41Å; V235-R239 HydrophobicContact CG1-CG 4.32Å; V235-R239 WeakPolarHBondContact O-CB 3.34Å; V235-R239 VanDerWaalsContact O-CG 3.3Å; V235-R239 WeakPolarHBondContact O-CG 3.36Å; V235-R239 PolarHBondContact O-N 3.32Å; V235-T258 HydrophobicContact CG2-CG2 3.93Å |
| 236 | G | 83.1 | Confident | 80.2 | Confident | 38 Ų | 38 | 67.5 Ų | 67.5 | 39% | 0.392 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -57.8 | -48.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L232 L233 I234 R239 A240 | L232-G236 PolarHBondContact O-N 2.81Å; L233-G236 PolarHBondContact O-N 3.49Å; I234-G236 PolarHBondContact O-N 3.49Å; G236-R239 PolarHBondContact O-N 3Å; G236-A240 WeakPolarHBondContact O-CB 3.32Å; G236-A240 PolarHBondContact O-N 3.46Å |
| 237 | K | 83.8 | Confident | 78.5 | Confident | 92 Ų | 92 | 73.5 Ų | 73.5 | 40% | 0.4 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.5 | -45.9 | 177.1 | -174.4 | 67.1 | 173 | -171.3 | 0 | 111.9 | V149 L233 I234 V235 R239 A240 V241 | V149-K237 HydrophobicContact CG1-CD 4.48Å; V149-K237 HydrophobicContact CG1-CG 4.36Å; V149-K237 HydrophobicContact CG2-CB 4.03Å; V149-K237 HydrophobicContact CG2-CG 4.22Å; L233-K237 WeakPolarHBondContact O-CB 3.47Å; L233-K237 PolarHBondContact O-N 3.01Å; I234-K237 PolarHBondContact O-N 2.91Å; V235-K237 PolarHBondContact O-N 3.37Å; K237-R239 VanDerWaalsContact C-N 3.34Å; K237-R239 PolarHBondContact O-N 2.82Å; K237-A240 PolarHBondContact O-N 2.84Å; K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.43Å |
| 238 | M | 76.7 | Confident | 76.9 | Confident | 29 Ų | 29 | 80.7 Ų | 80.7 | 14% | 0.143 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -62.7 | -39.6 | 178.8 | -74.8 | -173.4 | 178.7 | 0 | 0 | 112.2 | V148 I234 V235 A242 E254 T258 | V148-M238 HydrophobicContact CB-CE 4.5Å; V148-M238 HydrophobicContact CG1-CE 3.71Å; V148-M238 HydrophobicContact CG1-CG 4.15Å; V148-M238 HydrophobicContact CG2-CE 3.95Å; I234-M238 HydrophobicContact CG2-CE 3.75Å; I234-M238 HydrophobicContact CG2-CG 4.42Å; I234-M238 HydrophobicContact CG2-SD 4.08Å; I234-M238 WeakPolarHBondContact O-CB 3.49Å; I234-M238 WeakPolarHBondContact O-CG 3.48Å; I234-M238 PolarHBondContact O-N 2.61Å; V235-M238 PolarHBondContact O-N 3.41Å; M238-A242 VanDerWaalsContact O-CB 3.27Å; M238-A242 WeakPolarHBondContact O-CB 3.41Å; M238-A242 PolarHBondContact O-N 3.33Å; M238-E254 HydrophobicContact CE-CB 3.49Å; M238-E254 VanDerWaalsContact CE-CB 3.49Å; M238-E254 HydrophobicContact CE-CG 3.84Å; M238-E254 HydrophobicContact SD-CB 4Å; M238-T258 WeakPolarHBondContact CE-OG1 3.34Å; M238-T258 PolarHBondContact SD-OG1 3.5Å |
| 239 | R | 78.4 | Confident | 75.3 | Confident | 177 Ų | 177 | 86.9 Ų | 86.9 | 67% | 0.668 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -64.4 | -46.2 | 174.7 | -74 | 178.9 | -176.8 | -167.6 | 2.4 | 111.2 | V235 G236 K237 V241 A242 L243 | V235-R239 HydrophobicContact CG1-CG 4.32Å; V235-R239 WeakPolarHBondContact O-CB 3.34Å; V235-R239 VanDerWaalsContact O-CG 3.3Å; V235-R239 WeakPolarHBondContact O-CG 3.36Å; V235-R239 PolarHBondContact O-N 3.32Å; G236-R239 PolarHBondContact O-N 3Å; K237-R239 VanDerWaalsContact C-N 3.34Å; K237-R239 PolarHBondContact O-N 2.82Å; R239-V241 VanDerWaalsContact C-N 3.34Å; R239-V241 PolarHBondContact O-N 3.36Å; R239-A242 PolarHBondContact O-N 2.83Å; R239-L243 WeakPolarHBondContact O-CG 3.15Å; R239-L243 PolarHBondContact O-N 3.34Å |
| 240 | A | 81.1 | Confident | 73.6 | Confident | 39 Ų | 39 | 89.2 Ų | 89.2 | 32% | 0.322 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -60.8 | -40.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | G236 K237 R244 | G236-A240 WeakPolarHBondContact O-CB 3.32Å; G236-A240 PolarHBondContact O-N 3.46Å; K237-A240 PolarHBondContact O-N 2.84Å; A240-R244 WeakPolarHBondContact O-CG 3.37Å; A240-R244 PolarHBondContact O-N 2.87Å |
| 241 | V | 76.1 | Confident | 72.1 | Confident | 70 Ų | 70 | 94.1 Ų | 94.1 | 42% | 0.424 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -68.7 | -40.3 | 175.5 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | K237 R239 L243 R244 A245 | K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.43Å; R239-V241 VanDerWaalsContact C-N 3.34Å; R239-V241 PolarHBondContact O-N 3.36Å; V241-L243 VanDerWaalsContact C-N 3.29Å; V241-L243 PolarHBondContact O-N 3.43Å; V241-R244 PolarHBondContact O-N 2.99Å; V241-A245 PolarHBondContact O-N 3.45Å; V241-A245 VanDerWaalsContact O-N 3.09Å |
| 242 | A | 70.4 | Confident | 70.9 | Confident | 30 Ų | 30 | 102.8 Ų | 102.8 | 25% | 0.248 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -62.9 | -35.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | M238 R239 | M238-A242 VanDerWaalsContact O-CB 3.27Å; M238-A242 WeakPolarHBondContact O-CB 3.41Å; M238-A242 PolarHBondContact O-N 3.33Å; R239-A242 PolarHBondContact O-N 2.83Å |
| 243 | L | 71.8 | Confident | 69.5 | Low | 155 Ų | 155 | 100.2 Ų | 100.2 | 81% | 0.812 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -70.5 | -33 | 175.3 | -69 | 170.8 | 0 | 0 | 0 | 112.6 | R239 V241 | R239-L243 WeakPolarHBondContact O-CG 3.15Å; R239-L243 PolarHBondContact O-N 3.34Å; V241-L243 VanDerWaalsContact C-N 3.29Å; V241-L243 PolarHBondContact O-N 3.43Å |
| 244 | R | 72.1 | Confident | 68.3 | Low | 220 Ų | 220 | 98.7 Ų | 98.7 | 83% | 0.83 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -85.4 | -29.2 | -175.3 | -72 | 179.1 | -176.3 | 177.1 | 1 | 114.8 | A240 V241 | A240-R244 WeakPolarHBondContact O-CG 3.37Å; A240-R244 PolarHBondContact O-N 2.87Å; V241-R244 PolarHBondContact O-N 2.99Å |
| 245 | A | 63.7 | Low | 67.3 | Low | 53 Ų | 53 | 104.2 Ų | 104.2 | 44% | 0.438 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -127.7 | 1.6 | -162.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | V241 W247 | V241-A245 PolarHBondContact O-N 3.45Å; V241-A245 VanDerWaalsContact O-N 3.09Å; A245-W247 VanDerWaalsContact O-CD1 3.25Å; A245-W247 PolarHBondContact O-N 3.5Å |
| 246 | G | 57.9 | Low | 66.7 | Low | 63 Ų | 63 | 105.7 Ų | 105.7 | 65% | 0.649 | 51% | 0.511 | S | S | * | . | trans | 55.5 | 14.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | Q248 | G246-Q248 PolarHBondContact O-N 3.33Š| ||
| 247 | W | 56.4 | Low | 65.8 | Low | 168 Ų | 168 | 106.9 Ų | 106.9 | 64% | 0.636 | 51% | 0.507 | S | S | * | . | trans | -85.2 | 99.5 | -169.2 | -103.7 | 45.5 | 0 | 0 | 0 | 111.9 | A245 R250 R251 | A245-W247 VanDerWaalsContact O-CD1 3.25Å; A245-W247 PolarHBondContact O-N 3.5Å; W247-R250 HydrophobicContact CE3-CB 3.58Å; W247-R250 HydrophobicContact CE3-CG 4.29Å; W247-R250 HydrophobicContact CZ3-CB 4.04Å; W247-R250 HydrophobicContact CZ3-CG 4.47Å; W247-R251 WeakPolarHBondContact O-CB 3.16Å | ||
| 248 | Q | 56.8 | Low | 64.9 | Low | 154 Ų | 154 | 103.1 Ų | 103.1 | 72% | 0.72 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -78.4 | -30.5 | -177.3 | -79.6 | 158.2 | -37 | 0 | 0 | 114.6 | G246 | G246-Q248 PolarHBondContact O-N 3.33Å |
| 249 | Q | 52.7 | Low | 64.7 | Low | 157 Ų | 157 | 110.1 Ų | 110.1 | 73% | 0.734 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -75.6 | -44.2 | -174.1 | -160.3 | 81.7 | -20.3 | 0 | 0 | 112.7 | R251 R252 | Q249-R251 VanDerWaalsContact C-N 3.34Å; Q249-R252 PolarHBondContact O-N 2.81Å |
| 250 | R | 54.8 | Low | 64.2 | Low | 151 Ų | 151 | 102.8 Ų | 102.8 | 57% | 0.57 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -69.2 | -32.2 | 177 | -164.2 | 175.1 | -176.7 | 167.4 | 5.2 | 112 | W247 R252 E254 | W247-R250 HydrophobicContact CE3-CB 3.58Å; W247-R250 HydrophobicContact CE3-CG 4.29Å; W247-R250 HydrophobicContact CZ3-CB 4.04Å; W247-R250 HydrophobicContact CZ3-CG 4.47Å; R250-R252 VanDerWaalsContact C-N 3.35Å; R250-R252 PolarHBondContact O-N 2.92Å; R250-E254 IonicContact NE-OE1 2.8Å; R250-E254 WeakPolarHBondContact O-CB 3.2Å; R250-E254 WeakPolarHBondContact O-CG 3.31Å; R250-E254 PolarHBondContact O-N 2.89Å |
| 251 | R | 57.3 | Low | 63.4 | Low | 119 Ų | 119 | 101.4 Ų | 101.4 | 45% | 0.449 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.7 | -29.8 | 176.7 | -168.7 | 176.1 | -177.6 | -159.4 | 0.3 | 113.8 | W247 Q249 K255 | W247-R251 WeakPolarHBondContact O-CB 3.16Å; Q249-R251 VanDerWaalsContact C-N 3.34Å; R251-K255 HydrophobicContact CG-CD 4.37Å; R251-K255 VanDerWaalsContact O-CB 3.29Å; R251-K255 WeakPolarHBondContact O-CB 3.37Å; R251-K255 VanDerWaalsContact O-CG 3.24Å; R251-K255 WeakPolarHBondContact O-CG 3.15Å; R251-K255 PolarHBondContact O-N 3.49Å |
| 252 | R | 56.6 | Low | 63.2 | Low | 192 Ų | 192 | 102.2 Ų | 102.2 | 73% | 0.725 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -73 | -46.6 | 178.2 | -81.6 | -174.1 | -172.8 | 168.1 | 2.7 | 112.7 | Q249 R250 E254 K256 | Q249-R252 PolarHBondContact O-N 2.81Å; R250-R252 VanDerWaalsContact C-N 3.35Å; R250-R252 PolarHBondContact O-N 2.92Å; R252-E254 VanDerWaalsContact C-N 3.35Å; R252-K256 PolarHBondContact O-N 2.7Å; R252-K256 VanDerWaalsContact O-N 3.1Å |
| 253 | S | 57 | Low | 63.5 | Low | 73 Ų | 73 | 104 Ų | 104 | 51% | 0.51 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 176.4 | 164 | 0 | 0 | 0 | 0 | 111.3 | K256 I257 | S253-K256 PolarHBondContact O-N 3.24Å; S253-I257 WeakPolarHBondContact O-CG1 3.36Å; S253-I257 PolarHBondContact O-N 3.34Å |
| 254 | E | 62.1 | Low | 63.6 | Low | 47 Ų | 47 | 96.9 Ų | 96.9 | 22% | 0.22 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -66.3 | -44.8 | 178.7 | -80.6 | 178.5 | -168.7 | 0 | 0 | 112.6 | M238 R250 R252 K256 I257 T258 | M238-E254 HydrophobicContact CE-CB 3.49Å; M238-E254 VanDerWaalsContact CE-CB 3.49Å; M238-E254 HydrophobicContact CE-CG 3.84Å; M238-E254 HydrophobicContact SD-CB 4Å; R250-E254 IonicContact NE-OE1 2.8Å; R250-E254 WeakPolarHBondContact O-CB 3.2Å; R250-E254 WeakPolarHBondContact O-CG 3.31Å; R250-E254 PolarHBondContact O-N 2.89Å; R252-E254 VanDerWaalsContact C-N 3.35Å; E254-K256 VanDerWaalsContact C-N 3.32Å; E254-K256 PolarHBondContact O-N 3.48Å; E254-I257 PolarHBondContact O-N 2.94Å; E254-T258 PolarHBondContact O-N 3.42Å; E254-T258 PolarHBondContact O-OG1 3.26Å |
| 255 | K | 64.1 | Low | 63.7 | Low | 119 Ų | 119 | 87.5 Ų | 87.5 | 52% | 0.517 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.1 | -38.2 | 173.7 | -81.9 | -179.1 | 177.3 | -172.5 | 0 | 113.1 | R251 I257 T258 R259 | R251-K255 HydrophobicContact CG-CD 4.37Å; R251-K255 VanDerWaalsContact O-CB 3.29Å; R251-K255 WeakPolarHBondContact O-CB 3.37Å; R251-K255 VanDerWaalsContact O-CG 3.24Å; R251-K255 WeakPolarHBondContact O-CG 3.15Å; R251-K255 PolarHBondContact O-N 3.49Å; K255-I257 VanDerWaalsContact C-N 3.33Å; K255-T258 PolarHBondContact O-N 2.88Å; K255-R259 VanDerWaalsContact O-CB 3.27Å; K255-R259 WeakPolarHBondContact O-CB 3.28Å; K255-R259 PolarHBondContact O-N 3.3Å |
| 256 | K | 67.6 | Low | 64.7 | Low | 73 Ų | 73 | 87.3 Ų | 87.3 | 32% | 0.317 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.3 | -42.8 | 177.2 | -177.2 | 178.7 | 174.9 | -178 | 0 | 110.9 | R252 S253 E254 L260 L314 D316 | R252-K256 PolarHBondContact O-N 2.7Å; R252-K256 VanDerWaalsContact O-N 3.1Å; S253-K256 PolarHBondContact O-N 3.24Å; E254-K256 VanDerWaalsContact C-N 3.32Å; E254-K256 PolarHBondContact O-N 3.48Å; K256-L260 WeakPolarHBondContact O-CB 3.41Å; K256-L260 PolarHBondContact O-N 3.48Å; K256-L314 WeakPolarHBondContact CE-O 3.28Å; K256-D316 IonicContact NZ-OD1 2.75Å; K256-D316 PolarHBondContact NZ-OD1 2.94Å; K256-D316 IonicContact NZ-OD2 2.67Å; K256-D316 PolarHBondContact NZ-OD2 3.25Å |
| 257 | I | 64.3 | Low | 66 | Low | 63 Ų | 63 | 86 Ų | 86 | 32% | 0.323 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -69.2 | -43.9 | 178.2 | -64.3 | 168.6 | 0 | 0 | 0 | 110.9 | S253 E254 K255 R259 L260 V261 | S253-I257 WeakPolarHBondContact O-CG1 3.36Å; S253-I257 PolarHBondContact O-N 3.34Å; E254-I257 PolarHBondContact O-N 2.94Å; K255-I257 VanDerWaalsContact C-N 3.33Å; I257-R259 PolarHBondContact O-N 3.28Å; I257-L260 WeakPolarHBondContact O-CB 3.28Å; I257-L260 PolarHBondContact O-N 2.69Å; I257-V261 WeakPolarHBondContact O-CG2 3.46Å; I257-V261 PolarHBondContact O-N 2.9Å; I257-V261 VanDerWaalsContact O-N 3.12Å |
| 258 | T | 66.3 | Low | 67.4 | Low | 14 Ų | 14 | 78.1 Ų | 78.1 | 9% | 0.086 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 175.5 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | V235 M238 E254 K255 V261 L262 | V235-T258 HydrophobicContact CG2-CG2 3.93Å; M238-T258 WeakPolarHBondContact CE-OG1 3.34Å; M238-T258 PolarHBondContact SD-OG1 3.5Å; E254-T258 PolarHBondContact O-N 3.42Å; E254-T258 PolarHBondContact O-OG1 3.26Å; K255-T258 PolarHBondContact O-N 2.88Å; T258-V261 PolarHBondContact O-N 3.46Å; T258-L262 HydrophobicContact CG2-CD1 4.16Å; T258-L262 HydrophobicContact CG2-CG 4.5Å; T258-L262 WeakPolarHBondContact O-CB 3.5Å; T258-L262 WeakPolarHBondContact O-CG 3.26Å; T258-L262 PolarHBondContact O-N 2.97Å |
| 259 | R | 71.1 | Confident | 68.9 | Low | 176 Ų | 176 | 72.8 Ų | 72.8 | 66% | 0.664 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -62.7 | -43.5 | 175.3 | -178.8 | 178.5 | 171.1 | -178.9 | -2 | 111.5 | K255 I257 V261 L262 M263 | K255-R259 VanDerWaalsContact O-CB 3.27Å; K255-R259 WeakPolarHBondContact O-CB 3.28Å; K255-R259 PolarHBondContact O-N 3.3Å; I257-R259 PolarHBondContact O-N 3.28Å; R259-V261 PolarHBondContact O-N 2.88Å; R259-L262 PolarHBondContact O-N 3.5Å; R259-M263 WeakPolarHBondContact O-CG 3.31Å; R259-M263 PolarHBondContact O-N 2.78Å |
| 260 | L | 68 | Low | 70.8 | Confident | 22 Ų | 22 | 71.1 Ų | 71.1 | 12% | 0.115 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -53.2 | -53.6 | 175.4 | 164.5 | 56.4 | 0 | 0 | 0 | 110.5 | K256 I257 M263 V264 L310 L314 | K256-L260 WeakPolarHBondContact O-CB 3.41Å; K256-L260 PolarHBondContact O-N 3.48Å; I257-L260 WeakPolarHBondContact O-CB 3.28Å; I257-L260 PolarHBondContact O-N 2.69Å; L260-M263 WeakPolarHBondContact O-CB 3.3Å; L260-M263 PolarHBondContact O-N 2.83Å; L260-M263 VanDerWaalsContact O-N 3.17Å; L260-V264 HydrophobicContact CD1-CG2 4.11Å; L260-V264 WeakPolarHBondContact O-CG2 3.38Å; L260-V264 PolarHBondContact O-N 3.01Å; L260-L310 HydrophobicContact CD1-CB 4.26Å; L260-L310 VanDerWaalsContact CD1-O 3.3Å; L260-L310 WeakPolarHBondContact CD1-O 3.42Å; L260-L314 HydrophobicContact CB-CB 4.12Å; L260-L314 HydrophobicContact CB-CD2 4.17Å; L260-L314 HydrophobicContact CD1-CB 3.51Å; L260-L314 HydrophobicContact CD1-CD1 3.56Å; L260-L314 HydrophobicContact CD1-CD2 4.39Å; L260-L314 HydrophobicContact CD1-CG 3.95Å; L260-L314 HydrophobicContact CD2-CB 3.86Å; L260-L314 HydrophobicContact CG-CB 4.02Å |
| 261 | V | 64.6 | Low | 72.5 | Confident | 10 Ų | 10 | 64.4 Ų | 64.4 | 6% | 0.061 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -77.9 | -27.5 | -173.7 | -156.3 | 0 | 0 | 0 | 0 | 113.4 | R144 Y231 I257 T258 R259 M263 V264 V265 | R144-V261 HydrophobicContact CG-CG2 4.35Å; Y231-V261 HydrophobicContact CE1-CB 3.72Å; Y231-V261 HydrophobicContact CE1-CG1 4.17Å; Y231-V261 HydrophobicContact CE1-CG2 4.33Å; Y231-V261 HydrophobicContact CE2-CB 4.1Å; Y231-V261 HydrophobicContact CE2-CG1 3.7Å; Y231-V261 WeakPolarHBondContact OH-CB 3.17Å; Y231-V261 WeakPolarHBondContact OH-CG1 3.4Å; I257-V261 WeakPolarHBondContact O-CG2 3.46Å; I257-V261 PolarHBondContact O-N 2.9Å; I257-V261 VanDerWaalsContact O-N 3.12Å; T258-V261 PolarHBondContact O-N 3.46Å; R259-V261 PolarHBondContact O-N 2.88Å; V261-M263 VanDerWaalsContact C-N 3.25Å; V261-M263 PolarHBondContact O-N 3.18Å; V261-V264 HydrophobicContact CG1-CB 4.13Å; V261-V264 HydrophobicContact CG1-CG2 4.42Å; V261-V264 WeakPolarHBondContact O-CB 3.21Å; V261-V264 PolarHBondContact O-N 2.87Å; V261-V264 VanDerWaalsContact O-N 3.16Å; V261-V265 VanDerWaalsContact O-CG2 3.31Å; V261-V265 WeakPolarHBondContact O-CG2 3.21Å; V261-V265 PolarHBondContact O-N 3.43Å |
| 262 | L | 71.1 | Confident | 74.2 | Confident | 88 Ų | 88 | 59 Ų | 59 | 46% | 0.461 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.1 | -38.8 | 166.4 | -76.3 | 173.2 | 0 | 0 | 0 | 111.8 | Y231 T258 R259 V265 A266 | Y231-L262 HydrophobicContact CG-CD2 4.44Å; T258-L262 HydrophobicContact CG2-CD1 4.16Å; T258-L262 HydrophobicContact CG2-CG 4.5Å; T258-L262 WeakPolarHBondContact O-CB 3.5Å; T258-L262 WeakPolarHBondContact O-CG 3.26Å; T258-L262 PolarHBondContact O-N 2.97Å; R259-L262 PolarHBondContact O-N 3.5Å; L262-V265 PolarHBondContact O-N 3.31Å; L262-A266 WeakPolarHBondContact O-CB 3.41Å; L262-A266 PolarHBondContact O-N 2.95Å |
| 263 | M | 77.4 | Confident | 75.9 | Confident | 66 Ų | 66 | 54.2 Ų | 54.2 | 33% | 0.325 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66.6 | -40.8 | 173.4 | -67.5 | -161.6 | -39.5 | 0 | 0 | 111.9 | R259 L260 V261 V265 A266 V267 L310 L314 | R259-M263 WeakPolarHBondContact O-CG 3.31Å; R259-M263 PolarHBondContact O-N 2.78Å; L260-M263 WeakPolarHBondContact O-CB 3.3Å; L260-M263 PolarHBondContact O-N 2.83Å; L260-M263 VanDerWaalsContact O-N 3.17Å; V261-M263 VanDerWaalsContact C-N 3.25Å; V261-M263 PolarHBondContact O-N 3.18Å; M263-V265 VanDerWaalsContact C-N 3.3Å; M263-V265 PolarHBondContact O-N 3.39Å; M263-A266 PolarHBondContact O-N 3.05Å; M263-V267 WeakPolarHBondContact O-CB 3.33Å; M263-V267 VanDerWaalsContact O-CG2 3.24Å; M263-V267 WeakPolarHBondContact O-CG2 3.32Å; M263-V267 PolarHBondContact O-N 3.39Å; M263-L310 HydrophobicContact CB-CD2 4Å; M263-L310 HydrophobicContact CE-CD2 4.14Å; M263-L314 HydrophobicContact CE-CD1 3.35Å; M263-L314 HydrophobicContact CE-CD2 3.91Å; M263-L314 HydrophobicContact CE-CG 4.28Å |
| 264 | V | 73.1 | Confident | 77.7 | Confident | 6 Ų | 6 | 52.4 Ų | 52.4 | 4% | 0.036 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 175.2 | 177.7 | 0 | 0 | 0 | 0 | 111 | L137 L260 V261 F268 L310 | L137-V264 HydrophobicContact CD1-CG1 4.48Å; L137-V264 HydrophobicContact CD2-CG1 3.55Å; L260-V264 HydrophobicContact CD1-CG2 4.11Å; L260-V264 WeakPolarHBondContact O-CG2 3.38Å; L260-V264 PolarHBondContact O-N 3.01Å; V261-V264 HydrophobicContact CG1-CB 4.13Å; V261-V264 HydrophobicContact CG1-CG2 4.42Å; V261-V264 WeakPolarHBondContact O-CB 3.21Å; V261-V264 PolarHBondContact O-N 2.87Å; V261-V264 VanDerWaalsContact O-N 3.16Å; V264-F268 WeakPolarHBondContact O-CB 3.49Å; V264-F268 PolarHBondContact O-N 3.29Å; V264-L310 HydrophobicContact CB-CD1 4.18Å; V264-L310 HydrophobicContact CG1-CD1 4.43Å; V264-L310 HydrophobicContact CG2-CB 4.13Å; V264-L310 HydrophobicContact CG2-CD1 3.78Å; V264-L310 HydrophobicContact CG2-CD2 4.21Å; V264-L310 HydrophobicContact CG2-CG 4.26Å |
| 265 | V | 75 | Confident | 79.2 | Confident | 24 Ų | 24 | 52.5 Ų | 52.5 | 15% | 0.145 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.4 | -44.5 | 178.1 | 176.5 | 0 | 0 | 0 | 0 | 111.7 | I227 Y231 V261 L262 M263 V267 F268 V269 | I227-V265 HydrophobicContact CG2-CG1 4.47Å; I227-V265 HydrophobicContact CG2-CG2 3.29Å; Y231-V265 HydrophobicContact CD2-CG2 4.25Å; Y231-V265 HydrophobicContact CE2-CG2 3.96Å; V261-V265 VanDerWaalsContact O-CG2 3.31Å; V261-V265 WeakPolarHBondContact O-CG2 3.21Å; V261-V265 PolarHBondContact O-N 3.43Å; L262-V265 PolarHBondContact O-N 3.31Å; M263-V265 VanDerWaalsContact C-N 3.3Å; M263-V265 PolarHBondContact O-N 3.39Å; V265-V267 VanDerWaalsContact C-N 3.31Å; V265-V267 PolarHBondContact O-N 3.26Å; V265-F268 PolarHBondContact O-N 3.47Å; V265-V269 HydrophobicContact CG1-CG2 4.45Å; V265-V269 WeakPolarHBondContact O-CG2 3.3Å; V265-V269 PolarHBondContact O-N 3.1Å |
| 266 | A | 83.8 | Confident | 80.6 | Confident | 48 Ų | 48 | 47 Ų | 47 | 40% | 0.397 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.1 | -45 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L262 M263 V269 L270 | L262-A266 WeakPolarHBondContact O-CB 3.41Å; L262-A266 PolarHBondContact O-N 2.95Å; M263-A266 PolarHBondContact O-N 3.05Å; A266-V269 PolarHBondContact O-N 3.31Å; A266-L270 WeakPolarHBondContact O-CB 3.38Å; A266-L270 WeakPolarHBondContact O-CG 3.45Å; A266-L270 PolarHBondContact O-N 3.29Å |
| 267 | V | 86.9 | Confident | 81.8 | Confident | 35 Ų | 35 | 46.2 Ų | 46.2 | 21% | 0.212 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.6 | -48.6 | 175 | 167.9 | 0 | 0 | 0 | 0 | 111.1 | M263 V265 V269 L270 C271 A306 L310 | M263-V267 WeakPolarHBondContact O-CB 3.33Å; M263-V267 VanDerWaalsContact O-CG2 3.24Å; M263-V267 WeakPolarHBondContact O-CG2 3.32Å; M263-V267 PolarHBondContact O-N 3.39Å; V265-V267 VanDerWaalsContact C-N 3.31Å; V265-V267 PolarHBondContact O-N 3.26Å; V267-V269 VanDerWaalsContact C-N 3.3Å; V267-V269 PolarHBondContact O-N 3.08Å; V267-L270 PolarHBondContact O-N 3.36Å; V267-C271 VanDerWaalsContact O-CB 3.3Å; V267-C271 WeakPolarHBondContact O-CB 3.29Å; V267-C271 PolarHBondContact O-N 2.89Å; V267-C271 PolarHBondContact O-SG 3.2Å; V267-C271 VanDerWaalsContact O-SG 3.35Å; V267-A306 HydrophobicContact CG1-CB 3.39Å; V267-L310 HydrophobicContact CB-CD1 4.45Å; V267-L310 HydrophobicContact CG1-CD1 4.49Å; V267-L310 HydrophobicContact CG2-CD1 4.41Å |
| 268 | F | 85.2 | Confident | 83.1 | Confident | 3 Ų | 3 | 43.7 Ų | 43.7 | 1% | 0.013 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -55.7 | -46.9 | 177.7 | 176.9 | -93.2 | 0 | 0 | 0 | 111.7 | V134 L137 F220 V224 V264 V265 C271 W272 | V134-F268 HydrophobicContact CB-CE2 3.8Å; V134-F268 HydrophobicContact CB-CZ 3.73Å; V134-F268 HydrophobicContact CG2-CE1 3.89Å; V134-F268 HydrophobicContact CG2-CE2 3.74Å; V134-F268 HydrophobicContact CG2-CZ 3.26Å; L137-F268 HydrophobicContact CD1-CB 4.27Å; L137-F268 HydrophobicContact CD1-CD2 3.64Å; L137-F268 HydrophobicContact CD1-CE2 4.34Å; L137-F268 HydrophobicContact CD1-CG 4.14Å; F220-F268 AromaticContact CD2-CE1 3.96Å; F220-F268 HydrophobicContact CD2-CE1 3.96Å; F220-F268 HydrophobicContact CE2-CE1 4.41Å; V224-F268 HydrophobicContact CG2-CD1 4.05Å; V224-F268 HydrophobicContact CG2-CE1 3.89Å; V264-F268 WeakPolarHBondContact O-CB 3.49Å; V264-F268 PolarHBondContact O-N 3.29Å; V265-F268 PolarHBondContact O-N 3.47Å; F268-C271 PolarHBondContact O-N 3.13Å; F268-W272 AromaticContact CD2-CD1 3.41Å; F268-W272 VanDerWaalsContact CD2-CD1 3.41Å; F268-W272 HydrophobicContact CD2-CG 4.4Å; F268-W272 AromaticContact CD2-NE1 3.82Å; F268-W272 AromaticContact CE2-CD1 3.25Å; F268-W272 AromaticContact CE2-CG 3.96Å; F268-W272 HydrophobicContact CE2-CG 3.96Å; F268-W272 AromaticContact CE2-NE1 3.51Å; F268-W272 HydrophobicContact CZ-CB 4.42Å; F268-W272 AromaticContact CZ-CD1 3.81Å; F268-W272 HydrophobicContact CZ-CG 4.1Å; F268-W272 WeakPolarHBondContact O-CB 3.2Å; F268-W272 PolarHBondContact O-N 3Å |
| 269 | V | 88.2 | Confident | 84.3 | Confident | 43 Ų | 43 | 46.2 Ų | 46.2 | 26% | 0.261 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62.6 | -48.8 | 178 | 170 | 0 | 0 | 0 | 0 | 111 | F220 V224 V265 A266 V267 C271 W272 M273 | F220-V269 HydrophobicContact CE2-CG2 4.5Å; F220-V269 HydrophobicContact CZ-CG1 4.21Å; F220-V269 HydrophobicContact CZ-CG2 4.47Å; V224-V269 HydrophobicContact CG1-CG2 4.17Å; V224-V269 HydrophobicContact CG2-CG2 3.85Å; V265-V269 HydrophobicContact CG1-CG2 4.45Å; V265-V269 WeakPolarHBondContact O-CG2 3.3Å; V265-V269 PolarHBondContact O-N 3.1Å; A266-V269 PolarHBondContact O-N 3.31Å; V267-V269 VanDerWaalsContact C-N 3.3Å; V267-V269 PolarHBondContact O-N 3.08Å; V269-C271 VanDerWaalsContact C-N 3.28Å; V269-C271 PolarHBondContact O-N 3.03Å; V269-W272 PolarHBondContact O-N 3.16Å; V269-M273 HydrophobicContact CG1-CB 4.42Å; V269-M273 WeakPolarHBondContact O-CB 3.47Å; V269-M273 PolarHBondContact O-N 3.49Å |
| 270 | L | 91.6 | Very high | 85.2 | Confident | 121 Ų | 121 | 40 Ų | 40 | 63% | 0.634 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -63.3 | -34.9 | -179.7 | -70.5 | 171.1 | 0 | 0 | 0 | 112.3 | A266 V267 P274 L299 | A266-L270 WeakPolarHBondContact O-CB 3.38Å; A266-L270 WeakPolarHBondContact O-CG 3.45Å; A266-L270 PolarHBondContact O-N 3.29Å; V267-L270 PolarHBondContact O-N 3.36Å; L270-P274 VanDerWaalsContact O-CD 3.23Å; L270-P274 WeakPolarHBondContact O-CD 3.31Å; L270-L299 WeakPolarHBondContact O-CD2 3.13Å |
| 271 | C | 92.3 | Very high | 86.3 | Confident | 11 Ų | 11 | 42.6 Ų | 42.6 | 7% | 0.074 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -76.1 | -42.7 | -179.7 | -74.4 | 0 | 0 | 0 | 0 | 113 | V267 F268 V269 L299 S300 N303 | V267-C271 VanDerWaalsContact O-CB 3.3Å; V267-C271 WeakPolarHBondContact O-CB 3.29Å; V267-C271 PolarHBondContact O-N 2.89Å; V267-C271 PolarHBondContact O-SG 3.2Å; V267-C271 VanDerWaalsContact O-SG 3.35Å; F268-C271 PolarHBondContact O-N 3.13Å; V269-C271 VanDerWaalsContact C-N 3.28Å; V269-C271 PolarHBondContact O-N 3.03Å; C271-L299 VanDerWaalsContact CB-O 3.25Å; C271-L299 WeakPolarHBondContact CB-O 3.26Å; C271-L299 CarbonylContact O-C 3.56Å; C271-L299 PolarHBondContact SG-O 3.02Å; C271-S300 PolarHBondContact O-N 3.48Å; C271-N303 HydrophobicContact CB-CB 3.67Å |
| 272 | W | 92.5 | Very high | 87.4 | Confident | 5 Ų | 5 | 44.5 Ų | 44.5 | 2% | 0.019 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -94.8 | -29.3 | -172.4 | -77.8 | 97.2 | 0 | 0 | 0 | 114.4 | M130 F220 F268 V269 F275 Y276 N303 | M130-W272 HydrophobicContact CB-CH2 3.53Å; M130-W272 HydrophobicContact CB-CZ2 4.17Å; M130-W272 HydrophobicContact CB-CZ3 4.1Å; M130-W272 HydrophobicContact CG-CE3 4.25Å; M130-W272 HydrophobicContact CG-CH2 3.42Å; M130-W272 VanDerWaalsContact CG-CH2 3.42Å; M130-W272 HydrophobicContact CG-CZ2 4.1Å; M130-W272 HydrophobicContact CG-CZ3 3.51Å; M130-W272 HydrophobicContact SD-CE3 4.26Å; M130-W272 HydrophobicContact SD-CH2 3.92Å; M130-W272 HydrophobicContact SD-CZ3 3.45Å; M130-W272 WeakPolarHBondContact SD-CZ3 3.21Å; F220-W272 HydrophobicContact CD2-CB 3.92Å; F220-W272 HydrophobicContact CE2-CB 4.14Å; F268-W272 AromaticContact CD2-CD1 3.41Å; F268-W272 VanDerWaalsContact CD2-CD1 3.41Å; F268-W272 HydrophobicContact CD2-CG 4.4Å; F268-W272 AromaticContact CD2-NE1 3.82Å; F268-W272 AromaticContact CE2-CD1 3.25Å; F268-W272 AromaticContact CE2-CG 3.96Å; F268-W272 HydrophobicContact CE2-CG 3.96Å; F268-W272 AromaticContact CE2-NE1 3.51Å; F268-W272 HydrophobicContact CZ-CB 4.42Å; F268-W272 AromaticContact CZ-CD1 3.81Å; F268-W272 HydrophobicContact CZ-CG 4.1Å; F268-W272 WeakPolarHBondContact O-CB 3.2Å; F268-W272 PolarHBondContact O-N 3Å; V269-W272 PolarHBondContact O-N 3.16Å; W272-F275 HydrophobicContact CE3-CD1 4.1Å; W272-F275 HydrophobicContact CZ3-CD1 4.1Å; W272-F275 HydrophobicContact CZ3-CE1 4.38Å; W272-F275 WeakPolarHBondContact O-CB 3.48Å; W272-F275 PolarHBondContact O-N 2.9Å; W272-Y276 HydrophobicContact CB-CD2 4.23Å; W272-Y276 HydrophobicContact CB-CE2 4.03Å; W272-Y276 HydrophobicContact CD2-CE2 4.34Å; W272-Y276 HydrophobicContact CE3-CD2 4.5Å; W272-Y276 AromaticContact CE3-CE2 3.74Å; W272-Y276 HydrophobicContact CE3-CE2 3.74Å; W272-Y276 WeakPolarHBondContact O-CD2 3.42Å; W272-Y276 PolarHBondContact O-N 3.46Å; W272-Y276 VanDerWaalsContact O-N 3.17Å; W272-N303 VanDerWaalsContact NE1-CG 3.35Å; W272-N303 PolarHBondContact NE1-ND2 2.88Å |
| 273 | M | 92.8 | Very high | 88.1 | Confident | 92 Ų | 92 | 42.9 Ų | 42.9 | 45% | 0.453 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -56.8 | -46 | -176.8 | 179.8 | -91.9 | -167.6 | 0 | 0 | 112.5 | F220 V269 F275 Y276 V277 | F220-M273 HydrophobicContact CE2-CB 3.92Å; F220-M273 HydrophobicContact CZ-CB 3.67Å; F220-M273 HydrophobicContact CZ-CG 4.13Å; V269-M273 HydrophobicContact CG1-CB 4.42Å; V269-M273 WeakPolarHBondContact O-CB 3.47Å; V269-M273 PolarHBondContact O-N 3.49Å; M273-F275 VanDerWaalsContact C-N 3.32Å; M273-F275 PolarHBondContact O-N 3.25Å; M273-Y276 PolarHBondContact O-N 3.36Å; M273-V277 HydrophobicContact CE-CG2 3.7Å; M273-V277 HydrophobicContact CG-CG2 4.17Å; M273-V277 WeakPolarHBondContact O-CB 3.41Å; M273-V277 VanDerWaalsContact O-CG2 3.32Å; M273-V277 WeakPolarHBondContact O-CG2 3.37Å; M273-V277 PolarHBondContact O-N 3.23Å; M273-V277 HydrophobicContact SD-CG2 3.81Å |
| 274 | P | 94.1 | Very high | 88.5 | Confident | 35 Ų | 35 | 47.7 Ų | 47.7 | 23% | 0.227 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.6 | -37 | -179.4 | -28.5 | 42.7 | 0 | 0 | 0 | 113 | L270 V277 V278 S296 L299 | L270-P274 VanDerWaalsContact O-CD 3.23Å; L270-P274 WeakPolarHBondContact O-CD 3.31Å; P274-V277 PolarHBondContact O-N 2.94Å; P274-V278 WeakPolarHBondContact O-CB 3.49Å; P274-V278 VanDerWaalsContact O-CG2 3.3Å; P274-V278 WeakPolarHBondContact O-CG2 2.87Å; P274-V278 PolarHBondContact O-N 3.47Å; P274-S296 PolarHBondContact O-OG 3.44Å; P274-L299 HydrophobicContact CB-CD2 4.04Å; P274-L299 HydrophobicContact CG-CD2 3.6Å |
| 275 | F | 93 | Very high | 89 | Confident | 49 Ų | 49 | 50.3 Ų | 50.3 | 22% | 0.215 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59 | -51.5 | 173.7 | 175.8 | -97.6 | 0 | 0 | 0 | 111.7 | M130 W272 M273 V277 V278 Q279 L297 | M130-F275 HydrophobicContact SD-CE1 4.47Å; W272-F275 HydrophobicContact CE3-CD1 4.1Å; W272-F275 HydrophobicContact CZ3-CD1 4.1Å; W272-F275 HydrophobicContact CZ3-CE1 4.38Å; W272-F275 WeakPolarHBondContact O-CB 3.48Å; W272-F275 PolarHBondContact O-N 2.9Å; M273-F275 VanDerWaalsContact C-N 3.32Å; M273-F275 PolarHBondContact O-N 3.25Å; F275-V277 PolarHBondContact O-N 3.03Å; F275-V278 PolarHBondContact O-N 2.97Å; F275-Q279 VanDerWaalsContact O-CB 3.3Å; F275-Q279 WeakPolarHBondContact O-CB 2.95Å; F275-Q279 PolarHBondContact O-N 3.39Å; F275-L297 HydrophobicContact CD2-CD1 4.33Å; F275-L297 HydrophobicContact CE2-CD1 4.08Å |
| 276 | Y | 93.3 | Very high | 88.8 | Confident | 2 Ų | 2 | 56.2 Ų | 56.2 | 1% | 0.008 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -68 | -36.5 | -179.9 | -72.8 | -70 | 0 | 0 | 0 | 113.4 | M130 F216 G219 F220 W272 M273 Q279 L280 | M130-Y276 HydrophobicContact CE-CE1 3.87Å; M130-Y276 WeakPolarHBondContact CE-OH 3.3Å; M130-Y276 HydrophobicContact SD-CE1 4.4Å; M130-Y276 PolarHBondContact SD-OH 3.08Å; F216-Y276 HydrophobicContact CB-CD1 3.86Å; F216-Y276 HydrophobicContact CB-CE1 4.25Å; F216-Y276 AromaticContact CD2-CD1 3.95Å; F216-Y276 HydrophobicContact CD2-CD1 3.95Å; F216-Y276 HydrophobicContact CD2-CD2 4.46Å; F216-Y276 AromaticContact CD2-CG 3.78Å; F216-Y276 HydrophobicContact CD2-CG 3.78Å; F216-Y276 HydrophobicContact CG-CD1 4.43Å; G219-Y276 VanDerWaalsContact C-OH 3.27Å; G219-Y276 WeakPolarHBondContact CA-OH 3.07Å; G219-Y276 PolarHBondContact O-OH 3.33Å; F220-Y276 HydrophobicContact CB-CD2 3.68Å; F220-Y276 HydrophobicContact CB-CE2 3.47Å; F220-Y276 VanDerWaalsContact CB-CE2 3.47Å; F220-Y276 HydrophobicContact CB-CG 4.38Å; F220-Y276 AromaticContact CD2-CD2 3.84Å; F220-Y276 HydrophobicContact CD2-CD2 3.84Å; F220-Y276 AromaticContact CD2-CE2 3.97Å; F220-Y276 HydrophobicContact CD2-CE2 3.97Å; F220-Y276 AromaticContact CG-CD2 3.85Å; F220-Y276 HydrophobicContact CG-CD2 3.85Å; F220-Y276 HydrophobicContact CG-CE2 4.02Å; W272-Y276 HydrophobicContact CB-CD2 4.23Å; W272-Y276 HydrophobicContact CB-CE2 4.03Å; W272-Y276 HydrophobicContact CD2-CE2 4.34Å; W272-Y276 HydrophobicContact CE3-CD2 4.5Å; W272-Y276 AromaticContact CE3-CE2 3.74Å; W272-Y276 HydrophobicContact CE3-CE2 3.74Å; W272-Y276 WeakPolarHBondContact O-CD2 3.42Å; W272-Y276 PolarHBondContact O-N 3.46Å; W272-Y276 VanDerWaalsContact O-N 3.17Å; M273-Y276 PolarHBondContact O-N 3.36Å; Y276-Q279 PolarHBondContact O-N 3.36Å; Y276-L280 WeakPolarHBondContact O-CB 3.34Å; Y276-L280 WeakPolarHBondContact O-CG 3.18Å; Y276-L280 PolarHBondContact O-N 3.17Å |
| 277 | V | 93.2 | Very high | 88.2 | Confident | 57 Ų | 57 | 58.8 Ų | 58.8 | 35% | 0.345 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.5 | -49.5 | 175 | 168.3 | 0 | 0 | 0 | 0 | 110 | M273 P274 F275 Q279 L280 L281 | M273-V277 HydrophobicContact CE-CG2 3.7Å; M273-V277 HydrophobicContact CG-CG2 4.17Å; M273-V277 WeakPolarHBondContact O-CB 3.41Å; M273-V277 VanDerWaalsContact O-CG2 3.32Å; M273-V277 WeakPolarHBondContact O-CG2 3.37Å; M273-V277 PolarHBondContact O-N 3.23Å; M273-V277 HydrophobicContact SD-CG2 3.81Å; P274-V277 PolarHBondContact O-N 2.94Å; F275-V277 PolarHBondContact O-N 3.03Å; V277-Q279 VanDerWaalsContact C-N 3.32Å; V277-Q279 PolarHBondContact O-N 3.28Å; V277-L280 PolarHBondContact O-N 3Å; V277-L281 HydrophobicContact CG1-CD1 3.82Å; V277-L281 HydrophobicContact CG1-CG 4.3Å; V277-L281 WeakPolarHBondContact O-CB 3.32Å; V277-L281 VanDerWaalsContact O-CG 3.25Å; V277-L281 WeakPolarHBondContact O-CG 3.13Å; V277-L281 PolarHBondContact O-N 3.49Å |
| 278 | V | 92.2 | Very high | 87.8 | Confident | 11 Ų | 11 | 59.7 Ų | 59.7 | 7% | 0.067 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 177.2 | 169.4 | 0 | 0 | 0 | 0 | 111.1 | P274 F275 L280 L281 N282 L288 V292 N293 S296 | P274-V278 WeakPolarHBondContact O-CB 3.49Å; P274-V278 VanDerWaalsContact O-CG2 3.3Å; P274-V278 WeakPolarHBondContact O-CG2 2.87Å; P274-V278 PolarHBondContact O-N 3.47Å; F275-V278 PolarHBondContact O-N 2.97Å; V278-L280 VanDerWaalsContact C-N 3.34Å; V278-L280 PolarHBondContact O-N 3.41Å; V278-L281 PolarHBondContact O-N 2.91Å; V278-N282 WeakPolarHBondContact O-CB 3.13Å; V278-N282 PolarHBondContact O-N 2.82Å; V278-N282 PolarHBondContact O-ND2 2.85Å; V278-L288 HydrophobicContact CG1-CD1 4.45Å; V278-V292 HydrophobicContact CG2-CG1 3.65Å; V278-N293 WeakPolarHBondContact CG1-OD1 3.12Å; V278-S296 VanDerWaalsContact CG2-OG 3.31Å; V278-S296 WeakPolarHBondContact CG2-OG 3.19Å |
| 279 | Q | 90.8 | Very high | 87.6 | Confident | 66 Ų | 66 | 64 Ų | 64 | 31% | 0.308 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.2 | -36.1 | 179.6 | -170.3 | 58 | 69.3 | 0 | 0 | 113 | V212 F275 Y276 V277 | V212-Q279 HydrophobicContact CB-CG 4.2Å; V212-Q279 HydrophobicContact CG1-CB 4.34Å; V212-Q279 HydrophobicContact CG1-CG 3.7Å; V212-Q279 HydrophobicContact CG2-CG 3.51Å; F275-Q279 VanDerWaalsContact O-CB 3.3Å; F275-Q279 WeakPolarHBondContact O-CB 2.95Å; F275-Q279 PolarHBondContact O-N 3.39Å; Y276-Q279 PolarHBondContact O-N 3.36Å; V277-Q279 VanDerWaalsContact C-N 3.32Å; V277-Q279 PolarHBondContact O-N 3.28Å |
| 280 | L | 91.3 | Very high | 87.3 | Confident | 45 Ų | 45 | 64.5 Ų | 64.5 | 24% | 0.236 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -70.2 | -43.4 | 172.4 | -77.6 | 165.3 | 0 | 0 | 0 | 111.6 | V212 V213 F216 Y276 V277 V278 N282 L283 F284 | V212-L280 HydrophobicContact CG1-CD2 3.79Å; V212-L280 HydrophobicContact CG1-CG 4.04Å; V213-L280 HydrophobicContact CG2-CD2 4.46Å; F216-L280 HydrophobicContact CD1-CD1 4.41Å; F216-L280 HydrophobicContact CD2-CD1 4.26Å; F216-L280 HydrophobicContact CE2-CD1 4.39Å; F216-L280 HydrophobicContact CG-CD1 4.24Å; Y276-L280 WeakPolarHBondContact O-CB 3.34Å; Y276-L280 WeakPolarHBondContact O-CG 3.18Å; Y276-L280 PolarHBondContact O-N 3.17Å; V277-L280 PolarHBondContact O-N 3Å; V278-L280 VanDerWaalsContact C-N 3.34Å; V278-L280 PolarHBondContact O-N 3.41Å; L280-N282 VanDerWaalsContact C-N 3.31Å; L280-N282 PolarHBondContact O-N 3.49Å; L280-L283 HydrophobicContact CD2-CD1 4.34Å; L280-L283 VanDerWaalsContact O-CB 3.29Å; L280-L283 WeakPolarHBondContact O-CB 3.36Å; L280-L283 PolarHBondContact O-N 3.31Å; L280-L283 VanDerWaalsContact O-N 3.09Å; L280-F284 VanDerWaalsContact O-CD2 3.23Å; L280-F284 WeakPolarHBondContact O-CD2 3.03Å |
| 281 | L | 90.9 | Very high | 86.9 | Confident | 78 Ų | 78 | 61.9 Ų | 61.9 | 41% | 0.408 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.1 | -38.1 | 178 | -71.3 | 173 | 0 | 0 | 0 | 111.9 | V277 V278 L283 F284 V285 L288 | V277-L281 HydrophobicContact CG1-CD1 3.82Å; V277-L281 HydrophobicContact CG1-CG 4.3Å; V277-L281 WeakPolarHBondContact O-CB 3.32Å; V277-L281 VanDerWaalsContact O-CG 3.25Å; V277-L281 WeakPolarHBondContact O-CG 3.13Å; V277-L281 PolarHBondContact O-N 3.49Å; V278-L281 PolarHBondContact O-N 2.91Å; L281-L283 PolarHBondContact O-N 3Å; L281-L283 VanDerWaalsContact O-N 3.09Å; L281-F284 PolarHBondContact O-N 2.76Å; L281-V285 PolarHBondContact O-N 2.91Å; L281-L288 HydrophobicContact CB-CD1 3.71Å; L281-L288 HydrophobicContact CD1-CD1 4.47Å |
| 282 | N | 87.5 | Confident | 86.7 | Confident | 49 Ų | 49 | 64.4 Ų | 64.4 | 26% | 0.262 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -14.8 | 174.6 | -80 | -35.7 | 0 | 0 | 0 | 113.6 | V278 L280 L288 N293 | V278-N282 WeakPolarHBondContact O-CB 3.13Å; V278-N282 PolarHBondContact O-N 2.82Å; V278-N282 PolarHBondContact O-ND2 2.85Å; L280-N282 VanDerWaalsContact C-N 3.31Å; L280-N282 PolarHBondContact O-N 3.49Å; N282-L288 WeakPolarHBondContact OD1-CD1 3.49Å; N282-N293 PolarHBondContact ND2-OD1 3.05Å |
| 283 | L | 86.3 | Confident | 86.4 | Confident | 54 Ų | 54 | 66.6 Ų | 66.6 | 28% | 0.283 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | -25.5 | 171.4 | -61.4 | 177.8 | 0 | 0 | 0 | 112.9 | A209 V212 L280 L281 | A209-L283 HydrophobicContact CB-CD1 4.12Å; A209-L283 HydrophobicContact CB-CD2 4.19Å; V212-L283 HydrophobicContact CB-CD1 4Å; V212-L283 HydrophobicContact CB-CD2 4.36Å; V212-L283 HydrophobicContact CB-CG 4.45Å; V212-L283 HydrophobicContact CG1-CD1 3.87Å; V212-L283 HydrophobicContact CG1-CG 4.34Å; V212-L283 HydrophobicContact CG2-CD2 4.1Å; L280-L283 HydrophobicContact CD2-CD1 4.34Å; L280-L283 VanDerWaalsContact O-CB 3.29Å; L280-L283 WeakPolarHBondContact O-CB 3.36Å; L280-L283 PolarHBondContact O-N 3.31Å; L280-L283 VanDerWaalsContact O-N 3.09Å; L281-L283 PolarHBondContact O-N 3Å; L281-L283 VanDerWaalsContact O-N 3.09Å |
| 284 | F | 85.8 | Confident | 86.2 | Confident | 168 Ų | 168 | 64.6 Ų | 64.6 | 74% | 0.737 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.1 | -29.7 | -174.2 | -56.4 | -76.1 | 0 | 0 | 0 | 112.6 | L280 L281 | L280-F284 VanDerWaalsContact O-CD2 3.23Å; L280-F284 WeakPolarHBondContact O-CD2 3.03Å; L281-F284 PolarHBondContact O-N 2.76Å |
| 285 | V | 83.3 | Confident | 86 | Confident | 60 Ų | 60 | 66.4 Ų | 66.4 | 36% | 0.364 | 37% | 0.372 | S | S | . | . | trans | -122.7 | 121.7 | -175 | -176.8 | 0 | 0 | 0 | 0 | 109.1 | L281 L288 | L281-V285 PolarHBondContact O-N 2.91Å; V285-L288 HydrophobicContact CG1-CG 4.41Å | ||
| 286 | T | 69.9 | Low | 86 | Confident | 149 Ų | 149 | 64.5 Ų | 64.5 | 91% | 0.914 | 37% | 0.365 | S | S | * | . | S | Bend | trans | -91.8 | -3.4 | -176.9 | 51.5 | 0 | 0 | 0 | 0 | 114.1 | ||
| 287 | S | 71.8 | Confident | 85.9 | Confident | 102 Ų | 102 | 66.2 Ų | 66.2 | 71% | 0.713 | 37% | 0.374 | S | S | * | . | trans | -118.8 | 29.9 | -170.5 | 55.8 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 288 | L | 78.3 | Confident | 85.9 | Confident | 54 Ų | 54 | 64.1 Ų | 64.1 | 28% | 0.283 | 36% | 0.361 | S | S | . | . | trans | -70.2 | 138.8 | 171.6 | -75.9 | 178 | 0 | 0 | 0 | 111.1 | V278 L281 N282 V285 A290 | V278-L288 HydrophobicContact CG1-CD1 4.45Å; L281-L288 HydrophobicContact CB-CD1 3.71Å; L281-L288 HydrophobicContact CD1-CD1 4.47Å; N282-L288 WeakPolarHBondContact OD1-CD1 3.49Å; V285-L288 HydrophobicContact CG1-CG 4.41Å; L288-A290 PolarHBondContact O-N 3.44Å | ||
| 289 | D | 81.8 | Confident | 86 | Confident | 94 Ų | 94 | 66.4 Ų | 66.4 | 50% | 0.503 | 37% | 0.372 | S | S | . | . | trans | -59.2 | 136.6 | 178.9 | -176.5 | 14 | 0 | 0 | 0 | 111.2 | T291 V292 N293 | D289-T291 PolarHBondContact O-N 3.33Å; D289-T291 PolarHBondContact OD1-N 3.18Å; D289-T291 PolarHBondContact OD1-OG1 3.22Å; D289-T291 WeakPolarHBondContact OD2-CB 3.32Å; D289-T291 PolarHBondContact OD2-OG1 2.64Å; D289-V292 HydrophobicContact CB-CG2 4.17Å; D289-V292 WeakPolarHBondContact O-CB 3.34Å; D289-V292 PolarHBondContact O-N 3.36Å; D289-V292 VanDerWaalsContact O-N 3.08Å; D289-N293 PolarHBondContact O-N 2.02Å; D289-N293 PolarHBondContact O-ND2 3.43Å | ||
| 290 | A | 80.5 | Confident | 86.1 | Confident | 53 Ų | 53 | 63.3 Ų | 63.3 | 44% | 0.438 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -59 | -33.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | L288 V292 N293 H294 | L288-A290 PolarHBondContact O-N 3.44Å; A290-V292 VanDerWaalsContact C-N 3.29Å; A290-V292 PolarHBondContact O-N 3.13Å; A290-N293 WeakPolarHBondContact O-CB 3.43Å; A290-N293 PolarHBondContact O-N 3.07Å; A290-H294 PolarHBondContact O-CD2 2.67Å; A290-H294 PolarHBondContact O-N 2.98Å |
| 291 | T | 84.3 | Confident | 86.2 | Confident | 66 Ų | 66 | 61.2 Ų | 61.2 | 41% | 0.405 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -56.5 | -43.4 | 175.2 | -44.9 | 0 | 0 | 0 | 0 | 111.6 | I50 D289 N293 H294 V295 | I50-T291 HydrophobicContact CD1-CG2 4.3Å; D289-T291 PolarHBondContact O-N 3.33Å; D289-T291 PolarHBondContact OD1-N 3.18Å; D289-T291 PolarHBondContact OD1-OG1 3.22Å; D289-T291 WeakPolarHBondContact OD2-CB 3.32Å; D289-T291 PolarHBondContact OD2-OG1 2.64Å; T291-N293 VanDerWaalsContact C-N 3.34Å; T291-N293 PolarHBondContact O-N 2.99Å; T291-H294 PolarHBondContact O-N 3.41Å; T291-V295 HydrophobicContact CG2-CG2 4.37Å; T291-V295 WeakPolarHBondContact O-CB 3.4Å; T291-V295 VanDerWaalsContact O-CG2 3.29Å; T291-V295 WeakPolarHBondContact O-CG2 3.39Å; T291-V295 PolarHBondContact O-N 2.95Å |
| 292 | V | 86.9 | Confident | 86.2 | Confident | 63 Ų | 63 | 58.8 Ų | 58.8 | 38% | 0.382 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.3 | -39.9 | -179.5 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | V278 D289 A290 S296 | V278-V292 HydrophobicContact CG2-CG1 3.65Å; D289-V292 HydrophobicContact CB-CG2 4.17Å; D289-V292 WeakPolarHBondContact O-CB 3.34Å; D289-V292 PolarHBondContact O-N 3.36Å; D289-V292 VanDerWaalsContact O-N 3.08Å; A290-V292 VanDerWaalsContact C-N 3.29Å; A290-V292 PolarHBondContact O-N 3.13Å; V292-S296 WeakPolarHBondContact O-CB 3.05Å; V292-S296 PolarHBondContact O-N 3.43Å; V292-S296 PolarHBondContact O-OG 3.38Å |
| 293 | N | 86.9 | Confident | 86.4 | Confident | 51 Ų | 51 | 56.5 Ų | 56.5 | 27% | 0.273 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 175.2 | -71.3 | -74.5 | 0 | 0 | 0 | 111.6 | V278 N282 D289 A290 T291 L297 | V278-N293 WeakPolarHBondContact CG1-OD1 3.12Å; N282-N293 PolarHBondContact ND2-OD1 3.05Å; D289-N293 PolarHBondContact O-N 2.02Å; D289-N293 PolarHBondContact O-ND2 3.43Å; A290-N293 WeakPolarHBondContact O-CB 3.43Å; A290-N293 PolarHBondContact O-N 3.07Å; T291-N293 VanDerWaalsContact C-N 3.34Å; T291-N293 PolarHBondContact O-N 2.99Å; N293-L297 VanDerWaalsContact O-CB 3.3Å; N293-L297 WeakPolarHBondContact O-CB 3.33Å; N293-L297 PolarHBondContact O-N 3.41Å |
| 294 | H | 88.6 | Confident | 86.5 | Confident | 51 Ų | 51 | 54 Ų | 54 | 24% | 0.236 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.9 | -45.2 | 178.1 | -72.5 | -57.5 | 0 | 0 | 0 | 112.6 | I50 A107 A290 T291 L297 I298 | I50-H294 HydrophobicContact CD1-CB 4.27Å; I50-H294 HydrophobicContact CG2-CB 4.29Å; A107-H294 VanDerWaalsContact CB-CE1 3.4Å; A107-H294 WeakPolarHBondContact CB-CE1 3.24Å; A290-H294 PolarHBondContact O-CD2 2.67Å; A290-H294 PolarHBondContact O-N 2.98Å; T291-H294 PolarHBondContact O-N 3.41Å; H294-L297 PolarHBondContact O-N 2.9Å; H294-I298 WeakPolarHBondContact O-CB 3.42Å; H294-I298 VanDerWaalsContact O-CG1 3.26Å; H294-I298 WeakPolarHBondContact O-CG1 3.46Å; H294-I298 PolarHBondContact O-N 2.77Å |
| 295 | V | 89.8 | Confident | 86.6 | Confident | 72 Ų | 72 | 46.7 Ų | 46.7 | 44% | 0.436 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.9 | -45.2 | 179.3 | 170.7 | 0 | 0 | 0 | 0 | 111 | T291 L297 I298 L299 | T291-V295 HydrophobicContact CG2-CG2 4.37Å; T291-V295 WeakPolarHBondContact O-CB 3.4Å; T291-V295 VanDerWaalsContact O-CG2 3.29Å; T291-V295 WeakPolarHBondContact O-CG2 3.39Å; T291-V295 PolarHBondContact O-N 2.95Å; V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 PolarHBondContact O-N 3.19Å; V295-I298 PolarHBondContact O-N 3.44Å; V295-L299 VanDerWaalsContact O-CB 3.28Å; V295-L299 WeakPolarHBondContact O-CB 3.25Å; V295-L299 PolarHBondContact O-N 2.99Å |
| 296 | S | 92.8 | Very high | 86.5 | Confident | 9 Ų | 9 | 44.8 Ų | 44.8 | 6% | 0.063 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.1 | -35.6 | 177.3 | -70.8 | 0 | 0 | 0 | 0 | 112.8 | P274 V278 V292 S300 | P274-S296 PolarHBondContact O-OG 3.44Å; V278-S296 VanDerWaalsContact CG2-OG 3.31Å; V278-S296 WeakPolarHBondContact CG2-OG 3.19Å; V292-S296 WeakPolarHBondContact O-CB 3.05Å; V292-S296 PolarHBondContact O-N 3.43Å; V292-S296 PolarHBondContact O-OG 3.38Å; S296-S300 PolarHBondContact O-N 3.04Å |
| 297 | L | 91.8 | Very high | 86.9 | Confident | 39 Ų | 39 | 37.8 Ų | 37.8 | 20% | 0.204 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -71.7 | -42.8 | 175.3 | -179 | 61.4 | 0 | 0 | 0 | 112.3 | V103 F275 N293 H294 V295 L299 S300 Y301 | V103-L297 HydrophobicContact CG1-CD2 3.88Å; F275-L297 HydrophobicContact CD2-CD1 4.33Å; F275-L297 HydrophobicContact CE2-CD1 4.08Å; N293-L297 VanDerWaalsContact O-CB 3.3Å; N293-L297 WeakPolarHBondContact O-CB 3.33Å; N293-L297 PolarHBondContact O-N 3.41Å; H294-L297 PolarHBondContact O-N 2.9Å; V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 PolarHBondContact O-N 3.19Å; L297-L299 PolarHBondContact O-N 2.82Å; L297-S300 PolarHBondContact O-N 3.49Å; L297-S300 PolarHBondContact O-OG 3.02Å; L297-Y301 HydrophobicContact CD1-CD2 4.5Å; L297-Y301 HydrophobicContact CD1-CE2 3.85Å; L297-Y301 HydrophobicContact CD2-CE2 4.22Å; L297-Y301 HydrophobicContact CG-CD2 4.23Å; L297-Y301 HydrophobicContact CG-CE2 3.65Å; L297-Y301 WeakPolarHBondContact O-CD2 3.37Å; L297-Y301 PolarHBondContact O-N 3.33Å; L297-Y301 VanDerWaalsContact O-N 3.14Å |
| 298 | I | 93.1 | Very high | 87 | Confident | 13 Ų | 13 | 33.5 Ų | 33.5 | 7% | 0.067 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.2 | -41.5 | 172.8 | -75.8 | 169.3 | 0 | 0 | 0 | 110.8 | I50 I53 Y54 V57 H294 V295 S300 Y301 A302 | I50-I298 HydrophobicContact CG2-CD1 3.99Å; I53-I298 HydrophobicContact CB-CD1 4.4Å; I53-I298 HydrophobicContact CG2-CD1 4.3Å; I53-I298 HydrophobicContact CG2-CG2 3.42Å; I53-I298 VanDerWaalsContact CG2-CG2 3.42Å; Y54-I298 HydrophobicContact CD1-CD1 4.35Å; Y54-I298 HydrophobicContact CD1-CG1 3.72Å; Y54-I298 HydrophobicContact CD2-CD1 3.88Å; Y54-I298 HydrophobicContact CD2-CG1 4.12Å; Y54-I298 HydrophobicContact CE1-CD1 4.2Å; Y54-I298 HydrophobicContact CE1-CG1 3.38Å; Y54-I298 HydrophobicContact CE2-CD1 3.7Å; Y54-I298 HydrophobicContact CE2-CG1 3.8Å; Y54-I298 HydrophobicContact CG-CD1 4.2Å; Y54-I298 HydrophobicContact CG-CG1 4.08Å; Y54-I298 VanDerWaalsContact CZ-CG1 3.41Å; V57-I298 HydrophobicContact CG2-CG2 4.36Å; H294-I298 WeakPolarHBondContact O-CB 3.42Å; H294-I298 VanDerWaalsContact O-CG1 3.26Å; H294-I298 WeakPolarHBondContact O-CG1 3.46Å; H294-I298 PolarHBondContact O-N 2.77Å; V295-I298 PolarHBondContact O-N 3.44Å; I298-S300 VanDerWaalsContact C-N 3.29Å; I298-S300 PolarHBondContact O-N 3.01Å; I298-Y301 WeakPolarHBondContact O-CB 3.19Å; I298-Y301 PolarHBondContact O-N 3.02Å; I298-Y301 VanDerWaalsContact O-N 3.16Å; I298-A302 PolarHBondContact O-N 3.39Å |
| 299 | L | 93.2 | Very high | 86.4 | Confident | 58 Ų | 58 | 34.4 Ų | 34.4 | 30% | 0.304 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -67.6 | -31.3 | -178 | -172.1 | 57.8 | 0 | 0 | 0 | 112.1 | L270 C271 P274 V295 L297 A302 | L270-L299 WeakPolarHBondContact O-CD2 3.13Å; C271-L299 VanDerWaalsContact CB-O 3.25Å; C271-L299 WeakPolarHBondContact CB-O 3.26Å; C271-L299 CarbonylContact O-C 3.56Å; C271-L299 PolarHBondContact SG-O 3.02Å; P274-L299 HydrophobicContact CB-CD2 4.04Å; P274-L299 HydrophobicContact CG-CD2 3.6Å; V295-L299 VanDerWaalsContact O-CB 3.28Å; V295-L299 WeakPolarHBondContact O-CB 3.25Å; V295-L299 PolarHBondContact O-N 2.99Å; L297-L299 PolarHBondContact O-N 2.82Å; L299-A302 WeakPolarHBondContact O-CB 3.34Å; L299-A302 PolarHBondContact O-N 2.86Å |
| 300 | S | 93.4 | Very high | 85.7 | Confident | 2 Ų | 2 | 30.4 Ų | 30.4 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -69.8 | -38.1 | 170.5 | 75.4 | 0 | 0 | 0 | 0 | 112 | C271 S296 L297 I298 A302 N303 | C271-S300 PolarHBondContact O-N 3.48Å; S296-S300 PolarHBondContact O-N 3.04Å; L297-S300 PolarHBondContact O-N 3.49Å; L297-S300 PolarHBondContact O-OG 3.02Å; I298-S300 VanDerWaalsContact C-N 3.29Å; I298-S300 PolarHBondContact O-N 3.01Å; S300-A302 VanDerWaalsContact C-N 3.33Å; S300-A302 PolarHBondContact O-N 3.42Å; S300-N303 WeakPolarHBondContact O-CB 3.4Å; S300-N303 PolarHBondContact O-N 3.43Å |
| 301 | Y | 93.2 | Very high | 84.9 | Confident | 1 Ų | 1 | 28.5 Ų | 28.5 | 0% | 0.004 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.2 | -39.7 | 170.6 | -69.4 | -64.2 | 0 | 0 | 0 | 112.3 | Y54 F96 M97 V100 V103 D126 L297 I298 N303 S304 | Y54-Y301 HydrophobicContact CE1-CD2 4.01Å; Y54-Y301 AromaticContact CE1-CE2 3.98Å; Y54-Y301 HydrophobicContact CE1-CE2 3.98Å; F96-Y301 AromaticContact CD1-CD1 3.83Å; F96-Y301 HydrophobicContact CD1-CD1 3.83Å; F96-Y301 HydrophobicContact CD1-CE1 4.32Å; F96-Y301 HydrophobicContact CD2-CD1 4.1Å; F96-Y301 AromaticContact CD2-CE1 3.74Å; F96-Y301 HydrophobicContact CD2-CE1 3.74Å; F96-Y301 AromaticContact CE1-CD1 3.3Å; F96-Y301 HydrophobicContact CE1-CD1 3.3Å; F96-Y301 AromaticContact CE1-CE1 3.89Å; F96-Y301 HydrophobicContact CE1-CE1 3.89Å; F96-Y301 HydrophobicContact CE1-CG 4.17Å; F96-Y301 AromaticContact CE2-CD1 3.58Å; F96-Y301 HydrophobicContact CE2-CD1 3.58Å; F96-Y301 AromaticContact CE2-CE1 3.19Å; F96-Y301 HydrophobicContact CE2-CE1 3.19Å; F96-Y301 HydrophobicContact CG-CD1 4.22Å; F96-Y301 HydrophobicContact CG-CE1 4.29Å; F96-Y301 AromaticContact CZ-CD1 3.14Å; F96-Y301 HydrophobicContact CZ-CD1 3.14Å; F96-Y301 AromaticContact CZ-CE1 3.28Å; F96-Y301 HydrophobicContact CZ-CE1 3.28Å; F96-Y301 HydrophobicContact CZ-CG 4.07Å; M97-Y301 WeakPolarHBondContact CE-O 3.44Å; V100-Y301 HydrophobicContact CG2-CD1 3.46Å; V100-Y301 VanDerWaalsContact CG2-CD1 3.46Å; V100-Y301 HydrophobicContact CG2-CD2 4.29Å; V100-Y301 HydrophobicContact CG2-CE1 3.62Å; V100-Y301 HydrophobicContact CG2-CE2 4.39Å; V100-Y301 HydrophobicContact CG2-CG 3.86Å; V103-Y301 HydrophobicContact CG1-CE2 4.42Å; V103-Y301 WeakPolarHBondContact CG2-OH 3.35Å; D126-Y301 PolarHBondContact OD2-OH 3.19Å; L297-Y301 HydrophobicContact CD1-CD2 4.5Å; L297-Y301 HydrophobicContact CD1-CE2 3.85Å; L297-Y301 HydrophobicContact CD2-CE2 4.22Å; L297-Y301 HydrophobicContact CG-CD2 4.23Å; L297-Y301 HydrophobicContact CG-CE2 3.65Å; L297-Y301 WeakPolarHBondContact O-CD2 3.37Å; L297-Y301 PolarHBondContact O-N 3.33Å; L297-Y301 VanDerWaalsContact O-N 3.14Å; I298-Y301 WeakPolarHBondContact O-CB 3.19Å; I298-Y301 PolarHBondContact O-N 3.02Å; I298-Y301 VanDerWaalsContact O-N 3.16Å; Y301-N303 PolarHBondContact O-N 3.37Å; Y301-S304 PolarHBondContact O-N 3.26Å |
| 302 | A | 91.8 | Very high | 83.7 | Confident | 26 Ų | 26 | 25.9 Ų | 25.9 | 22% | 0.215 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.1 | -21.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | I298 L299 S300 S304 C305 A306 | I298-A302 PolarHBondContact O-N 3.39Å; L299-A302 WeakPolarHBondContact O-CB 3.34Å; L299-A302 PolarHBondContact O-N 2.86Å; S300-A302 VanDerWaalsContact C-N 3.33Å; S300-A302 PolarHBondContact O-N 3.42Å; A302-S304 VanDerWaalsContact C-N 3.27Å; A302-S304 PolarHBondContact O-N 2.94Å; A302-C305 WeakPolarHBondContact O-CB 3.3Å; A302-C305 PolarHBondContact O-N 3.22Å; A302-C305 VanDerWaalsContact O-N 3.16Å; A302-A306 PolarHBondContact O-N 2.89Å |
| 303 | N | 90.3 | Very high | 82.2 | Confident | 2 Ų | 2 | 30.2 Ų | 30.2 | 1% | 0.011 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -54.6 | -42.9 | 172.6 | -177.8 | 68.9 | 0 | 0 | 0 | 112.1 | C271 W272 S300 Y301 C305 A306 | C271-N303 HydrophobicContact CB-CB 3.67Å; W272-N303 VanDerWaalsContact NE1-CG 3.35Å; W272-N303 PolarHBondContact NE1-ND2 2.88Å; S300-N303 WeakPolarHBondContact O-CB 3.4Å; S300-N303 PolarHBondContact O-N 3.43Å; Y301-N303 PolarHBondContact O-N 3.37Å; N303-C305 VanDerWaalsContact C-N 3.33Å; N303-C305 PolarHBondContact O-N 3.49Å; N303-A306 PolarHBondContact O-N 2.88Å |
| 304 | S | 89.7 | Confident | 80.5 | Confident | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.9 | -31.5 | -179.1 | 154.4 | 0 | 0 | 0 | 0 | 112 | N65 D93 M97 Y301 A302 A306 N307 P308 | N65-S304 PolarHBondContact ND2-O 3.42Å; N65-S304 PolarHBondContact ND2-OG 3.3Å; N65-S304 VanDerWaalsContact ND2-OG 3.13Å; D93-S304 VanDerWaalsContact CB-OG 3.29Å; D93-S304 WeakPolarHBondContact CB-OG 3.49Å; D93-S304 WeakPolarHBondContact OD1-CB 3.24Å; M97-S304 VanDerWaalsContact CE-OG 3.29Å; M97-S304 WeakPolarHBondContact CE-OG 3.3Å; Y301-S304 PolarHBondContact O-N 3.26Å; A302-S304 VanDerWaalsContact C-N 3.27Å; A302-S304 PolarHBondContact O-N 2.94Å; S304-A306 VanDerWaalsContact C-N 3.29Å; S304-A306 PolarHBondContact O-N 3.39Å; S304-N307 PolarHBondContact O-N 2.86Å; S304-P308 VanDerWaalsContact O-CD 3.27Å; S304-P308 WeakPolarHBondContact O-CD 3.08Å |
| 305 | C | 87.5 | Confident | 79.1 | Confident | 16 Ų | 16 | 28.7 Ų | 28.7 | 11% | 0.108 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -67.1 | -30.1 | 174.9 | -65.9 | 0 | 0 | 0 | 0 | 113 | V57 V60 G61 A302 N303 N307 | V57-C305 PolarHBondContact O-SG 3.18Å; V60-C305 HydrophobicContact CG1-CB 3.9Å; G61-C305 PolarHBondContact N-SG 3.11Å; A302-C305 WeakPolarHBondContact O-CB 3.3Å; A302-C305 PolarHBondContact O-N 3.22Å; A302-C305 VanDerWaalsContact O-N 3.16Å; N303-C305 VanDerWaalsContact C-N 3.33Å; N303-C305 PolarHBondContact O-N 3.49Å; C305-N307 VanDerWaalsContact C-N 3.33Å |
| 306 | A | 81.9 | Confident | 77.5 | Confident | 19 Ų | 19 | 28.5 Ų | 28.5 | 16% | 0.157 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -74.6 | -25.9 | -177 | 0 | 0 | 0 | 0 | 0 | 112.7 | V267 A302 N303 S304 V309 L310 | V267-A306 HydrophobicContact CG1-CB 3.39Å; A302-A306 PolarHBondContact O-N 2.89Å; N303-A306 PolarHBondContact O-N 2.88Å; S304-A306 VanDerWaalsContact C-N 3.29Å; S304-A306 PolarHBondContact O-N 3.39Å; A306-V309 WeakPolarHBondContact O-CB 3.28Å; A306-V309 PolarHBondContact O-N 3.35Å; A306-L310 HydrophobicContact CB-CD1 4.05Å; A306-L310 WeakPolarHBondContact O-CB 3.48Å; A306-L310 WeakPolarHBondContact O-CD1 3.26Å; A306-L310 WeakPolarHBondContact O-CG 3.4Å; A306-L310 PolarHBondContact O-N 3.46Å |
| 307 | N | 78 | Confident | 75.8 | Confident | 3 Ų | 3 | 33 Ų | 33 | 2% | 0.016 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59 | -54.3 | -176.6 | -71.7 | -27.4 | 0 | 0 | 0 | 112.3 | D93 S304 C305 V309 L310 Y311 | D93-N307 PolarHBondContact OD2-ND2 2.81Å; S304-N307 PolarHBondContact O-N 2.86Å; C305-N307 VanDerWaalsContact C-N 3.33Å; N307-V309 VanDerWaalsContact C-N 3.32Å; N307-V309 PolarHBondContact O-N 2.98Å; N307-L310 PolarHBondContact O-N 2.93Å; N307-Y311 HydrophobicContact CB-CE2 3.89Å; N307-Y311 WeakPolarHBondContact O-CD2 3.41Å; N307-Y311 WeakPolarHBondContact O-CE2 3.28Å; N307-Y311 PolarHBondContact O-N 2.88Å |
| 308 | P | 72.6 | Confident | 74.3 | Confident | 11 Ų | 11 | 31.3 Ų | 31.3 | 7% | 0.071 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -56.7 | -39.3 | 174.1 | -26.5 | 34 | 0 | 0 | 0 | 114.4 | N65 V68 S304 Y311 G312 | N65-P308 WeakPolarHBondContact OD1-CG 3.47Å; V68-P308 HydrophobicContact CG2-CB 3.95Å; V68-P308 HydrophobicContact CG2-CG 4.11Å; S304-P308 VanDerWaalsContact O-CD 3.27Å; S304-P308 WeakPolarHBondContact O-CD 3.08Å; P308-Y311 PolarHBondContact O-N 2.96Å; P308-G312 WeakPolarHBondContact O-CA 3.31Å; P308-G312 PolarHBondContact O-N 3.46Å |
| 309 | V | 66.4 | Low | 72.9 | Confident | 73 Ų | 73 | 34.9 Ų | 34.9 | 44% | 0.442 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -64.5 | -48.5 | 178 | 175 | 0 | 0 | 0 | 0 | 109.8 | A306 N307 Y311 G312 F313 | A306-V309 WeakPolarHBondContact O-CB 3.28Å; A306-V309 PolarHBondContact O-N 3.35Å; N307-V309 VanDerWaalsContact C-N 3.32Å; N307-V309 PolarHBondContact O-N 2.98Å; V309-Y311 VanDerWaalsContact C-N 3.29Å; V309-Y311 PolarHBondContact O-N 2.72Å; V309-G312 PolarHBondContact O-N 2.95Å; V309-F313 HydrophobicContact CB-CD2 4.34Å; V309-F313 HydrophobicContact CG1-CD2 3.59Å; V309-F313 HydrophobicContact CG1-CE2 3.84Å; V309-F313 WeakPolarHBondContact O-CB 3.05Å; V309-F313 VanDerWaalsContact O-CD2 3.23Å; V309-F313 WeakPolarHBondContact O-CD2 3.22Å; V309-F313 PolarHBondContact O-N 2.89Å |
| 310 | L | 66.4 | Low | 71.4 | Confident | 10 Ų | 10 | 39 Ų | 39 | 5% | 0.052 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.1 | -37.6 | 179.4 | -69.7 | 162.4 | 0 | 0 | 0 | 111.4 | L260 M263 V264 V267 A306 N307 L314 | L260-L310 HydrophobicContact CD1-CB 4.26Å; L260-L310 VanDerWaalsContact CD1-O 3.3Å; L260-L310 WeakPolarHBondContact CD1-O 3.42Å; M263-L310 HydrophobicContact CB-CD2 4Å; M263-L310 HydrophobicContact CE-CD2 4.14Å; V264-L310 HydrophobicContact CB-CD1 4.18Å; V264-L310 HydrophobicContact CG1-CD1 4.43Å; V264-L310 HydrophobicContact CG2-CB 4.13Å; V264-L310 HydrophobicContact CG2-CD1 3.78Å; V264-L310 HydrophobicContact CG2-CD2 4.21Å; V264-L310 HydrophobicContact CG2-CG 4.26Å; V267-L310 HydrophobicContact CB-CD1 4.45Å; V267-L310 HydrophobicContact CG1-CD1 4.49Å; V267-L310 HydrophobicContact CG2-CD1 4.41Å; A306-L310 HydrophobicContact CB-CD1 4.05Å; A306-L310 WeakPolarHBondContact O-CB 3.48Å; A306-L310 WeakPolarHBondContact O-CD1 3.26Å; A306-L310 WeakPolarHBondContact O-CG 3.4Å; A306-L310 PolarHBondContact O-N 3.46Å; N307-L310 PolarHBondContact O-N 2.93Å; L310-L314 HydrophobicContact CD2-CD1 4.26Å; L310-L314 WeakPolarHBondContact O-CB 3.38Å; L310-L314 WeakPolarHBondContact O-CD1 3.33Å |
| 311 | Y | 64.4 | Low | 69.9 | Low | 13 Ų | 13 | 39.4 Ų | 39.4 | 5% | 0.051 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -80.9 | -40.3 | 178.5 | -55 | -46.2 | 0 | 0 | 0 | 113.6 | L86 L89 L140 N307 P308 V309 S315 | L86-Y311 HydrophobicContact CD1-CD1 4.44Å; L86-Y311 HydrophobicContact CD2-CD1 3.83Å; L86-Y311 HydrophobicContact CD2-CD2 3.95Å; L86-Y311 HydrophobicContact CD2-CE1 3.38Å; L86-Y311 HydrophobicContact CD2-CE2 3.5Å; L86-Y311 HydrophobicContact CD2-CG 4.12Å; L89-Y311 HydrophobicContact CD2-CE2 4.19Å; L89-Y311 VanDerWaalsContact CD2-OH 3.27Å; L89-Y311 WeakPolarHBondContact CD2-OH 3.18Å; L140-Y311 HydrophobicContact CD2-CE1 4.44Å; N307-Y311 HydrophobicContact CB-CE2 3.89Å; N307-Y311 WeakPolarHBondContact O-CD2 3.41Å; N307-Y311 WeakPolarHBondContact O-CE2 3.28Å; N307-Y311 PolarHBondContact O-N 2.88Å; P308-Y311 PolarHBondContact O-N 2.96Å; V309-Y311 VanDerWaalsContact C-N 3.29Å; V309-Y311 PolarHBondContact O-N 2.72Å; Y311-S315 WeakPolarHBondContact O-CB 3.18Å; Y311-S315 PolarHBondContact O-N 3.37Å; Y311-S315 VanDerWaalsContact O-N 3.11Å |
| 312 | G | 60 | Low | 68.5 | Low | 12 Ų | 12 | 40.9 Ų | 40.9 | 12% | 0.124 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -68.1 | -38.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | P308 V309 R319 | P308-G312 WeakPolarHBondContact O-CA 3.31Å; P308-G312 PolarHBondContact O-N 3.46Å; V309-G312 PolarHBondContact O-N 2.95Å; G312-R319 WeakPolarHBondContact O-CB 3.44Å |
| 313 | F | 54.6 | Low | 67.3 | Low | 154 Ų | 154 | 43.7 Ų | 43.7 | 68% | 0.675 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -84.1 | -27.2 | -179.5 | -74.8 | -74.9 | 0 | 0 | 0 | 113.8 | V309 | V309-F313 HydrophobicContact CB-CD2 4.34Å; V309-F313 HydrophobicContact CG1-CD2 3.59Å; V309-F313 HydrophobicContact CG1-CE2 3.84Å; V309-F313 WeakPolarHBondContact O-CB 3.05Å; V309-F313 VanDerWaalsContact O-CD2 3.23Å; V309-F313 WeakPolarHBondContact O-CD2 3.22Å; V309-F313 PolarHBondContact O-N 2.89Å |
| 314 | L | 51.8 | Low | 65.9 | Low | 34 Ų | 34 | 49.9 Ų | 49.9 | 18% | 0.178 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -115.9 | -17.2 | -166.4 | -66.2 | 127.5 | 0 | 0 | 0 | 115.1 | K256 L260 M263 L310 | K256-L314 WeakPolarHBondContact CE-O 3.28Å; L260-L314 HydrophobicContact CB-CB 4.12Å; L260-L314 HydrophobicContact CB-CD2 4.17Å; L260-L314 HydrophobicContact CD1-CB 3.51Å; L260-L314 HydrophobicContact CD1-CD1 3.56Å; L260-L314 HydrophobicContact CD1-CD2 4.39Å; L260-L314 HydrophobicContact CD1-CG 3.95Å; L260-L314 HydrophobicContact CD2-CB 3.86Å; L260-L314 HydrophobicContact CG-CB 4.02Å; M263-L314 HydrophobicContact CE-CD1 3.35Å; M263-L314 HydrophobicContact CE-CD2 3.91Å; M263-L314 HydrophobicContact CE-CG 4.28Å; L310-L314 HydrophobicContact CD2-CD1 4.26Å; L310-L314 WeakPolarHBondContact O-CB 3.38Å; L310-L314 WeakPolarHBondContact O-CD1 3.33Å |
| 315 | S | 59.2 | Low | 64.8 | Low | 35 Ų | 35 | 51.5 Ų | 51.5 | 25% | 0.245 | 25% | 0.249 | C | C | . | . | trans | -94.9 | 113.8 | 169.8 | -179.1 | 0 | 0 | 0 | 0 | 110.8 | Y311 N317 F318 R319 | Y311-S315 WeakPolarHBondContact O-CB 3.18Å; Y311-S315 PolarHBondContact O-N 3.37Å; Y311-S315 VanDerWaalsContact O-N 3.11Å; S315-N317 PolarHBondContact O-N 2.91Å; S315-N317 VanDerWaalsContact O-N 3.11Å; S315-F318 PolarHBondContact O-N 3.26Å; S315-R319 PolarHBondContact O-N 3.02Å | ||
| 316 | D | 56.6 | Low | 63.8 | Low | 69 Ų | 69 | 56 Ų | 56 | 37% | 0.369 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -59.5 | -27.1 | -178.8 | -66.2 | -44.3 | 0 | 0 | 0 | 112.8 | K256 R320 | K256-D316 IonicContact NZ-OD1 2.75Å; K256-D316 PolarHBondContact NZ-OD1 2.94Å; K256-D316 IonicContact NZ-OD2 2.67Å; K256-D316 PolarHBondContact NZ-OD2 3.25Å; D316-R320 WeakPolarHBondContact O-CB 3.48Å; D316-R320 WeakPolarHBondContact O-CD 3.47Å; D316-R320 WeakPolarHBondContact O-CG 3.25Å; D316-R320 PolarHBondContact O-N 3.04Å |
| 317 | N | 56.7 | Low | 62.9 | Low | 103 Ų | 103 | 57.5 Ų | 57.5 | 55% | 0.551 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -73.6 | -41.6 | 175.5 | -69.3 | -19.5 | 0 | 0 | 0 | 111.8 | S315 S321 | S315-N317 PolarHBondContact O-N 2.91Å; S315-N317 VanDerWaalsContact O-N 3.11Å; N317-S321 PolarHBondContact O-N 3.24Å; N317-S321 PolarHBondContact O-OG 2.57Å; N317-S321 VanDerWaalsContact O-OG 3.08Å |
| 318 | F | 60.6 | Low | 61.9 | Low | 3 Ų | 3 | 60.8 Ų | 60.8 | 1% | 0.013 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -70.3 | -44.9 | 175.4 | -83.4 | -90.6 | 0 | 0 | 0 | 110.9 | V71 I72 M78 L86 S315 R320 S321 F322 | V71-F318 HydrophobicContact CG1-CD1 4.1Å; V71-F318 HydrophobicContact CG1-CE1 4.26Å; I72-F318 HydrophobicContact CD1-CE1 4.08Å; I72-F318 HydrophobicContact CD1-CZ 3.91Å; I72-F318 HydrophobicContact CG1-CE1 3.74Å; I72-F318 HydrophobicContact CG1-CZ 3.75Å; M78-F318 HydrophobicContact CE-CD1 4.34Å; M78-F318 HydrophobicContact CE-CE1 3.83Å; M78-F318 HydrophobicContact CE-CE2 4.27Å; M78-F318 HydrophobicContact CE-CZ 3.79Å; L86-F318 HydrophobicContact CD1-CE2 3.51Å; L86-F318 HydrophobicContact CD1-CZ 3.61Å; S315-F318 PolarHBondContact O-N 3.26Å; F318-R320 VanDerWaalsContact C-N 3.3Å; F318-R320 PolarHBondContact O-N 3.26Å; F318-S321 PolarHBondContact O-N 3.33Å; F318-F322 HydrophobicContact CB-CD2 4.41Å; F318-F322 HydrophobicContact CD1-CD2 4.44Å; F318-F322 HydrophobicContact CD1-CE2 4.03Å; F318-F322 WeakPolarHBondContact O-CB 3.29Å; F318-F322 VanDerWaalsContact O-CD2 3.31Å; F318-F322 WeakPolarHBondContact O-CD2 3.23Å; F318-F322 PolarHBondContact O-N 2.79Å |
| 319 | R | 63 | Low | 60.9 | Low | 88 Ų | 88 | 68.8 Ų | 68.8 | 33% | 0.332 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -55.1 | -45.6 | 177.9 | -161.1 | -179.9 | 103.6 | 175.4 | 5.9 | 112 | G312 S315 Q323 W359 | G312-R319 WeakPolarHBondContact O-CB 3.44Å; S315-R319 PolarHBondContact O-N 3.02Å; R319-Q323 WeakPolarHBondContact O-CB 3.31Å; R319-Q323 WeakPolarHBondContact O-CG 3.5Å; R319-Q323 PolarHBondContact O-N 3.03Å; R319-W359 VanDerWaalsContact NH2-CH2 3.33Å |
| 320 | R | 61.7 | Low | 60.1 | Low | 146 Ų | 146 | 69.1 Ų | 69.1 | 55% | 0.551 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -65.4 | -39.5 | 176.9 | -73.9 | 173.4 | -173.3 | 167.2 | 2.5 | 112.5 | D316 F318 R324 | D316-R320 WeakPolarHBondContact O-CB 3.48Å; D316-R320 WeakPolarHBondContact O-CD 3.47Å; D316-R320 WeakPolarHBondContact O-CG 3.25Å; D316-R320 PolarHBondContact O-N 3.04Å; F318-R320 VanDerWaalsContact C-N 3.3Å; F318-R320 PolarHBondContact O-N 3.26Å; R320-R324 VanDerWaalsContact O-CG 3.32Å; R320-R324 WeakPolarHBondContact O-CG 3.47Å; R320-R324 PolarHBondContact O-N 3.49Å; R320-R324 VanDerWaalsContact O-N 3.1Å |
| 321 | S | 61.2 | Low | 59.3 | Low | 9 Ų | 9 | 71.6 Ų | 71.6 | 6% | 0.063 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -68.9 | -44.1 | 177 | -65.6 | 0 | 0 | 0 | 0 | 112.1 | N317 F318 Q323 R324 V325 | N317-S321 PolarHBondContact O-N 3.24Å; N317-S321 PolarHBondContact O-OG 2.57Å; N317-S321 VanDerWaalsContact O-OG 3.08Å; F318-S321 PolarHBondContact O-N 3.33Å; S321-Q323 PolarHBondContact O-N 2.93Å; S321-R324 WeakPolarHBondContact O-CB 3.31Å; S321-R324 PolarHBondContact O-N 2.92Å; S321-V325 WeakPolarHBondContact O-CG2 3.26Å; S321-V325 PolarHBondContact O-N 3.41Å; S321-V325 VanDerWaalsContact O-N 3.07Å |
| 322 | F | 65.1 | Low | 58.6 | Low | 33 Ų | 33 | 76.7 Ų | 76.7 | 15% | 0.145 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -58.4 | -46.8 | 173.5 | -92.6 | -110.1 | 0 | 0 | 0 | 111.7 | L67 V68 V71 F318 R324 V325 L326 | L67-F322 HydrophobicContact CB-CE1 4.42Å; L67-F322 HydrophobicContact CB-CZ 4.39Å; L67-F322 HydrophobicContact CD1-CE1 4.49Å; L67-F322 HydrophobicContact CD2-CD1 3.61Å; L67-F322 HydrophobicContact CD2-CE1 3.1Å; L67-F322 HydrophobicContact CD2-CZ 3.83Å; L67-F322 HydrophobicContact CG-CD1 4.09Å; L67-F322 HydrophobicContact CG-CE1 3.44Å; L67-F322 VanDerWaalsContact CG-CE1 3.44Å; L67-F322 HydrophobicContact CG-CE2 4.44Å; L67-F322 HydrophobicContact CG-CZ 3.62Å; V68-F322 HydrophobicContact CG2-CZ 4.36Å; V71-F322 HydrophobicContact CB-CE2 4.46Å; V71-F322 HydrophobicContact CG1-CD2 4.47Å; V71-F322 HydrophobicContact CG2-CD2 4.07Å; V71-F322 HydrophobicContact CG2-CE2 4.05Å; F318-F322 HydrophobicContact CB-CD2 4.41Å; F318-F322 HydrophobicContact CD1-CD2 4.44Å; F318-F322 HydrophobicContact CD1-CE2 4.03Å; F318-F322 WeakPolarHBondContact O-CB 3.29Å; F318-F322 VanDerWaalsContact O-CD2 3.31Å; F318-F322 WeakPolarHBondContact O-CD2 3.23Å; F318-F322 PolarHBondContact O-N 2.79Å; F322-R324 VanDerWaalsContact C-N 3.28Å; F322-R324 PolarHBondContact O-N 3.28Å; F322-V325 PolarHBondContact O-N 3.45Å; F322-L326 WeakPolarHBondContact O-CB 3.19Å; F322-L326 PolarHBondContact O-N 3.06Å |
| 323 | Q | 65.2 | Low | 58 | Low | 84 Ų | 84 | 82.3 Ų | 82.3 | 39% | 0.393 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.6 | -37.7 | 175.8 | -76.7 | 175.9 | -20.4 | 0 | 0 | 112 | R319 S321 C327 | R319-Q323 WeakPolarHBondContact O-CB 3.31Å; R319-Q323 WeakPolarHBondContact O-CG 3.5Å; R319-Q323 PolarHBondContact O-N 3.03Å; S321-Q323 PolarHBondContact O-N 2.93Å; Q323-C327 WeakPolarHBondContact O-CB 3.41Å; Q323-C327 PolarHBondContact O-N 3.23Å |
| 324 | R | 61.7 | Low | 57.5 | Low | 133 Ų | 133 | 82.3 Ų | 82.3 | 50% | 0.502 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -67.2 | -39.4 | 175.5 | -73.4 | 175.3 | -158.9 | 162.9 | 2.3 | 112.8 | R320 S321 F322 L328 | R320-R324 VanDerWaalsContact O-CG 3.32Å; R320-R324 WeakPolarHBondContact O-CG 3.47Å; R320-R324 PolarHBondContact O-N 3.49Å; R320-R324 VanDerWaalsContact O-N 3.1Å; S321-R324 WeakPolarHBondContact O-CB 3.31Å; S321-R324 PolarHBondContact O-N 2.92Å; F322-R324 VanDerWaalsContact C-N 3.28Å; F322-R324 PolarHBondContact O-N 3.28Å; R324-L328 WeakPolarHBondContact O-CB 3.49Å; R324-L328 WeakPolarHBondContact O-CD1 3.39Å; R324-L328 PolarHBondContact O-N 2.93Å |
| 325 | V | 65.8 | Low | 57.2 | Low | 33 Ų | 33 | 83.1 Ų | 83.1 | 20% | 0.2 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -67.9 | -46 | 177.6 | 179.4 | 0 | 0 | 0 | 0 | 110.7 | F70 V71 Y75 S321 F322 C327 L328 R329 | F70-V325 HydrophobicContact CE1-CG1 4.05Å; F70-V325 HydrophobicContact CE1-CG2 3.98Å; V71-V325 HydrophobicContact CG2-CG2 4.35Å; Y75-V325 HydrophobicContact CE2-CG2 4.29Å; S321-V325 WeakPolarHBondContact O-CG2 3.26Å; S321-V325 PolarHBondContact O-N 3.41Å; S321-V325 VanDerWaalsContact O-N 3.07Å; F322-V325 PolarHBondContact O-N 3.45Å; V325-C327 PolarHBondContact O-N 3.44Å; V325-L328 PolarHBondContact O-N 3.09Å; V325-R329 PolarHBondContact O-N 3.09Å |
| 326 | L | 66.8 | Low | 56.5 | Low | 110 Ų | 110 | 85.8 Ų | 85.8 | 58% | 0.576 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -61.9 | -42.6 | 176.4 | -78.3 | 158.4 | 0 | 0 | 0 | 111.7 | F322 R329 C330 | F322-L326 WeakPolarHBondContact O-CB 3.19Å; F322-L326 PolarHBondContact O-N 3.06Å; L326-R329 WeakPolarHBondContact O-CB 3.17Å; L326-R329 PolarHBondContact O-N 3Å; L326-C330 PolarHBondContact O-N 2.71Å; L326-C330 VanDerWaalsContact O-N 3.08Å; L326-C330 PolarHBondContact O-SG 3.33Å |
| 327 | C | 62.4 | Low | 55.8 | Low | 51 Ų | 51 | 86.3 Ų | 86.3 | 35% | 0.345 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -68.8 | -39 | 178.2 | -156.3 | 0 | 0 | 0 | 0 | 112 | Q323 V325 R329 C330 C331 | Q323-C327 WeakPolarHBondContact O-CB 3.41Å; Q323-C327 PolarHBondContact O-N 3.23Å; V325-C327 PolarHBondContact O-N 3.44Å; C327-R329 VanDerWaalsContact C-N 3.25Å; C327-R329 PolarHBondContact O-N 2.83Å; C327-C330 PolarHBondContact O-N 3.12Å; C327-C331 PolarHBondContact O-N 2.95Å; C327-C331 VanDerWaalsContact O-N 3.08Å; C327-C331 PolarHBondContact O-SG 2.91Å |
| 328 | L | 57.4 | Low | 54.9 | Low | 73 Ų | 73 | 84 Ų | 84 | 38% | 0.382 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.9 | -38.8 | 170.6 | -111.9 | 93.4 | 0 | 0 | 0 | 111.7 | R324 V325 C331 L332 Y346 | R324-L328 WeakPolarHBondContact O-CB 3.49Å; R324-L328 WeakPolarHBondContact O-CD1 3.39Å; R324-L328 PolarHBondContact O-N 2.93Å; V325-L328 PolarHBondContact O-N 3.09Å; L328-C331 PolarHBondContact O-N 3.39Å; L328-L332 WeakPolarHBondContact O-CB 3.42Å; L328-L332 VanDerWaalsContact O-CG 3.25Å; L328-L332 WeakPolarHBondContact O-CG 3.43Å; L328-L332 PolarHBondContact O-N 3.34Å; L328-Y346 HydrophobicContact CD1-CD1 4.09Å; L328-Y346 HydrophobicContact CD1-CE1 3.85Å |
| 329 | R | 51.9 | Low | 53.7 | Low | 178 Ų | 178 | 89 Ų | 89 | 67% | 0.672 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.5 | -37.1 | 179.4 | -134.9 | -178.5 | -171.1 | -143.6 | 3.1 | 111.9 | V325 L326 C327 L332 L333 | V325-R329 PolarHBondContact O-N 3.09Å; L326-R329 WeakPolarHBondContact O-CB 3.17Å; L326-R329 PolarHBondContact O-N 3Å; C327-R329 VanDerWaalsContact C-N 3.25Å; C327-R329 PolarHBondContact O-N 2.83Å; R329-L332 PolarHBondContact O-N 2.99Å; R329-L333 HydrophobicContact CG-CD1 4.29Å; R329-L333 WeakPolarHBondContact O-CB 3.42Å; R329-L333 VanDerWaalsContact O-CD1 3.26Å; R329-L333 WeakPolarHBondContact O-CD1 3.46Å; R329-L333 PolarHBondContact O-N 2.91Å |
| 330 | C | 50.2 | Low | 52.8 | Low | 80 Ų | 80 | 92.5 Ų | 92.5 | 54% | 0.541 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.6 | -47.4 | 171.2 | -64.9 | 0 | 0 | 0 | 0 | 111.4 | L326 C327 L332 L333 E334 | L326-C330 PolarHBondContact O-N 2.71Å; L326-C330 VanDerWaalsContact O-N 3.08Å; L326-C330 PolarHBondContact O-SG 3.33Å; C327-C330 PolarHBondContact O-N 3.12Å; C330-L332 VanDerWaalsContact C-N 3.35Å; C330-L332 PolarHBondContact O-N 3.36Å; C330-L333 PolarHBondContact O-N 3.36Å; C330-E334 PolarHBondContact O-N 2.88Å |
| 331 | C | 48.8 | Very low | 51.5 | Low | 62 Ų | 62 | 95 Ų | 95 | 42% | 0.419 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.8 | -36 | 178.7 | -59.1 | 0 | 0 | 0 | 0 | 113.1 | C327 L328 G335 | C327-C331 PolarHBondContact O-N 2.95Å; C327-C331 VanDerWaalsContact O-N 3.08Å; C327-C331 PolarHBondContact O-SG 2.91Å; L328-C331 PolarHBondContact O-N 3.39Å; C331-G335 PolarHBondContact O-N 2.84Å; C331-G335 VanDerWaalsContact O-N 3.11Å |
| 332 | L | 49.7 | Very low | 50.2 | Low | 120 Ų | 120 | 103.1 Ų | 103.1 | 63% | 0.628 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -74.4 | -31.2 | 178.6 | -72.5 | 168.5 | 0 | 0 | 0 | 112.8 | L328 R329 C330 G335 A336 | L328-L332 WeakPolarHBondContact O-CB 3.42Å; L328-L332 VanDerWaalsContact O-CG 3.25Å; L328-L332 WeakPolarHBondContact O-CG 3.43Å; L328-L332 PolarHBondContact O-N 3.34Å; R329-L332 PolarHBondContact O-N 2.99Å; C330-L332 VanDerWaalsContact C-N 3.35Å; C330-L332 PolarHBondContact O-N 3.36Å; L332-G335 PolarHBondContact O-N 3.23Å; L332-A336 PolarHBondContact O-N 2.66Å |
| 333 | L | 47.7 | Very low | 49 | Very low | 131 Ų | 131 | 107.5 Ų | 107.5 | 69% | 0.686 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -71.3 | -31.7 | 173 | -100 | 105.7 | 0 | 0 | 0 | 112.5 | R329 C330 | R329-L333 HydrophobicContact CG-CD1 4.29Å; R329-L333 WeakPolarHBondContact O-CB 3.42Å; R329-L333 VanDerWaalsContact O-CD1 3.26Å; R329-L333 WeakPolarHBondContact O-CD1 3.46Å; R329-L333 PolarHBondContact O-N 2.91Å; C330-L333 PolarHBondContact O-N 3.36Å |
| 334 | E | 45.5 | Very low | 47.7 | Very low | 154 Ų | 154 | 111.6 Ų | 111.6 | 72% | 0.72 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -76.3 | -25.2 | 172.6 | -76 | -179.9 | 136.5 | 0 | 0 | 112.9 | C330 | C330-E334 PolarHBondContact O-N 2.88Å |
| 335 | G | 44.1 | Very low | 46.6 | Very low | 51 Ų | 51 | 110.9 Ų | 110.9 | 53% | 0.526 | 65% | 0.652 | S | S | . | * | G | 310 helix | trans | -80 | -9.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | C331 L332 G337 | C331-G335 PolarHBondContact O-N 2.84Å; C331-G335 VanDerWaalsContact O-N 3.11Å; L332-G335 PolarHBondContact O-N 3.23Å; G335-G337 PolarHBondContact O-N 3.08Å; G335-G337 VanDerWaalsContact O-N 3.07Å |
| 336 | A | 43.8 | Very low | 45.5 | Very low | 91 Ų | 91 | 116.3 Ų | 116.3 | 75% | 0.752 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -74.8 | 8.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | L332 | L332-A336 PolarHBondContact O-N 2.66Š|
| 337 | G | 42.8 | Very low | 44.3 | Very low | 79 Ų | 79 | 116.8 Ų | 116.8 | 81% | 0.814 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -97.3 | 5.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | G335 | G335-G337 PolarHBondContact O-N 3.08Å; G335-G337 VanDerWaalsContact O-N 3.07Å |
| 338 | G | 38.1 | Very low | 43.1 | Very low | 56 Ų | 56 | 117.8 Ų | 117.8 | 58% | 0.577 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -175.5 | 116.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 339 | A | 35.9 | Very low | 42.3 | Very low | 107 Ų | 107 | 119.4 Ų | 119.4 | 88% | 0.884 | 69% | 0.69 | S | S | * | * | trans | 59.5 | 135.3 | 152.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 340 | D | 43.2 | Very low | 41.9 | Very low | 162 Ų | 162 | 114.1 Ų | 114.1 | 87% | 0.866 | 68% | 0.684 | S | S | * | * | trans | -47.2 | 131.3 | 172.5 | -66.3 | -58.6 | 0 | 0 | 0 | 114 | ||||
| 341 | E | 34.8 | Very low | 41.5 | Very low | 199 Ų | 199 | 116.9 Ų | 116.9 | 93% | 0.93 | 69% | 0.693 | S | S | * | * | trans | -167.7 | 152.2 | 142.7 | -111.9 | -176.9 | 128.3 | 0 | 0 | 113.4 | ||||
| 342 | E | 34.3 | Very low | 40.8 | Very low | 179 Ų | 179 | 123.2 Ų | 123.2 | 84% | 0.836 | 71% | 0.713 | S | S | * | * | trans | -57.5 | 164.3 | -173.3 | -103.8 | -173.9 | 105.3 | 0 | 0 | 116.7 | L344 | E342-L344 PolarHBondContact O-N 3.15Š| ||
| 343 | P | 38.6 | Very low | 40.1 | Very low | 125 Ų | 125 | 122.5 Ų | 122.5 | 81% | 0.812 | 72% | 0.718 | S | S | * | * | trans | -78.9 | 91.9 | -164.4 | 32.1 | -32.6 | 0 | 0 | 0 | 112.5 | ||||
| 344 | L | 38.3 | Very low | 39.9 | Very low | 169 Ų | 169 | 128 Ų | 128 | 89% | 0.885 | 73% | 0.73 | S | S | * | * | trans | -83 | 148.6 | 178.7 | -150.1 | 73.1 | 0 | 0 | 0 | 113.8 | E342 Y346 | E342-L344 PolarHBondContact O-N 3.15Å; L344-Y346 PolarHBondContact O-N 3.02Å | ||
| 345 | D | 38.8 | Very low | 39.6 | Very low | 119 Ų | 119 | 124.4 Ų | 124.4 | 64% | 0.636 | 73% | 0.734 | S | S | * | * | trans | -70.9 | 71.5 | -157.5 | -141.4 | -9.7 | 0 | 0 | 0 | 115.1 | Y347 A348 | D345-Y347 PolarHBondContact O-N 3.02Å; D345-A348 PolarHBondContact O-N 3.35Å | ||
| 346 | Y | 41.8 | Very low | 39 | Very low | 147 Ų | 147 | 125.8 Ų | 125.8 | 58% | 0.576 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -13.7 | 177.8 | -170.1 | -101.8 | 0 | 0 | 0 | 114.4 | L328 L344 A348 | L328-Y346 HydrophobicContact CD1-CD1 4.09Å; L328-Y346 HydrophobicContact CD1-CE1 3.85Å; L344-Y346 PolarHBondContact O-N 3.02Å; Y346-A348 VanDerWaalsContact C-N 3.33Å; Y346-A348 PolarHBondContact O-N 3.33Å |
| 347 | Y | 41.8 | Very low | 38.8 | Very low | 119 Ų | 119 | 126.9 Ų | 126.9 | 47% | 0.467 | 76% | 0.757 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.2 | -26.6 | -179.7 | -94.1 | -83.2 | 0 | 0 | 0 | 114.1 | D345 | D345-Y347 PolarHBondContact O-N 3.02Š|
| 348 | A | 38.7 | Very low | 38.3 | Very low | 72 Ų | 72 | 126.1 Ų | 126.1 | 60% | 0.595 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -35.8 | -175 | 0 | 0 | 0 | 0 | 0 | 113 | D345 Y346 | D345-A348 PolarHBondContact O-N 3.35Å; Y346-A348 VanDerWaalsContact C-N 3.33Å; Y346-A348 PolarHBondContact O-N 3.33Å |
| 349 | T | 40.5 | Very low | 38.3 | Very low | 108 Ų | 108 | 133.7 Ų | 133.7 | 66% | 0.663 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -78.5 | -32.6 | -171.5 | -33.2 | 0 | 0 | 0 | 0 | 112.6 | L351 K352 | T349-L351 VanDerWaalsContact C-N 3.26Å; T349-L351 PolarHBondContact O-N 3.28Å; T349-K352 PolarHBondContact O-N 3.23Å |
| 350 | A | 42.3 | Very low | 38 | Very low | 67 Ų | 67 | 136.8 Ų | 136.8 | 55% | 0.554 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -71.5 | -15.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 351 | L | 41.9 | Very low | 37.6 | Very low | 137 Ų | 137 | 133.8 Ų | 133.8 | 72% | 0.717 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -83.5 | -13 | 179.5 | -89 | 156.7 | 0 | 0 | 0 | 113.6 | T349 | T349-L351 VanDerWaalsContact C-N 3.26Å; T349-L351 PolarHBondContact O-N 3.28Å |
| 352 | K | 35.2 | Very low | 37.7 | Very low | 196 Ų | 196 | 129.3 Ų | 129.3 | 85% | 0.852 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -94.9 | -14.2 | -174.8 | -133.8 | 174.6 | -176.2 | -179.4 | 0 | 114.7 | T349 R354 | T349-K352 PolarHBondContact O-N 3.23Å; K352-R354 PolarHBondContact O-N 3.15Å |
| 353 | S | 34.4 | Very low | 37.7 | Very low | 104 Ų | 104 | 126.3 Ų | 126.3 | 73% | 0.727 | 73% | 0.734 | S | S | * | * | trans | -91.7 | 78.8 | 176.6 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 354 | R | 44 | Very low | 37.8 | Very low | 248 Ų | 248 | 125.8 Ų | 125.8 | 94% | 0.936 | 72% | 0.723 | S | S | * | * | trans | -120.2 | 95.4 | 170.1 | -132.5 | -174 | 179.9 | -166.4 | -1.3 | 109.1 | K352 | K352-R354 PolarHBondContact O-N 3.15Š| ||
| 355 | G | 38.2 | Very low | 37.7 | Very low | 78 Ų | 78 | 123 Ų | 123 | 80% | 0.804 | 72% | 0.715 | S | S | * | * | trans | 157.9 | 105.7 | 169.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 356 | G | 32.1 | Very low | 37.5 | Very low | 79 Ų | 79 | 123.4 Ų | 123.4 | 81% | 0.814 | 73% | 0.726 | S | S | * | * | trans | 135.9 | 121.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 357 | A | 38.8 | Very low | 37.1 | Very low | 114 Ų | 114 | 124.6 Ų | 124.6 | 94% | 0.942 | 74% | 0.737 | S | S | * | * | trans | -70.1 | 146.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 358 | G | 32.1 | Very low | 36.9 | Very low | 64 Ų | 64 | 127.2 Ų | 127.2 | 66% | 0.66 | 75% | 0.753 | S | S | * | * | S | Bend | trans | 132.9 | 128.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | M360 | G358-M360 VanDerWaalsContact C-N 3.31Å; G358-M360 PolarHBondContact O-N 3.13Å |
| 359 | W | 39.7 | Very low | 36.8 | Very low | 214 Ų | 214 | 132.4 Ų | 132.4 | 81% | 0.811 | 77% | 0.765 | S | S | * | * | trans | -73.3 | 83.9 | 173.3 | -69.8 | 64.4 | 0 | 0 | 0 | 109.2 | R319 | R319-W359 VanDerWaalsContact NH2-CH2 3.33Š| ||
| 360 | M | 28.8 | Very low | 36.5 | Very low | 173 Ų | 173 | 133.2 Ų | 133.2 | 85% | 0.852 | 77% | 0.773 | S | S | * | * | trans | -139.9 | 132.3 | 167.5 | -75.1 | 171.4 | 69.3 | 0 | 0 | 108.7 | G358 | G358-M360 VanDerWaalsContact C-N 3.31Å; G358-M360 PolarHBondContact O-N 3.13Å | ||
| 361 | C | 34.3 | Very low | 36.3 | Very low | 98 Ų | 98 | 138.2 Ų | 138.2 | 66% | 0.662 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 138.3 | 165.9 | -71.8 | 0 | 0 | 0 | 0 | 108.5 | ||
| 362 | P | 38.1 | Very low | 35.8 | Very low | 105 Ų | 105 | 140.3 Ų | 140.3 | 68% | 0.682 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 143.2 | 174.3 | 24.1 | -30.4 | 0 | 0 | 0 | 109.7 | ||
| 363 | P | 34 | Very low | 35.9 | Very low | 117 Ų | 117 | 137.1 Ų | 137.1 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 144.4 | 178.2 | 1.2 | 10.1 | 0 | 0 | 0 | 110.8 | ||
| 364 | L | 39.3 | Very low | 35.9 | Very low | 113 Ų | 113 | 140.9 Ų | 140.9 | 59% | 0.592 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 152.8 | 178.9 | -82.6 | 148.5 | 0 | 0 | 0 | 112.2 | C366 | L364-C366 PolarHBondContact O-N 3.32Š|
| 365 | P | 36.3 | Very low | 35.5 | Very low | 111 Ų | 111 | 133.8 Ų | 133.8 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | G | 310 helix | trans | -64.7 | -7.9 | -178.9 | -18.2 | 30.8 | 0 | 0 | 0 | 115.6 | Q367 | P365-Q367 VanDerWaalsContact C-N 3.28Å; P365-Q367 PolarHBondContact O-N 3.09Å |
| 366 | C | 34.5 | Very low | 35.6 | Very low | 127 Ų | 127 | 135.5 Ų | 135.5 | 86% | 0.858 | 79% | 0.786 | S | S | * | * | G | 310 helix | trans | -82.8 | 3.8 | -176.9 | -69.7 | 0 | 0 | 0 | 0 | 114.5 | L364 | L364-C366 PolarHBondContact O-N 3.32Š|
| 367 | Q | 34.3 | Very low | 35.8 | Very low | 172 Ų | 172 | 141 Ų | 141 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | G | 310 helix | trans | -107.7 | 9.9 | 177.9 | -72.8 | -152.4 | -33.2 | 0 | 0 | 114.9 | P365 | P365-Q367 VanDerWaalsContact C-N 3.28Å; P365-Q367 PolarHBondContact O-N 3.09Å |
| 368 | Q | 37.5 | Very low | 35.7 | Very low | 175 Ų | 175 | 145 Ų | 145 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -94.1 | 107.7 | 172.8 | -76.4 | 179.1 | -12.3 | 0 | 0 | 109.9 | ||||
| 369 | E | 35.6 | Very low | 35.8 | Very low | 180 Ų | 180 | 153.7 Ų | 153.7 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | trans | -53 | 138.8 | 162.5 | -92.3 | -179.9 | 96.7 | 0 | 0 | 109.8 | L371 | E369-L371 PolarHBondContact O-N 3.32Š| ||
| 370 | P | 34.8 | Very low | 35.6 | Very low | 126 Ų | 126 | 150.4 Ų | 150.4 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -71.4 | 113.7 | -176.6 | 26.4 | -30.4 | 0 | 0 | 0 | 110.7 | ||||
| 371 | L | 38.1 | Very low | 36.3 | Very low | 171 Ų | 171 | 147.9 Ų | 147.9 | 90% | 0.895 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 124.8 | 172 | -129.5 | 89.4 | 0 | 0 | 0 | 110 | E369 | E369-L371 PolarHBondContact O-N 3.32Š|
| 372 | Q | 32.2 | Very low | 36.3 | Very low | 181 Ų | 181 | 150.5 Ų | 150.5 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -63 | 149.2 | 173.7 | -80.9 | -160.7 | -30.1 | 0 | 0 | 112.6 | ||
| 373 | P | 36.1 | Very low | 36.2 | Very low | 129 Ų | 129 | 151.4 Ų | 151.4 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -83 | 129.2 | 180 | 31.6 | -30.6 | 0 | 0 | 0 | 112.7 | ||
| 374 | E | 35.4 | Very low | 36.6 | Very low | 183 Ų | 183 | 157.2 Ų | 157.2 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 151.9 | 168.4 | -109.2 | -91.4 | 121.4 | 0 | 0 | 111.2 | ||
| 375 | P | 36.1 | Very low | 36.3 | Very low | 100 Ų | 100 | 158.6 Ų | 158.6 | 65% | 0.649 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 155.3 | -162.9 | 34.4 | -29.7 | 0 | 0 | 0 | 114.5 | ||
| 376 | S | 38.7 | Very low | 36.3 | Very low | 114 Ų | 114 | 158.8 Ų | 158.8 | 80% | 0.797 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 130.9 | -176.2 | 58.2 | 0 | 0 | 0 | 0 | 114.6 | ||
| 377 | H | 36.4 | Very low | 36.2 | Very low | 195 Ų | 195 | 158.6 Ų | 158.6 | 90% | 0.903 | 82% | 0.818 | S | S | * | * | trans | -112.7 | 129.5 | 160.7 | -112.5 | -81.2 | 0 | 0 | 0 | 112.7 | ||||
| 378 | K | 37.1 | Very low | 36.2 | Very low | 196 Ų | 196 | 163.5 Ų | 163.5 | 85% | 0.852 | 84% | 0.837 | S | S | * | * | trans | -65.2 | 141.7 | -175.1 | -70.7 | 173.9 | 176.6 | 175.4 | 0 | 112.6 | ||||
| 379 | R | 34.7 | Very low | 36.2 | Very low | 247 Ų | 247 | 162.9 Ų | 162.9 | 93% | 0.932 | 84% | 0.838 | S | S | * | * | trans | -78.9 | 127.8 | 173.5 | -130.8 | -178.1 | -73.3 | -145.1 | -0.7 | 110.1 | ||||
| 380 | I | 35.5 | Very low | 36.2 | Very low | 146 Ų | 146 | 162 Ų | 162 | 75% | 0.749 | 84% | 0.837 | S | S | * | * | trans | -111.1 | 131.6 | 162.7 | -58.8 | 173.8 | 0 | 0 | 0 | 107.2 | L382 | I380-L382 HydrophobicContact CG2-CD1 4.41Š| ||
| 381 | P | 42.8 | Very low | 36.3 | Very low | 119 Ų | 119 | 164 Ų | 164 | 77% | 0.773 | 84% | 0.838 | S | S | * | * | trans | -98.9 | 135.3 | 174.3 | 34 | -25.2 | 0 | 0 | 0 | 111.4 | ||||
| 382 | L | 34.8 | Very low | 36.2 | Very low | 153 Ų | 153 | 163.6 Ų | 163.6 | 80% | 0.801 | 84% | 0.835 | S | S | * | * | trans | -137.4 | 108.9 | 161.9 | -98.7 | 126.5 | 0 | 0 | 0 | 111.2 | I380 | I380-L382 HydrophobicContact CG2-CD1 4.41Š| ||
| 383 | T | 35.4 | Very low | 36.4 | Very low | 125 Ų | 125 | 162.5 Ų | 162.5 | 77% | 0.767 | 83% | 0.834 | S | S | * | * | trans | 33 | 128.3 | 135.1 | 15.3 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 384 | R | 42.2 | Very low | 36.4 | Very low | 239 Ų | 239 | 164.7 Ų | 164.7 | 90% | 0.902 | 83% | 0.834 | S | S | * | * | trans | -30.1 | 137.7 | 154.2 | -106.2 | 177.5 | 177.7 | 175.2 | -0.3 | 115.6 | ||||
| 385 | T | 33.5 | Very low | 36.5 | Very low | 141 Ų | 141 | 163.4 Ų | 163.4 | 87% | 0.865 | 83% | 0.833 | S | S | * | * | trans | -152 | 142.7 | 134.2 | -34.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 386 | T | 36.3 | Very low | 36.5 | Very low | 116 Ų | 116 | 168.3 Ų | 168.3 | 71% | 0.712 | 85% | 0.847 | S | S | * | * | trans | -87.2 | 173.6 | -177.8 | 26.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 387 | T | 32.9 | Very low | 36.4 | Very low | 123 Ų | 123 | 172.8 Ų | 172.8 | 76% | 0.755 | 85% | 0.851 | S | S | * | * | trans | 80.6 | 134.9 | 165.3 | 65.4 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 388 | F | 34.8 | Very low | 36.4 | Very low | 274 Ų | 274 | 170.8 Ų | 170.8 | 100% | 1.202 | 85% | 0.846 | S | S | * | * | cis | -128.6 | 0 | 13 | -96.4 | -94.6 | 0 | 0 | 0 | 111.7 |
Retrieved 388 of 388 residues in 651.9 ms
(Link to these results)