| 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 | 46.1 | Very low | 44.8 | Very low | 249 Ų | 249 | 135.8 Ų | 135.8 | 100% | 1.227 | 87% | 0.867 | S | S | * | * | 0 | 103 | 0 | -88.1 | -167.4 | -89.3 | 0 | 0 | 108.9 | |||||
| 2 | A | 47.1 | Very low | 44.3 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 86% | 0.86 | 86% | 0.859 | S | S | * | * | trans | 179.7 | 119.8 | 146.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 3 | E | 38.2 | Very low | 43.6 | Very low | 201 Ų | 201 | 131.1 Ų | 131.1 | 94% | 0.939 | 86% | 0.863 | S | S | * | * | trans | -86.7 | 171.6 | -167.3 | -69.1 | -160.6 | 142.6 | 0 | 0 | 114.1 | ||||
| 4 | A | 46.2 | Very low | 43.3 | Very low | 94 Ų | 94 | 135.3 Ų | 135.3 | 78% | 0.777 | 87% | 0.865 | S | S | * | * | trans | -59.6 | 164.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 5 | S | 48 | Very low | 43.3 | Very low | 124 Ų | 124 | 137.9 Ų | 137.9 | 87% | 0.867 | 86% | 0.862 | S | S | * | * | trans | -143.6 | 100.2 | 151 | -162.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 6 | S | 52.2 | Low | 43.2 | Very low | 111 Ų | 111 | 142.1 Ų | 142.1 | 78% | 0.776 | 86% | 0.864 | S | S | * | * | trans | -102.3 | 113.4 | 164 | 54.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 7 | A | 43.3 | Very low | 43 | Very low | 98 Ų | 98 | 146.5 Ų | 146.5 | 81% | 0.81 | 86% | 0.861 | S | S | * | * | trans | -95.1 | 101.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 8 | N | 44.9 | Very low | 42.5 | Very low | 153 Ų | 153 | 148.2 Ų | 148.2 | 82% | 0.818 | 86% | 0.859 | S | S | * | * | trans | -100.2 | 118.1 | 161.3 | -168.9 | 18.4 | 0 | 0 | 0 | 106.5 | ||||
| 9 | L | 42.6 | Very low | 42.7 | Very low | 166 Ų | 166 | 149.2 Ų | 149.2 | 87% | 0.869 | 86% | 0.855 | S | S | * | * | trans | -123.4 | 105.3 | 170.2 | -77.4 | 172.8 | 0 | 0 | 0 | 107.8 | ||||
| 10 | G | 43.4 | Very low | 42.4 | Very low | 72 Ų | 72 | 145.2 Ų | 145.2 | 74% | 0.742 | 85% | 0.848 | S | S | * | * | trans | -73.8 | 151.2 | 165.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 11 | S | 40.9 | Very low | 42.4 | Very low | 122 Ų | 122 | 143.8 Ų | 143.8 | 85% | 0.853 | 85% | 0.846 | S | S | * | * | trans | -155.8 | 111.4 | 154.6 | -172.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 12 | G | 39.3 | Very low | 42.3 | Very low | 75 Ų | 75 | 137.2 Ų | 137.2 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | -87.3 | 141.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 13 | C | 34.2 | Very low | 42 | Very low | 135 Ų | 135 | 137.2 Ų | 137.2 | 91% | 0.912 | 82% | 0.818 | S | S | * | * | trans | -154.8 | 143.7 | 157.7 | -136.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 14 | E | 39.9 | Very low | 42.1 | Very low | 190 Ų | 190 | 136.3 Ų | 136.3 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | -79.1 | 157.1 | -156.9 | -60.4 | -173.7 | 124 | 0 | 0 | 115.9 | ||||
| 15 | E | 44 | Very low | 42.3 | Very low | 175 Ų | 175 | 137.5 Ų | 137.5 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | 4.5 | 115.5 | 149.8 | -162.6 | -179.9 | 145.3 | 0 | 0 | 118.6 | ||||
| 16 | K | 40.6 | Very low | 42.8 | Very low | 204 Ų | 204 | 136.2 Ų | 136.2 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | trans | -139.3 | 110.9 | 138.6 | -94.2 | -167.1 | 178.1 | 173.8 | 0 | 110.9 | H18 | K16-H18 PolarHBondContact O-N 3.13Š| ||
| 17 | R | 39.8 | Very low | 42.8 | Very low | 217 Ų | 217 | 135.5 Ų | 135.5 | 82% | 0.819 | 80% | 0.796 | S | S | * | * | trans | -56.4 | 118.2 | 164.3 | -166.8 | -178.5 | -159.4 | -153.7 | 4.1 | 109.5 | ||||
| 18 | H | 35 | Very low | 43.3 | Very low | 178 Ų | 178 | 137.6 Ų | 137.6 | 82% | 0.824 | 80% | 0.801 | S | S | * | * | trans | -133.6 | 93 | 162 | -139.2 | -73.1 | 0 | 0 | 0 | 108.5 | K16 | K16-H18 PolarHBondContact O-N 3.13Š| ||
| 19 | E | 46.5 | Very low | 43.6 | Very low | 167 Ų | 167 | 133.4 Ų | 133.4 | 78% | 0.78 | 79% | 0.794 | S | S | * | * | trans | -59.9 | 129.2 | 156 | -80.3 | -89.2 | 143.6 | 0 | 0 | 107.6 | ||||
| 20 | G | 35.8 | Very low | 44.4 | Very low | 69 Ų | 69 | 131.3 Ų | 131.3 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | trans | 164.1 | 86.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 21 | S | 43.3 | Very low | 45.2 | Very low | 116 Ų | 116 | 134.8 Ų | 134.8 | 81% | 0.811 | 80% | 0.795 | S | S | * | * | trans | -55.3 | 163.7 | -175.2 | -53.6 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 22 | S | 44 | Very low | 46.6 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | 93.2 | 121.6 | 143.5 | -151.2 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 23 | S | 40.9 | Very low | 48.9 | Very low | 104 Ų | 104 | 133.1 Ų | 133.1 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | cis | -151.9 | 120.5 | 16.9 | -76 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 24 | E | 39.9 | Very low | 51.6 | Low | 181 Ų | 181 | 137.3 Ų | 137.3 | 85% | 0.846 | 76% | 0.76 | S | S | * | * | trans | -90.6 | 102.6 | 167.1 | -179.5 | 155.1 | 132.1 | 0 | 0 | 108.3 | V26 | E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 HydrophobicContact CG-CG2 3.79Å; E24-V26 PolarHBondContact O-N 3.35Å; E24-V26 VanDerWaalsContact O-N 3.16Å | ||
| 25 | S | 49.9 | Very low | 54.1 | Low | 119 Ų | 119 | 132.7 Ų | 132.7 | 83% | 0.832 | 74% | 0.744 | S | S | * | * | trans | -85.9 | 75 | 174.4 | 52.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 26 | V | 57.8 | Low | 56.4 | Low | 98 Ų | 98 | 131 Ų | 131 | 59% | 0.594 | 73% | 0.734 | S | S | * | * | trans | -77.5 | 128.5 | 161.7 | 169.1 | 0 | 0 | 0 | 0 | 107.6 | E24 | E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 HydrophobicContact CG-CG2 3.79Å; E24-V26 PolarHBondContact O-N 3.35Å; E24-V26 VanDerWaalsContact O-N 3.16Å | ||
| 27 | P | 52.5 | Low | 58.9 | Low | 96 Ų | 96 | 125.2 Ų | 125.2 | 62% | 0.623 | 71% | 0.712 | S | S | * | * | trans | -60.9 | 133.4 | 178.9 | 24.9 | -33.2 | 0 | 0 | 0 | 109.9 | G29 | P27-G29 VanDerWaalsContact C-N 3.32Å; P27-G29 PolarHBondContact O-N 2.94Å | ||
| 28 | P | 53.3 | Low | 61.5 | Low | 142 Ų | 142 | 119.6 Ų | 119.6 | 92% | 0.922 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | 85.8 | 179.6 | 30.8 | -31.8 | 0 | 0 | 0 | 108.7 | ||
| 29 | G | 52.7 | Low | 64.3 | Low | 64 Ų | 64 | 115.1 Ų | 115.1 | 66% | 0.66 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -153.7 | -10.5 | -174.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | P27 | P27-G29 VanDerWaalsContact C-N 3.32Å; P27-G29 PolarHBondContact O-N 2.94Å |
| 30 | T | 58.2 | Low | 66.6 | Low | 122 Ų | 122 | 111 Ų | 111 | 75% | 0.748 | 67% | 0.666 | S | S | * | * | trans | -138.2 | 24.4 | -165.9 | -25.6 | 0 | 0 | 0 | 0 | 115.7 | I32 | T30-I32 VanDerWaalsContact C-N 3.34Å; T30-I32 PolarHBondContact O-N 3.07Å | ||
| 31 | T | 61.7 | Low | 69.3 | Low | 145 Ų | 145 | 112.3 Ų | 112.3 | 89% | 0.89 | 66% | 0.655 | S | S | * | * | trans | -93.4 | 72.8 | 161.3 | 46.8 | 0 | 0 | 0 | 0 | 108.9 | S33 | T31-S33 PolarHBondContact O-N 3.32Å; T31-S33 VanDerWaalsContact O-N 3.08Å | ||
| 32 | I | 70.5 | Confident | 71.7 | Confident | 100 Ų | 100 | 109.9 Ų | 109.9 | 51% | 0.513 | 64% | 0.635 | S | S | . | * | trans | -59.7 | 117.5 | 168.2 | -61.1 | 174.3 | 0 | 0 | 0 | 106.5 | T30 R34 K36 L37 | T30-I32 VanDerWaalsContact C-N 3.34Å; T30-I32 PolarHBondContact O-N 3.07Å; I32-R34 PolarHBondContact O-N 3Å; I32-K36 HydrophobicContact CG2-CB 3.8Å; I32-L37 HydrophobicContact CG2-CB 3.99Å | ||
| 33 | S | 86.3 | Confident | 74.1 | Confident | 63 Ų | 63 | 109.9 Ų | 109.9 | 44% | 0.441 | 63% | 0.627 | S | S | . | * | trans | -49.3 | 134.8 | 173.4 | 170 | 0 | 0 | 0 | 0 | 109.5 | T31 V35 K36 L37 | T31-S33 PolarHBondContact O-N 3.32Å; T31-S33 VanDerWaalsContact O-N 3.08Å; S33-V35 PolarHBondContact O-N 3.18Å; S33-K36 WeakPolarHBondContact O-CA 3.35Å; S33-K36 WeakPolarHBondContact O-CB 3.41Å; S33-K36 PolarHBondContact O-N 3.25Å; S33-L37 PolarHBondContact O-N 3.24Å | ||
| 34 | R | 90.7 | Very high | 76.4 | Confident | 223 Ų | 223 | 108 Ų | 108 | 84% | 0.842 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -50.2 | -34 | -179.9 | -68.8 | 174.7 | 65.1 | -173.3 | 0.9 | 112.5 | I32 L38 | I32-R34 PolarHBondContact O-N 3Å; R34-L38 WeakPolarHBondContact O-CB 3.34Å; R34-L38 PolarHBondContact O-N 3.36Å |
| 35 | V | 92.2 | Very high | 78.6 | Confident | 92 Ų | 92 | 105.6 Ų | 105.6 | 56% | 0.558 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.5 | -49.6 | 175.7 | -179.3 | 0 | 0 | 0 | 0 | 110.9 | S33 L37 L38 D39 | S33-V35 PolarHBondContact O-N 3.18Å; V35-L37 VanDerWaalsContact C-N 3.25Å; V35-L37 PolarHBondContact O-N 3.42Å; V35-L38 WeakPolarHBondContact O-CB 3.34Å; V35-L38 PolarHBondContact O-N 2.87Å; V35-D39 VanDerWaalsContact O-CG 3.31Å; V35-D39 PolarHBondContact O-N 3.44Å |
| 36 | K | 92 | Very high | 80.2 | Confident | 140 Ų | 140 | 104 Ų | 104 | 61% | 0.609 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61.5 | -34.2 | 176.4 | -69.3 | -174.4 | 175.2 | -177.9 | 0 | 112.6 | I32 S33 T40 | I32-K36 HydrophobicContact CG2-CB 3.8Å; S33-K36 WeakPolarHBondContact O-CA 3.35Å; S33-K36 WeakPolarHBondContact O-CB 3.41Å; S33-K36 PolarHBondContact O-N 3.25Å; K36-T40 WeakPolarHBondContact O-CB 3.33Å; K36-T40 PolarHBondContact O-N 3.35Å; K36-T40 VanDerWaalsContact O-N 3.08Å; K36-T40 PolarHBondContact O-OG1 2.94Å |
| 37 | L | 93.9 | Very high | 81.6 | Confident | 83 Ų | 83 | 106.6 Ų | 106.6 | 44% | 0.435 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.5 | -43.9 | 173.9 | -179.1 | 63.3 | 0 | 0 | 0 | 111 | I32 S33 V35 T40 M41 | I32-L37 HydrophobicContact CG2-CB 3.99Å; S33-L37 PolarHBondContact O-N 3.24Å; V35-L37 VanDerWaalsContact C-N 3.25Å; V35-L37 PolarHBondContact O-N 3.42Å; L37-T40 PolarHBondContact O-N 2.91Å; L37-M41 HydrophobicContact CG-CE 4.15Å; L37-M41 WeakPolarHBondContact O-CG 3.49Å; L37-M41 PolarHBondContact O-N 3.32Å |
| 38 | L | 93.9 | Very high | 83.2 | Confident | 98 Ų | 98 | 109.4 Ų | 109.4 | 51% | 0.513 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61.3 | -47.4 | 176.2 | -167.8 | 78.8 | 0 | 0 | 0 | 111.1 | R34 V35 T40 M41 V42 | R34-L38 WeakPolarHBondContact O-CB 3.34Å; R34-L38 PolarHBondContact O-N 3.36Å; V35-L38 WeakPolarHBondContact O-CB 3.34Å; V35-L38 PolarHBondContact O-N 2.87Å; L38-T40 VanDerWaalsContact C-N 3.3Å; L38-T40 PolarHBondContact O-N 3.21Å; L38-M41 HydrophobicContact CD1-CE 4.14Å; L38-M41 PolarHBondContact O-N 3.48Å; L38-M41 VanDerWaalsContact O-N 3.12Å; L38-V42 HydrophobicContact CG-CG2 4.4Å; L38-V42 WeakPolarHBondContact O-CG2 3.44Å; L38-V42 PolarHBondContact O-N 2.97Å |
| 39 | D | 95.1 | Very high | 84.4 | Confident | 84 Ų | 84 | 104.3 Ų | 104.3 | 45% | 0.449 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -56.7 | -46.7 | 178.1 | -64.5 | -25.2 | 0 | 0 | 0 | 110.7 | V35 M41 V42 D43 | V35-D39 VanDerWaalsContact O-CG 3.31Å; V35-D39 PolarHBondContact O-N 3.44Å; D39-M41 PolarHBondContact O-N 2.91Å; D39-V42 PolarHBondContact O-N 3.43Å; D39-D43 WeakPolarHBondContact O-CB 3.35Å; D39-D43 PolarHBondContact O-N 2.89Å |
| 40 | T | 94.1 | Very high | 85.7 | Confident | 80 Ų | 80 | 107 Ų | 107 | 49% | 0.491 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.4 | -41 | 177.2 | -52.7 | 0 | 0 | 0 | 0 | 111.9 | K36 L37 L38 T44 | K36-T40 WeakPolarHBondContact O-CB 3.33Å; K36-T40 PolarHBondContact O-N 3.35Å; K36-T40 VanDerWaalsContact O-N 3.08Å; K36-T40 PolarHBondContact O-OG1 2.94Å; L37-T40 PolarHBondContact O-N 2.91Å; L38-T40 VanDerWaalsContact C-N 3.3Å; L38-T40 PolarHBondContact O-N 3.21Å; T40-T44 HydrophobicContact CG2-CG2 4.45Å; T40-T44 WeakPolarHBondContact O-CB 3.48Å; T40-T44 VanDerWaalsContact O-CG2 3.28Å; T40-T44 WeakPolarHBondContact O-CG2 3.44Å; T40-T44 PolarHBondContact O-N 2.77Å; T40-T44 PolarHBondContact O-OG1 3.11Å |
| 41 | M | 93.3 | Very high | 86.8 | Confident | 97 Ų | 97 | 105.6 Ų | 105.6 | 48% | 0.478 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.9 | -40.1 | 176.2 | -74.5 | -170.1 | -60 | 0 | 0 | 111.8 | L37 L38 D39 T44 F45 | L37-M41 HydrophobicContact CG-CE 4.15Å; L37-M41 WeakPolarHBondContact O-CG 3.49Å; L37-M41 PolarHBondContact O-N 3.32Å; L38-M41 HydrophobicContact CD1-CE 4.14Å; L38-M41 PolarHBondContact O-N 3.48Å; L38-M41 VanDerWaalsContact O-N 3.12Å; D39-M41 PolarHBondContact O-N 2.91Å; M41-T44 WeakPolarHBondContact CA-OG1 3.35Å; M41-T44 PolarHBondContact O-OG1 3.4Å; M41-T44 VanDerWaalsContact O-OG1 3.11Å; M41-F45 WeakPolarHBondContact O-CB 3.43Å; M41-F45 PolarHBondContact O-N 2.75Å |
| 42 | V | 93.1 | Very high | 87.6 | Confident | 65 Ų | 65 | 101.5 Ų | 101.5 | 39% | 0.394 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66 | -47 | 177.5 | 170.7 | 0 | 0 | 0 | 0 | 110.3 | L38 D39 F45 L46 | L38-V42 HydrophobicContact CG-CG2 4.4Å; L38-V42 WeakPolarHBondContact O-CG2 3.44Å; L38-V42 PolarHBondContact O-N 2.97Å; D39-V42 PolarHBondContact O-N 3.43Å; V42-F45 PolarHBondContact O-N 3Å; V42-L46 HydrophobicContact CG1-CD1 3.73Å; V42-L46 HydrophobicContact CG1-CG 4.18Å; V42-L46 WeakPolarHBondContact O-CB 3.45Å; V42-L46 VanDerWaalsContact O-CG 3.24Å; V42-L46 WeakPolarHBondContact O-CG 3.34Å; V42-L46 PolarHBondContact O-N 2.9Å |
| 43 | D | 93.3 | Very high | 88 | Confident | 111 Ų | 111 | 100 Ų | 100 | 59% | 0.594 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -61.4 | -48.1 | 178.6 | -77.3 | -16.7 | 0 | 0 | 0 | 111.8 | D39 F45 L46 Q47 | D39-D43 WeakPolarHBondContact O-CB 3.35Å; D39-D43 PolarHBondContact O-N 2.89Å; D43-F45 VanDerWaalsContact C-N 3.33Å; D43-F45 PolarHBondContact O-N 2.87Å; D43-L46 PolarHBondContact O-N 2.87Å; D43-Q47 VanDerWaalsContact O-CB 3.32Å; D43-Q47 WeakPolarHBondContact O-CB 3.3Å; D43-Q47 PolarHBondContact O-N 2.77Å |
| 44 | T | 89.3 | Confident | 87.3 | Confident | 65 Ų | 65 | 105.1 Ų | 105.1 | 40% | 0.399 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.4 | -35.8 | 178.2 | 54.6 | 0 | 0 | 0 | 0 | 112.3 | T40 M41 K48 | T40-T44 HydrophobicContact CG2-CG2 4.45Å; T40-T44 WeakPolarHBondContact O-CB 3.48Å; T40-T44 VanDerWaalsContact O-CG2 3.28Å; T40-T44 WeakPolarHBondContact O-CG2 3.44Å; T40-T44 PolarHBondContact O-N 2.77Å; T40-T44 PolarHBondContact O-OG1 3.11Å; M41-T44 WeakPolarHBondContact CA-OG1 3.35Å; M41-T44 PolarHBondContact O-OG1 3.4Å; M41-T44 VanDerWaalsContact O-OG1 3.11Å; T44-K48 WeakPolarHBondContact O-CG 3.38Å; T44-K48 PolarHBondContact O-N 3.49Å |
| 45 | F | 86.1 | Confident | 86.7 | Confident | 131 Ų | 131 | 105.1 Ų | 105.1 | 58% | 0.575 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -67 | -50.1 | 175 | 177.9 | -117.1 | 0 | 0 | 0 | 111.4 | M41 V42 D43 Q47 K48 L49 | M41-F45 WeakPolarHBondContact O-CB 3.43Å; M41-F45 PolarHBondContact O-N 2.75Å; V42-F45 PolarHBondContact O-N 3Å; D43-F45 VanDerWaalsContact C-N 3.33Å; D43-F45 PolarHBondContact O-N 2.87Å; F45-Q47 VanDerWaalsContact C-N 3.32Å; F45-Q47 PolarHBondContact O-N 3.34Å; F45-K48 PolarHBondContact O-N 3.06Å; F45-L49 HydrophobicContact CD1-CD1 3.55Å; F45-L49 HydrophobicContact CD2-CD1 4.24Å; F45-L49 HydrophobicContact CE1-CD1 3.07Å; F45-L49 HydrophobicContact CE1-CG 4.28Å; F45-L49 HydrophobicContact CE2-CD1 3.82Å; F45-L49 HydrophobicContact CE2-CG 4.26Å; F45-L49 HydrophobicContact CG-CD1 4.12Å; F45-L49 HydrophobicContact CZ-CD1 3.23Å; F45-L49 HydrophobicContact CZ-CG 4.06Å; F45-L49 VanDerWaalsContact O-CB 3.29Å; F45-L49 WeakPolarHBondContact O-CB 3.46Å; F45-L49 PolarHBondContact O-N 3.3Å |
| 46 | L | 84.9 | Confident | 86.1 | Confident | 86 Ų | 86 | 105.6 Ų | 105.6 | 45% | 0.45 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60 | -41.8 | 178.2 | -72.3 | 176.4 | 0 | 0 | 0 | 111.4 | V42 D43 K48 L49 V50 | V42-L46 HydrophobicContact CG1-CD1 3.73Å; V42-L46 HydrophobicContact CG1-CG 4.18Å; V42-L46 WeakPolarHBondContact O-CB 3.45Å; V42-L46 VanDerWaalsContact O-CG 3.24Å; V42-L46 WeakPolarHBondContact O-CG 3.34Å; V42-L46 PolarHBondContact O-N 2.9Å; D43-L46 PolarHBondContact O-N 2.87Å; L46-K48 PolarHBondContact O-N 3.29Å; L46-L49 WeakPolarHBondContact O-CB 3.49Å; L46-L49 PolarHBondContact O-N 2.94Å; L46-V50 WeakPolarHBondContact O-CB 3.46Å; L46-V50 VanDerWaalsContact O-CG2 3.24Å; L46-V50 WeakPolarHBondContact O-CG2 3.29Å; L46-V50 PolarHBondContact O-N 3.48Å |
| 47 | Q | 86.6 | Confident | 86 | Confident | 151 Ų | 151 | 101.4 Ų | 101.4 | 71% | 0.706 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61 | -44.7 | 176.5 | -171.2 | 170.7 | 71.6 | 0 | 0 | 111.9 | D43 F45 A51 | D43-Q47 VanDerWaalsContact O-CB 3.32Å; D43-Q47 WeakPolarHBondContact O-CB 3.3Å; D43-Q47 PolarHBondContact O-N 2.77Å; F45-Q47 VanDerWaalsContact C-N 3.32Å; F45-Q47 PolarHBondContact O-N 3.34Å; Q47-A51 WeakPolarHBondContact O-CB 3.45Å; Q47-A51 PolarHBondContact O-N 2.99Å; Q47-A51 VanDerWaalsContact O-N 3.13Å |
| 48 | K | 85.3 | Confident | 85.8 | Confident | 155 Ų | 155 | 100.7 Ų | 100.7 | 67% | 0.674 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68 | -37.5 | 175.5 | -71.7 | 176.8 | -179.3 | -179.3 | 0 | 112.4 | T44 F45 L46 A52 | T44-K48 WeakPolarHBondContact O-CG 3.38Å; T44-K48 PolarHBondContact O-N 3.49Å; F45-K48 PolarHBondContact O-N 3.06Å; L46-K48 PolarHBondContact O-N 3.29Å; K48-A52 VanDerWaalsContact O-CB 3.25Å; K48-A52 WeakPolarHBondContact O-CB 3.46Å; K48-A52 PolarHBondContact O-N 3.18Å |
| 49 | L | 79.9 | Confident | 85.8 | Confident | 36 Ų | 36 | 100.3 Ų | 100.3 | 19% | 0.188 | 56% | 0.56 | C | S | . | * | H | α-helix | trans | -64.8 | -47.8 | 178.4 | -113.7 | 165.2 | 0 | 0 | 0 | 112.3 | F45 L46 A51 A52 G53 R54 R55 | F45-L49 HydrophobicContact CD1-CD1 3.55Å; F45-L49 HydrophobicContact CD2-CD1 4.24Å; F45-L49 HydrophobicContact CE1-CD1 3.07Å; F45-L49 HydrophobicContact CE1-CG 4.28Å; F45-L49 HydrophobicContact CE2-CD1 3.82Å; F45-L49 HydrophobicContact CE2-CG 4.26Å; F45-L49 HydrophobicContact CG-CD1 4.12Å; F45-L49 HydrophobicContact CZ-CD1 3.23Å; F45-L49 HydrophobicContact CZ-CG 4.06Å; F45-L49 VanDerWaalsContact O-CB 3.29Å; F45-L49 WeakPolarHBondContact O-CB 3.46Å; F45-L49 PolarHBondContact O-N 3.3Å; L46-L49 WeakPolarHBondContact O-CB 3.49Å; L46-L49 PolarHBondContact O-N 2.94Å; L49-A51 VanDerWaalsContact C-N 3.32Å; L49-A52 CarbonylContact O-C 3.58Å; L49-A52 PolarHBondContact O-N 2.93Å; L49-G53 PolarHBondContact O-N 3.4Å; L49-R54 WeakPolarHBondContact CD2-O 3.37Å; L49-R55 HydrophobicContact CD2-CG 4.45Å |
| 50 | V | 79.6 | Confident | 85.7 | Confident | 121 Ų | 121 | 100.5 Ų | 100.5 | 73% | 0.733 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -63.3 | -42.6 | 177.9 | 170.4 | 0 | 0 | 0 | 0 | 109.7 | L46 A52 G53 | L46-V50 WeakPolarHBondContact O-CB 3.46Å; L46-V50 VanDerWaalsContact O-CG2 3.24Å; L46-V50 WeakPolarHBondContact O-CG2 3.29Å; L46-V50 PolarHBondContact O-N 3.48Å; V50-A52 VanDerWaalsContact C-N 3.32Å; V50-A52 PolarHBondContact O-N 3.44Å; V50-G53 PolarHBondContact O-N 2.89Å |
| 51 | A | 80.4 | Confident | 85.8 | Confident | 91 Ų | 91 | 102.2 Ų | 102.2 | 75% | 0.752 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.8 | -35.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | Q47 L49 | Q47-A51 WeakPolarHBondContact O-CB 3.45Å; Q47-A51 PolarHBondContact O-N 2.99Å; Q47-A51 VanDerWaalsContact O-N 3.13Å; L49-A51 VanDerWaalsContact C-N 3.32Å |
| 52 | A | 79.8 | Confident | 85.7 | Confident | 59 Ų | 59 | 103.9 Ų | 103.9 | 49% | 0.488 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -85.9 | -18.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | K48 L49 V50 R54 | K48-A52 VanDerWaalsContact O-CB 3.25Å; K48-A52 WeakPolarHBondContact O-CB 3.46Å; K48-A52 PolarHBondContact O-N 3.18Å; L49-A52 CarbonylContact O-C 3.58Å; L49-A52 PolarHBondContact O-N 2.93Å; V50-A52 VanDerWaalsContact C-N 3.32Å; V50-A52 PolarHBondContact O-N 3.44Å; A52-R54 HydrophobicContact CB-CB 4.37Å; A52-R54 HydrophobicContact CB-CG 4.43Å; A52-R54 WeakPolarHBondContact O-CG 3.29Å; A52-R54 PolarHBondContact O-N 2.9Å; A52-R54 VanDerWaalsContact O-N 3.1Å |
| 53 | G | 77.1 | Confident | 85.7 | Confident | 70 Ų | 70 | 102.9 Ų | 102.9 | 72% | 0.722 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 60 | 14.5 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L49 V50 | L49-G53 PolarHBondContact O-N 3.4Å; V50-G53 PolarHBondContact O-N 2.89Å |
| 54 | R | 73.4 | Confident | 85.7 | Confident | 169 Ų | 169 | 102.2 Ų | 102.2 | 64% | 0.638 | 56% | 0.561 | S | S | * | * | trans | -102.6 | 98.3 | -170 | -75.6 | -170.3 | -174 | -99.7 | -3.3 | 112.6 | L49 A52 S66 | L49-R54 WeakPolarHBondContact CD2-O 3.37Å; A52-R54 HydrophobicContact CB-CB 4.37Å; A52-R54 HydrophobicContact CB-CG 4.43Å; A52-R54 WeakPolarHBondContact O-CG 3.29Å; A52-R54 PolarHBondContact O-N 2.9Å; A52-R54 VanDerWaalsContact O-N 3.1Å; R54-S66 PolarHBondContact NH1-OG 3.47Å; R54-S66 VanDerWaalsContact NH1-OG 3.17Å | ||
| 55 | R | 78.1 | Confident | 85.9 | Confident | 223 Ų | 223 | 105.4 Ų | 105.4 | 84% | 0.842 | 57% | 0.571 | S | S | * | * | trans | -87.2 | 147.6 | 159.5 | -82.5 | -177.3 | 174.5 | 158.6 | -0.9 | 110.6 | L49 S57 | L49-R55 HydrophobicContact CD2-CG 4.45Å; R55-S57 PolarHBondContact O-N 3.34Å | ||
| 56 | P | 79.8 | Confident | 86.1 | Confident | 103 Ų | 103 | 101.7 Ų | 101.7 | 67% | 0.669 | 56% | 0.561 | S | S | * | * | trans | -52.7 | 135.1 | 166.6 | -20.4 | 31.1 | 0 | 0 | 0 | 109.1 | G58 D63 | P56-G58 PolarHBondContact O-N 3.46Å; P56-D63 WeakPolarHBondContact CB-OD2 3.48Å | ||
| 57 | S | 87.9 | Confident | 86.4 | Confident | 51 Ų | 51 | 102.4 Ų | 102.4 | 36% | 0.357 | 57% | 0.569 | S | S | . | * | trans | -73.9 | -15.6 | -177.6 | 63.1 | 0 | 0 | 0 | 0 | 112.8 | R55 I59 D63 | R55-S57 PolarHBondContact O-N 3.34Å; S57-I59 PolarHBondContact O-N 3.07Å; S57-I59 PolarHBondContact OG-N 2.99Å; S57-D63 WeakPolarHBondContact CB-OD1 3.3Å; S57-D63 PolarHBondContact N-OD1 3.15Å; S57-D63 PolarHBondContact N-OD2 3.41Å; S57-D63 PolarHBondContact OG-OD1 3.07Å | ||
| 58 | G | 89.9 | Confident | 86.8 | Confident | 68 Ų | 68 | 98.5 Ų | 98.5 | 70% | 0.701 | 55% | 0.552 | S | S | * | * | S | Bend | trans | 81 | 1.5 | -172.4 | 0 | 0 | 0 | 0 | 0 | 113 | P56 D63 | P56-G58 PolarHBondContact O-N 3.46Å; G58-D63 PolarHBondContact N-OD2 3.15Å |
| 59 | I | 94.2 | Very high | 87.3 | Confident | 91 Ų | 91 | 93 Ų | 93 | 47% | 0.467 | 54% | 0.535 | S | S | . | . | trans | -107 | 108.7 | 174.2 | -58.2 | 174.3 | 0 | 0 | 0 | 107 | S57 E61 K62 D63 | S57-I59 PolarHBondContact O-N 3.07Å; S57-I59 PolarHBondContact OG-N 2.99Å; I59-E61 VanDerWaalsContact C-N 3.28Å; I59-E61 VanDerWaalsContact CG2-OE2 3.31Å; I59-E61 WeakPolarHBondContact CG2-OE2 3.49Å; I59-E61 PolarHBondContact O-N 3.16Å; I59-K62 HydrophobicContact CB-CB 4.16Å; I59-K62 HydrophobicContact CG2-CB 4.2Å; I59-K62 PolarHBondContact O-N 3.47Å; I59-K62 VanDerWaalsContact O-N 3.12Å; I59-D63 PolarHBondContact O-N 2.97Å; I59-D63 VanDerWaalsContact O-N 3.1Å | ||
| 60 | P | 93.8 | Very high | 88.1 | Confident | 87 Ų | 87 | 95 Ų | 95 | 57% | 0.565 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -60.9 | -36.2 | -169.5 | 22.1 | -30.9 | 0 | 0 | 0 | 112.7 | K62 D63 L64 | P60-K62 PolarHBondContact O-N 3.31Å; P60-D63 PolarHBondContact O-N 3.23Å; P60-L64 WeakPolarHBondContact O-CB 3.46Å; P60-L64 PolarHBondContact O-N 3.47Å |
| 61 | E | 95.3 | Very high | 89 | Confident | 117 Ų | 117 | 96.9 Ų | 96.9 | 55% | 0.547 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.3 | -43.9 | 178.4 | -61.3 | 73.8 | -161.7 | 0 | 0 | 111.2 | I59 H65 | I59-E61 VanDerWaalsContact C-N 3.28Å; I59-E61 VanDerWaalsContact CG2-OE2 3.31Å; I59-E61 WeakPolarHBondContact CG2-OE2 3.49Å; I59-E61 PolarHBondContact O-N 3.16Å; E61-H65 WeakPolarHBondContact O-CB 3.48Å; E61-H65 PolarHBondContact O-CD2 3.44Å; E61-H65 VanDerWaalsContact O-CG 3.22Å; E61-H65 PolarHBondContact O-N 3.39Å |
| 62 | K | 92.1 | Very high | 89.8 | Confident | 132 Ų | 132 | 97.9 Ų | 97.9 | 57% | 0.574 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -68.7 | -42.4 | -178.9 | -179.3 | 171.6 | 177.4 | 175.1 | 0 | 111.6 | I59 P60 H65 S66 | I59-K62 HydrophobicContact CB-CB 4.16Å; I59-K62 HydrophobicContact CG2-CB 4.2Å; I59-K62 PolarHBondContact O-N 3.47Å; I59-K62 VanDerWaalsContact O-N 3.12Å; P60-K62 PolarHBondContact O-N 3.31Å; K62-H65 PolarHBondContact O-N 3.1Å; K62-S66 PolarHBondContact O-N 3.43Å; K62-S66 VanDerWaalsContact O-N 3.08Å |
| 63 | D | 92.3 | Very high | 90.7 | Very high | 44 Ų | 44 | 98.9 Ų | 98.9 | 24% | 0.235 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -69.2 | -39.6 | -179.8 | -65.3 | -15.1 | 0 | 0 | 0 | 110.4 | P56 S57 G58 I59 P60 S66 V67 | P56-D63 WeakPolarHBondContact CB-OD2 3.48Å; S57-D63 WeakPolarHBondContact CB-OD1 3.3Å; S57-D63 PolarHBondContact N-OD1 3.15Å; S57-D63 PolarHBondContact N-OD2 3.41Å; S57-D63 PolarHBondContact OG-OD1 3.07Å; G58-D63 PolarHBondContact N-OD2 3.15Å; I59-D63 PolarHBondContact O-N 2.97Å; I59-D63 VanDerWaalsContact O-N 3.1Å; P60-D63 PolarHBondContact O-N 3.23Å; D63-S66 PolarHBondContact O-N 3.3Å; D63-V67 WeakPolarHBondContact O-CG2 3.33Å; D63-V67 PolarHBondContact O-N 3.22Å |
| 64 | L | 94.3 | Very high | 91.7 | Very high | 97 Ų | 97 | 101.8 Ų | 101.8 | 51% | 0.508 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.5 | -47 | 173.4 | -177.5 | 64.9 | 0 | 0 | 0 | 111.7 | P60 S66 V67 M68 | P60-L64 WeakPolarHBondContact O-CB 3.46Å; P60-L64 PolarHBondContact O-N 3.47Å; L64-S66 VanDerWaalsContact C-N 3.26Å; L64-S66 PolarHBondContact O-N 2.99Å; L64-V67 PolarHBondContact O-N 3Å; L64-V67 VanDerWaalsContact O-N 3.11Å; L64-M68 HydrophobicContact CD1-CG 3.85Å; L64-M68 HydrophobicContact CD1-SD 3.65Å; L64-M68 HydrophobicContact CD2-SD 4.14Å; L64-M68 HydrophobicContact CG-CG 4.14Å; L64-M68 HydrophobicContact CG-SD 3.72Å; L64-M68 WeakPolarHBondContact O-CB 3.43Å; L64-M68 WeakPolarHBondContact O-CG 3.39Å; L64-M68 PolarHBondContact O-N 2.97Å |
| 65 | H | 92.3 | Very high | 92.9 | Very high | 131 Ų | 131 | 99.1 Ų | 99.1 | 61% | 0.606 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -58 | -41.2 | 177.6 | -78.1 | -155.5 | 0 | 0 | 0 | 111.5 | E61 K62 V67 M68 A69 | E61-H65 WeakPolarHBondContact O-CB 3.48Å; E61-H65 PolarHBondContact O-CD2 3.44Å; E61-H65 VanDerWaalsContact O-CG 3.22Å; E61-H65 PolarHBondContact O-N 3.39Å; K62-H65 PolarHBondContact O-N 3.1Å; H65-V67 VanDerWaalsContact C-N 3.31Å; H65-V67 PolarHBondContact O-N 3.4Å; H65-M68 PolarHBondContact O-N 3.35Å; H65-A69 WeakPolarHBondContact O-CA 3.39Å; H65-A69 WeakPolarHBondContact O-CB 3.49Å; H65-A69 PolarHBondContact O-N 3.31Å |
| 66 | S | 90.3 | Very high | 93.9 | Very high | 53 Ų | 53 | 93.4 Ų | 93.4 | 37% | 0.371 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.8 | -38.6 | 177.7 | -173.2 | 0 | 0 | 0 | 0 | 112.5 | R54 K62 D63 L64 | R54-S66 PolarHBondContact NH1-OG 3.47Å; R54-S66 VanDerWaalsContact NH1-OG 3.17Å; K62-S66 PolarHBondContact O-N 3.43Å; K62-S66 VanDerWaalsContact O-N 3.08Å; D63-S66 PolarHBondContact O-N 3.3Å; L64-S66 VanDerWaalsContact C-N 3.26Å; L64-S66 PolarHBondContact O-N 2.99Å |
| 67 | V | 91.2 | Very high | 94.8 | Very high | 101 Ų | 101 | 91.6 Ų | 91.6 | 61% | 0.612 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -73.4 | -39.8 | 178.1 | 174.3 | 0 | 0 | 0 | 0 | 111 | D63 L64 H65 P70 | D63-V67 WeakPolarHBondContact O-CG2 3.33Å; D63-V67 PolarHBondContact O-N 3.22Å; L64-V67 PolarHBondContact O-N 3Å; L64-V67 VanDerWaalsContact O-N 3.11Å; H65-V67 VanDerWaalsContact C-N 3.31Å; H65-V67 PolarHBondContact O-N 3.4Å; V67-P70 WeakPolarHBondContact O-CD 3.37Å |
| 68 | M | 96.4 | Very high | 95.3 | Very high | 69 Ų | 69 | 91.1 Ų | 91.1 | 34% | 0.34 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -83.3 | -24.3 | -175.4 | -66.8 | -169.4 | 78.4 | 0 | 0 | 114.1 | L64 H65 P70 Y71 F72 | L64-M68 HydrophobicContact CD1-CG 3.85Å; L64-M68 HydrophobicContact CD1-SD 3.65Å; L64-M68 HydrophobicContact CD2-SD 4.14Å; L64-M68 HydrophobicContact CG-CG 4.14Å; L64-M68 HydrophobicContact CG-SD 3.72Å; L64-M68 WeakPolarHBondContact O-CB 3.43Å; L64-M68 WeakPolarHBondContact O-CG 3.39Å; L64-M68 PolarHBondContact O-N 2.97Å; H65-M68 PolarHBondContact O-N 3.35Å; M68-P70 VanDerWaalsContact C-CD 3.42Å; M68-Y71 PolarHBondContact O-N 2.85Å; M68-F72 HydrophobicContact CB-CD2 4.02Å; M68-F72 HydrophobicContact CB-CE2 3.69Å; M68-F72 HydrophobicContact CE-CE1 4.31Å; M68-F72 HydrophobicContact CE-CE2 3.64Å; M68-F72 HydrophobicContact CE-CZ 3.37Å; M68-F72 PolarHBondContact O-N 3.49Å; M68-F72 HydrophobicContact SD-CE2 4.12Å; M68-F72 HydrophobicContact SD-CZ 4.36Å |
| 69 | A | 96.1 | Very high | 95.7 | Very high | 39 Ų | 39 | 92.7 Ų | 92.7 | 32% | 0.322 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -51.1 | -43.7 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | H65 Y71 F72 L73 | H65-A69 WeakPolarHBondContact O-CA 3.39Å; H65-A69 WeakPolarHBondContact O-CB 3.49Å; H65-A69 PolarHBondContact O-N 3.31Å; A69-Y71 VanDerWaalsContact C-N 3.28Å; A69-Y71 PolarHBondContact O-N 3.34Å; A69-F72 PolarHBondContact O-N 2.89Å; A69-L73 WeakPolarHBondContact O-CB 3.29Å; A69-L73 VanDerWaalsContact O-CG 3.24Å; A69-L73 WeakPolarHBondContact O-CG 3.29Å; A69-L73 PolarHBondContact O-N 2.92Å |
| 70 | P | 96.5 | Very high | 96 | Very high | 78 Ų | 78 | 94.4 Ų | 94.4 | 51% | 0.506 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -57.3 | -39.4 | 178.4 | -25 | 35.4 | 0 | 0 | 0 | 113.2 | V67 M68 Q74 | V67-P70 WeakPolarHBondContact O-CD 3.37Å; M68-P70 VanDerWaalsContact C-CD 3.42Å; P70-Q74 WeakPolarHBondContact O-CB 3.42Å; P70-Q74 PolarHBondContact O-N 3.07Å |
| 71 | Y | 97.8 | Very high | 96.2 | Very high | 161 Ų | 161 | 97.7 Ų | 97.7 | 63% | 0.631 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -70.3 | -44.2 | -179.1 | -59 | -77.4 | 0 | 0 | 0 | 112.1 | M68 A69 L73 Q74 Q75 | M68-Y71 PolarHBondContact O-N 2.85Å; A69-Y71 VanDerWaalsContact C-N 3.28Å; A69-Y71 PolarHBondContact O-N 3.34Å; Y71-L73 VanDerWaalsContact C-N 3.34Å; Y71-L73 PolarHBondContact O-N 3.26Å; Y71-Q74 PolarHBondContact O-N 3.26Å; Y71-Q75 WeakPolarHBondContact O-CB 3.43Å; Y71-Q75 PolarHBondContact O-N 3.2Å |
| 72 | F | 97.9 | Very high | 96.4 | Very high | 113 Ų | 113 | 98 Ų | 98 | 50% | 0.496 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -67.8 | -35.8 | 178 | -67.4 | -47 | 0 | 0 | 0 | 112.4 | M68 A69 Q75 R76 | M68-F72 HydrophobicContact CB-CD2 4.02Å; M68-F72 HydrophobicContact CB-CE2 3.69Å; M68-F72 HydrophobicContact CE-CE1 4.31Å; M68-F72 HydrophobicContact CE-CE2 3.64Å; M68-F72 HydrophobicContact CE-CZ 3.37Å; M68-F72 PolarHBondContact O-N 3.49Å; M68-F72 HydrophobicContact SD-CE2 4.12Å; M68-F72 HydrophobicContact SD-CZ 4.36Å; A69-F72 PolarHBondContact O-N 2.89Å; F72-Q75 PolarHBondContact O-N 2.95Å; F72-R76 VanDerWaalsContact O-CB 3.27Å; F72-R76 WeakPolarHBondContact O-CB 3.45Å; F72-R76 PolarHBondContact O-N 3.34Å |
| 73 | L | 98.4 | Very high | 96.7 | Very high | 80 Ų | 80 | 95.3 Ų | 95.3 | 42% | 0.419 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.4 | -46.6 | 173.1 | -69.7 | 172.7 | 0 | 0 | 0 | 110.9 | A69 Y71 Q75 R76 D77 | A69-L73 WeakPolarHBondContact O-CB 3.29Å; A69-L73 VanDerWaalsContact O-CG 3.24Å; A69-L73 WeakPolarHBondContact O-CG 3.29Å; A69-L73 PolarHBondContact O-N 2.92Å; Y71-L73 VanDerWaalsContact C-N 3.34Å; Y71-L73 PolarHBondContact O-N 3.26Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; L73-Q75 PolarHBondContact O-N 3.41Å; L73-R76 PolarHBondContact O-N 2.88Å; L73-D77 WeakPolarHBondContact O-CB 3.46Å; L73-D77 PolarHBondContact O-N 2.9Å |
| 74 | Q | 98.5 | Very high | 97 | Very high | 131 Ų | 131 | 99.1 Ų | 99.1 | 61% | 0.612 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -59.4 | -42.9 | 175.6 | 179.9 | 178.9 | -15.3 | 0 | 0 | 112.4 | P70 Y71 T78 | P70-Q74 WeakPolarHBondContact O-CB 3.42Å; P70-Q74 PolarHBondContact O-N 3.07Å; Y71-Q74 PolarHBondContact O-N 3.26Å; Q74-T78 WeakPolarHBondContact O-CB 3.35Å; Q74-T78 PolarHBondContact O-N 3.4Å; Q74-T78 PolarHBondContact O-OG1 3.31Å |
| 75 | Q | 98.6 | Very high | 97.2 | Very high | 112 Ų | 112 | 100.8 Ų | 100.8 | 52% | 0.523 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62 | -50.3 | 177 | -177.9 | -178.7 | -1.9 | 0 | 0 | 110.9 | Y71 F72 L73 D77 T78 L79 | Y71-Q75 WeakPolarHBondContact O-CB 3.43Å; Y71-Q75 PolarHBondContact O-N 3.2Å; F72-Q75 PolarHBondContact O-N 2.95Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; L73-Q75 PolarHBondContact O-N 3.41Å; Q75-D77 VanDerWaalsContact C-N 3.34Å; Q75-D77 PolarHBondContact O-N 2.95Å; Q75-T78 PolarHBondContact O-N 2.87Å; Q75-L79 HydrophobicContact CG-CD1 4.2Å; Q75-L79 WeakPolarHBondContact O-CG 3.36Å; Q75-L79 PolarHBondContact O-N 3.01Å |
| 76 | R | 98.6 | Very high | 97.5 | Very high | 103 Ų | 103 | 99.2 Ų | 99.2 | 39% | 0.389 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.8 | -46.8 | 178.8 | -176.9 | -164.6 | 71.6 | 179.8 | -1.9 | 111.6 | F72 L73 T78 L79 R80 | F72-R76 VanDerWaalsContact O-CB 3.27Å; F72-R76 WeakPolarHBondContact O-CB 3.45Å; F72-R76 PolarHBondContact O-N 3.34Å; L73-R76 PolarHBondContact O-N 2.88Å; R76-T78 VanDerWaalsContact C-N 3.3Å; R76-T78 PolarHBondContact O-N 2.85Å; R76-L79 PolarHBondContact O-N 3.34Å; R76-R80 VanDerWaalsContact CD-CZ 3.48Å; R76-R80 VanDerWaalsContact CZ-NH1 3.29Å; R76-R80 VanDerWaalsContact NE-NH1 3.2Å; R76-R80 WeakPolarHBondContact O-CB 3.29Å; R76-R80 VanDerWaalsContact O-CG 3.27Å; R76-R80 WeakPolarHBondContact O-CG 3.36Å; R76-R80 PolarHBondContact O-N 3.46Å |
| 77 | D | 98.8 | Very high | 97.9 | Very high | 65 Ų | 65 | 102.3 Ų | 102.3 | 35% | 0.348 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.9 | -30.2 | -176.7 | -63.4 | -14.6 | 0 | 0 | 0 | 111.5 | L73 Q75 R80 R81 | L73-D77 WeakPolarHBondContact O-CB 3.46Å; L73-D77 PolarHBondContact O-N 2.9Å; Q75-D77 VanDerWaalsContact C-N 3.34Å; Q75-D77 PolarHBondContact O-N 2.95Å; D77-R80 IonicContact OD1-NH1 3.75Å; D77-R81 WeakPolarHBondContact O-CG 3.36Å; D77-R81 PolarHBondContact O-N 3.35Å; D77-R81 VanDerWaalsContact O-N 3.17Å; D77-R81 PolarHBondContact O-NE 3.4Å |
| 78 | T | 98.6 | Very high | 98.3 | Very high | 41 Ų | 41 | 99.9 Ų | 99.9 | 25% | 0.252 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.2 | -49.9 | 170.6 | -59.8 | 0 | 0 | 0 | 0 | 111.2 | Q74 Q75 R76 R80 R81 H82 | Q74-T78 WeakPolarHBondContact O-CB 3.35Å; Q74-T78 PolarHBondContact O-N 3.4Å; Q74-T78 PolarHBondContact O-OG1 3.31Å; Q75-T78 PolarHBondContact O-N 2.87Å; R76-T78 VanDerWaalsContact C-N 3.3Å; R76-T78 PolarHBondContact O-N 2.85Å; T78-R80 VanDerWaalsContact C-N 3.33Å; T78-R80 PolarHBondContact O-N 3.05Å; T78-R81 PolarHBondContact O-N 3.41Å; T78-R81 PolarHBondContact OG1-NH2 2.99Å; T78-H82 PolarHBondContact O-N 3.46Å; T78-H82 PolarHBondContact O-ND1 2.92Å |
| 79 | L | 98.8 | Very high | 98.4 | Very high | 101 Ų | 101 | 100.3 Ų | 100.3 | 53% | 0.529 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 177.9 | -69.2 | 172.6 | 0 | 0 | 0 | 111.6 | Q75 R76 R81 H82 V83 | Q75-L79 HydrophobicContact CG-CD1 4.2Å; Q75-L79 WeakPolarHBondContact O-CG 3.36Å; Q75-L79 PolarHBondContact O-N 3.01Å; R76-L79 PolarHBondContact O-N 3.34Å; L79-R81 VanDerWaalsContact C-N 3.32Å; L79-R81 PolarHBondContact O-N 3.33Å; L79-H82 PolarHBondContact O-N 3.41Å; L79-H82 VanDerWaalsContact O-N 3.09Å; L79-V83 WeakPolarHBondContact O-CG2 2.92Å; L79-V83 PolarHBondContact O-N 2.85Å |
| 80 | R | 98.8 | Very high | 98.5 | Very high | 128 Ų | 128 | 102.3 Ų | 102.3 | 48% | 0.483 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -55.7 | -44.8 | 176.2 | -77.3 | 172.1 | 175.7 | -176.1 | -5.4 | 112.6 | R76 D77 T78 H82 V83 Q84 | R76-R80 VanDerWaalsContact CD-CZ 3.48Å; R76-R80 VanDerWaalsContact CZ-NH1 3.29Å; R76-R80 VanDerWaalsContact NE-NH1 3.2Å; R76-R80 WeakPolarHBondContact O-CB 3.29Å; R76-R80 VanDerWaalsContact O-CG 3.27Å; R76-R80 WeakPolarHBondContact O-CG 3.36Å; R76-R80 PolarHBondContact O-N 3.46Å; D77-R80 IonicContact OD1-NH1 3.75Å; T78-R80 VanDerWaalsContact C-N 3.33Å; T78-R80 PolarHBondContact O-N 3.05Å; R80-H82 VanDerWaalsContact C-N 3.33Å; R80-H82 PolarHBondContact O-N 3.44Å; R80-V83 PolarHBondContact O-N 3.11Å; R80-Q84 WeakPolarHBondContact O-CB 3.27Å; R80-Q84 VanDerWaalsContact O-CG 3.29Å; R80-Q84 WeakPolarHBondContact O-CG 3.44Å; R80-Q84 PolarHBondContact O-N 3Å |
| 81 | R | 98.8 | Very high | 98.6 | Very high | 156 Ų | 156 | 103.8 Ų | 103.8 | 59% | 0.589 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.5 | -40.4 | 176.5 | -75 | -178.8 | -68.7 | 158.8 | -0.8 | 112.4 | D77 T78 L79 K85 | D77-R81 WeakPolarHBondContact O-CG 3.36Å; D77-R81 PolarHBondContact O-N 3.35Å; D77-R81 VanDerWaalsContact O-N 3.17Å; D77-R81 PolarHBondContact O-NE 3.4Å; T78-R81 PolarHBondContact O-N 3.41Å; T78-R81 PolarHBondContact OG1-NH2 2.99Å; L79-R81 VanDerWaalsContact C-N 3.32Å; L79-R81 PolarHBondContact O-N 3.33Å; R81-K85 VanDerWaalsContact O-CB 3.3Å; R81-K85 WeakPolarHBondContact O-CB 3.3Å; R81-K85 PolarHBondContact O-N 3.09Å |
| 82 | H | 98.7 | Very high | 98.7 | Very high | 122 Ų | 122 | 102.7 Ų | 102.7 | 57% | 0.565 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.8 | -43.9 | 177.9 | -71.7 | 78.4 | 0 | 0 | 0 | 111.6 | T78 L79 R80 K85 Q86 | T78-H82 PolarHBondContact O-N 3.46Å; T78-H82 PolarHBondContact O-ND1 2.92Å; L79-H82 PolarHBondContact O-N 3.41Å; L79-H82 VanDerWaalsContact O-N 3.09Å; R80-H82 VanDerWaalsContact C-N 3.33Å; R80-H82 PolarHBondContact O-N 3.44Å; H82-K85 PolarHBondContact O-N 2.87Å; H82-Q86 WeakPolarHBondContact O-CB 3.41Å; H82-Q86 PolarHBondContact O-N 3.35Å |
| 83 | V | 98.9 | Very high | 98.7 | Very high | 77 Ų | 77 | 102.5 Ų | 102.5 | 47% | 0.467 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -50.2 | 176.4 | 174.5 | 0 | 0 | 0 | 0 | 110.9 | L79 R80 K85 Q86 E87 | L79-V83 WeakPolarHBondContact O-CG2 2.92Å; L79-V83 PolarHBondContact O-N 2.85Å; R80-V83 PolarHBondContact O-N 3.11Å; V83-K85 VanDerWaalsContact C-N 3.3Å; V83-K85 PolarHBondContact O-N 3.34Å; V83-Q86 PolarHBondContact O-N 2.89Å; V83-Q86 VanDerWaalsContact O-N 3.11Å; V83-E87 HydrophobicContact CG1-CG 4.2Å; V83-E87 WeakPolarHBondContact CG1-OE1 3.41Å; V83-E87 WeakPolarHBondContact O-CG 3.24Å; V83-E87 PolarHBondContact O-N 3.43Å |
| 84 | Q | 98.8 | Very high | 98.7 | Very high | 123 Ų | 123 | 100.7 Ų | 100.7 | 58% | 0.575 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.2 | -39.9 | 179.4 | -74.1 | 173.8 | -12.7 | 0 | 0 | 112.6 | R80 E87 A88 | R80-Q84 WeakPolarHBondContact O-CB 3.27Å; R80-Q84 VanDerWaalsContact O-CG 3.29Å; R80-Q84 WeakPolarHBondContact O-CG 3.44Å; R80-Q84 PolarHBondContact O-N 3Å; Q84-E87 PolarHBondContact O-N 3.42Å; Q84-A88 WeakPolarHBondContact O-CB 3.27Å; Q84-A88 PolarHBondContact O-N 2.93Å |
| 85 | K | 98.7 | Very high | 98.7 | Very high | 132 Ų | 132 | 98.3 Ų | 98.3 | 57% | 0.574 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60.8 | -48.8 | 174.8 | -179.7 | 179.2 | 172 | -176.7 | 0 | 110.8 | R81 H82 V83 E87 A88 E89 | R81-K85 VanDerWaalsContact O-CB 3.3Å; R81-K85 WeakPolarHBondContact O-CB 3.3Å; R81-K85 PolarHBondContact O-N 3.09Å; H82-K85 PolarHBondContact O-N 2.87Å; V83-K85 VanDerWaalsContact C-N 3.3Å; V83-K85 PolarHBondContact O-N 3.34Å; K85-E87 VanDerWaalsContact C-N 3.34Å; K85-E87 PolarHBondContact O-N 3.17Å; K85-A88 PolarHBondContact O-N 3.45Å; K85-E89 WeakPolarHBondContact CE-OE1 3.49Å; K85-E89 IonicContact NZ-OE1 3.93Å; K85-E89 WeakPolarHBondContact O-CG 3.43Å; K85-E89 PolarHBondContact O-N 3.24Å |
| 86 | Q | 98.8 | Very high | 98.7 | Very high | 98 Ų | 98 | 95.9 Ų | 95.9 | 46% | 0.458 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.8 | -39.8 | -179.9 | -168.5 | 63.8 | 49.4 | 0 | 0 | 112.1 | H82 V83 E89 N90 | H82-Q86 WeakPolarHBondContact O-CB 3.41Å; H82-Q86 PolarHBondContact O-N 3.35Å; V83-Q86 PolarHBondContact O-N 2.89Å; V83-Q86 VanDerWaalsContact O-N 3.11Å; Q86-E89 PolarHBondContact O-N 3.17Å; Q86-N90 PolarHBondContact NE2-OD1 3.46Å; Q86-N90 VanDerWaalsContact NE2-OD1 3.09Å; Q86-N90 VanDerWaalsContact O-CB 3.29Å; Q86-N90 WeakPolarHBondContact O-CB 3.35Å; Q86-N90 PolarHBondContact O-N 2.79Å; Q86-N90 PolarHBondContact O-OD1 2.99Å |
| 87 | E | 98.8 | Very high | 98.8 | Very high | 119 Ų | 119 | 94.6 Ų | 94.6 | 56% | 0.556 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.7 | -42 | 177 | -74.3 | 172.7 | 169.4 | 0 | 0 | 111.5 | V83 Q84 K85 N90 Q91 | V83-E87 HydrophobicContact CG1-CG 4.2Å; V83-E87 WeakPolarHBondContact CG1-OE1 3.41Å; V83-E87 WeakPolarHBondContact O-CG 3.24Å; V83-E87 PolarHBondContact O-N 3.43Å; Q84-E87 PolarHBondContact O-N 3.42Å; K85-E87 VanDerWaalsContact C-N 3.34Å; K85-E87 PolarHBondContact O-N 3.17Å; E87-N90 PolarHBondContact O-N 3.32Å; E87-Q91 WeakPolarHBondContact O-CB 3.48Å; E87-Q91 PolarHBondContact O-N 3.36Å |
| 88 | A | 98.8 | Very high | 98.8 | Very high | 50 Ų | 50 | 95.9 Ų | 95.9 | 41% | 0.413 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64 | -44.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q84 K85 Q91 Q92 | Q84-A88 WeakPolarHBondContact O-CB 3.27Å; Q84-A88 PolarHBondContact O-N 2.93Å; K85-A88 PolarHBondContact O-N 3.45Å; A88-Q91 PolarHBondContact O-N 3.09Å; A88-Q92 WeakPolarHBondContact O-CG 3.42Å; A88-Q92 PolarHBondContact O-N 3.33Å; A88-Q92 VanDerWaalsContact O-N 3.07Å |
| 89 | E | 98.7 | Very high | 98.8 | Very high | 77 Ų | 77 | 95.9 Ų | 95.9 | 36% | 0.36 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 175.6 | -71.7 | 174.4 | -169.6 | 0 | 0 | 111.3 | K85 Q86 Q91 Q92 L93 | K85-E89 WeakPolarHBondContact CE-OE1 3.49Å; K85-E89 IonicContact NZ-OE1 3.93Å; K85-E89 WeakPolarHBondContact O-CG 3.43Å; K85-E89 PolarHBondContact O-N 3.24Å; Q86-E89 PolarHBondContact O-N 3.17Å; E89-Q91 VanDerWaalsContact C-N 3.31Å; E89-Q91 PolarHBondContact O-N 3.18Å; E89-Q92 PolarHBondContact O-N 2.97Å; E89-L93 WeakPolarHBondContact O-CG 3.39Å; E89-L93 PolarHBondContact O-N 3.29Å |
| 90 | N | 98.8 | Very high | 98.8 | Very high | 81 Ų | 81 | 92.4 Ų | 92.4 | 43% | 0.433 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.2 | -38 | 177.4 | -74.2 | -4.1 | 0 | 0 | 0 | 112 | Q86 E87 L93 A94 | Q86-N90 PolarHBondContact NE2-OD1 3.46Å; Q86-N90 VanDerWaalsContact NE2-OD1 3.09Å; Q86-N90 VanDerWaalsContact O-CB 3.29Å; Q86-N90 WeakPolarHBondContact O-CB 3.35Å; Q86-N90 PolarHBondContact O-N 2.79Å; Q86-N90 PolarHBondContact O-OD1 2.99Å; E87-N90 PolarHBondContact O-N 3.32Å; N90-L93 PolarHBondContact O-N 3.49Å; N90-A94 WeakPolarHBondContact O-CB 3.47Å; N90-A94 PolarHBondContact O-N 3.26Å |
| 91 | Q | 98.8 | Very high | 98.8 | Very high | 110 Ų | 110 | 93.9 Ų | 93.9 | 51% | 0.514 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63 | -46.1 | 175.9 | -173.9 | 61.5 | 33.8 | 0 | 0 | 111 | E87 A88 E89 L93 A94 D95 | E87-Q91 WeakPolarHBondContact O-CB 3.48Å; E87-Q91 PolarHBondContact O-N 3.36Å; A88-Q91 PolarHBondContact O-N 3.09Å; E89-Q91 VanDerWaalsContact C-N 3.31Å; E89-Q91 PolarHBondContact O-N 3.18Å; Q91-L93 VanDerWaalsContact C-N 3.32Å; Q91-L93 PolarHBondContact O-N 3.4Å; Q91-A94 WeakPolarHBondContact O-CB 3.37Å; Q91-A94 PolarHBondContact O-N 3.46Å; Q91-D95 PolarHBondContact NE2-OD1 2.95Å; Q91-D95 VanDerWaalsContact O-CG 3.32Å; Q91-D95 PolarHBondContact O-N 2.88Å |
| 92 | Q | 98.7 | Very high | 98.8 | Very high | 137 Ų | 137 | 93.4 Ų | 93.4 | 64% | 0.64 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.4 | -41.9 | 175.7 | -69.6 | 174.6 | 7.2 | 0 | 0 | 111.9 | A88 E89 D95 A96 | A88-Q92 WeakPolarHBondContact O-CG 3.42Å; A88-Q92 PolarHBondContact O-N 3.33Å; A88-Q92 VanDerWaalsContact O-N 3.07Å; E89-Q92 PolarHBondContact O-N 2.97Å; Q92-D95 PolarHBondContact O-N 2.9Å; Q92-A96 WeakPolarHBondContact O-CB 3.37Å; Q92-A96 PolarHBondContact O-N 3.42Å |
| 93 | L | 98.8 | Very high | 98.8 | Very high | 109 Ų | 109 | 93.4 Ų | 93.4 | 57% | 0.571 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.9 | -40.6 | 175.7 | -70.6 | 173.7 | 0 | 0 | 0 | 112 | E89 N90 Q91 D95 A96 V97 | E89-L93 WeakPolarHBondContact O-CG 3.39Å; E89-L93 PolarHBondContact O-N 3.29Å; N90-L93 PolarHBondContact O-N 3.49Å; Q91-L93 VanDerWaalsContact C-N 3.32Å; Q91-L93 PolarHBondContact O-N 3.4Å; L93-D95 VanDerWaalsContact C-N 3.35Å; L93-A96 PolarHBondContact O-N 2.76Å; L93-V97 WeakPolarHBondContact O-CB 3.39Å; L93-V97 VanDerWaalsContact O-CG2 3.29Å; L93-V97 WeakPolarHBondContact O-CG2 3.14Å; L93-V97 PolarHBondContact O-N 2.82Å |
| 94 | A | 98.8 | Very high | 98.8 | Very high | 43 Ų | 43 | 93.4 Ų | 93.4 | 36% | 0.355 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.8 | -44.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | N90 Q91 A96 V97 L98 | N90-A94 WeakPolarHBondContact O-CB 3.47Å; N90-A94 PolarHBondContact O-N 3.26Å; Q91-A94 WeakPolarHBondContact O-CB 3.37Å; Q91-A94 PolarHBondContact O-N 3.46Å; A94-A96 PolarHBondContact O-N 3.43Å; A94-V97 PolarHBondContact O-N 3.1Å; A94-L98 WeakPolarHBondContact O-CG 3.31Å; A94-L98 PolarHBondContact O-N 3.17Å |
| 95 | D | 98.8 | Very high | 98.7 | Very high | 81 Ų | 81 | 93.2 Ų | 93.2 | 43% | 0.433 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 177 | -67.2 | -23.4 | 0 | 0 | 0 | 111.5 | Q91 Q92 L93 L98 A99 | Q91-D95 PolarHBondContact NE2-OD1 2.95Å; Q91-D95 VanDerWaalsContact O-CG 3.32Å; Q91-D95 PolarHBondContact O-N 2.88Å; Q92-D95 PolarHBondContact O-N 2.9Å; L93-D95 VanDerWaalsContact C-N 3.35Å; D95-L98 PolarHBondContact O-N 2.96Å; D95-A99 WeakPolarHBondContact O-CB 3.42Å; D95-A99 PolarHBondContact O-N 2.93Å |
| 96 | A | 98.8 | Very high | 98.7 | Very high | 61 Ų | 61 | 92.3 Ų | 92.3 | 50% | 0.504 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q92 L93 A94 A99 G100 | Q92-A96 WeakPolarHBondContact O-CB 3.37Å; Q92-A96 PolarHBondContact O-N 3.42Å; L93-A96 PolarHBondContact O-N 2.76Å; A94-A96 PolarHBondContact O-N 3.43Å; A96-A99 PolarHBondContact O-N 3.18Å; A96-G100 PolarHBondContact O-N 3.34Å |
| 97 | V | 98.9 | Very high | 98.7 | Very high | 75 Ų | 75 | 91.6 Ų | 91.6 | 46% | 0.455 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.1 | 165.4 | 0 | 0 | 0 | 0 | 110.9 | L93 A94 G100 R101 | L93-V97 WeakPolarHBondContact O-CB 3.39Å; L93-V97 VanDerWaalsContact O-CG2 3.29Å; L93-V97 WeakPolarHBondContact O-CG2 3.14Å; L93-V97 PolarHBondContact O-N 2.82Å; A94-V97 PolarHBondContact O-N 3.1Å; V97-G100 PolarHBondContact O-N 2.81Å; V97-R101 WeakPolarHBondContact O-CG 3.42Å; V97-R101 PolarHBondContact O-N 3.3Å |
| 98 | L | 98.9 | Very high | 98.7 | Very high | 92 Ų | 92 | 92 Ų | 92 | 48% | 0.482 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 176.5 | -69.8 | 175.3 | 0 | 0 | 0 | 111.6 | A94 D95 R101 R102 | A94-L98 WeakPolarHBondContact O-CG 3.31Å; A94-L98 PolarHBondContact O-N 3.17Å; D95-L98 PolarHBondContact O-N 2.96Å; L98-R101 PolarHBondContact O-N 3.11Å; L98-R102 WeakPolarHBondContact O-CG 3.37Å; L98-R102 PolarHBondContact O-N 2.84Å; L98-R102 VanDerWaalsContact O-N 3.15Å; L98-R102 PolarHBondContact O-NH1 3.35Å |
| 99 | A | 98.7 | Very high | 98.7 | Very high | 41 Ų | 41 | 95 Ų | 95 | 34% | 0.339 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.5 | -45.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | D95 A96 R101 R102 Q103 | D95-A99 WeakPolarHBondContact O-CB 3.42Å; D95-A99 PolarHBondContact O-N 2.93Å; A96-A99 PolarHBondContact O-N 3.18Å; A99-R101 PolarHBondContact O-N 3.43Å; A99-R102 PolarHBondContact O-N 3.29Å; A99-Q103 PolarHBondContact O-N 3.04Å; A99-Q103 VanDerWaalsContact O-N 3.1Å |
| 100 | G | 98.8 | Very high | 98.7 | Very high | 29 Ų | 29 | 95.8 Ų | 95.8 | 30% | 0.299 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.4 | -41.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | A96 V97 R102 Q103 V104 | A96-G100 PolarHBondContact O-N 3.34Å; V97-G100 PolarHBondContact O-N 2.81Å; G100-R102 PolarHBondContact O-N 3.37Å; G100-Q103 PolarHBondContact O-N 2.67Å; G100-V104 WeakPolarHBondContact O-CG2 3.36Å; G100-V104 PolarHBondContact O-N 3.08Å |
| 101 | R | 98.8 | Very high | 98.6 | Very high | 158 Ų | 158 | 96.7 Ų | 96.7 | 60% | 0.596 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.9 | -45 | 176 | -74.2 | 176.6 | -165.9 | -88.6 | 0.8 | 112 | V97 L98 A99 Q103 V104 E105 | V97-R101 WeakPolarHBondContact O-CG 3.42Å; V97-R101 PolarHBondContact O-N 3.3Å; L98-R101 PolarHBondContact O-N 3.11Å; A99-R101 PolarHBondContact O-N 3.43Å; R101-Q103 VanDerWaalsContact C-N 3.32Å; R101-Q103 PolarHBondContact O-N 3.5Å; R101-V104 PolarHBondContact O-N 3.46Å; R101-E105 WeakPolarHBondContact O-CG 3.37Å; R101-E105 PolarHBondContact O-N 3.33Å |
| 102 | R | 98.7 | Very high | 98.6 | Very high | 147 Ų | 147 | 96.2 Ų | 96.2 | 56% | 0.555 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.5 | -42.5 | 175.6 | -70 | -172.3 | -63.7 | -90.8 | 6.1 | 112.1 | L98 A99 G100 V104 E105 E106 | L98-R102 WeakPolarHBondContact O-CG 3.37Å; L98-R102 PolarHBondContact O-N 2.84Å; L98-R102 VanDerWaalsContact O-N 3.15Å; L98-R102 PolarHBondContact O-NH1 3.35Å; A99-R102 PolarHBondContact O-N 3.29Å; G100-R102 PolarHBondContact O-N 3.37Å; R102-V104 VanDerWaalsContact C-N 3.33Å; R102-V104 PolarHBondContact O-N 3.32Å; R102-E105 PolarHBondContact O-N 2.93Å; R102-E106 PolarHBondContact O-N 3.12Å |
| 103 | Q | 98.6 | Very high | 98.5 | Very high | 122 Ų | 122 | 92.3 Ų | 92.3 | 57% | 0.57 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64 | -39.7 | 178.2 | -171 | 175.6 | 21.3 | 0 | 0 | 112 | A99 G100 R101 E106 L107 | A99-Q103 PolarHBondContact O-N 3.04Å; A99-Q103 VanDerWaalsContact O-N 3.1Å; G100-Q103 PolarHBondContact O-N 2.67Å; R101-Q103 VanDerWaalsContact C-N 3.32Å; R101-Q103 PolarHBondContact O-N 3.5Å; Q103-E106 PolarHBondContact O-N 3.45Å; Q103-L107 HydrophobicContact CG-CD1 4.27Å; Q103-L107 WeakPolarHBondContact O-CB 3.24Å; Q103-L107 VanDerWaalsContact O-CG 3.29Å; Q103-L107 WeakPolarHBondContact O-CG 3.39Å; Q103-L107 PolarHBondContact O-N 3.1Å |
| 104 | V | 98.8 | Very high | 98.4 | Very high | 77 Ų | 77 | 92.9 Ų | 92.9 | 47% | 0.467 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 175.6 | 171.6 | 0 | 0 | 0 | 0 | 111 | G100 R101 R102 E106 L107 Q108 | G100-V104 WeakPolarHBondContact O-CG2 3.36Å; G100-V104 PolarHBondContact O-N 3.08Å; R101-V104 PolarHBondContact O-N 3.46Å; R102-V104 VanDerWaalsContact C-N 3.33Å; R102-V104 PolarHBondContact O-N 3.32Å; V104-E106 PolarHBondContact O-N 3.24Å; V104-L107 PolarHBondContact O-N 3.44Å; V104-Q108 HydrophobicContact CG1-CG 4.41Å; V104-Q108 WeakPolarHBondContact O-CB 3.25Å; V104-Q108 VanDerWaalsContact O-CG 3.3Å; V104-Q108 WeakPolarHBondContact O-CG 2.88Å; V104-Q108 PolarHBondContact O-N 2.93Å |
| 105 | E | 98.7 | Very high | 98.2 | Very high | 118 Ų | 118 | 96.5 Ų | 96.5 | 55% | 0.551 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.4 | -45.3 | 176.1 | -72.6 | 168.7 | -173 | 0 | 0 | 111.6 | R101 R102 Q108 L109 | R101-E105 WeakPolarHBondContact O-CG 3.37Å; R101-E105 PolarHBondContact O-N 3.33Å; R102-E105 PolarHBondContact O-N 2.93Å; E105-Q108 WeakPolarHBondContact O-CB 3.44Å; E105-Q108 PolarHBondContact O-N 3.01Å; E105-L109 WeakPolarHBondContact O-CG 3.29Å; E105-L109 PolarHBondContact O-N 3.46Å |
| 106 | E | 98.6 | Very high | 98 | Very high | 113 Ų | 113 | 97.7 Ų | 97.7 | 53% | 0.528 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.6 | -46.4 | 176.7 | -174.3 | -178.4 | 173.8 | 0 | 0 | 111.9 | R102 Q103 V104 Q108 L109 Q110 | R102-E106 PolarHBondContact O-N 3.12Å; Q103-E106 PolarHBondContact O-N 3.45Å; V104-E106 PolarHBondContact O-N 3.24Å; E106-Q108 VanDerWaalsContact C-N 3.3Å; E106-Q108 PolarHBondContact O-N 2.85Å; E106-L109 WeakPolarHBondContact O-CB 3.34Å; E106-L109 PolarHBondContact O-N 3.38Å; E106-Q110 WeakPolarHBondContact O-CG 3.33Å; E106-Q110 PolarHBondContact O-N 2.87Å; E106-Q110 PolarHBondContact OE1-NE2 3.13Å |
| 107 | L | 98.6 | Very high | 97.7 | Very high | 83 Ų | 83 | 97.7 Ų | 97.7 | 44% | 0.435 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -38.8 | 177.6 | -73.7 | 172.2 | 0 | 0 | 0 | 111.7 | Q103 V104 L109 Q110 V111 | Q103-L107 HydrophobicContact CG-CD1 4.27Å; Q103-L107 WeakPolarHBondContact O-CB 3.24Å; Q103-L107 VanDerWaalsContact O-CG 3.29Å; Q103-L107 WeakPolarHBondContact O-CG 3.39Å; Q103-L107 PolarHBondContact O-N 3.1Å; V104-L107 PolarHBondContact O-N 3.44Å; L107-L109 VanDerWaalsContact C-N 3.34Å; L107-L109 PolarHBondContact O-N 3.39Å; L107-Q110 PolarHBondContact O-N 2.89Å; L107-V111 WeakPolarHBondContact O-CB 3.21Å; L107-V111 VanDerWaalsContact O-CG2 3.3Å; L107-V111 WeakPolarHBondContact O-CG2 3.32Å; L107-V111 PolarHBondContact O-N 3.23Å |
| 108 | Q | 98.4 | Very high | 97.4 | Very high | 127 Ų | 127 | 101.4 Ų | 101.4 | 59% | 0.593 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.5 | -43.9 | 174.8 | -76.3 | 179.6 | 11.6 | 0 | 0 | 111.6 | V104 E105 E106 V111 Q112 | V104-Q108 HydrophobicContact CG1-CG 4.41Å; V104-Q108 WeakPolarHBondContact O-CB 3.25Å; V104-Q108 VanDerWaalsContact O-CG 3.3Å; V104-Q108 WeakPolarHBondContact O-CG 2.88Å; V104-Q108 PolarHBondContact O-N 2.93Å; E105-Q108 WeakPolarHBondContact O-CB 3.44Å; E105-Q108 PolarHBondContact O-N 3.01Å; E106-Q108 VanDerWaalsContact C-N 3.3Å; E106-Q108 PolarHBondContact O-N 2.85Å; Q108-V111 PolarHBondContact O-N 3.26Å; Q108-Q112 WeakPolarHBondContact O-CB 3.24Å; Q108-Q112 PolarHBondContact O-N 2.8Å |
| 109 | L | 98.2 | Very high | 96.9 | Very high | 113 Ų | 113 | 101.5 Ų | 101.5 | 59% | 0.592 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.1 | -43 | 175.9 | -68.5 | 173 | 0 | 0 | 0 | 111.8 | E105 E106 L107 Q112 A113 | E105-L109 WeakPolarHBondContact O-CG 3.29Å; E105-L109 PolarHBondContact O-N 3.46Å; E106-L109 WeakPolarHBondContact O-CB 3.34Å; E106-L109 PolarHBondContact O-N 3.38Å; L107-L109 VanDerWaalsContact C-N 3.34Å; L107-L109 PolarHBondContact O-N 3.39Å; L109-Q112 PolarHBondContact O-N 3.32Å; L109-A113 WeakPolarHBondContact O-CB 3.48Å; L109-A113 PolarHBondContact O-N 3.07Å |
| 110 | Q | 98.3 | Very high | 96.3 | Very high | 94 Ų | 94 | 105.4 Ų | 105.4 | 44% | 0.439 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.4 | -46.5 | 177.2 | -70.6 | -179.5 | 12.4 | 0 | 0 | 111.9 | E106 L107 Q112 A113 Q114 | E106-Q110 WeakPolarHBondContact O-CG 3.33Å; E106-Q110 PolarHBondContact O-N 2.87Å; E106-Q110 PolarHBondContact OE1-NE2 3.13Å; L107-Q110 PolarHBondContact O-N 2.89Å; Q110-Q112 VanDerWaalsContact C-N 3.32Å; Q110-Q112 PolarHBondContact O-N 3.47Å; Q110-A113 PolarHBondContact O-N 3.42Å; Q110-Q114 WeakPolarHBondContact O-CG 3.39Å; Q110-Q114 PolarHBondContact O-N 2.81Å |
| 111 | V | 97.8 | Very high | 95.4 | Very high | 100 Ų | 100 | 113.2 Ų | 113.2 | 61% | 0.606 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60 | -45 | 176.9 | 168.4 | 0 | 0 | 0 | 0 | 110.5 | L107 Q108 Q114 Q115 | L107-V111 WeakPolarHBondContact O-CB 3.21Å; L107-V111 VanDerWaalsContact O-CG2 3.3Å; L107-V111 WeakPolarHBondContact O-CG2 3.32Å; L107-V111 PolarHBondContact O-N 3.23Å; Q108-V111 PolarHBondContact O-N 3.26Å; V111-Q114 PolarHBondContact O-N 3.46Å; V111-Q115 WeakPolarHBondContact O-CB 3.48Å; V111-Q115 PolarHBondContact O-N 3.3Å |
| 112 | Q | 97.7 | Very high | 93.7 | Very high | 100 Ų | 100 | 108.5 Ų | 108.5 | 47% | 0.467 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 178.4 | -171.7 | 175.9 | 39.1 | 0 | 0 | 111.8 | Q108 L109 Q110 Q114 Q115 Q116 | Q108-Q112 WeakPolarHBondContact O-CB 3.24Å; Q108-Q112 PolarHBondContact O-N 2.8Å; L109-Q112 PolarHBondContact O-N 3.32Å; Q110-Q112 VanDerWaalsContact C-N 3.32Å; Q110-Q112 PolarHBondContact O-N 3.47Å; Q112-Q114 PolarHBondContact O-N 2.93Å; Q112-Q115 PolarHBondContact O-N 3.21Å; Q112-Q116 WeakPolarHBondContact O-CG 3.28Å; Q112-Q116 PolarHBondContact O-N 3.17Å |
| 113 | A | 96.1 | Very high | 91.8 | Very high | 55 Ų | 55 | 106.1 Ų | 106.1 | 46% | 0.455 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | L109 Q110 Q116 A117 | L109-A113 WeakPolarHBondContact O-CB 3.48Å; L109-A113 PolarHBondContact O-N 3.07Å; Q110-A113 PolarHBondContact O-N 3.42Å; A113-Q116 PolarHBondContact O-N 2.88Å; A113-A117 WeakPolarHBondContact O-CB 3.47Å; A113-A117 PolarHBondContact O-N 2.8Å |
| 114 | Q | 96.9 | Very high | 89.7 | Confident | 122 Ų | 122 | 105 Ų | 105 | 57% | 0.57 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -60.8 | -47.9 | 173.4 | -75 | -152 | 30.9 | 0 | 0 | 111.1 | Q110 V111 Q112 Q116 A117 W118 | Q110-Q114 WeakPolarHBondContact O-CG 3.39Å; Q110-Q114 PolarHBondContact O-N 2.81Å; V111-Q114 PolarHBondContact O-N 3.46Å; Q112-Q114 PolarHBondContact O-N 2.93Å; Q114-Q116 VanDerWaalsContact C-N 3.28Å; Q114-Q116 PolarHBondContact O-N 3.25Å; Q114-A117 WeakPolarHBondContact O-CB 3.49Å; Q114-A117 PolarHBondContact O-N 3.37Å; Q114-A117 VanDerWaalsContact O-N 3.11Å; Q114-W118 PolarHBondContact O-N 3.44Å |
| 115 | Q | 95.8 | Very high | 87.6 | Confident | 118 Ų | 118 | 107.5 Ų | 107.5 | 55% | 0.551 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -58 | -42.5 | 179.9 | -168.4 | -178 | 38.3 | 0 | 0 | 111.8 | V111 Q112 W118 Q119 | V111-Q115 WeakPolarHBondContact O-CB 3.48Å; V111-Q115 PolarHBondContact O-N 3.3Å; Q112-Q115 PolarHBondContact O-N 3.21Å; Q115-W118 PolarHBondContact O-N 2.87Å; Q115-Q119 WeakPolarHBondContact O-CG 3.03Å; Q115-Q119 PolarHBondContact O-N 3Å |
| 116 | Q | 93.4 | Very high | 85.4 | Confident | 107 Ų | 107 | 107.6 Ų | 107.6 | 50% | 0.5 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.4 | -46.1 | 174.8 | -69.9 | 174.9 | 9.6 | 0 | 0 | 111.6 | Q112 A113 Q114 W118 Q119 V120 | Q112-Q116 WeakPolarHBondContact O-CG 3.28Å; Q112-Q116 PolarHBondContact O-N 3.17Å; A113-Q116 PolarHBondContact O-N 2.88Å; Q114-Q116 VanDerWaalsContact C-N 3.28Å; Q114-Q116 PolarHBondContact O-N 3.25Å; Q116-W118 VanDerWaalsContact C-N 3.29Å; Q116-W118 PolarHBondContact O-N 2.81Å; Q116-Q119 PolarHBondContact O-N 3.11Å; Q116-Q119 VanDerWaalsContact O-N 3.13Å; Q116-V120 WeakPolarHBondContact O-CG2 3.33Å; Q116-V120 PolarHBondContact O-N 2.79Å |
| 117 | A | 93.2 | Very high | 82.8 | Confident | 61 Ų | 61 | 106.8 Ų | 106.8 | 50% | 0.504 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -58.9 | -40.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A113 Q114 R121 | A113-A117 WeakPolarHBondContact O-CB 3.47Å; A113-A117 PolarHBondContact O-N 2.8Å; Q114-A117 WeakPolarHBondContact O-CB 3.49Å; Q114-A117 PolarHBondContact O-N 3.37Å; Q114-A117 VanDerWaalsContact O-N 3.11Å; A117-R121 WeakPolarHBondContact O-CB 3.35Å; A117-R121 PolarHBondContact O-N 3.08Å |
| 118 | W | 92.3 | Very high | 80.3 | Confident | 153 Ų | 153 | 108.3 Ų | 108.3 | 58% | 0.58 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -65.2 | -41.8 | 174.3 | -79.8 | 104.9 | 0 | 0 | 0 | 112.5 | Q114 Q115 Q116 R121 S122 | Q114-W118 PolarHBondContact O-N 3.44Å; Q115-W118 PolarHBondContact O-N 2.87Å; Q116-W118 VanDerWaalsContact C-N 3.29Å; Q116-W118 PolarHBondContact O-N 2.81Å; W118-R121 PolarHBondContact O-N 3.41Å; W118-S122 PolarHBondContact O-N 3.44Å |
| 119 | Q | 87.9 | Confident | 77.8 | Confident | 94 Ų | 94 | 106 Ų | 106 | 44% | 0.439 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65.2 | -39 | 177.4 | -76.5 | -175.4 | 68.2 | 0 | 0 | 112.9 | Q115 Q116 R121 S122 Q126 | Q115-Q119 WeakPolarHBondContact O-CG 3.03Å; Q115-Q119 PolarHBondContact O-N 3Å; Q116-Q119 PolarHBondContact O-N 3.11Å; Q116-Q119 VanDerWaalsContact O-N 3.13Å; Q119-R121 VanDerWaalsContact C-N 3.34Å; Q119-S122 CarbonylContact O-C 3.54Å; Q119-Q126 PolarHBondContact O-NE2 3.06Å |
| 120 | V | 87.1 | Confident | 75.5 | Confident | 122 Ų | 122 | 109.5 Ų | 109.5 | 74% | 0.739 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -67 | -37.4 | 175.7 | 174.6 | 0 | 0 | 0 | 0 | 111 | Q116 | Q116-V120 WeakPolarHBondContact O-CG2 3.33Å; Q116-V120 PolarHBondContact O-N 2.79Å |
| 121 | R | 79.8 | Confident | 73.7 | Confident | 193 Ų | 193 | 111.3 Ų | 111.3 | 73% | 0.728 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -75.2 | -27.6 | -179.8 | -169.9 | 176.2 | -179.2 | -149.4 | 0.5 | 113.7 | A117 W118 Q119 P123 | A117-R121 WeakPolarHBondContact O-CB 3.35Å; A117-R121 PolarHBondContact O-N 3.08Å; W118-R121 PolarHBondContact O-N 3.41Å; Q119-R121 VanDerWaalsContact C-N 3.34Å; R121-P123 VanDerWaalsContact C-CD 3.49Å; R121-P123 WeakPolarHBondContact O-CD 3.46Å |
| 122 | S | 63.6 | Low | 71.6 | Confident | 60 Ų | 60 | 113.8 Ų | 113.8 | 42% | 0.42 | 63% | 0.625 | S | S | . | * | trans | -118.9 | 75.1 | 179.3 | -72.9 | 0 | 0 | 0 | 0 | 112.2 | W118 Q119 A124 | W118-S122 PolarHBondContact O-N 3.44Å; Q119-S122 CarbonylContact O-C 3.54Å; S122-A124 PolarHBondContact O-N 2.92Å | ||
| 123 | P | 58.1 | Low | 69.5 | Low | 96 Ų | 96 | 114.3 Ų | 114.3 | 62% | 0.623 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -69.3 | -14.8 | 177.7 | 27.7 | -34.1 | 0 | 0 | 0 | 113.6 | R121 V125 Q126 | R121-P123 VanDerWaalsContact C-CD 3.49Å; R121-P123 WeakPolarHBondContact O-CD 3.46Å; P123-V125 PolarHBondContact O-N 2.89Å; P123-Q126 PolarHBondContact O-N 3.12Å |
| 124 | A | 53.4 | Low | 67.5 | Low | 99 Ų | 99 | 119.8 Ų | 119.8 | 82% | 0.818 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -72.9 | -8.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | S122 | S122-A124 PolarHBondContact O-N 2.92Š|
| 125 | V | 56.2 | Low | 65.2 | Low | 130 Ų | 130 | 119.1 Ų | 119.1 | 79% | 0.788 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -108.8 | 24.3 | 178.8 | -173.2 | 0 | 0 | 0 | 0 | 111.3 | P123 | P123-V125 PolarHBondContact O-N 2.89Š|
| 126 | Q | 52.6 | Low | 63.2 | Low | 119 Ų | 119 | 119.4 Ų | 119.4 | 56% | 0.556 | 68% | 0.678 | S | S | * | * | trans | -108 | 2.8 | 179.4 | -67.3 | -170.7 | 33.4 | 0 | 0 | 115.1 | Q119 P123 P128 | Q119-Q126 PolarHBondContact O-NE2 3.06Å; P123-Q126 PolarHBondContact O-N 3.12Å; Q126-P128 WeakPolarHBondContact O-CD 3.45Å | ||
| 127 | S | 43.5 | Very low | 61.4 | Low | 96 Ų | 96 | 120 Ų | 120 | 67% | 0.671 | 69% | 0.694 | S | S | * | * | trans | -98.4 | 111.8 | 166.4 | -170.8 | 0 | 0 | 0 | 0 | 109.4 | A129 | S127-A129 PolarHBondContact O-N 2.98Š| ||
| 128 | P | 46.2 | Very low | 59.4 | Low | 116 Ų | 116 | 129 Ų | 129 | 75% | 0.753 | 72% | 0.715 | S | S | * | * | trans | -66.8 | 92.1 | 152.7 | 29.3 | -28 | 0 | 0 | 0 | 104.7 | Q126 K130 | Q126-P128 WeakPolarHBondContact O-CD 3.45Å; P128-K130 VanDerWaalsContact C-N 3.28Å; P128-K130 PolarHBondContact O-N 3.29Å | ||
| 129 | A | 46.4 | Very low | 57.4 | Low | 77 Ų | 77 | 133.1 Ų | 133.1 | 64% | 0.636 | 73% | 0.73 | S | S | * | * | trans | -50.8 | 106.4 | 163.7 | 0 | 0 | 0 | 0 | 0 | 105.4 | S127 V131 | S127-A129 PolarHBondContact O-N 2.98Å; A129-V131 VanDerWaalsContact C-N 3.26Å; A129-V131 PolarHBondContact O-N 2.94Å | ||
| 130 | K | 50.2 | Low | 55.7 | Low | 187 Ų | 187 | 133.3 Ų | 133.3 | 81% | 0.813 | 75% | 0.747 | S | S | * | * | trans | -57.2 | 98.4 | 175.7 | -167.3 | 174.6 | -171 | 178.3 | 0 | 104.6 | P128 Q132 | P128-K130 VanDerWaalsContact C-N 3.28Å; P128-K130 PolarHBondContact O-N 3.29Å; K130-Q132 PolarHBondContact O-N 2.87Å | ||
| 131 | V | 58.7 | Low | 54.2 | Low | 133 Ų | 133 | 132.1 Ų | 132.1 | 81% | 0.806 | 75% | 0.75 | S | S | * | * | trans | -64.2 | 92.5 | 175.6 | 179.4 | 0 | 0 | 0 | 0 | 104.9 | A129 P133 | A129-V131 VanDerWaalsContact C-N 3.26Å; A129-V131 PolarHBondContact O-N 2.94Å; V131-P133 WeakPolarHBondContact O-CD 3.38Å | ||
| 132 | Q | 54.8 | Low | 53 | Low | 152 Ų | 152 | 138.1 Ų | 138.1 | 71% | 0.71 | 77% | 0.773 | S | S | * | * | trans | -63.7 | 123.8 | 169.9 | -73.3 | -177.7 | 18.2 | 0 | 0 | 105.7 | K130 L134 | K130-Q132 PolarHBondContact O-N 2.87Å; Q132-L134 PolarHBondContact O-N 3.01Å | ||
| 133 | P | 52.7 | Low | 52.5 | Low | 110 Ų | 110 | 142.1 Ų | 142.1 | 71% | 0.714 | 79% | 0.791 | S | S | * | * | trans | -63.8 | 112.7 | 172.2 | 25 | -28.4 | 0 | 0 | 0 | 106.8 | V131 C135 | V131-P133 WeakPolarHBondContact O-CD 3.38Å; P133-C135 VanDerWaalsContact C-N 3.31Å; P133-C135 PolarHBondContact O-N 2.88Å | ||
| 134 | L | 54 | Low | 52.2 | Low | 170 Ų | 170 | 144.5 Ų | 144.5 | 89% | 0.89 | 80% | 0.8 | S | S | * | * | trans | -63 | 96.9 | 167.8 | -113 | 90.1 | 0 | 0 | 0 | 107 | Q132 P136 | Q132-L134 PolarHBondContact O-N 3.01Å; L134-P136 VanDerWaalsContact O-CD 3.29Å; L134-P136 WeakPolarHBondContact O-CD 3.49Å | ||
| 135 | C | 49.6 | Very low | 52.1 | Low | 108 Ų | 108 | 147 Ų | 147 | 73% | 0.73 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 117.9 | 167 | -70.6 | 0 | 0 | 0 | 0 | 107.9 | P133 S137 | P133-C135 VanDerWaalsContact C-N 3.31Å; P133-C135 PolarHBondContact O-N 2.88Å; C135-S137 PolarHBondContact O-N 3.08Å; C135-S137 VanDerWaalsContact O-N 3.15Å |
| 136 | P | 54 | Low | 51.9 | Low | 125 Ų | 125 | 148 Ų | 148 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 116.9 | 174.1 | 26.8 | -30.3 | 0 | 0 | 0 | 108.4 | L134 R138 | L134-P136 VanDerWaalsContact O-CD 3.29Å; L134-P136 WeakPolarHBondContact O-CD 3.49Å; P136-R138 PolarHBondContact O-N 3.35Å; P136-R138 VanDerWaalsContact O-N 3.07Å |
| 137 | S | 54.5 | Low | 51.8 | Low | 119 Ų | 119 | 149.8 Ų | 149.8 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 116.6 | 173.3 | -59.8 | 0 | 0 | 0 | 0 | 109.5 | C135 R139 | C135-S137 PolarHBondContact O-N 3.08Å; C135-S137 VanDerWaalsContact O-N 3.15Å; S137-R139 PolarHBondContact O-N 3.36Å |
| 138 | R | 51.7 | Low | 52.4 | Low | 251 Ų | 251 | 153.4 Ų | 153.4 | 95% | 0.947 | 82% | 0.824 | S | S | * | * | trans | -59.4 | 106.3 | 174.1 | -141.9 | 178.4 | -145.3 | -134.9 | 4.3 | 107.7 | P136 A140 | P136-R138 PolarHBondContact O-N 3.35Å; P136-R138 VanDerWaalsContact O-N 3.07Å; R138-A140 PolarHBondContact O-N 3.36Å | ||
| 139 | R | 51.3 | Low | 52.8 | Low | 238 Ų | 238 | 156.1 Ų | 156.1 | 90% | 0.898 | 83% | 0.829 | S | S | * | * | trans | -67.7 | 103.6 | 174.7 | -163.2 | 180 | -68.4 | -134.1 | 1.6 | 107.2 | S137 A141 | S137-R139 PolarHBondContact O-N 3.36Å; R139-A141 PolarHBondContact O-N 3.16Å; R139-A141 VanDerWaalsContact O-N 3.16Å | ||
| 140 | A | 50.7 | Low | 53.3 | Low | 98 Ų | 98 | 162.2 Ų | 162.2 | 81% | 0.81 | 84% | 0.844 | S | S | * | * | trans | -65.9 | 108.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | R138 | R138-A140 PolarHBondContact O-N 3.36Š| ||
| 141 | A | 55.5 | Low | 53.6 | Low | 97 Ų | 97 | 160.1 Ų | 160.1 | 80% | 0.802 | 85% | 0.847 | S | S | * | * | trans | -78.1 | 133.5 | 165.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | R139 | R139-A141 PolarHBondContact O-N 3.16Å; R139-A141 VanDerWaalsContact O-N 3.16Å | ||
| 142 | R | 55.7 | Low | 53.1 | Low | 320 Ų | 320 | 162.5 Ų | 162.5 | 100% | 1.208 | 85% | 0.85 | S | S | * | * | trans | -64.1 | 0 | 173.5 | -82.9 | 175.2 | 168.5 | -119.3 | 0.4 | 112 |
Retrieved 142 of 142 residues in 91.6 ms
(Link to these results)