| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.2 | Very low | 40.5 | Very low | 244 Ų | 244 | 159.1 Ų | 159.1 | 100% | 1.202 | 84% | 0.839 | S | S | * | * | 0 | 117.4 | 0 | -78.7 | 171.4 | 175.6 | 0 | 0 | 106.2 | |||||
| 2 | M | 34 | Very low | 40.9 | Very low | 159 Ų | 159 | 162.6 Ų | 162.6 | 78% | 0.783 | 83% | 0.834 | S | S | * | * | cis | -136.2 | 140.6 | 31.4 | -66.8 | 170.6 | -168.1 | 0 | 0 | 111.8 | Y4 | M2-Y4 HydrophobicContact CB-CE2 4.43Š| ||
| 3 | N | 37.1 | Very low | 41 | Very low | 154 Ų | 154 | 164.8 Ų | 164.8 | 82% | 0.824 | 84% | 0.839 | S | S | * | * | trans | -68.5 | 138.7 | 160 | -95.6 | -13.1 | 0 | 0 | 0 | 109.1 | ||||
| 4 | Y | 40.3 | Very low | 41.5 | Very low | 210 Ų | 210 | 165.5 Ų | 165.5 | 82% | 0.824 | 83% | 0.828 | S | S | * | * | trans | -113.6 | 119.4 | 156.5 | -84.6 | -85.2 | 0 | 0 | 0 | 109.2 | M2 | M2-Y4 HydrophobicContact CB-CE2 4.43Š| ||
| 5 | T | 42.2 | Very low | 41.7 | Very low | 130 Ų | 130 | 163.1 Ų | 163.1 | 80% | 0.798 | 82% | 0.819 | S | S | * | * | trans | -77.1 | 151.8 | -176.9 | 17.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 6 | T | 44.9 | Very low | 42.5 | Very low | 137 Ų | 137 | 163.1 Ų | 163.1 | 84% | 0.84 | 81% | 0.808 | S | S | * | * | trans | -65.5 | 146.7 | 177.1 | 44.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 7 | G | 42.3 | Very low | 42.8 | Very low | 66 Ų | 66 | 163.2 Ų | 163.2 | 68% | 0.68 | 81% | 0.806 | S | S | * | * | trans | 77.5 | 113.2 | 130.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 8 | Y | 38.7 | Very low | 43.1 | Very low | 238 Ų | 238 | 164.2 Ų | 164.2 | 93% | 0.933 | 81% | 0.805 | S | S | * | * | trans | -151.3 | 94 | 147.9 | -105.2 | -83.8 | 0 | 0 | 0 | 108.5 | ||||
| 9 | E | 44.9 | Very low | 43.5 | Very low | 192 Ų | 192 | 164.1 Ų | 164.1 | 90% | 0.897 | 80% | 0.796 | S | S | * | * | trans | -83.8 | 114.7 | 156.3 | -88.1 | 175 | 150.6 | 0 | 0 | 106.3 | ||||
| 10 | G | 43 | Very low | 43.8 | Very low | 54 Ų | 54 | 164.9 Ų | 164.9 | 56% | 0.557 | 80% | 0.798 | S | S | * | * | trans | -88.2 | 104 | 170.1 | 0 | 0 | 0 | 0 | 0 | 109 | Y12 | G10-Y12 PolarHBondContact O-N 2.74Š| ||
| 11 | D | 40.6 | Very low | 44 | Very low | 166 Ų | 166 | 164.4 Ų | 164.4 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | trans | -69.8 | 115.6 | 163.9 | -87.5 | -28.1 | 0 | 0 | 0 | 108.4 | E13 | D11-E13 PolarHBondContact O-N 3.37Š| ||
| 12 | Y | 45.3 | Very low | 44.6 | Very low | 201 Ų | 201 | 158.5 Ų | 158.5 | 79% | 0.788 | 77% | 0.77 | S | S | * | * | trans | -85.6 | 100.9 | 168.2 | -64.8 | -83.2 | 0 | 0 | 0 | 107.9 | G10 Y14 | G10-Y12 PolarHBondContact O-N 2.74Å; Y12-Y14 PolarHBondContact O-N 3.39Å | ||
| 13 | E | 43.1 | Very low | 45.4 | Very low | 191 Ų | 191 | 155.6 Ų | 155.6 | 89% | 0.893 | 77% | 0.766 | S | S | * | * | trans | -76 | 109.9 | 171.4 | -164.8 | 164.5 | -165.5 | 0 | 0 | 108.4 | D11 D15 | D11-E13 PolarHBondContact O-N 3.37Å; E13-D15 PolarHBondContact O-N 3.27Å | ||
| 14 | Y | 47.7 | Very low | 46.1 | Very low | 175 Ų | 175 | 156.4 Ų | 156.4 | 69% | 0.686 | 77% | 0.77 | S | S | * | * | trans | -75.5 | 114.4 | 175 | -72.3 | -87 | 0 | 0 | 0 | 108.7 | Y12 Y16 | Y12-Y14 PolarHBondContact O-N 3.39Å; Y14-Y16 WeakPolarHBondContact O-CD2 3.39Å; Y14-Y16 PolarHBondContact O-N 3.46Å; Y14-Y16 VanDerWaalsContact O-N 3.1Å | ||
| 15 | D | 44.2 | Very low | 46.4 | Very low | 130 Ų | 130 | 150.8 Ų | 150.8 | 70% | 0.695 | 76% | 0.757 | S | S | * | * | trans | -75.6 | 96.5 | 179.3 | -153.6 | -10.6 | 0 | 0 | 0 | 109.9 | E13 E17 | E13-D15 PolarHBondContact O-N 3.27Å; D15-E17 VanDerWaalsContact C-N 3.31Å | ||
| 16 | Y | 53.9 | Low | 46.7 | Very low | 163 Ų | 163 | 148.6 Ų | 148.6 | 64% | 0.639 | 75% | 0.745 | S | S | * | * | trans | -86.5 | 1.1 | -179.9 | -74 | -81 | 0 | 0 | 0 | 113.1 | Y14 F18 Y19 | Y14-Y16 WeakPolarHBondContact O-CD2 3.39Å; Y14-Y16 PolarHBondContact O-N 3.46Å; Y14-Y16 VanDerWaalsContact O-N 3.1Å; Y16-F18 PolarHBondContact O-N 3.29Å; Y16-Y19 PolarHBondContact O-N 3.19Å | ||
| 17 | E | 48.8 | Very low | 47.2 | Very low | 165 Ų | 165 | 148.9 Ų | 148.9 | 77% | 0.771 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -64.8 | -14.4 | -172.2 | -70.7 | -163.4 | 159 | 0 | 0 | 114 | D15 | D15-E17 VanDerWaalsContact C-N 3.31Š|
| 18 | F | 48.1 | Very low | 47.8 | Very low | 180 Ų | 180 | 152.6 Ų | 152.6 | 79% | 0.789 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -84 | -9.2 | -179.1 | -156.8 | -99.1 | 0 | 0 | 0 | 115.3 | Y16 | Y16-F18 PolarHBondContact O-N 3.29Š|
| 19 | Y | 49.3 | Very low | 48.6 | Very low | 163 Ų | 163 | 142.9 Ų | 142.9 | 64% | 0.639 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -92.2 | -4.7 | -177.5 | -74.7 | -83.4 | 0 | 0 | 0 | 114.6 | Y16 D21 M22 | Y16-Y19 PolarHBondContact O-N 3.19Å; Y19-D21 VanDerWaalsContact C-N 3.32Å; Y19-D21 PolarHBondContact O-N 3.43Å; Y19-M22 HydrophobicContact CD1-CE 3.53Å; Y19-M22 HydrophobicContact CE1-CE 3.78Å |
| 20 | H | 49.9 | Very low | 48.8 | Very low | 179 Ų | 179 | 139.3 Ų | 139.3 | 83% | 0.829 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -14.3 | -176.2 | -91.8 | -67.2 | 0 | 0 | 0 | 115 | ||
| 21 | D | 49.3 | Very low | 49.4 | Very low | 156 Ų | 156 | 142.1 Ų | 142.1 | 83% | 0.834 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.3 | 6.4 | -177.8 | -157 | 31.7 | 0 | 0 | 0 | 113.6 | Y19 S23 | Y19-D21 VanDerWaalsContact C-N 3.32Å; Y19-D21 PolarHBondContact O-N 3.43Å; D21-S23 PolarHBondContact O-N 3.35Å |
| 22 | M | 48.6 | Very low | 49.8 | Very low | 120 Ų | 120 | 137.5 Ų | 137.5 | 59% | 0.591 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -78.2 | 115.9 | 169.1 | -111.7 | 174 | -80.9 | 0 | 0 | 108.5 | Y19 D24 | Y19-M22 HydrophobicContact CD1-CE 3.53Å; Y19-M22 HydrophobicContact CE1-CE 3.78Å; M22-D24 PolarHBondContact O-N 3.45Å |
| 23 | S | 50.3 | Low | 50.1 | Low | 98 Ų | 98 | 134.8 Ų | 134.8 | 69% | 0.685 | 71% | 0.708 | S | S | * | * | trans | -48.4 | 131 | 166.7 | -51.5 | 0 | 0 | 0 | 0 | 108.9 | D21 V25 | D21-S23 PolarHBondContact O-N 3.35Å; S23-V25 PolarHBondContact O-N 2.73Å | ||
| 24 | D | 51.9 | Low | 50.7 | Low | 171 Ų | 171 | 128.7 Ų | 128.7 | 91% | 0.914 | 69% | 0.686 | S | S | * | * | trans | -63.9 | 66.5 | 174.4 | -78.4 | -40.8 | 0 | 0 | 0 | 110.6 | M22 P26 | M22-D24 PolarHBondContact O-N 3.45Å; D24-P26 WeakPolarHBondContact O-CD 3.42Å | ||
| 25 | V | 47.3 | Very low | 51 | Low | 91 Ų | 91 | 129.2 Ų | 129.2 | 55% | 0.552 | 69% | 0.692 | S | S | * | * | trans | -89.6 | 115.7 | 172.6 | -173.2 | 0 | 0 | 0 | 0 | 105.6 | S23 V27 | S23-V25 PolarHBondContact O-N 2.73Å; V25-V27 PolarHBondContact O-N 3.4Å | ||
| 26 | P | 49.3 | Very low | 51.8 | Low | 84 Ų | 84 | 125.9 Ų | 125.9 | 55% | 0.545 | 68% | 0.678 | S | S | . | * | trans | -52.6 | 128.7 | 173 | -22.7 | 32.1 | 0 | 0 | 0 | 109.1 | D24 D28 C29 | D24-P26 WeakPolarHBondContact O-CD 3.42Å; P26-D28 PolarHBondContact O-N 3.16Å; P26-C29 PolarHBondContact O-N 3.3Å | ||
| 27 | V | 55.1 | Low | 52.6 | Low | 143 Ų | 143 | 121.2 Ų | 121.2 | 87% | 0.867 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.5 | -20.3 | -177 | -173.1 | 0 | 0 | 0 | 0 | 112.3 | V25 | V25-V27 PolarHBondContact O-N 3.4Š|
| 28 | D | 53.7 | Low | 54.3 | Low | 145 Ų | 145 | 116.9 Ų | 116.9 | 78% | 0.775 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | -2.1 | -178.9 | -61.2 | -38.8 | 0 | 0 | 0 | 115.4 | P26 | P26-D28 PolarHBondContact O-N 3.16Š|
| 29 | C | 56.5 | Low | 56.2 | Low | 33 Ų | 33 | 112.1 Ų | 112.1 | 22% | 0.223 | 64% | 0.637 | C | S | . | * | trans | -130.5 | 59.5 | -170.2 | -67.9 | 0 | 0 | 0 | 0 | 115.8 | P26 T31 C34 | P26-C29 PolarHBondContact O-N 3.3Å; C29-T31 VanDerWaalsContact C-N 3.29Å; C29-T31 PolarHBondContact O-N 3.43Å; C29-C34 VanDerWaalsContact CA-SG 3.56Å; C29-C34 HydrophobicContact CB-CB 4.2Å; C29-C34 WeakPolarHBondContact CB-SG 3.38Å; C29-C34 WeakPolarHBondContact SG-CB 3.48Å; C29-C34 CovalentContact SG-SG 2.01Å; C29-C34 PolarHBondContact SG-SG 3.22Å | ||
| 30 | P | 48.4 | Very low | 58.1 | Low | 118 Ų | 118 | 106.5 Ų | 106.5 | 77% | 0.766 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | -16 | -178.4 | 26.8 | -33 | 0 | 0 | 0 | 114.8 | ||
| 31 | T | 57 | Low | 60.1 | Low | 113 Ų | 113 | 99 Ų | 99 | 69% | 0.693 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.3 | 6.2 | -172.8 | 55.9 | 0 | 0 | 0 | 0 | 115 | C29 N33 | C29-T31 VanDerWaalsContact C-N 3.29Å; C29-T31 PolarHBondContact O-N 3.43Å; T31-N33 PolarHBondContact O-N 3.49Å |
| 32 | G | 48.3 | Very low | 62.2 | Low | 68 Ų | 68 | 96.5 Ų | 96.5 | 70% | 0.701 | 57% | 0.567 | S | S | * | * | S | Bend | trans | 70.8 | -8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | C34 | G32-C34 VanDerWaalsContact C-N 3.3Å; G32-C34 PolarHBondContact O-N 3.32Å |
| 33 | N | 50.7 | Low | 64.4 | Low | 144 Ų | 144 | 94.6 Ų | 94.6 | 77% | 0.77 | 56% | 0.563 | S | S | * | * | trans | -92.5 | 42.3 | 178.8 | -77 | -9.4 | 0 | 0 | 0 | 113 | T31 F35 | T31-N33 PolarHBondContact O-N 3.49Å; N33-F35 PolarHBondContact O-N 3.45Å | ||
| 34 | C | 57.4 | Low | 66.6 | Low | 64 Ų | 64 | 90 Ų | 90 | 43% | 0.432 | 53% | 0.531 | S | S | . | . | trans | -77.8 | 112.2 | 173.2 | -75.4 | 0 | 0 | 0 | 0 | 109.1 | C29 G32 S36 | C29-C34 VanDerWaalsContact CA-SG 3.56Å; C29-C34 HydrophobicContact CB-CB 4.2Å; C29-C34 WeakPolarHBondContact CB-SG 3.38Å; C29-C34 WeakPolarHBondContact SG-CB 3.48Å; C29-C34 CovalentContact SG-SG 2.01Å; C29-C34 PolarHBondContact SG-SG 3.22Å; G32-C34 VanDerWaalsContact C-N 3.3Å; G32-C34 PolarHBondContact O-N 3.32Å; C34-S36 PolarHBondContact O-N 2.98Å | ||
| 35 | F | 53.3 | Low | 68.7 | Low | 186 Ų | 186 | 84.3 Ų | 84.3 | 82% | 0.816 | 50% | 0.5 | S | S | * | . | trans | -49.1 | 119.8 | 157.8 | -85.3 | -86.4 | 0 | 0 | 0 | 106.4 | N33 S37 | N33-F35 PolarHBondContact O-N 3.45Å; F35-S37 PolarHBondContact O-N 3.35Å | ||
| 36 | S | 60.4 | Low | 71.1 | Confident | 59 Ų | 59 | 86.2 Ų | 86.2 | 41% | 0.413 | 50% | 0.504 | S | S | . | . | trans | -53.4 | 121.6 | 176.4 | 172 | 0 | 0 | 0 | 0 | 107.6 | C34 D38 V39 Y40 | C34-S36 PolarHBondContact O-N 2.98Å; S36-D38 PolarHBondContact O-N 3.16Å; S36-D38 PolarHBondContact OG-N 3.31Å; S36-V39 PolarHBondContact O-N 2.94Å; S36-Y40 PolarHBondContact O-N 2.85Å | ||
| 37 | S | 72.1 | Confident | 73.3 | Confident | 65 Ų | 65 | 84.7 Ų | 84.7 | 46% | 0.455 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -47.9 | -32.6 | 177.2 | -177.1 | 0 | 0 | 0 | 0 | 110.7 | F35 Y40 V41 | F35-S37 PolarHBondContact O-N 3.35Å; S37-Y40 PolarHBondContact O-N 3.34Å; S37-V41 VanDerWaalsContact O-CG2 3.28Å; S37-V41 WeakPolarHBondContact O-CG2 3.36Å; S37-V41 PolarHBondContact O-N 2.85Å |
| 38 | D | 83.3 | Confident | 75.3 | Confident | 74 Ų | 74 | 78.3 Ų | 78.3 | 40% | 0.396 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -68 | -37 | 178.5 | -55.2 | -38.4 | 0 | 0 | 0 | 112.8 | S36 Y40 V41 I42 K103 | S36-D38 PolarHBondContact O-N 3.16Å; S36-D38 PolarHBondContact OG-N 3.31Å; D38-Y40 PolarHBondContact O-N 3.31Å; D38-V41 PolarHBondContact O-N 2.99Å; D38-I42 WeakPolarHBondContact O-CB 3.17Å; D38-I42 WeakPolarHBondContact O-CD1 3.16Å; D38-I42 WeakPolarHBondContact O-CG1 3.35Å; D38-I42 PolarHBondContact O-N 3.44Å; D38-K103 IonicContact OD1-NZ 3.79Å; D38-K103 PolarHBondContact OD1-NZ 3.49Å |
| 39 | V | 88 | Confident | 77.4 | Confident | 80 Ų | 80 | 73.4 Ų | 73.4 | 49% | 0.485 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 176.5 | 176.1 | 0 | 0 | 0 | 0 | 110.9 | S36 T43 | S36-V39 PolarHBondContact O-N 2.94Å; V39-T43 WeakPolarHBondContact O-CB 3.34Å; V39-T43 PolarHBondContact O-N 3.02Å; V39-T43 PolarHBondContact O-OG1 3.23Å |
| 40 | Y | 89.1 | Confident | 79.3 | Confident | 46 Ų | 46 | 74.2 Ų | 74.2 | 18% | 0.18 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -64.1 | -47.6 | 175.7 | 177.2 | -114.3 | 0 | 0 | 0 | 111.3 | S36 S37 D38 I42 T43 L44 F277 L281 | S36-Y40 PolarHBondContact O-N 2.85Å; S37-Y40 PolarHBondContact O-N 3.34Å; D38-Y40 PolarHBondContact O-N 3.31Å; Y40-I42 PolarHBondContact O-N 3.48Å; Y40-T43 WeakPolarHBondContact O-CB 3.22Å; Y40-T43 PolarHBondContact O-N 3.08Å; Y40-L44 HydrophobicContact CD1-CD1 3.91Å; Y40-L44 HydrophobicContact CD2-CG 4.5Å; Y40-L44 HydrophobicContact CE1-CD1 3.46Å; Y40-L44 VanDerWaalsContact CE1-CD1 3.46Å; Y40-L44 HydrophobicContact CE1-CG 4.34Å; Y40-L44 HydrophobicContact CE2-CD1 4.14Å; Y40-L44 HydrophobicContact CE2-CD2 4.31Å; Y40-L44 HydrophobicContact CE2-CG 4.16Å; Y40-L44 HydrophobicContact CG-CD1 4.46Å; Y40-L44 WeakPolarHBondContact O-CG 3.26Å; Y40-L44 PolarHBondContact O-N 3.47Å; Y40-F277 HydrophobicContact CD1-CE1 4.06Å; Y40-F277 AromaticContact CD1-CE2 3.95Å; Y40-F277 HydrophobicContact CD1-CE2 3.95Å; Y40-F277 AromaticContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD1-CZ 3.46Å; Y40-F277 VanDerWaalsContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD2-CE1 4.41Å; Y40-F277 HydrophobicContact CD2-CZ 4.43Å; Y40-F277 HydrophobicContact CE1-CD1 4.4Å; Y40-F277 HydrophobicContact CE1-CD2 4.5Å; Y40-F277 AromaticContact CE1-CE1 3.84Å; Y40-F277 HydrophobicContact CE1-CE1 3.84Å; Y40-F277 AromaticContact CE1-CE2 3.96Å; Y40-F277 HydrophobicContact CE1-CE2 3.96Å; Y40-F277 AromaticContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE2-CE1 4.25Å; Y40-F277 HydrophobicContact CG-CE1 4.32Å; Y40-F277 AromaticContact CG-CZ 3.89Å; Y40-F277 HydrophobicContact CG-CZ 3.89Å; Y40-F277 AromaticContact CZ-CE1 3.95Å; Y40-F277 PolarHBondContact OH-O 2.89Å; Y40-L281 HydrophobicContact CE2-CB 4.4Å |
| 41 | V | 92 | Very high | 81.6 | Confident | 22 Ų | 22 | 69 Ų | 69 | 13% | 0.133 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -58.2 | -48.6 | 176 | 168.9 | 0 | 0 | 0 | 0 | 111 | S37 D38 T43 L44 L45 I100 | S37-V41 VanDerWaalsContact O-CG2 3.28Å; S37-V41 WeakPolarHBondContact O-CG2 3.36Å; S37-V41 PolarHBondContact O-N 2.85Å; D38-V41 PolarHBondContact O-N 2.99Å; V41-T43 VanDerWaalsContact C-N 3.31Å; V41-T43 PolarHBondContact O-N 3.26Å; V41-L44 PolarHBondContact O-N 3.34Å; V41-L45 HydrophobicContact CG1-CD1 3.97Å; V41-L45 HydrophobicContact CG1-CG 4.37Å; V41-L45 VanDerWaalsContact O-CG 3.29Å; V41-L45 WeakPolarHBondContact O-CG 3.32Å; V41-L45 PolarHBondContact O-N 3.29Å; V41-I100 HydrophobicContact CG1-CG2 4.23Å |
| 42 | I | 94.1 | Very high | 83.5 | Confident | 102 Ų | 102 | 66.9 Ų | 66.9 | 52% | 0.523 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -58.9 | -44.1 | 177.5 | -69.8 | 163.3 | 0 | 0 | 0 | 110.6 | D38 Y40 L44 L45 M46 | D38-I42 WeakPolarHBondContact O-CB 3.17Å; D38-I42 WeakPolarHBondContact O-CD1 3.16Å; D38-I42 WeakPolarHBondContact O-CG1 3.35Å; D38-I42 PolarHBondContact O-N 3.44Å; Y40-I42 PolarHBondContact O-N 3.48Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-L44 PolarHBondContact O-N 2.94Å; I42-L45 PolarHBondContact O-N 2.96Å; I42-M46 HydrophobicContact CG2-CG 4.29Å; I42-M46 WeakPolarHBondContact O-CB 3.29Å; I42-M46 VanDerWaalsContact O-CG 3.24Å; I42-M46 WeakPolarHBondContact O-CG 3.4Å; I42-M46 PolarHBondContact O-N 3.4Å |
| 43 | T | 94.5 | Very high | 85.8 | Confident | 81 Ų | 81 | 69.3 Ų | 69.3 | 50% | 0.497 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.7 | -43.7 | 178.6 | -58 | 0 | 0 | 0 | 0 | 111.6 | V39 Y40 V41 M46 L47 | V39-T43 WeakPolarHBondContact O-CB 3.34Å; V39-T43 PolarHBondContact O-N 3.02Å; V39-T43 PolarHBondContact O-OG1 3.23Å; Y40-T43 WeakPolarHBondContact O-CB 3.22Å; Y40-T43 PolarHBondContact O-N 3.08Å; V41-T43 VanDerWaalsContact C-N 3.31Å; V41-T43 PolarHBondContact O-N 3.26Å; T43-M46 PolarHBondContact O-N 2.78Å; T43-L47 WeakPolarHBondContact O-CB 3.28Å; T43-L47 PolarHBondContact O-N 3.41Å |
| 44 | L | 95.6 | Very high | 87.9 | Confident | 2 Ų | 2 | 65.6 Ų | 65.6 | 1% | 0.01 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63.3 | -44.7 | 175.8 | -71.2 | 174.5 | 0 | 0 | 0 | 112.2 | Y40 V41 I42 M46 L47 Y48 I100 P280 L281 | Y40-L44 HydrophobicContact CD1-CD1 3.91Å; Y40-L44 HydrophobicContact CD2-CG 4.5Å; Y40-L44 HydrophobicContact CE1-CD1 3.46Å; Y40-L44 VanDerWaalsContact CE1-CD1 3.46Å; Y40-L44 HydrophobicContact CE1-CG 4.34Å; Y40-L44 HydrophobicContact CE2-CD1 4.14Å; Y40-L44 HydrophobicContact CE2-CD2 4.31Å; Y40-L44 HydrophobicContact CE2-CG 4.16Å; Y40-L44 HydrophobicContact CG-CD1 4.46Å; Y40-L44 WeakPolarHBondContact O-CG 3.26Å; Y40-L44 PolarHBondContact O-N 3.47Å; V41-L44 PolarHBondContact O-N 3.34Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-L44 PolarHBondContact O-N 2.94Å; L44-M46 VanDerWaalsContact C-N 3.32Å; L44-M46 PolarHBondContact O-N 2.95Å; L44-L47 WeakPolarHBondContact O-CB 3.03Å; L44-L47 PolarHBondContact O-N 2.98Å; L44-Y48 WeakPolarHBondContact O-CD1 3.03Å; L44-Y48 PolarHBondContact O-N 2.72Å; L44-I100 HydrophobicContact CB-CG2 3.96Å; L44-I100 HydrophobicContact CD1-CG2 3.91Å; L44-P280 HydrophobicContact CD1-CB 3.81Å; L44-P280 HydrophobicContact CD2-CB 4.33Å; L44-L281 VanDerWaalsContact CD2-CA 3.46Å; L44-L281 HydrophobicContact CD2-CB 3.83Å; L44-L281 HydrophobicContact CD2-CD1 4.06Å |
| 45 | L | 97 | Very high | 89.7 | Confident | 51 Ų | 51 | 62.5 Ų | 62.5 | 27% | 0.267 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 178.1 | -67.7 | 175.7 | 0 | 0 | 0 | 111.2 | V41 I42 Y48 A49 A97 I100 A101 | V41-L45 HydrophobicContact CG1-CD1 3.97Å; V41-L45 HydrophobicContact CG1-CG 4.37Å; V41-L45 VanDerWaalsContact O-CG 3.29Å; V41-L45 WeakPolarHBondContact O-CG 3.32Å; V41-L45 PolarHBondContact O-N 3.29Å; I42-L45 PolarHBondContact O-N 2.96Å; L45-Y48 PolarHBondContact O-N 2.84Å; L45-A49 WeakPolarHBondContact O-CB 3.41Å; L45-A49 PolarHBondContact O-N 2.88Å; L45-A97 HydrophobicContact CD2-CB 3.87Å; L45-A97 WeakPolarHBondContact CD2-O 3.31Å; L45-I100 HydrophobicContact CD2-CB 4.27Å; L45-I100 HydrophobicContact CD2-CG2 4.17Å; L45-I100 HydrophobicContact CG-CG2 4.38Å; L45-A101 HydrophobicContact CD1-CB 4.06Å; L45-A101 HydrophobicContact CD2-CB 4.1Å |
| 46 | M | 97 | Very high | 91.8 | Very high | 131 Ų | 131 | 55.4 Ų | 55.4 | 65% | 0.645 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -63.3 | -41.8 | 175 | -69.8 | -63 | -72.8 | 0 | 0 | 111.8 | I42 T43 L44 A49 A50 | I42-M46 HydrophobicContact CG2-CG 4.29Å; I42-M46 WeakPolarHBondContact O-CB 3.29Å; I42-M46 VanDerWaalsContact O-CG 3.24Å; I42-M46 WeakPolarHBondContact O-CG 3.4Å; I42-M46 PolarHBondContact O-N 3.4Å; T43-M46 PolarHBondContact O-N 2.78Å; L44-M46 VanDerWaalsContact C-N 3.32Å; L44-M46 PolarHBondContact O-N 2.95Å; M46-A49 PolarHBondContact O-N 3.47Å; M46-A50 VanDerWaalsContact O-CB 3.3Å; M46-A50 WeakPolarHBondContact O-CB 3.39Å; M46-A50 PolarHBondContact O-N 2.9Å |
| 47 | L | 96.3 | Very high | 93.4 | Very high | 52 Ų | 52 | 56.2 Ų | 56.2 | 27% | 0.272 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -59.3 | -51.4 | 174.4 | 174.2 | 64.7 | 0 | 0 | 0 | 111.1 | T43 L44 A49 A50 I51 L281 | T43-L47 WeakPolarHBondContact O-CB 3.28Å; T43-L47 PolarHBondContact O-N 3.41Å; L44-L47 WeakPolarHBondContact O-CB 3.03Å; L44-L47 PolarHBondContact O-N 2.98Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-A49 PolarHBondContact O-N 3.26Å; L47-A50 PolarHBondContact O-N 3.36Å; L47-I51 HydrophobicContact CD1-CD1 3.83Å; L47-I51 HydrophobicContact CD1-CG1 4.25Å; L47-I51 HydrophobicContact CG-CD1 3.87Å; L47-I51 WeakPolarHBondContact O-CD1 3.37Å; L47-I51 VanDerWaalsContact O-CG1 3.22Å; L47-I51 WeakPolarHBondContact O-CG1 3.46Å; L47-I51 PolarHBondContact O-N 3.47Å; L47-L281 HydrophobicContact CD2-CD1 4.13Å |
| 48 | Y | 97.3 | Very high | 94.3 | Very high | 8 Ų | 8 | 53.6 Ų | 53.6 | 3% | 0.031 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.7 | -40.5 | -177.9 | -81 | 47 | 0 | 0 | 0 | 111.2 | L44 L45 I51 F52 L93 L96 A97 I100 P280 G284 | L44-Y48 WeakPolarHBondContact O-CD1 3.03Å; L44-Y48 PolarHBondContact O-N 2.72Å; L45-Y48 PolarHBondContact O-N 2.84Å; Y48-I51 PolarHBondContact O-N 3.41Å; Y48-F52 WeakPolarHBondContact O-CB 3.1Å; Y48-F52 PolarHBondContact O-N 3.31Å; Y48-L93 HydrophobicContact CD2-CB 4.5Å; Y48-L93 HydrophobicContact CD2-CD2 3.63Å; Y48-L93 HydrophobicContact CE2-CD2 4.03Å; Y48-L93 HydrophobicContact CG-CD2 3.96Å; Y48-L96 HydrophobicContact CD2-CB 4.21Å; Y48-L96 HydrophobicContact CE2-CB 3.73Å; Y48-A97 HydrophobicContact CD2-CB 4.23Å; Y48-I100 HydrophobicContact CD2-CD1 4.22Å; Y48-I100 HydrophobicContact CE1-CD1 4.12Å; Y48-I100 HydrophobicContact CE2-CD1 3.69Å; Y48-P280 PolarHBondContact OH-O 3.2Å; Y48-G284 VanDerWaalsContact CE1-CA 3.48Å |
| 49 | A | 97.7 | Very high | 94.8 | Very high | 42 Ų | 42 | 50.1 Ų | 50.1 | 35% | 0.347 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L45 M46 L47 I51 F52 L53 | L45-A49 WeakPolarHBondContact O-CB 3.41Å; L45-A49 PolarHBondContact O-N 2.88Å; M46-A49 PolarHBondContact O-N 3.47Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-A49 PolarHBondContact O-N 3.26Å; A49-I51 PolarHBondContact O-N 3Å; A49-F52 PolarHBondContact O-N 3.41Å; A49-L53 WeakPolarHBondContact O-CB 3.49Å; A49-L53 VanDerWaalsContact O-CG 3.24Å; A49-L53 WeakPolarHBondContact O-CG 3.02Å; A49-L53 PolarHBondContact O-N 3.13Å |
| 50 | A | 96.6 | Very high | 95.1 | Very high | 51 Ų | 51 | 48.5 Ų | 48.5 | 42% | 0.421 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | M46 L47 F52 L53 V54 | M46-A50 VanDerWaalsContact O-CB 3.3Å; M46-A50 WeakPolarHBondContact O-CB 3.39Å; M46-A50 PolarHBondContact O-N 2.9Å; L47-A50 PolarHBondContact O-N 3.36Å; A50-F52 VanDerWaalsContact C-N 3.32Å; A50-F52 PolarHBondContact O-N 3.28Å; A50-L53 PolarHBondContact O-N 2.83Å; A50-V54 WeakPolarHBondContact O-CB 3.33Å; A50-V54 WeakPolarHBondContact O-CG2 3.38Å; A50-V54 PolarHBondContact O-N 2.77Å |
| 51 | I | 96.3 | Very high | 95.2 | Very high | 8 Ų | 8 | 49.6 Ų | 49.6 | 4% | 0.041 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63 | -40.7 | 177.3 | -59.2 | 161 | 0 | 0 | 0 | 110.4 | L47 Y48 A49 G55 L93 G284 A288 A291 | L47-I51 HydrophobicContact CD1-CD1 3.83Å; L47-I51 HydrophobicContact CD1-CG1 4.25Å; L47-I51 HydrophobicContact CG-CD1 3.87Å; L47-I51 WeakPolarHBondContact O-CD1 3.37Å; L47-I51 VanDerWaalsContact O-CG1 3.22Å; L47-I51 WeakPolarHBondContact O-CG1 3.46Å; L47-I51 PolarHBondContact O-N 3.47Å; Y48-I51 PolarHBondContact O-N 3.41Å; A49-I51 PolarHBondContact O-N 3Å; I51-G55 VanDerWaalsContact O-CA 3.25Å; I51-G55 WeakPolarHBondContact O-CA 3.32Å; I51-G55 PolarHBondContact O-N 3.14Å; I51-L93 HydrophobicContact CB-CD1 3.65Å; I51-L93 HydrophobicContact CG2-CD1 3.35Å; I51-G284 VanDerWaalsContact CD1-O 3.27Å; I51-G284 WeakPolarHBondContact CD1-O 3.48Å; I51-A288 HydrophobicContact CD1-CB 3.72Å; I51-A288 HydrophobicContact CG1-CB 3.97Å; I51-A291 HydrophobicContact CB-CB 4.45Å; I51-A291 HydrophobicContact CG2-CB 3.81Å |
| 52 | F | 97.3 | Very high | 95 | Very high | 68 Ų | 68 | 49.1 Ų | 49.1 | 30% | 0.298 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.6 | -51.8 | 176 | 172.7 | -99.3 | 0 | 0 | 0 | 112.2 | Y48 A49 A50 V54 G55 V56 C90 L93 P94 | Y48-F52 WeakPolarHBondContact O-CB 3.1Å; Y48-F52 PolarHBondContact O-N 3.31Å; A49-F52 PolarHBondContact O-N 3.41Å; A50-F52 VanDerWaalsContact C-N 3.32Å; A50-F52 PolarHBondContact O-N 3.28Å; F52-V54 VanDerWaalsContact C-N 3.29Å; F52-V54 PolarHBondContact O-N 2.84Å; F52-G55 PolarHBondContact O-N 3.46Å; F52-V56 HydrophobicContact CD2-CG2 3.57Å; F52-V56 HydrophobicContact CE2-CG2 3.55Å; F52-V56 HydrophobicContact CG-CG2 4.34Å; F52-V56 HydrophobicContact CZ-CG2 4.3Å; F52-V56 WeakPolarHBondContact O-CB 3.43Å; F52-V56 WeakPolarHBondContact O-CG2 3.1Å; F52-V56 PolarHBondContact O-N 3.48Å; F52-C90 WeakPolarHBondContact CD2-O 3.44Å; F52-L93 HydrophobicContact CB-CB 4.4Å; F52-L93 HydrophobicContact CB-CD1 4.28Å; F52-P94 HydrophobicContact CD2-CG 3.54Å; F52-P94 HydrophobicContact CE2-CG 3.59Å; F52-P94 HydrophobicContact CG-CG 4.07Å; F52-P94 HydrophobicContact CZ-CG 4.17Å |
| 53 | L | 96.3 | Very high | 94.8 | Very high | 119 Ų | 119 | 44.9 Ų | 44.9 | 62% | 0.623 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -66 | -29.5 | -176 | -71.2 | 174 | 0 | 0 | 0 | 113 | A49 A50 P57 | A49-L53 WeakPolarHBondContact O-CB 3.49Å; A49-L53 VanDerWaalsContact O-CG 3.24Å; A49-L53 WeakPolarHBondContact O-CG 3.02Å; A49-L53 PolarHBondContact O-N 3.13Å; A50-L53 PolarHBondContact O-N 2.83Å; L53-P57 WeakPolarHBondContact O-CD 3.24Å; L53-P57 WeakPolarHBondContact O-CG 3.46Å |
| 54 | V | 94.7 | Very high | 94.5 | Very high | 66 Ų | 66 | 48.6 Ų | 48.6 | 40% | 0.4 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -86.8 | -46.8 | 174.1 | 175.8 | 0 | 0 | 0 | 0 | 110.8 | A50 F52 G58 A291 I295 | A50-V54 WeakPolarHBondContact O-CB 3.33Å; A50-V54 WeakPolarHBondContact O-CG2 3.38Å; A50-V54 PolarHBondContact O-N 2.77Å; F52-V54 VanDerWaalsContact C-N 3.29Å; F52-V54 PolarHBondContact O-N 2.84Å; V54-G58 WeakPolarHBondContact O-CA 3.48Å; V54-G58 PolarHBondContact O-N 2.91Å; V54-A291 HydrophobicContact CB-CB 4.27Å; V54-A291 HydrophobicContact CG1-CB 4.15Å; V54-I295 HydrophobicContact CG1-CD1 4.15Å; V54-I295 HydrophobicContact CG1-CG1 4.36Å |
| 55 | G | 95.1 | Very high | 94 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -71.3 | -41.5 | -169.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | I51 F52 N59 | I51-G55 VanDerWaalsContact O-CA 3.25Å; I51-G55 WeakPolarHBondContact O-CA 3.32Å; I51-G55 PolarHBondContact O-N 3.14Å; F52-G55 PolarHBondContact O-N 3.46Å; G55-N59 VanDerWaalsContact O-CB 3.27Å; G55-N59 WeakPolarHBondContact O-CB 3.18Å; G55-N59 PolarHBondContact O-N 2.95Å; G55-N59 PolarHBondContact O-ND2 2.91Å |
| 56 | V | 96.6 | Very high | 93.3 | Very high | 37 Ų | 37 | 48 Ų | 48 | 22% | 0.224 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.1 | -59.1 | 179.1 | 175.3 | 0 | 0 | 0 | 0 | 112 | F52 G58 A60 L87 C90 V91 | F52-V56 HydrophobicContact CD2-CG2 3.57Å; F52-V56 HydrophobicContact CE2-CG2 3.55Å; F52-V56 HydrophobicContact CG-CG2 4.34Å; F52-V56 HydrophobicContact CZ-CG2 4.3Å; F52-V56 WeakPolarHBondContact O-CB 3.43Å; F52-V56 WeakPolarHBondContact O-CG2 3.1Å; F52-V56 PolarHBondContact O-N 3.48Å; V56-G58 VanDerWaalsContact C-N 3.31Å; V56-G58 PolarHBondContact O-N 3.38Å; V56-A60 WeakPolarHBondContact O-CB 3.41Å; V56-A60 PolarHBondContact O-N 2.84Å; V56-L87 HydrophobicContact CG1-CD2 4.42Å; V56-L87 WeakPolarHBondContact O-CD2 3.42Å; V56-C90 HydrophobicContact CG2-CB 3.64Å; V56-V91 HydrophobicContact CG2-CG2 4.25Å |
| 57 | P | 95 | Very high | 92.9 | Very high | 75 Ų | 75 | 48.1 Ų | 48.1 | 49% | 0.487 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -65.6 | -36.7 | -179.6 | 25.2 | -33.1 | 0 | 0 | 0 | 112 | L53 A60 M61 | L53-P57 WeakPolarHBondContact O-CD 3.24Å; L53-P57 WeakPolarHBondContact O-CG 3.46Å; P57-A60 PolarHBondContact O-N 3.12Å; P57-M61 WeakPolarHBondContact O-CB 3.31Å; P57-M61 PolarHBondContact O-N 2.95Å |
| 58 | G | 91.4 | Very high | 92.2 | Very high | 11 Ų | 11 | 50.1 Ų | 50.1 | 11% | 0.113 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.4 | -52.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V54 V56 M61 V62 P294 | V54-G58 WeakPolarHBondContact O-CA 3.48Å; V54-G58 PolarHBondContact O-N 2.91Å; V56-G58 VanDerWaalsContact C-N 3.31Å; V56-G58 PolarHBondContact O-N 3.38Å; G58-M61 PolarHBondContact O-N 3.45Å; G58-V62 WeakPolarHBondContact O-CG2 3.34Å; G58-V62 PolarHBondContact O-N 3.26Å; G58-P294 VanDerWaalsContact C-CG 3.46Å |
| 59 | N | 93.5 | Very high | 91.3 | Very high | 1 Ų | 1 | 51.9 Ų | 51.9 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -73.4 | -30.4 | 179.8 | -70.3 | -66.3 | 0 | 0 | 0 | 112.6 | G55 M61 V62 A63 A83 D86 L87 S290 P294 | G55-N59 VanDerWaalsContact O-CB 3.27Å; G55-N59 WeakPolarHBondContact O-CB 3.18Å; G55-N59 PolarHBondContact O-N 2.95Å; G55-N59 PolarHBondContact O-ND2 2.91Å; N59-M61 VanDerWaalsContact C-N 3.35Å; N59-V62 PolarHBondContact O-N 3.5Å; N59-A63 VanDerWaalsContact O-CB 3.27Å; N59-A63 WeakPolarHBondContact O-CB 2.93Å; N59-A63 PolarHBondContact O-N 3.48Å; N59-A83 HydrophobicContact CB-CB 4.39Å; N59-D86 HydrophobicContact CB-CB 4.42Å; N59-L87 HydrophobicContact CB-CD2 3.89Å; N59-L87 HydrophobicContact CB-CG 3.73Å; N59-S290 PolarHBondContact ND2-O 2.92Å; N59-P294 HydrophobicContact CB-CG 4.37Å; N59-P294 VanDerWaalsContact CG-CG 3.49Å; N59-P294 VanDerWaalsContact OD1-CG 3.31Å; N59-P294 WeakPolarHBondContact OD1-CG 3.43Å |
| 60 | A | 94.1 | Very high | 90.5 | Very high | 46 Ų | 46 | 51.4 Ų | 51.4 | 38% | 0.38 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | V56 P57 A63 W64 L87 | V56-A60 WeakPolarHBondContact O-CB 3.41Å; V56-A60 PolarHBondContact O-N 2.84Å; P57-A60 PolarHBondContact O-N 3.12Å; A60-A63 PolarHBondContact O-N 3.32Å; A60-W64 WeakPolarHBondContact O-CB 3.48Å; A60-W64 PolarHBondContact O-N 2.85Å; A60-L87 HydrophobicContact CB-CD2 4.37Å |
| 61 | M | 90 | Very high | 89.6 | Confident | 68 Ų | 68 | 57.6 Ų | 57.6 | 34% | 0.335 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.9 | -46 | 174.2 | -179.9 | -179.1 | 65.2 | 0 | 0 | 111.6 | P57 G58 N59 A63 W64 V65 L298 | P57-M61 WeakPolarHBondContact O-CB 3.31Å; P57-M61 PolarHBondContact O-N 2.95Å; G58-M61 PolarHBondContact O-N 3.45Å; N59-M61 VanDerWaalsContact C-N 3.35Å; M61-A63 VanDerWaalsContact C-N 3.34Å; M61-A63 PolarHBondContact O-N 3.14Å; M61-W64 PolarHBondContact O-N 3.04Å; M61-V65 WeakPolarHBondContact O-CG2 3.34Å; M61-V65 PolarHBondContact O-N 3.35Å; M61-L298 HydrophobicContact CE-CD1 4.2Å; M61-L298 HydrophobicContact CE-CD2 3.95Å; M61-L298 HydrophobicContact CE-CG 4.31Å |
| 62 | V | 88 | Confident | 88.5 | Confident | 12 Ų | 12 | 64.7 Ų | 64.7 | 7% | 0.073 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.6 | -46.8 | 176.6 | 173.4 | 0 | 0 | 0 | 0 | 110.3 | G58 N59 W64 V65 T66 A83 P294 F297 | G58-V62 WeakPolarHBondContact O-CG2 3.34Å; G58-V62 PolarHBondContact O-N 3.26Å; N59-V62 PolarHBondContact O-N 3.5Å; V62-W64 VanDerWaalsContact C-N 3.34Å; V62-W64 PolarHBondContact O-N 3.41Å; V62-V65 PolarHBondContact O-N 3.26Å; V62-T66 HydrophobicContact CG1-CG2 4.05Å; V62-T66 VanDerWaalsContact O-CB 3.28Å; V62-T66 WeakPolarHBondContact O-CB 2.98Å; V62-T66 VanDerWaalsContact O-CG2 3.22Å; V62-T66 WeakPolarHBondContact O-CG2 3.48Å; V62-T66 PolarHBondContact O-N 3Å; V62-T66 PolarHBondContact O-OG1 2.9Å; V62-A83 HydrophobicContact CB-CB 4.16Å; V62-A83 HydrophobicContact CG1-CB 3.86Å; V62-P294 HydrophobicContact CG2-CB 4.26Å; V62-P294 HydrophobicContact CG2-CG 4.46Å; V62-F297 HydrophobicContact CG1-CD2 4.26Å; V62-F297 HydrophobicContact CG1-CE2 4.4Å; V62-F297 HydrophobicContact CG2-CD2 3.99Å |
| 63 | A | 90.4 | Very high | 87.5 | Confident | 14 Ų | 14 | 67.5 Ų | 67.5 | 12% | 0.116 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -59.7 | -43.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | N59 A60 M61 T66 W67 L80 A83 L87 | N59-A63 VanDerWaalsContact O-CB 3.27Å; N59-A63 WeakPolarHBondContact O-CB 2.93Å; N59-A63 PolarHBondContact O-N 3.48Å; A60-A63 PolarHBondContact O-N 3.32Å; M61-A63 VanDerWaalsContact C-N 3.34Å; M61-A63 PolarHBondContact O-N 3.14Å; A63-T66 PolarHBondContact O-OG1 3.49Å; A63-W67 WeakPolarHBondContact O-CB 3.18Å; A63-W67 PolarHBondContact O-N 2.8Å; A63-L80 HydrophobicContact CB-CD1 4.14Å; A63-L80 WeakPolarHBondContact O-CD1 3.27Å; A63-A83 HydrophobicContact CB-CB 4Å; A63-L87 HydrophobicContact CB-CD1 4.42Å |
| 64 | W | 88.4 | Confident | 86.6 | Confident | 159 Ų | 159 | 64.5 Ų | 64.5 | 60% | 0.602 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -62.5 | -48.2 | 178.6 | 178.3 | -107.4 | 0 | 0 | 0 | 112.9 | A60 M61 V62 K68 | A60-W64 WeakPolarHBondContact O-CB 3.48Å; A60-W64 PolarHBondContact O-N 2.85Å; M61-W64 PolarHBondContact O-N 3.04Å; V62-W64 VanDerWaalsContact C-N 3.34Å; V62-W64 PolarHBondContact O-N 3.41Å; W64-K68 VanDerWaalsContact CZ2-CE 3.44Å; W64-K68 PolarHBondContact O-N 3.34Å |
| 65 | V | 84.6 | Confident | 85.7 | Confident | 24 Ų | 24 | 62.7 Ų | 62.7 | 15% | 0.145 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.8 | -46.3 | -180 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | M61 V62 W67 K68 E69 L305 | M61-V65 WeakPolarHBondContact O-CG2 3.34Å; M61-V65 PolarHBondContact O-N 3.35Å; V62-V65 PolarHBondContact O-N 3.26Å; V65-W67 VanDerWaalsContact C-N 3.34Å; V65-W67 PolarHBondContact O-N 3.02Å; V65-K68 PolarHBondContact O-N 3.44Å; V65-E69 WeakPolarHBondContact O-CB 3.46Å; V65-E69 PolarHBondContact O-N 2.88Å; V65-L305 HydrophobicContact CG1-CD1 3.89Å |
| 66 | T | 83.8 | Confident | 85 | Confident | 15 Ų | 15 | 63.2 Ų | 63.2 | 9% | 0.092 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -71.2 | -29.3 | -178.2 | 56.9 | 0 | 0 | 0 | 0 | 112.4 | V62 A63 E69 S70 F79 L80 | V62-T66 HydrophobicContact CG1-CG2 4.05Å; V62-T66 VanDerWaalsContact O-CB 3.28Å; V62-T66 WeakPolarHBondContact O-CB 2.98Å; V62-T66 VanDerWaalsContact O-CG2 3.22Å; V62-T66 WeakPolarHBondContact O-CG2 3.48Å; V62-T66 PolarHBondContact O-N 3Å; V62-T66 PolarHBondContact O-OG1 2.9Å; A63-T66 PolarHBondContact O-OG1 3.49Å; T66-E69 PolarHBondContact O-N 3.12Å; T66-S70 WeakPolarHBondContact O-CA 3.28Å; T66-S70 WeakPolarHBondContact O-CB 3.22Å; T66-S70 PolarHBondContact O-N 3.28Å; T66-S70 PolarHBondContact O-OG 2.91Å; T66-S70 VanDerWaalsContact O-OG 3.13Å; T66-F79 HydrophobicContact CG2-CB 3.62Å; T66-L80 WeakPolarHBondContact OG1-CA 3.3Å; T66-L80 WeakPolarHBondContact OG1-CB 3.49Å; T66-L80 PolarHBondContact OG1-N 2.98Å |
| 67 | W | 87.3 | Confident | 84.5 | Confident | 135 Ų | 135 | 62.5 Ų | 62.5 | 51% | 0.511 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -57.3 | -51.2 | 169.9 | 176.5 | -104.4 | 0 | 0 | 0 | 111.3 | A63 V65 S70 L80 | A63-W67 WeakPolarHBondContact O-CB 3.18Å; A63-W67 PolarHBondContact O-N 2.8Å; V65-W67 VanDerWaalsContact C-N 3.34Å; V65-W67 PolarHBondContact O-N 3.02Å; W67-S70 PolarHBondContact O-OG 3.42Å; W67-L80 HydrophobicContact CB-CD1 4.18Å; W67-L80 HydrophobicContact CE3-CD1 4.3Å; W67-L80 HydrophobicContact CE3-CD2 3.6Å; W67-L80 HydrophobicContact CZ3-CD2 4.14Å |
| 68 | K | 82.3 | Confident | 84.1 | Confident | 93 Ų | 93 | 59.2 Ų | 59.2 | 40% | 0.404 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -63.2 | -46.4 | 177.4 | -66.6 | -175.7 | 179.4 | -172.6 | 0 | 111.5 | W64 V65 S70 R71 | W64-K68 VanDerWaalsContact CZ2-CE 3.44Å; W64-K68 PolarHBondContact O-N 3.34Å; V65-K68 PolarHBondContact O-N 3.44Å; K68-S70 PolarHBondContact O-N 3.38Å; K68-R71 WeakPolarHBondContact O-CB 3.49Å; K68-R71 PolarHBondContact O-N 2.63Å |
| 69 | E | 77.7 | Confident | 83.8 | Confident | 45 Ų | 45 | 61.6 Ų | 61.6 | 21% | 0.21 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -68.3 | -33.5 | -176.8 | -170.9 | 67 | -163.3 | 0 | 0 | 113 | V65 T66 R71 H72 R73 A76 | V65-E69 WeakPolarHBondContact O-CB 3.46Å; V65-E69 PolarHBondContact O-N 2.88Å; T66-E69 PolarHBondContact O-N 3.12Å; E69-R71 PolarHBondContact O-N 3.5Å; E69-R71 VanDerWaalsContact O-N 3.14Å; E69-H72 PolarHBondContact O-N 3.3Å; E69-R73 HydrophobicContact CG-CB 4.35Å; E69-R73 PolarHBondContact O-N 3.11Å; E69-R73 WeakPolarHBondContact OE1-CD 3.44Å; E69-R73 WeakPolarHBondContact OE1-CG 3.35Å; E69-R73 IonicContact OE1-CZ 3.15Å; E69-R73 IonicContact OE1-NE 3.2Å; E69-R73 PolarHBondContact OE1-NE 3.29Å; E69-R73 IonicContact OE1-NH1 2.72Å; E69-R73 PolarHBondContact OE1-NH1 3.04Å; E69-A76 HydrophobicContact CB-CB 3.8Å; E69-A76 HydrophobicContact CG-CB 3.66Å |
| 70 | S | 80.3 | Confident | 83.6 | Confident | 33 Ų | 33 | 62.6 Ų | 62.6 | 23% | 0.231 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.5 | -18.6 | -178.3 | 67 | 0 | 0 | 0 | 0 | 113.9 | T66 W67 K68 H72 | T66-S70 WeakPolarHBondContact O-CA 3.28Å; T66-S70 WeakPolarHBondContact O-CB 3.22Å; T66-S70 PolarHBondContact O-N 3.28Å; T66-S70 PolarHBondContact O-OG 2.91Å; T66-S70 VanDerWaalsContact O-OG 3.13Å; W67-S70 PolarHBondContact O-OG 3.42Å; K68-S70 PolarHBondContact O-N 3.38Å; S70-H72 PolarHBondContact O-N 3.34Å |
| 71 | R | 79.3 | Confident | 83.6 | Confident | 180 Ų | 180 | 62.9 Ų | 62.9 | 68% | 0.679 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -27.1 | 170.3 | -62.6 | -178.6 | 179.3 | -165.8 | -3.2 | 112.3 | K68 E69 | K68-R71 WeakPolarHBondContact O-CB 3.49Å; K68-R71 PolarHBondContact O-N 2.63Å; E69-R71 PolarHBondContact O-N 3.5Å; E69-R71 VanDerWaalsContact O-N 3.14Å |
| 72 | H | 73 | Confident | 83.6 | Confident | 158 Ų | 158 | 59.9 Ų | 59.9 | 73% | 0.731 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.2 | -33.6 | -175.2 | -58.5 | -71.6 | 0 | 0 | 0 | 113.1 | E69 S70 | E69-H72 PolarHBondContact O-N 3.3Å; S70-H72 PolarHBondContact O-N 3.34Å |
| 73 | R | 74.9 | Confident | 83.8 | Confident | 126 Ų | 126 | 59.4 Ų | 59.4 | 48% | 0.475 | 27% | 0.272 | S | S | . | . | trans | -123.3 | 115 | -178.2 | -61.6 | -165.8 | -178.3 | 137.8 | -7.1 | 111.6 | E69 G75 A76 | E69-R73 HydrophobicContact CG-CB 4.35Å; E69-R73 PolarHBondContact O-N 3.11Å; E69-R73 WeakPolarHBondContact OE1-CD 3.44Å; E69-R73 WeakPolarHBondContact OE1-CG 3.35Å; E69-R73 IonicContact OE1-CZ 3.15Å; E69-R73 IonicContact OE1-NE 3.2Å; E69-R73 PolarHBondContact OE1-NE 3.29Å; E69-R73 IonicContact OE1-NH1 2.72Å; E69-R73 PolarHBondContact OE1-NH1 3.04Å; R73-G75 PolarHBondContact O-N 3.35Å; R73-G75 VanDerWaalsContact O-N 3.14Å; R73-A76 WeakPolarHBondContact O-CB 3.22Å; R73-A76 PolarHBondContact O-N 2.81Å | ||
| 74 | L | 78.4 | Confident | 84 | Confident | 57 Ų | 57 | 61.6 Ų | 61.6 | 30% | 0.298 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -53.9 | -37.3 | 178.9 | -84.5 | 68.7 | 0 | 0 | 0 | 113.2 | A76 S77 K154 | L74-A76 PolarHBondContact O-N 3.48Å; L74-S77 VanDerWaalsContact O-CB 3.24Å; L74-S77 WeakPolarHBondContact O-CB 3.24Å; L74-S77 PolarHBondContact O-N 2.88Å; L74-S77 VanDerWaalsContact O-N 3.11Å; L74-K154 HydrophobicContact CD2-CB 3.73Å; L74-K154 HydrophobicContact CD2-CG 3.96Å; L74-K154 HydrophobicContact CG-CG 4.39Å |
| 75 | G | 75.1 | Confident | 84.4 | Confident | 28 Ų | 28 | 54 Ų | 54 | 29% | 0.289 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.9 | -28.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114 | R73 S77 W78 | R73-G75 PolarHBondContact O-N 3.35Å; R73-G75 VanDerWaalsContact O-N 3.14Å; G75-S77 PolarHBondContact O-N 2.99Å; G75-W78 PolarHBondContact O-N 3.14Å |
| 76 | A | 80.8 | Confident | 84.8 | Confident | 10 Ų | 10 | 52.9 Ų | 52.9 | 8% | 0.083 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -67.6 | -23.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E69 R73 L74 W78 F79 L80 | E69-A76 HydrophobicContact CB-CB 3.8Å; E69-A76 HydrophobicContact CG-CB 3.66Å; R73-A76 WeakPolarHBondContact O-CB 3.22Å; R73-A76 PolarHBondContact O-N 2.81Å; L74-A76 PolarHBondContact O-N 3.48Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.22Å; A76-F79 PolarHBondContact O-N 3.27Å; A76-L80 PolarHBondContact O-N 3.17Å; A76-L80 VanDerWaalsContact O-N 3.12Å |
| 77 | S | 85.8 | Confident | 85.4 | Confident | 23 Ų | 23 | 54.1 Ų | 54.1 | 16% | 0.161 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.5 | -35 | 176.7 | -170.9 | 0 | 0 | 0 | 0 | 112.4 | L74 G75 F79 L80 H81 Q161 | L74-S77 VanDerWaalsContact O-CB 3.24Å; L74-S77 WeakPolarHBondContact O-CB 3.24Å; L74-S77 PolarHBondContact O-N 2.88Å; L74-S77 VanDerWaalsContact O-N 3.11Å; G75-S77 PolarHBondContact O-N 2.99Å; S77-F79 VanDerWaalsContact C-N 3.35Å; S77-F79 PolarHBondContact O-N 3.42Å; S77-L80 WeakPolarHBondContact O-CB 3.43Å; S77-L80 PolarHBondContact O-N 3.11Å; S77-H81 PolarHBondContact O-CD2 3.47Å; S77-H81 PolarHBondContact O-N 3.41Å; S77-H81 VanDerWaalsContact O-N 3.1Å; S77-Q161 PolarHBondContact O-NE2 3.49Å; S77-Q161 PolarHBondContact OG-NE2 2.86Å; S77-Q161 PolarHBondContact OG-OE1 3.44Å |
| 78 | W | 86.3 | Confident | 85.7 | Confident | 5 Ų | 5 | 50.9 Ų | 50.9 | 2% | 0.019 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.8 | -44.7 | 176.5 | -71.7 | 119 | 0 | 0 | 0 | 112.2 | G75 A76 L80 H81 L82 L130 A133 L134 D137 V157 Q161 | G75-W78 PolarHBondContact O-N 3.14Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.22Å; W78-L80 VanDerWaalsContact C-N 3.33Å; W78-H81 PolarHBondContact O-N 2.98Å; W78-L82 WeakPolarHBondContact O-CB 3.43Å; W78-L82 PolarHBondContact O-N 2.92Å; W78-L130 HydrophobicContact CE3-CD2 4.32Å; W78-L130 HydrophobicContact CZ3-CD2 4.12Å; W78-A133 HydrophobicContact CH2-CB 3.53Å; W78-A133 HydrophobicContact CZ2-CB 4.46Å; W78-A133 HydrophobicContact CZ3-CB 3.67Å; W78-L134 HydrophobicContact CB-CD1 3.95Å; W78-L134 HydrophobicContact CD2-CB 4.32Å; W78-L134 HydrophobicContact CD2-CD1 4.46Å; W78-L134 HydrophobicContact CG-CB 4.37Å; W78-L134 HydrophobicContact CG-CD1 3.78Å; W78-D137 HydrophobicContact CZ2-CB 4.37Å; W78-D137 PolarHBondContact NE1-OD2 2.99Å; W78-V157 HydrophobicContact CZ2-CB 4.22Å; W78-V157 HydrophobicContact CZ2-CG1 3.8Å; W78-V157 HydrophobicContact CZ2-CG2 4.1Å; W78-Q161 HydrophobicContact CE3-CG 3.89Å; W78-Q161 HydrophobicContact CH2-CG 3.88Å; W78-Q161 HydrophobicContact CZ3-CG 3.51Å |
| 79 | F | 85.9 | Confident | 86.3 | Confident | 62 Ų | 62 | 46.5 Ų | 46.5 | 27% | 0.272 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -69.3 | -32.3 | 179.1 | -59.7 | -55.3 | 0 | 0 | 0 | 112.5 | T66 A76 S77 L82 A83 L134 F297 | T66-F79 HydrophobicContact CG2-CB 3.62Å; A76-F79 PolarHBondContact O-N 3.27Å; S77-F79 VanDerWaalsContact C-N 3.35Å; S77-F79 PolarHBondContact O-N 3.42Å; F79-L82 PolarHBondContact O-N 3.19Å; F79-A83 VanDerWaalsContact O-CB 3.25Å; F79-A83 WeakPolarHBondContact O-CB 3.25Å; F79-A83 PolarHBondContact O-N 3.41Å; F79-L134 HydrophobicContact CE1-CD2 4.07Å; F79-F297 AromaticContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE2 4.32Å; F79-F297 AromaticContact CD1-CZ 3.19Å; F79-F297 HydrophobicContact CD1-CZ 3.19Å; F79-F297 AromaticContact CE1-CE1 3.31Å; F79-F297 HydrophobicContact CE1-CE1 3.31Å; F79-F297 AromaticContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CG-CE1 4Å; F79-F297 HydrophobicContact CG-CZ 4.05Å; F79-F297 AromaticContact CZ-CE1 3.97Å; F79-F297 HydrophobicContact CZ-CE1 3.97Å |
| 80 | L | 89.4 | Confident | 87.1 | Confident | 21 Ų | 21 | 44.4 Ų | 44.4 | 11% | 0.11 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.3 | -52.6 | 172 | 174.6 | 66.6 | 0 | 0 | 0 | 111.3 | A63 T66 W67 A76 S77 W78 L82 A83 V84 | A63-L80 HydrophobicContact CB-CD1 4.14Å; A63-L80 WeakPolarHBondContact O-CD1 3.27Å; T66-L80 WeakPolarHBondContact OG1-CA 3.3Å; T66-L80 WeakPolarHBondContact OG1-CB 3.49Å; T66-L80 PolarHBondContact OG1-N 2.98Å; W67-L80 HydrophobicContact CB-CD1 4.18Å; W67-L80 HydrophobicContact CE3-CD1 4.3Å; W67-L80 HydrophobicContact CE3-CD2 3.6Å; W67-L80 HydrophobicContact CZ3-CD2 4.14Å; A76-L80 PolarHBondContact O-N 3.17Å; A76-L80 VanDerWaalsContact O-N 3.12Å; S77-L80 WeakPolarHBondContact O-CB 3.43Å; S77-L80 PolarHBondContact O-N 3.11Å; W78-L80 VanDerWaalsContact C-N 3.33Å; L80-L82 VanDerWaalsContact C-N 3.3Å; L80-L82 PolarHBondContact O-N 3.33Å; L80-A83 PolarHBondContact O-N 2.77Å; L80-V84 WeakPolarHBondContact O-CG2 3.33Å; L80-V84 PolarHBondContact O-N 2.97Å |
| 81 | H | 92.9 | Very high | 87.9 | Confident | 52 Ų | 52 | 46.3 Ų | 46.3 | 24% | 0.241 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64 | -36.1 | 179.4 | -79.8 | -88.4 | 0 | 0 | 0 | 112.3 | S77 W78 V84 A85 L130 Q161 W165 | S77-H81 PolarHBondContact O-CD2 3.47Å; S77-H81 PolarHBondContact O-N 3.41Å; S77-H81 VanDerWaalsContact O-N 3.1Å; W78-H81 PolarHBondContact O-N 2.98Å; H81-V84 PolarHBondContact O-N 2.95Å; H81-A85 PolarHBondContact O-N 3.01Å; H81-L130 HydrophobicContact CB-CD1 3.93Å; H81-L130 HydrophobicContact CB-CD2 3.96Å; H81-Q161 PolarHBondContact CD2-NE2 2.83Å; H81-W165 AromaticContact CG-NE1 3.89Å; H81-W165 AromaticContact ND1-CD1 3.72Å; H81-W165 AromaticContact ND1-NE1 3.07Å; H81-W165 PolarHBondContact ND1-NE1 3.33Å |
| 82 | L | 91.1 | Very high | 88.6 | Confident | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.026 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.4 | -44.8 | 174.9 | -171.8 | 64 | 0 | 0 | 0 | 111.4 | W78 F79 L80 V84 A85 D86 L131 | W78-L82 WeakPolarHBondContact O-CB 3.43Å; W78-L82 PolarHBondContact O-N 2.92Å; F79-L82 PolarHBondContact O-N 3.19Å; L80-L82 VanDerWaalsContact C-N 3.3Å; L80-L82 PolarHBondContact O-N 3.33Å; L82-V84 VanDerWaalsContact C-N 3.3Å; L82-V84 PolarHBondContact O-N 3.23Å; L82-A85 WeakPolarHBondContact O-CB 3.38Å; L82-A85 PolarHBondContact O-N 2.84Å; L82-A85 VanDerWaalsContact O-N 3.15Å; L82-D86 PolarHBondContact O-N 3.27Å; L82-L131 HydrophobicContact CD1-CG 4.19Å; L82-L131 HydrophobicContact CD2-CD2 3.98Å |
| 83 | A | 92.4 | Very high | 89.7 | Confident | 2 Ų | 2 | 30.6 Ų | 30.6 | 2% | 0.017 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -63 | -36.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | N59 V62 A63 F79 L80 D86 L87 | N59-A83 HydrophobicContact CB-CB 4.39Å; V62-A83 HydrophobicContact CB-CB 4.16Å; V62-A83 HydrophobicContact CG1-CB 3.86Å; A63-A83 HydrophobicContact CB-CB 4Å; F79-A83 VanDerWaalsContact O-CB 3.25Å; F79-A83 WeakPolarHBondContact O-CB 3.25Å; F79-A83 PolarHBondContact O-N 3.41Å; L80-A83 PolarHBondContact O-N 2.77Å; A83-D86 PolarHBondContact O-N 3.18Å; A83-L87 WeakPolarHBondContact O-CB 3.42Å; A83-L87 VanDerWaalsContact O-CG 3.24Å; A83-L87 WeakPolarHBondContact O-CG 3.41Å; A83-L87 PolarHBondContact O-N 3.25Å |
| 84 | V | 95.2 | Very high | 90.7 | Very high | 60 Ų | 60 | 27 Ų | 27 | 36% | 0.364 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -64.2 | -44 | 173 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | L80 H81 L82 L87 L88 W165 | L80-V84 WeakPolarHBondContact O-CG2 3.33Å; L80-V84 PolarHBondContact O-N 2.97Å; H81-V84 PolarHBondContact O-N 2.95Å; L82-V84 VanDerWaalsContact C-N 3.3Å; L82-V84 PolarHBondContact O-N 3.23Å; V84-L87 PolarHBondContact O-N 3.1Å; V84-L88 WeakPolarHBondContact O-CG 3.47Å; V84-L88 PolarHBondContact O-N 2.91Å; V84-W165 HydrophobicContact CG1-CH2 4.31Å; V84-W165 HydrophobicContact CG1-CZ2 4.24Å |
| 85 | A | 94.9 | Very high | 91.6 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.7 | -50 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | H81 L82 L87 L88 C89 C123 A126 L130 W165 | H81-A85 PolarHBondContact O-N 3.01Å; L82-A85 WeakPolarHBondContact O-CB 3.38Å; L82-A85 PolarHBondContact O-N 2.84Å; L82-A85 VanDerWaalsContact O-N 3.15Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.23Å; A85-L88 WeakPolarHBondContact O-CB 3.35Å; A85-L88 PolarHBondContact O-N 3.28Å; A85-L88 VanDerWaalsContact O-N 3.13Å; A85-C89 PolarHBondContact O-N 3.36Å; A85-C89 PolarHBondContact O-SG 3.48Å; A85-C123 PolarHBondContact O-SG 3.47Å; A85-C123 VanDerWaalsContact O-SG 3.37Å; A85-A126 HydrophobicContact CB-CB 4.02Å; A85-L130 HydrophobicContact CB-CD1 4.34Å; A85-W165 HydrophobicContact CB-CH2 4.11Å; A85-W165 HydrophobicContact CB-CZ2 4.24Å |
| 86 | D | 94.6 | Very high | 92.5 | Very high | 1 Ų | 1 | 29.2 Ų | 29.2 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.8 | -37.2 | 179.5 | -74.8 | -34 | 0 | 0 | 0 | 112.8 | N59 L82 A83 L88 C89 C90 S290 N293 | N59-D86 HydrophobicContact CB-CB 4.42Å; L82-D86 PolarHBondContact O-N 3.27Å; A83-D86 PolarHBondContact O-N 3.18Å; D86-L88 PolarHBondContact O-N 3.25Å; D86-C89 WeakPolarHBondContact O-CB 3.45Å; D86-C89 PolarHBondContact O-N 2.98Å; D86-C89 VanDerWaalsContact O-N 3.09Å; D86-C90 PolarHBondContact O-N 2.79Å; D86-C90 PolarHBondContact O-SG 3.39Å; D86-S290 WeakPolarHBondContact OD1-CA 3.34Å; D86-S290 WeakPolarHBondContact OD1-CB 3.37Å; D86-S290 PolarHBondContact OD1-OG 3.26Å; D86-N293 PolarHBondContact OD2-ND2 2.95Å |
| 87 | L | 95.5 | Very high | 93.3 | Very high | 40 Ų | 40 | 29.5 Ų | 29.5 | 21% | 0.209 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.2 | -43 | 173.5 | -82.7 | 172.2 | 0 | 0 | 0 | 112.4 | V56 N59 A60 A63 A83 V84 A85 C89 C90 V91 | V56-L87 HydrophobicContact CG1-CD2 4.42Å; V56-L87 WeakPolarHBondContact O-CD2 3.42Å; N59-L87 HydrophobicContact CB-CD2 3.89Å; N59-L87 HydrophobicContact CB-CG 3.73Å; A60-L87 HydrophobicContact CB-CD2 4.37Å; A63-L87 HydrophobicContact CB-CD1 4.42Å; A83-L87 WeakPolarHBondContact O-CB 3.42Å; A83-L87 VanDerWaalsContact O-CG 3.24Å; A83-L87 WeakPolarHBondContact O-CG 3.41Å; A83-L87 PolarHBondContact O-N 3.25Å; V84-L87 PolarHBondContact O-N 3.1Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.23Å; L87-C89 PolarHBondContact O-N 3.5Å; L87-C90 PolarHBondContact O-N 3.09Å; L87-V91 WeakPolarHBondContact O-CB 3.28Å; L87-V91 VanDerWaalsContact O-CG2 3.28Å; L87-V91 WeakPolarHBondContact O-CG2 3.38Å; L87-V91 PolarHBondContact O-N 2.86Å |
| 88 | L | 94.1 | Very high | 93.8 | Very high | 67 Ų | 67 | 30.7 Ų | 30.7 | 35% | 0.351 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -57.9 | -35.7 | 175.3 | -68.6 | 170.1 | 0 | 0 | 0 | 110.9 | V84 A85 D86 S92 V119 C123 W165 | V84-L88 WeakPolarHBondContact O-CG 3.47Å; V84-L88 PolarHBondContact O-N 2.91Å; A85-L88 WeakPolarHBondContact O-CB 3.35Å; A85-L88 PolarHBondContact O-N 3.28Å; A85-L88 VanDerWaalsContact O-N 3.13Å; D86-L88 PolarHBondContact O-N 3.25Å; L88-S92 PolarHBondContact O-N 2.97Å; L88-S92 PolarHBondContact O-OG 3.26Å; L88-V119 HydrophobicContact CB-CG1 4.41Å; L88-C123 VanDerWaalsContact C-SG 3.56Å; L88-W165 HydrophobicContact CD1-CH2 3.97Å; L88-W165 HydrophobicContact CD1-CZ3 4.17Å |
| 89 | C | 93.7 | Very high | 94.1 | Very high | 2 Ų | 2 | 31.2 Ų | 31.2 | 1% | 0.014 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -75.4 | -46.8 | -177.5 | -42.3 | 0 | 0 | 0 | 0 | 110.3 | A85 D86 L87 V91 S92 L93 C123 L287 | A85-C89 PolarHBondContact O-N 3.36Å; A85-C89 PolarHBondContact O-SG 3.48Å; D86-C89 WeakPolarHBondContact O-CB 3.45Å; D86-C89 PolarHBondContact O-N 2.98Å; D86-C89 VanDerWaalsContact O-N 3.09Å; L87-C89 PolarHBondContact O-N 3.5Å; C89-V91 PolarHBondContact O-N 2.95Å; C89-S92 WeakPolarHBondContact O-CB 3.25Å; C89-S92 PolarHBondContact O-N 2.88Å; C89-L93 PolarHBondContact O-N 3.2Å; C89-C123 WeakPolarHBondContact CA-SG 3.41Å; C89-C123 HydrophobicContact CB-CB 4.01Å; C89-C123 WeakPolarHBondContact CB-SG 3.27Å; C89-C123 PolarHBondContact N-SG 3.47Å; C89-C123 WeakPolarHBondContact SG-CB 3.47Å; C89-C123 CovalentContact SG-SG 2.04Å; C89-C123 PolarHBondContact SG-SG 2.89Å; C89-L287 HydrophobicContact CB-CD2 4.1Å |
| 90 | C | 96.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.1 | -44.4 | 179.4 | -65.4 | 0 | 0 | 0 | 0 | 111.5 | F52 V56 D86 L87 S92 L93 | F52-C90 WeakPolarHBondContact CD2-O 3.44Å; V56-C90 HydrophobicContact CG2-CB 3.64Å; D86-C90 PolarHBondContact O-N 2.79Å; D86-C90 PolarHBondContact O-SG 3.39Å; L87-C90 PolarHBondContact O-N 3.09Å; C90-S92 PolarHBondContact O-N 2.84Å; C90-L93 WeakPolarHBondContact O-CB 3.45Å; C90-L93 PolarHBondContact O-N 3.15Å; C90-L93 VanDerWaalsContact O-N 3.1Å |
| 91 | V | 95.9 | Very high | 94.7 | Very high | 73 Ų | 73 | 30.8 Ų | 30.8 | 44% | 0.442 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -64.9 | -23.2 | 178 | 172.5 | 0 | 0 | 0 | 0 | 112.4 | V56 L87 C89 P94 F95 | V56-V91 HydrophobicContact CG2-CG2 4.25Å; L87-V91 WeakPolarHBondContact O-CB 3.28Å; L87-V91 VanDerWaalsContact O-CG2 3.28Å; L87-V91 WeakPolarHBondContact O-CG2 3.38Å; L87-V91 PolarHBondContact O-N 2.86Å; C89-V91 PolarHBondContact O-N 2.95Å; V91-P94 WeakPolarHBondContact O-CD 3.34Å; V91-F95 WeakPolarHBondContact O-CD2 3.32Å; V91-F95 WeakPolarHBondContact O-CE2 3.46Å |
| 92 | S | 95.2 | Very high | 94.7 | Very high | 7 Ų | 7 | 32.5 Ų | 32.5 | 5% | 0.049 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -75.3 | -23.1 | 175.5 | -60.8 | 0 | 0 | 0 | 0 | 113.4 | L88 C89 C90 F95 L96 V119 | L88-S92 PolarHBondContact O-N 2.97Å; L88-S92 PolarHBondContact O-OG 3.26Å; C89-S92 WeakPolarHBondContact O-CB 3.25Å; C89-S92 PolarHBondContact O-N 2.88Å; C90-S92 PolarHBondContact O-N 2.84Å; S92-F95 WeakPolarHBondContact O-CB 3.24Å; S92-F95 PolarHBondContact O-N 3.27Å; S92-L96 WeakPolarHBondContact O-CG 3.32Å; S92-L96 PolarHBondContact O-N 3.46Å; S92-L96 VanDerWaalsContact O-N 3.07Å; S92-V119 WeakPolarHBondContact OG-CG1 3.45Å |
| 93 | L | 95.9 | Very high | 94.5 | Very high | 1 Ų | 1 | 38.3 Ų | 38.3 | 1% | 0.005 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.7 | -44.5 | -173.4 | -73.8 | 162.3 | 0 | 0 | 0 | 114.9 | Y48 I51 F52 C89 C90 F95 L96 A97 L287 | Y48-L93 HydrophobicContact CD2-CB 4.5Å; Y48-L93 HydrophobicContact CD2-CD2 3.63Å; Y48-L93 HydrophobicContact CE2-CD2 4.03Å; Y48-L93 HydrophobicContact CG-CD2 3.96Å; I51-L93 HydrophobicContact CB-CD1 3.65Å; I51-L93 HydrophobicContact CG2-CD1 3.35Å; F52-L93 HydrophobicContact CB-CB 4.4Å; F52-L93 HydrophobicContact CB-CD1 4.28Å; C89-L93 PolarHBondContact O-N 3.2Å; C90-L93 WeakPolarHBondContact O-CB 3.45Å; C90-L93 PolarHBondContact O-N 3.15Å; C90-L93 VanDerWaalsContact O-N 3.1Å; L93-F95 PolarHBondContact O-N 2.87Å; L93-L96 CarbonylContact O-C 3.58Å; L93-L96 PolarHBondContact O-N 3.13Å; L93-L96 VanDerWaalsContact O-N 3.1Å; L93-A97 WeakPolarHBondContact O-CB 3.41Å; L93-A97 PolarHBondContact O-N 3.01Å; L93-L287 HydrophobicContact CD2-CB 4.1Å; L93-L287 HydrophobicContact CD2-CD1 3.54Å; L93-L287 HydrophobicContact CD2-CG 4.45Å; L93-L287 HydrophobicContact CG-CD1 4.43Å |
| 94 | P | 95.9 | Very high | 94.3 | Very high | 51 Ų | 51 | 39.6 Ų | 39.6 | 33% | 0.331 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -58.6 | -38.3 | 177.3 | -24.5 | 35.2 | 0 | 0 | 0 | 112.2 | F52 V91 A97 V98 | F52-P94 HydrophobicContact CD2-CG 3.54Å; F52-P94 HydrophobicContact CE2-CG 3.59Å; F52-P94 HydrophobicContact CG-CG 4.07Å; F52-P94 HydrophobicContact CZ-CG 4.17Å; V91-P94 WeakPolarHBondContact O-CD 3.34Å; P94-A97 PolarHBondContact O-N 3.43Å; P94-V98 PolarHBondContact O-N 2.94Å |
| 95 | F | 96.4 | Very high | 94.2 | Very high | 101 Ų | 101 | 39.8 Ų | 39.8 | 44% | 0.443 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -69.4 | -35.2 | 177.2 | -58.5 | -84.3 | 0 | 0 | 0 | 112 | V91 S92 L93 A97 P99 Y108 L116 | V91-F95 WeakPolarHBondContact O-CD2 3.32Å; V91-F95 WeakPolarHBondContact O-CE2 3.46Å; S92-F95 WeakPolarHBondContact O-CB 3.24Å; S92-F95 PolarHBondContact O-N 3.27Å; L93-F95 PolarHBondContact O-N 2.87Å; F95-A97 VanDerWaalsContact C-N 3.32Å; F95-P99 WeakPolarHBondContact O-CD 3.4Å; F95-Y108 HydrophobicContact CB-CE2 4.42Å; F95-Y108 HydrophobicContact CD1-CE1 4.1Å; F95-Y108 WeakPolarHBondContact O-CE2 3.33Å; F95-Y108 PolarHBondContact O-OH 3.41Å; F95-L116 HydrophobicContact CB-CD1 3.95Å; F95-L116 HydrophobicContact CB-CD2 3.52Å; F95-L116 HydrophobicContact CB-CG 4.43Å |
| 96 | L | 95.3 | Very high | 94.2 | Very high | 31 Ų | 31 | 40.6 Ų | 40.6 | 16% | 0.162 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -73.5 | -25.2 | 174 | -63 | 169 | 0 | 0 | 0 | 112.7 | Y48 S92 L93 P99 L116 T120 L287 | Y48-L96 HydrophobicContact CD2-CB 4.21Å; Y48-L96 HydrophobicContact CE2-CB 3.73Å; S92-L96 WeakPolarHBondContact O-CG 3.32Å; S92-L96 PolarHBondContact O-N 3.46Å; S92-L96 VanDerWaalsContact O-N 3.07Å; L93-L96 CarbonylContact O-C 3.58Å; L93-L96 PolarHBondContact O-N 3.13Å; L93-L96 VanDerWaalsContact O-N 3.1Å; L96-P99 WeakPolarHBondContact O-CD 3.15Å; L96-L116 HydrophobicContact CD2-CD2 3.53Å; L96-L116 HydrophobicContact CD2-CG 3.79Å; L96-L116 HydrophobicContact CG-CD2 3.91Å; L96-L116 HydrophobicContact CG-CG 4.23Å; L96-T120 HydrophobicContact CD1-CG2 3.67Å; L96-T120 HydrophobicContact CD2-CG2 4.24Å; L96-T120 HydrophobicContact CG-CG2 4.43Å; L96-L287 HydrophobicContact CD1-CD1 3.71Å |
| 97 | A | 96.4 | Very high | 94.3 | Very high | 16 Ų | 16 | 43.2 Ų | 43.2 | 13% | 0.132 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -73.4 | -30.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L45 Y48 L93 P94 F95 I100 A101 | L45-A97 HydrophobicContact CD2-CB 3.87Å; L45-A97 WeakPolarHBondContact CD2-O 3.31Å; Y48-A97 HydrophobicContact CD2-CB 4.23Å; L93-A97 WeakPolarHBondContact O-CB 3.41Å; L93-A97 PolarHBondContact O-N 3.01Å; P94-A97 PolarHBondContact O-N 3.43Å; F95-A97 VanDerWaalsContact C-N 3.32Å; A97-I100 WeakPolarHBondContact O-CB 3.37Å; A97-I100 PolarHBondContact O-N 3.5Å; A97-A101 PolarHBondContact O-N 3.1Å |
| 98 | V | 96.3 | Very high | 94.3 | Very high | 47 Ų | 47 | 45 Ų | 45 | 29% | 0.285 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.2 | -48.6 | -179 | 171.3 | 0 | 0 | 0 | 0 | 112.7 | P94 I100 A101 Q102 P107 Y108 | P94-V98 PolarHBondContact O-N 2.94Å; V98-I100 PolarHBondContact O-N 3Å; V98-A101 PolarHBondContact O-N 3.45Å; V98-A101 VanDerWaalsContact O-N 3.12Å; V98-Q102 HydrophobicContact CG1-CG 4.28Å; V98-Q102 WeakPolarHBondContact O-CG 3.47Å; V98-Q102 PolarHBondContact O-N 3.32Å; V98-P107 HydrophobicContact CG1-CG 3.74Å; V98-Y108 HydrophobicContact CB-CE2 4.4Å; V98-Y108 WeakPolarHBondContact CB-OH 3.27Å; V98-Y108 VanDerWaalsContact CG2-OH 3.23Å; V98-Y108 WeakPolarHBondContact CG2-OH 3.32Å |
| 99 | P | 93.4 | Very high | 94.3 | Very high | 16 Ų | 16 | 43 Ų | 43 | 10% | 0.104 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.3 | -32.1 | 174.2 | -25.7 | 33.6 | 0 | 0 | 0 | 113.6 | F95 L96 Q102 K103 G104 H105 W106 Y108 | F95-P99 WeakPolarHBondContact O-CD 3.4Å; L96-P99 WeakPolarHBondContact O-CD 3.15Å; P99-Q102 CarbonylContact O-C 3.51Å; P99-Q102 PolarHBondContact O-N 3.39Å; P99-K103 PolarHBondContact O-N 3.13Å; P99-G104 WeakPolarHBondContact O-CA 3.46Å; P99-G104 PolarHBondContact O-N 2.82Å; P99-H105 VanDerWaalsContact CA-O 3.32Å; P99-H105 WeakPolarHBondContact CA-O 3.39Å; P99-W106 HydrophobicContact CB-CE3 4.23Å; P99-W106 HydrophobicContact CG-CD2 4.47Å; P99-W106 HydrophobicContact CG-CE3 3.51Å; P99-W106 HydrophobicContact CG-CZ3 3.73Å; P99-Y108 HydrophobicContact CG-CE2 4.39Å |
| 100 | I | 93.1 | Very high | 94.4 | Very high | 21 Ų | 21 | 45.1 Ų | 45.1 | 11% | 0.108 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.7 | -46.9 | 174.9 | -61.4 | 171.5 | 0 | 0 | 0 | 110 | V41 L44 L45 Y48 A97 V98 Q102 K103 P280 | V41-I100 HydrophobicContact CG1-CG2 4.23Å; L44-I100 HydrophobicContact CB-CG2 3.96Å; L44-I100 HydrophobicContact CD1-CG2 3.91Å; L45-I100 HydrophobicContact CD2-CB 4.27Å; L45-I100 HydrophobicContact CD2-CG2 4.17Å; L45-I100 HydrophobicContact CG-CG2 4.38Å; Y48-I100 HydrophobicContact CD2-CD1 4.22Å; Y48-I100 HydrophobicContact CE1-CD1 4.12Å; Y48-I100 HydrophobicContact CE2-CD1 3.69Å; A97-I100 WeakPolarHBondContact O-CB 3.37Å; A97-I100 PolarHBondContact O-N 3.5Å; V98-I100 PolarHBondContact O-N 3Å; I100-Q102 VanDerWaalsContact C-N 3.27Å; I100-Q102 PolarHBondContact O-N 2.94Å; I100-K103 PolarHBondContact O-N 3.4Å; I100-P280 HydrophobicContact CD1-CB 4.11Å; I100-P280 HydrophobicContact CG1-CB 4.44Å |
| 101 | A | 94.1 | Very high | 94.4 | Very high | 53 Ų | 53 | 48.9 Ų | 48.9 | 44% | 0.438 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.4 | -33 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L45 A97 V98 K103 | L45-A101 HydrophobicContact CD1-CB 4.06Å; L45-A101 HydrophobicContact CD2-CB 4.1Å; A97-A101 PolarHBondContact O-N 3.1Å; V98-A101 PolarHBondContact O-N 3.45Å; V98-A101 VanDerWaalsContact O-N 3.12Å; A101-K103 VanDerWaalsContact C-N 3.28Å; A101-K103 PolarHBondContact O-N 3.3Å |
| 102 | Q | 92.4 | Very high | 94.4 | Very high | 88 Ų | 88 | 46.2 Ų | 46.2 | 41% | 0.411 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.8 | 24.2 | 178.2 | -62 | -173.2 | -12.6 | 0 | 0 | 113.4 | V98 P99 I100 G104 H105 | V98-Q102 HydrophobicContact CG1-CG 4.28Å; V98-Q102 WeakPolarHBondContact O-CG 3.47Å; V98-Q102 PolarHBondContact O-N 3.32Å; P99-Q102 CarbonylContact O-C 3.51Å; P99-Q102 PolarHBondContact O-N 3.39Å; I100-Q102 VanDerWaalsContact C-N 3.27Å; I100-Q102 PolarHBondContact O-N 2.94Å; Q102-G104 PolarHBondContact O-N 3.12Å; Q102-G104 VanDerWaalsContact O-N 3.13Å; Q102-H105 HydrophobicContact CB-CB 3.97Å; Q102-H105 WeakPolarHBondContact O-CB 3.24Å; Q102-H105 PolarHBondContact O-N 3.04Å; Q102-H105 VanDerWaalsContact O-N 3.08Å; Q102-H105 PolarHBondContact OE1-CD2 3.29Å |
| 103 | K | 88.4 | Confident | 94.4 | Very high | 128 Ų | 128 | 45.9 Ų | 45.9 | 56% | 0.557 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.7 | 39.1 | 174.3 | -59.1 | -174.4 | 175.3 | -169 | 0 | 113.3 | D38 P99 I100 A101 R189 | D38-K103 IonicContact OD1-NZ 3.79Å; D38-K103 PolarHBondContact OD1-NZ 3.49Å; P99-K103 PolarHBondContact O-N 3.13Å; I100-K103 PolarHBondContact O-N 3.4Å; A101-K103 VanDerWaalsContact C-N 3.28Å; A101-K103 PolarHBondContact O-N 3.3Å; K103-R189 PolarHBondContact O-NH1 3.35Å |
| 104 | G | 87.6 | Confident | 94.4 | Very high | 29 Ų | 29 | 51 Ų | 51 | 30% | 0.299 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 96 | -4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | P99 Q102 | P99-G104 WeakPolarHBondContact O-CA 3.46Å; P99-G104 PolarHBondContact O-N 2.82Å; Q102-G104 PolarHBondContact O-N 3.12Å; Q102-G104 VanDerWaalsContact O-N 3.13Å |
| 105 | H | 92.4 | Very high | 94.4 | Very high | 63 Ų | 63 | 54.2 Ų | 54.2 | 29% | 0.292 | 31% | 0.308 | S | S | . | . | trans | -70.4 | 133.3 | 176.3 | -175.5 | 87.5 | 0 | 0 | 0 | 111.7 | P99 Q102 P107 R189 L190 | P99-H105 VanDerWaalsContact CA-O 3.32Å; P99-H105 WeakPolarHBondContact CA-O 3.39Å; Q102-H105 HydrophobicContact CB-CB 3.97Å; Q102-H105 WeakPolarHBondContact O-CB 3.24Å; Q102-H105 PolarHBondContact O-N 3.04Å; Q102-H105 VanDerWaalsContact O-N 3.08Å; Q102-H105 PolarHBondContact OE1-CD2 3.29Å; H105-P107 WeakPolarHBondContact O-CD 3.48Å; H105-R189 HydrophobicContact CB-CB 4.38Å; H105-L190 CarbonylContact C-O 3.52Å; H105-L190 WeakPolarHBondContact CA-O 3.29Å; H105-L190 PolarHBondContact ND1-N 3.1Å | ||
| 106 | W | 95.6 | Very high | 94.3 | Very high | 18 Ų | 18 | 50.2 Ų | 50.2 | 7% | 0.068 | 29% | 0.291 | C | S | . | . | trans | -101.8 | 104.8 | 179.6 | -175.6 | -90.2 | 0 | 0 | 0 | 111.9 | P99 Y108 G109 G112 C113 L116 L181 L190 C192 | P99-W106 HydrophobicContact CB-CE3 4.23Å; P99-W106 HydrophobicContact CG-CD2 4.47Å; P99-W106 HydrophobicContact CG-CE3 3.51Å; P99-W106 HydrophobicContact CG-CZ3 3.73Å; W106-Y108 HydrophobicContact CD2-CD2 4.28Å; W106-Y108 AromaticContact CE2-CD2 3.82Å; W106-Y108 HydrophobicContact CH2-CD2 4.12Å; W106-Y108 AromaticContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CG 4.35Å; W106-G109 PolarHBondContact NE1-O 2.88Å; W106-G112 VanDerWaalsContact CZ2-C 3.44Å; W106-G112 WeakPolarHBondContact CZ2-O 3.22Å; W106-C113 VanDerWaalsContact CZ2-CA 3.41Å; W106-C113 HydrophobicContact CZ2-CB 4.21Å; W106-L116 HydrophobicContact CH2-CB 4.01Å; W106-L116 HydrophobicContact CH2-CD2 3.62Å; W106-L116 HydrophobicContact CH2-CG 4.34Å; W106-L116 HydrophobicContact CZ2-CB 4.4Å; W106-L116 HydrophobicContact CZ2-CD2 4.44Å; W106-L116 HydrophobicContact CZ3-CD2 4.35Å; W106-L181 HydrophobicContact CB-CD1 4.12Å; W106-L181 HydrophobicContact CG-CD1 3.95Å; W106-L190 HydrophobicContact CB-CB 4.41Å; W106-L190 WeakPolarHBondContact CB-O 3.5Å; W106-L190 PolarHBondContact N-O 3.2Å; W106-C192 HydrophobicContact CB-CB 4.47Å; W106-C192 HydrophobicContact CD2-CB 3.61Å; W106-C192 HydrophobicContact CE3-CB 3.73Å; W106-C192 HydrophobicContact CG-CB 3.92Å; W106-C192 HydrophobicContact CZ3-CB 4.2Å | ||
| 107 | P | 95.6 | Very high | 94.2 | Very high | 56 Ų | 56 | 49.5 Ų | 49.5 | 36% | 0.364 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.1 | -9.9 | -172.7 | 34.4 | -36.8 | 0 | 0 | 0 | 114.5 | V98 H105 G109 | V98-P107 HydrophobicContact CG1-CG 3.74Å; H105-P107 WeakPolarHBondContact O-CD 3.48Å; P107-G109 VanDerWaalsContact C-N 3.32Å; P107-G109 PolarHBondContact O-N 3.07Å |
| 108 | Y | 95.8 | Very high | 94.2 | Very high | 76 Ų | 76 | 49.6 Ų | 49.6 | 30% | 0.298 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | 8 | -169.7 | -51.1 | -68.7 | 0 | 0 | 0 | 114.6 | F95 V98 P99 W106 G112 | F95-Y108 HydrophobicContact CB-CE2 4.42Å; F95-Y108 HydrophobicContact CD1-CE1 4.1Å; F95-Y108 WeakPolarHBondContact O-CE2 3.33Å; F95-Y108 PolarHBondContact O-OH 3.41Å; V98-Y108 HydrophobicContact CB-CE2 4.4Å; V98-Y108 WeakPolarHBondContact CB-OH 3.27Å; V98-Y108 VanDerWaalsContact CG2-OH 3.23Å; V98-Y108 WeakPolarHBondContact CG2-OH 3.32Å; P99-Y108 HydrophobicContact CG-CE2 4.39Å; W106-Y108 HydrophobicContact CD2-CD2 4.28Å; W106-Y108 AromaticContact CE2-CD2 3.82Å; W106-Y108 HydrophobicContact CH2-CD2 4.12Å; W106-Y108 AromaticContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CG 4.35Å; Y108-G112 PolarHBondContact O-N 3.35Å |
| 109 | G | 95.7 | Very high | 94.1 | Very high | 26 Ų | 26 | 48.9 Ų | 48.9 | 27% | 0.268 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | 60.3 | -168.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | W106 P107 G112 C113 | W106-G109 PolarHBondContact NE1-O 2.88Å; P107-G109 VanDerWaalsContact C-N 3.32Å; P107-G109 PolarHBondContact O-N 3.07Å; G109-G112 PolarHBondContact O-N 3.35Å; G109-C113 WeakPolarHBondContact O-CB 3.43Å; G109-C113 PolarHBondContact O-N 3.05Å |
| 110 | A | 95.6 | Very high | 94.1 | Very high | 46 Ų | 46 | 49.6 Ų | 49.6 | 38% | 0.38 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -69.4 | -35.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | C113 R114 L181 | A110-C113 PolarHBondContact O-N 3.34Å; A110-R114 PolarHBondContact O-N 3.45Å; A110-L181 HydrophobicContact CB-CB 4.22Å; A110-L181 HydrophobicContact CB-CD2 4.49Å |
| 111 | A | 95.4 | Very high | 94.1 | Very high | 80 Ų | 80 | 49.4 Ų | 49.4 | 66% | 0.661 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -65.2 | -46.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | C113 R114 L115 | A111-C113 VanDerWaalsContact C-N 3.31Å; A111-C113 PolarHBondContact O-N 3.24Å; A111-R114 PolarHBondContact O-N 3.24Å; A111-L115 WeakPolarHBondContact O-CB 3.27Å; A111-L115 PolarHBondContact O-N 3.23Å |
| 112 | G | 95.2 | Very high | 94.2 | Very high | 16 Ų | 16 | 48 Ų | 48 | 17% | 0.165 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.4 | -41.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | W106 Y108 G109 R114 L115 L116 | W106-G112 VanDerWaalsContact CZ2-C 3.44Å; W106-G112 WeakPolarHBondContact CZ2-O 3.22Å; Y108-G112 PolarHBondContact O-N 3.35Å; G109-G112 PolarHBondContact O-N 3.35Å; G112-R114 VanDerWaalsContact C-N 3.33Å; G112-R114 PolarHBondContact O-N 2.89Å; G112-L115 PolarHBondContact O-N 3.24Å; G112-L116 WeakPolarHBondContact O-CB 3.5Å; G112-L116 PolarHBondContact O-N 3.44Å |
| 113 | C | 95.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.9 | -44.3 | 179.2 | 173 | 0 | 0 | 0 | 0 | 112 | W106 G109 A110 A111 S117 R180 C192 | W106-C113 VanDerWaalsContact CZ2-CA 3.41Å; W106-C113 HydrophobicContact CZ2-CB 4.21Å; G109-C113 WeakPolarHBondContact O-CB 3.43Å; G109-C113 PolarHBondContact O-N 3.05Å; A110-C113 PolarHBondContact O-N 3.34Å; A111-C113 VanDerWaalsContact C-N 3.31Å; A111-C113 PolarHBondContact O-N 3.24Å; C113-S117 WeakPolarHBondContact O-CB 3.33Å; C113-S117 PolarHBondContact O-N 3.42Å; C113-S117 PolarHBondContact O-OG 3.45Å; C113-R180 PolarHBondContact SG-O 3.26Å; C113-C192 WeakPolarHBondContact CA-SG 3.22Å; C113-C192 HydrophobicContact CB-CB 3.73Å; C113-C192 WeakPolarHBondContact CB-SG 3.29Å; C113-C192 PolarHBondContact O-SG 2.86Å; C113-C192 VanDerWaalsContact SG-CA 3.54Å; C113-C192 WeakPolarHBondContact SG-CB 3.25Å; C113-C192 CovalentContact SG-SG 2.03Å; C113-C192 PolarHBondContact SG-SG 3Å |
| 114 | R | 96.1 | Very high | 94.5 | Very high | 109 Ų | 109 | 38 Ų | 38 | 41% | 0.411 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -70.7 | -49.3 | 175.8 | -63.5 | 178.1 | -166.6 | 175.3 | 5.7 | 111.3 | A110 A111 G112 S118 | A110-R114 PolarHBondContact O-N 3.45Å; A111-R114 PolarHBondContact O-N 3.24Å; G112-R114 VanDerWaalsContact C-N 3.33Å; G112-R114 PolarHBondContact O-N 2.89Å; R114-S118 VanDerWaalsContact O-CB 3.26Å; R114-S118 WeakPolarHBondContact O-CB 3.17Å; R114-S118 PolarHBondContact O-N 3.39Å; R114-S118 PolarHBondContact O-OG 3.23Å |
| 115 | L | 95 | Very high | 94.9 | Very high | 119 Ų | 119 | 37 Ų | 37 | 62% | 0.623 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -62.3 | -51.8 | -174.2 | 179.8 | 61.7 | 0 | 0 | 0 | 112.1 | A111 G112 S117 S118 V119 | A111-L115 WeakPolarHBondContact O-CB 3.27Å; A111-L115 PolarHBondContact O-N 3.23Å; G112-L115 PolarHBondContact O-N 3.24Å; L115-S117 PolarHBondContact O-N 2.9Å; L115-S118 WeakPolarHBondContact O-CB 3.45Å; L115-S118 PolarHBondContact O-N 3.27Å; L115-V119 HydrophobicContact CD1-CG2 4.19Å; L115-V119 WeakPolarHBondContact O-CG2 3.3Å; L115-V119 PolarHBondContact O-N 3.21Å |
| 116 | L | 94.8 | Very high | 95 | Very high | 17 Ų | 17 | 34 Ų | 34 | 9% | 0.089 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -67.9 | -39.2 | -175.3 | -166.9 | 61.1 | 0 | 0 | 0 | 111.4 | F95 L96 W106 G112 S118 V119 T120 | F95-L116 HydrophobicContact CB-CD1 3.95Å; F95-L116 HydrophobicContact CB-CD2 3.52Å; F95-L116 HydrophobicContact CB-CG 4.43Å; L96-L116 HydrophobicContact CD2-CD2 3.53Å; L96-L116 HydrophobicContact CD2-CG 3.79Å; L96-L116 HydrophobicContact CG-CD2 3.91Å; L96-L116 HydrophobicContact CG-CG 4.23Å; W106-L116 HydrophobicContact CH2-CB 4.01Å; W106-L116 HydrophobicContact CH2-CD2 3.62Å; W106-L116 HydrophobicContact CH2-CG 4.34Å; W106-L116 HydrophobicContact CZ2-CB 4.4Å; W106-L116 HydrophobicContact CZ2-CD2 4.44Å; W106-L116 HydrophobicContact CZ3-CD2 4.35Å; G112-L116 WeakPolarHBondContact O-CB 3.5Å; G112-L116 PolarHBondContact O-N 3.44Å; L116-S118 VanDerWaalsContact C-N 3.33Å; L116-S118 PolarHBondContact O-N 3.12Å; L116-V119 PolarHBondContact O-N 3.21Å; L116-T120 WeakPolarHBondContact O-CG2 3.36Å; L116-T120 PolarHBondContact O-N 2.91Å; L116-T120 PolarHBondContact O-OG1 2.94Å |
| 117 | S | 94.3 | Very high | 94.9 | Very high | 15 Ų | 15 | 33.1 Ų | 33.1 | 11% | 0.105 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.3 | -34.3 | 174.2 | -52.9 | 0 | 0 | 0 | 0 | 112.5 | C113 L115 T120 T121 S175 H179 | C113-S117 WeakPolarHBondContact O-CB 3.33Å; C113-S117 PolarHBondContact O-N 3.42Å; C113-S117 PolarHBondContact O-OG 3.45Å; L115-S117 PolarHBondContact O-N 2.9Å; S117-T120 PolarHBondContact O-OG1 3.3Å; S117-T121 WeakPolarHBondContact O-CB 3.46Å; S117-T121 PolarHBondContact O-N 3.48Å; S117-T121 PolarHBondContact O-OG1 3.46Å; S117-S175 PolarHBondContact O-OG 3.39Å; S117-H179 PolarHBondContact OG-CD2 2.87Å; S117-H179 VanDerWaalsContact OG-CD2 3.3Å |
| 118 | S | 95.6 | Very high | 94.9 | Very high | 19 Ų | 19 | 30.5 Ų | 30.5 | 13% | 0.133 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -68.9 | -44.1 | 172.1 | -69.7 | 0 | 0 | 0 | 0 | 111.9 | R114 L115 L116 T120 T121 L122 T172 A176 | R114-S118 VanDerWaalsContact O-CB 3.26Å; R114-S118 WeakPolarHBondContact O-CB 3.17Å; R114-S118 PolarHBondContact O-N 3.39Å; R114-S118 PolarHBondContact O-OG 3.23Å; L115-S118 WeakPolarHBondContact O-CB 3.45Å; L115-S118 PolarHBondContact O-N 3.27Å; L116-S118 VanDerWaalsContact C-N 3.33Å; L116-S118 PolarHBondContact O-N 3.12Å; S118-T120 PolarHBondContact O-N 2.84Å; S118-T121 PolarHBondContact O-N 2.93Å; S118-L122 VanDerWaalsContact O-CB 3.29Å; S118-L122 WeakPolarHBondContact O-CB 3.27Å; S118-L122 PolarHBondContact O-N 3.43Å; S118-T172 VanDerWaalsContact O-CG2 3.22Å; S118-T172 WeakPolarHBondContact O-CG2 3.42Å; S118-A176 WeakPolarHBondContact OG-CA 3.24Å; S118-A176 VanDerWaalsContact OG-CB 3.29Å; S118-A176 WeakPolarHBondContact OG-CB 3.44Å; S118-A176 PolarHBondContact OG-N 2.9Å |
| 119 | V | 94.8 | Very high | 94.9 | Very high | 32 Ų | 32 | 27.9 Ų | 27.9 | 19% | 0.194 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.4 | -44.9 | 179.7 | 173 | 0 | 0 | 0 | 0 | 111.1 | L88 S92 L115 L116 T121 L122 C123 | L88-V119 HydrophobicContact CB-CG1 4.41Å; S92-V119 WeakPolarHBondContact OG-CG1 3.45Å; L115-V119 HydrophobicContact CD1-CG2 4.19Å; L115-V119 WeakPolarHBondContact O-CG2 3.3Å; L115-V119 PolarHBondContact O-N 3.21Å; L116-V119 PolarHBondContact O-N 3.21Å; V119-T121 VanDerWaalsContact C-N 3.31Å; V119-T121 PolarHBondContact O-N 3.45Å; V119-L122 PolarHBondContact O-N 3.23Å; V119-C123 VanDerWaalsContact O-CB 3.25Å; V119-C123 WeakPolarHBondContact O-CB 3.42Å; V119-C123 PolarHBondContact O-N 3.5Å |
| 120 | T | 92.4 | Very high | 94.8 | Very high | 30 Ų | 30 | 26.9 Ų | 26.9 | 18% | 0.184 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63 | -37.7 | 176.9 | 55.1 | 0 | 0 | 0 | 0 | 112.5 | L96 L116 S117 S118 C123 M124 | L96-T120 HydrophobicContact CD1-CG2 3.67Å; L96-T120 HydrophobicContact CD2-CG2 4.24Å; L96-T120 HydrophobicContact CG-CG2 4.43Å; L116-T120 WeakPolarHBondContact O-CG2 3.36Å; L116-T120 PolarHBondContact O-N 2.91Å; L116-T120 PolarHBondContact O-OG1 2.94Å; S117-T120 PolarHBondContact O-OG1 3.3Å; S118-T120 PolarHBondContact O-N 2.84Å; T120-C123 VanDerWaalsContact O-CB 3.23Å; T120-C123 WeakPolarHBondContact O-CB 3.32Å; T120-M124 PolarHBondContact O-N 3.13Å |
| 121 | T | 94.1 | Very high | 94.6 | Very high | 17 Ų | 17 | 24.9 Ų | 24.9 | 10% | 0.104 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -70.1 | -41.8 | 175.9 | -57.5 | 0 | 0 | 0 | 0 | 111.9 | S117 S118 V119 C123 M124 Y125 T172 S175 | S117-T121 WeakPolarHBondContact O-CB 3.46Å; S117-T121 PolarHBondContact O-N 3.48Å; S117-T121 PolarHBondContact O-OG1 3.46Å; S118-T121 PolarHBondContact O-N 2.93Å; V119-T121 VanDerWaalsContact C-N 3.31Å; V119-T121 PolarHBondContact O-N 3.45Å; T121-C123 VanDerWaalsContact C-N 3.32Å; T121-C123 PolarHBondContact O-N 2.9Å; T121-M124 WeakPolarHBondContact O-CB 3.35Å; T121-M124 PolarHBondContact O-N 3.43Å; T121-Y125 HydrophobicContact CG2-CD2 3.75Å; T121-Y125 HydrophobicContact CG2-CE2 3.49Å; T121-Y125 VanDerWaalsContact CG2-CE2 3.49Å; T121-Y125 WeakPolarHBondContact O-CD2 3.33Å; T121-Y125 PolarHBondContact O-N 3.11Å; T121-Y125 VanDerWaalsContact O-N 3.13Å; T121-T172 HydrophobicContact CG2-CG2 4.24Å; T121-S175 PolarHBondContact OG1-OG 3.47Å |
| 122 | L | 96.1 | Very high | 94.5 | Very high | 25 Ų | 25 | 22.2 Ų | 22.2 | 13% | 0.131 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.3 | -44.6 | 176.7 | 176.4 | 60.4 | 0 | 0 | 0 | 110.6 | S118 V119 M124 Y125 A126 A168 L169 T172 | S118-L122 VanDerWaalsContact O-CB 3.29Å; S118-L122 WeakPolarHBondContact O-CB 3.27Å; S118-L122 PolarHBondContact O-N 3.43Å; V119-L122 PolarHBondContact O-N 3.23Å; L122-M124 PolarHBondContact O-N 3.36Å; L122-Y125 PolarHBondContact O-N 3.35Å; L122-A126 WeakPolarHBondContact O-CB 3.45Å; L122-A126 PolarHBondContact O-N 3.03Å; L122-A168 HydrophobicContact CD1-CB 3.79Å; L122-L169 HydrophobicContact CD1-CD2 3.82Å; L122-L169 HydrophobicContact CD1-CG 3.99Å; L122-L169 HydrophobicContact CD2-CD2 3.89Å; L122-T172 VanDerWaalsContact CA-OG1 3.28Å; L122-T172 WeakPolarHBondContact CA-OG1 3.45Å; L122-T172 HydrophobicContact CB-CG2 4.2Å; L122-T172 PolarHBondContact N-OG1 3.45Å |
| 123 | C | 92.9 | Very high | 94.4 | Very high | 1 Ų | 1 | 22.3 Ų | 22.3 | 1% | 0.007 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -49.6 | -52.3 | 172.7 | -105 | 0 | 0 | 0 | 0 | 113.7 | A85 L88 C89 V119 T120 T121 S127 | A85-C123 PolarHBondContact O-SG 3.47Å; A85-C123 VanDerWaalsContact O-SG 3.37Å; L88-C123 VanDerWaalsContact C-SG 3.56Å; C89-C123 WeakPolarHBondContact CA-SG 3.41Å; C89-C123 HydrophobicContact CB-CB 4.01Å; C89-C123 WeakPolarHBondContact CB-SG 3.27Å; C89-C123 PolarHBondContact N-SG 3.47Å; C89-C123 WeakPolarHBondContact SG-CB 3.47Å; C89-C123 CovalentContact SG-SG 2.04Å; C89-C123 PolarHBondContact SG-SG 2.89Å; V119-C123 VanDerWaalsContact O-CB 3.25Å; V119-C123 WeakPolarHBondContact O-CB 3.42Å; V119-C123 PolarHBondContact O-N 3.5Å; T120-C123 VanDerWaalsContact O-CB 3.23Å; T120-C123 WeakPolarHBondContact O-CB 3.32Å; T121-C123 VanDerWaalsContact C-N 3.32Å; T121-C123 PolarHBondContact O-N 2.9Å; C123-S127 VanDerWaalsContact O-CB 3.27Å; C123-S127 WeakPolarHBondContact O-CB 3.4Å; C123-S127 PolarHBondContact O-N 3.35Å; C123-S127 PolarHBondContact O-OG 3.09Å |
| 124 | M | 93 | Very high | 94 | Very high | 4 Ų | 4 | 23.3 Ų | 23.3 | 2% | 0.02 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -57.5 | -54.9 | 177.6 | 179.3 | -171.4 | 76.7 | 0 | 0 | 111.2 | T120 T121 L122 S127 V128 R210 W252 F255 | T120-M124 PolarHBondContact O-N 3.13Å; T121-M124 WeakPolarHBondContact O-CB 3.35Å; T121-M124 PolarHBondContact O-N 3.43Å; L122-M124 PolarHBondContact O-N 3.36Å; M124-S127 PolarHBondContact O-N 2.94Å; M124-V128 WeakPolarHBondContact O-CG1 3.29Å; M124-V128 PolarHBondContact O-N 3.22Å; M124-R210 HydrophobicContact CE-CG 3.85Å; M124-W252 HydrophobicContact CB-CH2 3.34Å; M124-W252 HydrophobicContact CB-CZ2 3.99Å; M124-W252 HydrophobicContact CB-CZ3 3.64Å; M124-W252 HydrophobicContact CG-CD2 4.34Å; M124-W252 HydrophobicContact CG-CE3 3.72Å; M124-W252 HydrophobicContact CG-CH2 3.5Å; M124-W252 VanDerWaalsContact CG-CH2 3.5Å; M124-W252 HydrophobicContact CG-CZ2 4.09Å; M124-W252 HydrophobicContact CG-CZ3 3.27Å; M124-W252 HydrophobicContact SD-CE3 3.97Å; M124-W252 HydrophobicContact SD-CH2 4.26Å; M124-W252 HydrophobicContact SD-CZ3 3.52Å; M124-W252 VanDerWaalsContact SD-CZ3 3.52Å; M124-F255 HydrophobicContact SD-CE1 4.18Å |
| 125 | Y | 96.1 | Very high | 93.6 | Very high | 7 Ų | 7 | 18.4 Ų | 18.4 | 3% | 0.027 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -67.1 | -41.4 | -176.5 | -72.4 | -57.2 | 0 | 0 | 0 | 112.5 | T121 L122 V128 L129 L171 R210 | T121-Y125 HydrophobicContact CG2-CD2 3.75Å; T121-Y125 HydrophobicContact CG2-CE2 3.49Å; T121-Y125 VanDerWaalsContact CG2-CE2 3.49Å; T121-Y125 WeakPolarHBondContact O-CD2 3.33Å; T121-Y125 PolarHBondContact O-N 3.11Å; T121-Y125 VanDerWaalsContact O-N 3.13Å; L122-Y125 PolarHBondContact O-N 3.35Å; Y125-V128 WeakPolarHBondContact O-CG1 3.21Å; Y125-L129 WeakPolarHBondContact O-CB 3.23Å; Y125-L129 WeakPolarHBondContact O-CD1 3.44Å; Y125-L129 WeakPolarHBondContact O-CG 3.37Å; Y125-L129 PolarHBondContact O-N 3.48Å; Y125-L171 HydrophobicContact CD1-CB 4.2Å; Y125-L171 HydrophobicContact CD1-CD1 3.81Å; Y125-L171 HydrophobicContact CD2-CB 3.68Å; Y125-L171 HydrophobicContact CE1-CB 4.12Å; Y125-L171 HydrophobicContact CE1-CD1 3.93Å; Y125-L171 HydrophobicContact CE2-CB 3.57Å; Y125-L171 VanDerWaalsContact CE2-O 3.3Å; Y125-L171 WeakPolarHBondContact CE2-O 3.5Å; Y125-L171 HydrophobicContact CG-CB 3.99Å; Y125-L171 HydrophobicContact CG-CD1 4.23Å; Y125-R210 VanDerWaalsContact OH-CA 3.31Å; Y125-R210 WeakPolarHBondContact OH-CA 3.18Å |
| 126 | A | 96.2 | Very high | 93.4 | Very high | 1 Ų | 1 | 14 Ų | 14 | 1% | 0.008 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.8 | -48.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | A85 L122 L130 W165 A168 | A85-A126 HydrophobicContact CB-CB 4.02Å; L122-A126 WeakPolarHBondContact O-CB 3.45Å; L122-A126 PolarHBondContact O-N 3.03Å; A126-L130 VanDerWaalsContact O-CB 3.23Å; A126-L130 WeakPolarHBondContact O-CB 3.05Å; A126-L130 WeakPolarHBondContact O-CD1 3.3Å; A126-L130 WeakPolarHBondContact O-CG 3.31Å; A126-L130 PolarHBondContact O-N 3.3Å; A126-W165 HydrophobicContact CB-CE3 4.27Å; A126-W165 HydrophobicContact CB-CH2 4.07Å; A126-W165 HydrophobicContact CB-CZ2 4.46Å; A126-W165 HydrophobicContact CB-CZ3 3.96Å; A126-A168 HydrophobicContact CB-CB 4.15Å |
| 127 | S | 93.3 | Very high | 93 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -60.7 | -50 | -180 | -58 | 0 | 0 | 0 | 0 | 111.9 | C123 M124 L130 L131 | C123-S127 VanDerWaalsContact O-CB 3.27Å; C123-S127 WeakPolarHBondContact O-CB 3.4Å; C123-S127 PolarHBondContact O-N 3.35Å; C123-S127 PolarHBondContact O-OG 3.09Å; M124-S127 PolarHBondContact O-N 2.94Å; S127-L130 PolarHBondContact O-N 3.18Å; S127-L131 WeakPolarHBondContact O-CB 3.38Å; S127-L131 VanDerWaalsContact O-CG 3.31Å; S127-L131 WeakPolarHBondContact O-CG 3.27Å; S127-L131 PolarHBondContact O-N 3.12Å |
| 128 | V | 94.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -68.3 | -39.3 | -177.1 | 75.8 | 0 | 0 | 0 | 0 | 112.5 | M124 Y125 L131 T132 P218 M222 F248 | M124-V128 WeakPolarHBondContact O-CG1 3.29Å; M124-V128 PolarHBondContact O-N 3.22Å; Y125-V128 WeakPolarHBondContact O-CG1 3.21Å; V128-L131 PolarHBondContact O-N 2.76Å; V128-T132 WeakPolarHBondContact O-CB 3.15Å; V128-T132 PolarHBondContact O-N 3.49Å; V128-T132 PolarHBondContact O-OG1 3.46Å; V128-P218 HydrophobicContact CG2-CB 3.43Å; V128-P218 VanDerWaalsContact CG2-CB 3.43Å; V128-P218 HydrophobicContact CG2-CG 3.69Å; V128-M222 HydrophobicContact CG2-CE 4.23Å; V128-F248 HydrophobicContact CB-CE1 4.06Å; V128-F248 HydrophobicContact CB-CE2 4.1Å; V128-F248 HydrophobicContact CB-CZ 3.51Å; V128-F248 HydrophobicContact CG2-CE1 3.63Å; V128-F248 HydrophobicContact CG2-CZ 3.65Å |
| 129 | L | 96 | Very high | 91.9 | Very high | 22 Ų | 22 | 16.3 Ų | 16.3 | 12% | 0.115 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -69.7 | -41.2 | 178.9 | -68.8 | 172.4 | 0 | 0 | 0 | 111.2 | Y125 T132 A133 L167 A168 L171 | Y125-L129 WeakPolarHBondContact O-CB 3.23Å; Y125-L129 WeakPolarHBondContact O-CD1 3.44Å; Y125-L129 WeakPolarHBondContact O-CG 3.37Å; Y125-L129 PolarHBondContact O-N 3.48Å; L129-T132 PolarHBondContact O-N 3.3Å; L129-A133 WeakPolarHBondContact O-CB 2.83Å; L129-A133 PolarHBondContact O-N 2.86Å; L129-L167 HydrophobicContact CD1-CB 4.03Å; L129-L167 HydrophobicContact CD1-CD2 3.97Å; L129-L167 HydrophobicContact CD1-CG 3.92Å; L129-L167 HydrophobicContact CD2-CD2 4.05Å; L129-A168 HydrophobicContact CD1-CB 4.11Å; L129-L171 HydrophobicContact CD1-CD1 4.49Å |
| 130 | L | 93.3 | Very high | 91.5 | Very high | 4 Ų | 4 | 17.8 Ų | 17.8 | 2% | 0.021 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64 | -41.8 | 174.8 | -71.3 | 168.3 | 0 | 0 | 0 | 111.8 | W78 H81 A85 A126 S127 A133 L134 W165 | W78-L130 HydrophobicContact CE3-CD2 4.32Å; W78-L130 HydrophobicContact CZ3-CD2 4.12Å; H81-L130 HydrophobicContact CB-CD1 3.93Å; H81-L130 HydrophobicContact CB-CD2 3.96Å; A85-L130 HydrophobicContact CB-CD1 4.34Å; A126-L130 VanDerWaalsContact O-CB 3.23Å; A126-L130 WeakPolarHBondContact O-CB 3.05Å; A126-L130 WeakPolarHBondContact O-CD1 3.3Å; A126-L130 WeakPolarHBondContact O-CG 3.31Å; A126-L130 PolarHBondContact O-N 3.3Å; S127-L130 PolarHBondContact O-N 3.18Å; L130-A133 PolarHBondContact O-N 3.31Å; L130-L134 VanDerWaalsContact O-CB 3.3Å; L130-L134 WeakPolarHBondContact O-CB 3.44Å; L130-L134 PolarHBondContact O-N 3.47Å; L130-W165 HydrophobicContact CD1-CZ2 4.34Å |
| 131 | L | 90.9 | Very high | 90.9 | Very high | 4 Ų | 4 | 18.4 Ų | 18.4 | 2% | 0.021 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -64.5 | -40 | 174.7 | -77.1 | 171.9 | 0 | 0 | 0 | 112.3 | L82 S127 V128 L134 S135 M222 V244 F248 | L82-L131 HydrophobicContact CD1-CG 4.19Å; L82-L131 HydrophobicContact CD2-CD2 3.98Å; S127-L131 WeakPolarHBondContact O-CB 3.38Å; S127-L131 VanDerWaalsContact O-CG 3.31Å; S127-L131 WeakPolarHBondContact O-CG 3.27Å; S127-L131 PolarHBondContact O-N 3.12Å; V128-L131 PolarHBondContact O-N 2.76Å; L131-L134 PolarHBondContact O-N 3.14Å; L131-S135 WeakPolarHBondContact O-CB 3.25Å; L131-S135 PolarHBondContact O-N 3.1Å; L131-S135 PolarHBondContact O-OG 3.28Å; L131-M222 HydrophobicContact CB-SD 4.02Å; L131-V244 HydrophobicContact CD1-CG1 4.46Å; L131-V244 HydrophobicContact CD2-CG1 3.61Å; L131-F248 HydrophobicContact CD1-CB 4.14Å; L131-F248 HydrophobicContact CD1-CD2 3.75Å; L131-F248 HydrophobicContact CD1-CE2 4.47Å; L131-F248 HydrophobicContact CD1-CG 4.02Å |
| 132 | T | 93.9 | Very high | 90.2 | Very high | 24 Ų | 24 | 18.5 Ų | 18.5 | 15% | 0.147 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63.3 | -47 | 175.7 | -57.4 | 0 | 0 | 0 | 0 | 110.6 | V128 L129 S135 A136 P218 F221 | V128-T132 WeakPolarHBondContact O-CB 3.15Å; V128-T132 PolarHBondContact O-N 3.49Å; V128-T132 PolarHBondContact O-OG1 3.46Å; L129-T132 PolarHBondContact O-N 3.3Å; T132-S135 WeakPolarHBondContact O-CB 3.33Å; T132-S135 PolarHBondContact O-N 3.47Å; T132-A136 PolarHBondContact O-N 3.19Å; T132-P218 WeakPolarHBondContact OG1-CB 3.28Å; T132-F221 HydrophobicContact CG2-CD1 3.55Å; T132-F221 HydrophobicContact CG2-CE1 3.94Å; T132-F221 HydrophobicContact CG2-CG 4.29Å |
| 133 | A | 93.1 | Very high | 89.4 | Confident | 18 Ų | 18 | 20.8 Ų | 20.8 | 15% | 0.149 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -66.5 | -39.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | W78 L129 L130 A136 D137 | W78-A133 HydrophobicContact CH2-CB 3.53Å; W78-A133 HydrophobicContact CZ2-CB 4.46Å; W78-A133 HydrophobicContact CZ3-CB 3.67Å; L129-A133 WeakPolarHBondContact O-CB 2.83Å; L129-A133 PolarHBondContact O-N 2.86Å; L130-A133 PolarHBondContact O-N 3.31Å; A133-A136 WeakPolarHBondContact O-CB 3.47Å; A133-A136 PolarHBondContact O-N 3.07Å; A133-D137 PolarHBondContact O-N 3.34Å |
| 134 | L | 88.4 | Confident | 89 | Confident | 22 Ų | 22 | 28.5 Ų | 28.5 | 12% | 0.115 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.2 | -49.3 | 170.6 | 172.7 | 60.3 | 0 | 0 | 0 | 110.5 | W78 F79 L130 L131 A136 D137 L138 | W78-L134 HydrophobicContact CB-CD1 3.95Å; W78-L134 HydrophobicContact CD2-CB 4.32Å; W78-L134 HydrophobicContact CD2-CD1 4.46Å; W78-L134 HydrophobicContact CG-CB 4.37Å; W78-L134 HydrophobicContact CG-CD1 3.78Å; F79-L134 HydrophobicContact CE1-CD2 4.07Å; L130-L134 VanDerWaalsContact O-CB 3.3Å; L130-L134 WeakPolarHBondContact O-CB 3.44Å; L130-L134 PolarHBondContact O-N 3.47Å; L131-L134 PolarHBondContact O-N 3.14Å; L134-A136 PolarHBondContact O-N 3.28Å; L134-D137 PolarHBondContact O-N 2.85Å; L134-D137 VanDerWaalsContact O-N 3.12Å; L134-L138 HydrophobicContact CD1-CD1 3.93Å; L134-L138 HydrophobicContact CD1-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CG 3.91Å; L134-L138 HydrophobicContact CG-CD1 3.95Å; L134-L138 HydrophobicContact CG-CG 4.34Å; L134-L138 VanDerWaalsContact O-CG 3.25Å; L134-L138 WeakPolarHBondContact O-CG 3.38Å; L134-L138 PolarHBondContact O-N 2.04Å |
| 135 | S | 87.6 | Confident | 88.3 | Confident | 5 Ų | 5 | 32.9 Ų | 32.9 | 4% | 0.035 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -57.5 | -38.6 | 178 | -58.2 | 0 | 0 | 0 | 0 | 111.9 | L131 T132 F139 H226 | L131-S135 WeakPolarHBondContact O-CB 3.25Å; L131-S135 PolarHBondContact O-N 3.1Å; L131-S135 PolarHBondContact O-OG 3.28Å; T132-S135 WeakPolarHBondContact O-CB 3.33Å; T132-S135 PolarHBondContact O-N 3.47Å; S135-F139 VanDerWaalsContact O-CB 3.28Å; S135-F139 WeakPolarHBondContact O-CB 3.46Å; S135-F139 PolarHBondContact O-N 3.48Å; S135-H226 PolarHBondContact OG-NE2 3.12Å |
| 136 | A | 90.4 | Very high | 87.7 | Confident | 26 Ų | 26 | 36.6 Ų | 36.6 | 22% | 0.215 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66 | -46.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | T132 A133 L134 L138 F139 L140 F221 | T132-A136 PolarHBondContact O-N 3.19Å; A133-A136 WeakPolarHBondContact O-CB 3.47Å; A133-A136 PolarHBondContact O-N 3.07Å; L134-A136 PolarHBondContact O-N 3.28Å; A136-L138 VanDerWaalsContact C-N 3.32Å; A136-L138 PolarHBondContact O-N 3.01Å; A136-F139 PolarHBondContact O-N 2.74Å; A136-L140 WeakPolarHBondContact O-CG 3.35Å; A136-L140 PolarHBondContact O-N 2.96Å; A136-F221 HydrophobicContact CB-CE1 3.9Å; A136-F221 HydrophobicContact CB-CZ 3.74Å |
| 137 | D | 86.3 | Confident | 87.1 | Confident | 8 Ų | 8 | 39.4 Ų | 39.4 | 4% | 0.043 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.4 | -39.7 | 176.7 | -177.6 | 46 | 0 | 0 | 0 | 111.3 | W78 A133 L134 L140 Q141 W147 R153 | W78-D137 HydrophobicContact CZ2-CB 4.37Å; W78-D137 PolarHBondContact NE1-OD2 2.99Å; A133-D137 PolarHBondContact O-N 3.34Å; L134-D137 PolarHBondContact O-N 2.85Å; L134-D137 VanDerWaalsContact O-N 3.12Å; D137-L140 PolarHBondContact O-N 3.36Å; D137-Q141 VanDerWaalsContact CG-NE2 3.25Å; D137-Q141 WeakPolarHBondContact O-CB 3.48Å; D137-Q141 VanDerWaalsContact O-CG 3.27Å; D137-Q141 WeakPolarHBondContact O-CG 3.14Å; D137-Q141 PolarHBondContact O-N 3.18Å; D137-Q141 PolarHBondContact O-NE2 2.93Å; D137-Q141 PolarHBondContact OD1-NE2 3.29Å; D137-Q141 PolarHBondContact OD2-NE2 2.91Å; D137-W147 PolarHBondContact OD1-NE1 2.66Å; D137-R153 IonicContact OD1-CZ 3.92Å; D137-R153 IonicContact OD1-NE 3.12Å; D137-R153 PolarHBondContact OD1-NE 3.37Å; D137-R153 VanDerWaalsContact OD1-NE 3.12Å; D137-R153 IonicContact OD1-NH2 3.78Å; D137-R153 IonicContact OD2-CZ 3.77Å; D137-R153 IonicContact OD2-NE 3.68Å; D137-R153 IonicContact OD2-NH2 2.94Å; D137-R153 PolarHBondContact OD2-NH2 3.42Å |
| 138 | L | 83.2 | Confident | 86.1 | Confident | 33 Ų | 33 | 46 Ų | 46 | 17% | 0.173 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66 | -42.4 | 176.4 | -64.3 | 176.1 | 0 | 0 | 0 | 111.4 | L134 A136 Q141 A142 W238 | L134-L138 HydrophobicContact CD1-CD1 3.93Å; L134-L138 HydrophobicContact CD1-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CG 3.91Å; L134-L138 HydrophobicContact CG-CD1 3.95Å; L134-L138 HydrophobicContact CG-CG 4.34Å; L134-L138 VanDerWaalsContact O-CG 3.25Å; L134-L138 WeakPolarHBondContact O-CG 3.38Å; L134-L138 PolarHBondContact O-N 2.04Å; A136-L138 VanDerWaalsContact C-N 3.32Å; A136-L138 PolarHBondContact O-N 3.01Å; L138-Q141 PolarHBondContact O-N 2.76Å; L138-A142 PolarHBondContact O-N 3.44Å; L138-A142 VanDerWaalsContact O-N 3.13Å; L138-W238 HydrophobicContact CB-CH2 4Å; L138-W238 HydrophobicContact CB-CZ3 3.75Å; L138-W238 HydrophobicContact CD1-CE3 4.45Å; L138-W238 HydrophobicContact CD1-CZ3 3.8Å; L138-W238 HydrophobicContact CD2-CH2 3.96Å; L138-W238 HydrophobicContact CD2-CZ3 3.65Å; L138-W238 HydrophobicContact CG-CH2 4.4Å; L138-W238 HydrophobicContact CG-CZ3 3.87Å |
| 139 | F | 84 | Confident | 85.3 | Confident | 59 Ų | 59 | 51.7 Ų | 51.7 | 26% | 0.259 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.1 | -49.1 | 174.4 | -178.2 | -93.9 | 0 | 0 | 0 | 111.3 | S135 A136 Q141 A142 F143 C225 V228 | S135-F139 VanDerWaalsContact O-CB 3.28Å; S135-F139 WeakPolarHBondContact O-CB 3.46Å; S135-F139 PolarHBondContact O-N 3.48Å; A136-F139 PolarHBondContact O-N 2.74Å; F139-Q141 VanDerWaalsContact C-N 3.32Å; F139-Q141 PolarHBondContact O-N 3.5Å; F139-A142 PolarHBondContact O-N 2.99Å; F139-A142 VanDerWaalsContact O-N 3.1Å; F139-F143 HydrophobicContact CD1-CD2 4.16Å; F139-F143 AromaticContact CD2-CD2 3.71Å; F139-F143 HydrophobicContact CD2-CD2 3.71Å; F139-F143 AromaticContact CD2-CE2 3.66Å; F139-F143 HydrophobicContact CD2-CE2 3.66Å; F139-F143 AromaticContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CG 4.37Å; F139-F143 AromaticContact CE2-CD2 3.48Å; F139-F143 HydrophobicContact CE2-CD2 3.48Å; F139-F143 VanDerWaalsContact CE2-CD2 3.48Å; F139-F143 AromaticContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CG 4.46Å; F139-F143 HydrophobicContact CE2-CZ 4.09Å; F139-F143 HydrophobicContact CG-CD2 4.05Å; F139-F143 HydrophobicContact CG-CE2 4.45Å; F139-F143 AromaticContact CZ-CD2 3.59Å; F139-F143 HydrophobicContact CZ-CD2 3.59Å; F139-F143 AromaticContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CG 4.17Å; F139-F143 HydrophobicContact CZ-CZ 4.4Å; F139-F143 WeakPolarHBondContact O-CD2 3.36Å; F139-F143 PolarHBondContact O-N 3.48Å; F139-C225 HydrophobicContact CB-CB 4.31Å; F139-C225 HydrophobicContact CD2-CB 4.11Å; F139-C225 HydrophobicContact CG-CB 4.46Å; F139-V228 HydrophobicContact CE2-CB 4.26Å; F139-V228 HydrophobicContact CE2-CG1 3.97Å |
| 140 | L | 85.4 | Confident | 84.7 | Confident | 64 Ų | 64 | 52.3 Ų | 52.3 | 34% | 0.335 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.2 | -39.2 | 178.5 | -72.5 | 172.7 | 0 | 0 | 0 | 112.6 | A136 D137 A142 F143 R144 W147 | A136-L140 WeakPolarHBondContact O-CG 3.35Å; A136-L140 PolarHBondContact O-N 2.96Å; D137-L140 PolarHBondContact O-N 3.36Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 3.48Å; L140-F143 PolarHBondContact O-N 2.89Å; L140-R144 WeakPolarHBondContact O-CA 3.12Å; L140-R144 WeakPolarHBondContact O-CB 3.23Å; L140-R144 PolarHBondContact O-N 3.25Å; L140-W147 HydrophobicContact CB-CG 4.05Å; L140-W147 HydrophobicContact CD1-CZ2 4.42Å |
| 141 | Q | 80.2 | Confident | 84.1 | Confident | 42 Ų | 42 | 59.4 Ų | 59.4 | 20% | 0.196 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.1 | -33.5 | 175.4 | -76.9 | 170.7 | 90.1 | 0 | 0 | 113.1 | D137 L138 F139 R153 | D137-Q141 VanDerWaalsContact CG-NE2 3.25Å; D137-Q141 WeakPolarHBondContact O-CB 3.48Å; D137-Q141 VanDerWaalsContact O-CG 3.27Å; D137-Q141 WeakPolarHBondContact O-CG 3.14Å; D137-Q141 PolarHBondContact O-N 3.18Å; D137-Q141 PolarHBondContact O-NE2 2.93Å; D137-Q141 PolarHBondContact OD1-NE2 3.29Å; D137-Q141 PolarHBondContact OD2-NE2 2.91Å; L138-Q141 PolarHBondContact O-N 2.76Å; F139-Q141 VanDerWaalsContact C-N 3.32Å; F139-Q141 PolarHBondContact O-N 3.5Å; Q141-R153 VanDerWaalsContact CD-NH2 3.32Å |
| 142 | A | 78.2 | Confident | 83.9 | Confident | 19 Ų | 19 | 65.7 Ų | 65.7 | 16% | 0.157 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -73.9 | -39.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L138 F139 L140 L229 M233 | L138-A142 PolarHBondContact O-N 3.44Å; L138-A142 VanDerWaalsContact O-N 3.13Å; F139-A142 PolarHBondContact O-N 2.99Å; F139-A142 VanDerWaalsContact O-N 3.1Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 3.48Å; A142-L229 HydrophobicContact CB-CD1 3.57Å; A142-M233 HydrophobicContact CB-CE 3.98Å |
| 143 | F | 81.2 | Confident | 83.6 | Confident | 74 Ų | 74 | 66 Ų | 66 | 33% | 0.325 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -95.3 | -24.8 | -172.5 | -80.3 | -81.9 | 0 | 0 | 0 | 115.2 | F139 L140 V228 | F139-F143 HydrophobicContact CD1-CD2 4.16Å; F139-F143 AromaticContact CD2-CD2 3.71Å; F139-F143 HydrophobicContact CD2-CD2 3.71Å; F139-F143 AromaticContact CD2-CE2 3.66Å; F139-F143 HydrophobicContact CD2-CE2 3.66Å; F139-F143 AromaticContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CG 4.37Å; F139-F143 AromaticContact CE2-CD2 3.48Å; F139-F143 HydrophobicContact CE2-CD2 3.48Å; F139-F143 VanDerWaalsContact CE2-CD2 3.48Å; F139-F143 AromaticContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CG 4.46Å; F139-F143 HydrophobicContact CE2-CZ 4.09Å; F139-F143 HydrophobicContact CG-CD2 4.05Å; F139-F143 HydrophobicContact CG-CE2 4.45Å; F139-F143 AromaticContact CZ-CD2 3.59Å; F139-F143 HydrophobicContact CZ-CD2 3.59Å; F139-F143 AromaticContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CG 4.17Å; F139-F143 HydrophobicContact CZ-CZ 4.4Å; F139-F143 WeakPolarHBondContact O-CD2 3.36Å; F139-F143 PolarHBondContact O-N 3.48Å; L140-F143 PolarHBondContact O-N 2.89Å; F143-V228 HydrophobicContact CE1-CG1 4.3Å; F143-V228 HydrophobicContact CE2-CG1 3.53Å; F143-V228 HydrophobicContact CZ-CG1 3.18Å |
| 144 | R | 82.9 | Confident | 83.5 | Confident | 163 Ų | 163 | 70.1 Ų | 70.1 | 62% | 0.615 | 36% | 0.357 | S | S | * | . | trans | -124.1 | 89.3 | 178.4 | -64 | -159.7 | -178.2 | -169.9 | 2.9 | 109.1 | L140 S146 W147 | L140-R144 WeakPolarHBondContact O-CA 3.12Å; L140-R144 WeakPolarHBondContact O-CB 3.23Å; L140-R144 PolarHBondContact O-N 3.25Å; R144-S146 PolarHBondContact O-N 3.28Å; R144-S146 VanDerWaalsContact O-N 3.1Å; R144-W147 HydrophobicContact CB-CB 3.94Å; R144-W147 WeakPolarHBondContact O-CA 3.37Å; R144-W147 WeakPolarHBondContact O-CB 3.17Å; R144-W147 PolarHBondContact O-N 3.12Å | ||
| 145 | P | 78.5 | Confident | 83.6 | Confident | 96 Ų | 96 | 74.2 Ų | 74.2 | 62% | 0.623 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -53.9 | -33 | 177.1 | -26.9 | 34.9 | 0 | 0 | 0 | 113 | W147 K148 | P145-W147 VanDerWaalsContact C-N 3.27Å; P145-W147 PolarHBondContact O-N 3.43Å; P145-K148 VanDerWaalsContact O-CB 3.32Å; P145-K148 WeakPolarHBondContact O-CB 3.27Å; P145-K148 PolarHBondContact O-N 3.13Å; P145-K148 VanDerWaalsContact O-N 3.13Å |
| 146 | S | 84.4 | Confident | 83.8 | Confident | 84 Ų | 84 | 75 Ų | 75 | 59% | 0.587 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -62.8 | -28.4 | 173.8 | 56.2 | 0 | 0 | 0 | 0 | 113.8 | R144 K148 S150 | R144-S146 PolarHBondContact O-N 3.28Å; R144-S146 VanDerWaalsContact O-N 3.1Å; S146-K148 VanDerWaalsContact C-N 3.34Å; S146-S150 VanDerWaalsContact O-CB 3.32Å; S146-S150 WeakPolarHBondContact O-CB 3.4Å; S146-S150 PolarHBondContact O-N 3.43Å; S146-S150 VanDerWaalsContact O-N 3.12Å |
| 147 | W | 83.4 | Confident | 83.8 | Confident | 61 Ų | 61 | 74 Ų | 74 | 23% | 0.231 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -66 | -37.8 | 173.4 | -179.3 | -109.9 | 0 | 0 | 0 | 111.6 | D137 L140 R144 P145 T149 S150 R153 | D137-W147 PolarHBondContact OD1-NE1 2.66Å; L140-W147 HydrophobicContact CB-CG 4.05Å; L140-W147 HydrophobicContact CD1-CZ2 4.42Å; R144-W147 HydrophobicContact CB-CB 3.94Å; R144-W147 WeakPolarHBondContact O-CA 3.37Å; R144-W147 WeakPolarHBondContact O-CB 3.17Å; R144-W147 PolarHBondContact O-N 3.12Å; P145-W147 VanDerWaalsContact C-N 3.27Å; P145-W147 PolarHBondContact O-N 3.43Å; W147-T149 PolarHBondContact O-N 3.36Å; W147-S150 PolarHBondContact O-N 3.1Å; W147-R153 HydrophobicContact CD2-CB 4.33Å; W147-R153 HydrophobicContact CD2-CG 4.44Å; W147-R153 HydrophobicContact CH2-CB 4.4Å; W147-R153 HydrophobicContact CZ2-CB 4.07Å; W147-R153 HydrophobicContact CZ2-CG 3.9Å; W147-R153 WeakPolarHBondContact O-CD 3.39Å |
| 148 | K | 72.5 | Confident | 84.2 | Confident | 137 Ų | 137 | 80.5 Ų | 80.5 | 60% | 0.596 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -60.8 | -35.7 | -178 | -171.4 | -180 | 177.5 | -177.5 | 0 | 112.2 | P145 S146 | P145-K148 VanDerWaalsContact O-CB 3.32Å; P145-K148 WeakPolarHBondContact O-CB 3.27Å; P145-K148 PolarHBondContact O-N 3.13Å; P145-K148 VanDerWaalsContact O-N 3.13Å; S146-K148 VanDerWaalsContact C-N 3.34Å |
| 149 | T | 78.2 | Confident | 84.8 | Confident | 120 Ų | 120 | 83 Ų | 83 | 74% | 0.736 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.2 | 6.2 | -178.9 | 57.6 | 0 | 0 | 0 | 0 | 113.3 | W147 | W147-T149 PolarHBondContact O-N 3.36Š|
| 150 | S | 82.6 | Confident | 85.3 | Confident | 36 Ų | 36 | 82.3 Ų | 82.3 | 25% | 0.252 | 42% | 0.422 | S | S | . | . | trans | -77.3 | 132 | -178.1 | -177.3 | 0 | 0 | 0 | 0 | 111.7 | S146 W147 H152 R153 | S146-S150 VanDerWaalsContact O-CB 3.32Å; S146-S150 WeakPolarHBondContact O-CB 3.4Å; S146-S150 PolarHBondContact O-N 3.43Å; S146-S150 VanDerWaalsContact O-N 3.12Å; W147-S150 PolarHBondContact O-N 3.1Å; S150-H152 PolarHBondContact O-N 2.81Å; S150-H152 PolarHBondContact OG-N 3.43Å; S150-R153 VanDerWaalsContact O-CB 3.27Å; S150-R153 WeakPolarHBondContact O-CB 3.41Å; S150-R153 PolarHBondContact O-N 3.04Å | ||
| 151 | D | 81.8 | Confident | 85.8 | Confident | 152 Ų | 152 | 79.6 Ų | 79.6 | 81% | 0.813 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | -28.3 | 170.6 | -68 | -30.9 | 0 | 0 | 0 | 112.3 | R153 | D151-R153 VanDerWaalsContact C-N 3.26Å; D151-R153 PolarHBondContact O-N 3.32Å |
| 152 | H | 85.9 | Confident | 86.6 | Confident | 136 Ų | 136 | 82 Ų | 82 | 63% | 0.63 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -71 | -17.8 | 176.9 | -60.1 | -63.5 | 0 | 0 | 0 | 113.5 | S150 K154 L155 G156 | S150-H152 PolarHBondContact O-N 2.81Å; S150-H152 PolarHBondContact OG-N 3.43Å; H152-K154 VanDerWaalsContact C-N 3.28Å; H152-K154 PolarHBondContact O-N 2.86Å; H152-L155 PolarHBondContact O-N 2.94Å; H152-G156 PolarHBondContact O-N 2.86Å |
| 153 | R | 88.2 | Confident | 87.5 | Confident | 30 Ų | 30 | 84 Ų | 84 | 11% | 0.113 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -61.7 | -38.2 | 179.5 | 178.2 | 172.3 | 171 | -117.9 | -5.6 | 112 | D137 Q141 W147 S150 D151 L155 G156 V157 | D137-R153 IonicContact OD1-CZ 3.92Å; D137-R153 IonicContact OD1-NE 3.12Å; D137-R153 PolarHBondContact OD1-NE 3.37Å; D137-R153 VanDerWaalsContact OD1-NE 3.12Å; D137-R153 IonicContact OD1-NH2 3.78Å; D137-R153 IonicContact OD2-CZ 3.77Å; D137-R153 IonicContact OD2-NE 3.68Å; D137-R153 IonicContact OD2-NH2 2.94Å; D137-R153 PolarHBondContact OD2-NH2 3.42Å; Q141-R153 VanDerWaalsContact CD-NH2 3.32Å; W147-R153 HydrophobicContact CD2-CB 4.33Å; W147-R153 HydrophobicContact CD2-CG 4.44Å; W147-R153 HydrophobicContact CH2-CB 4.4Å; W147-R153 HydrophobicContact CZ2-CB 4.07Å; W147-R153 HydrophobicContact CZ2-CG 3.9Å; W147-R153 WeakPolarHBondContact O-CD 3.39Å; S150-R153 VanDerWaalsContact O-CB 3.27Å; S150-R153 WeakPolarHBondContact O-CB 3.41Å; S150-R153 PolarHBondContact O-N 3.04Å; D151-R153 VanDerWaalsContact C-N 3.26Å; D151-R153 PolarHBondContact O-N 3.32Å; R153-L155 VanDerWaalsContact C-N 3.31Å; R153-L155 PolarHBondContact O-N 2.75Å; R153-G156 PolarHBondContact O-N 3.02Å; R153-V157 HydrophobicContact CG-CG2 4.31Å; R153-V157 WeakPolarHBondContact O-CG2 3.26Å; R153-V157 PolarHBondContact O-N 3.32Å |
| 154 | K | 89.3 | Confident | 88.3 | Confident | 105 Ų | 105 | 80.9 Ų | 80.9 | 46% | 0.457 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 177.6 | -168.9 | 173.4 | 179.7 | 177.4 | 0 | 111.8 | L74 H152 R158 | L74-K154 HydrophobicContact CD2-CB 3.73Å; L74-K154 HydrophobicContact CD2-CG 3.96Å; L74-K154 HydrophobicContact CG-CG 4.39Å; H152-K154 VanDerWaalsContact C-N 3.28Å; H152-K154 PolarHBondContact O-N 2.86Å; K154-R158 VanDerWaalsContact CE-NH2 3.3Å; K154-R158 WeakPolarHBondContact O-CG 3.46Å; K154-R158 PolarHBondContact O-N 2.89Å |
| 155 | L | 91.3 | Very high | 89 | Confident | 109 Ų | 109 | 75.1 Ų | 75.1 | 57% | 0.571 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -65.8 | -46.6 | 175.5 | -179.5 | 61.3 | 0 | 0 | 0 | 110.6 | H152 R153 V157 R158 V159 | H152-L155 PolarHBondContact O-N 2.94Å; R153-L155 VanDerWaalsContact C-N 3.31Å; R153-L155 PolarHBondContact O-N 2.75Å; L155-V157 PolarHBondContact O-N 3.27Å; L155-R158 PolarHBondContact O-N 3.46Å; L155-V159 HydrophobicContact CD1-CG2 3.98Å; L155-V159 HydrophobicContact CG-CG2 4.25Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.38Å; L155-V159 PolarHBondContact O-N 3.06Å |
| 156 | G | 92.3 | Very high | 89.9 | Confident | 21 Ų | 21 | 76.2 Ų | 76.2 | 22% | 0.216 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -55.1 | -49.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | H152 R153 R158 V159 S160 | H152-G156 PolarHBondContact O-N 2.86Å; R153-G156 PolarHBondContact O-N 3.02Å; G156-R158 PolarHBondContact O-N 3.28Å; G156-V159 PolarHBondContact O-N 3.12Å; G156-S160 WeakPolarHBondContact O-CB 3.29Å; G156-S160 PolarHBondContact O-N 3.49Å; G156-S160 PolarHBondContact O-OG 3.43Å; G156-S160 VanDerWaalsContact O-OG 3.06Å |
| 157 | V | 91.1 | Very high | 90.5 | Very high | 6 Ų | 6 | 75.5 Ų | 75.5 | 4% | 0.036 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -58.8 | -47.7 | 177.2 | 169 | 0 | 0 | 0 | 0 | 111.4 | W78 R153 L155 V159 S160 Q161 | W78-V157 HydrophobicContact CZ2-CB 4.22Å; W78-V157 HydrophobicContact CZ2-CG1 3.8Å; W78-V157 HydrophobicContact CZ2-CG2 4.1Å; R153-V157 HydrophobicContact CG-CG2 4.31Å; R153-V157 WeakPolarHBondContact O-CG2 3.26Å; R153-V157 PolarHBondContact O-N 3.32Å; L155-V157 PolarHBondContact O-N 3.27Å; V157-V159 PolarHBondContact O-N 3.46Å; V157-S160 PolarHBondContact O-N 2.88Å; V157-Q161 HydrophobicContact CG1-CG 4.42Å; V157-Q161 VanDerWaalsContact O-CG 3.27Å; V157-Q161 WeakPolarHBondContact O-CG 3.42Å; V157-Q161 PolarHBondContact O-N 3.35Å |
| 158 | R | 93 | Very high | 91.2 | Very high | 144 Ų | 144 | 72.6 Ų | 72.6 | 54% | 0.543 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.4 | -45.3 | 179.2 | -74.2 | 175.8 | 177.6 | -178.1 | -5.8 | 112.2 | K154 L155 G156 S160 Q161 V162 | K154-R158 VanDerWaalsContact CE-NH2 3.3Å; K154-R158 WeakPolarHBondContact O-CG 3.46Å; K154-R158 PolarHBondContact O-N 2.89Å; L155-R158 PolarHBondContact O-N 3.46Å; G156-R158 PolarHBondContact O-N 3.28Å; R158-S160 VanDerWaalsContact C-N 3.33Å; R158-S160 PolarHBondContact O-N 3.5Å; R158-Q161 PolarHBondContact O-N 3.44Å; R158-V162 WeakPolarHBondContact O-CG2 3.32Å; R158-V162 PolarHBondContact O-N 3.39Å |
| 159 | V | 95.4 | Very high | 92.4 | Very high | 84 Ų | 84 | 70 Ų | 70 | 51% | 0.509 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.5 | -45.5 | 177.2 | 169.4 | 0 | 0 | 0 | 0 | 110.1 | L155 G156 V157 Q161 V162 S163 | L155-V159 HydrophobicContact CD1-CG2 3.98Å; L155-V159 HydrophobicContact CG-CG2 4.25Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.38Å; L155-V159 PolarHBondContact O-N 3.06Å; G156-V159 PolarHBondContact O-N 3.12Å; V157-V159 PolarHBondContact O-N 3.46Å; V159-Q161 PolarHBondContact O-N 2.96Å; V159-V162 PolarHBondContact O-N 3.49Å; V159-S163 VanDerWaalsContact O-CB 3.26Å; V159-S163 WeakPolarHBondContact O-CB 3.49Å; V159-S163 PolarHBondContact O-N 3.3Å; V159-S163 PolarHBondContact O-OG 2.95Å; V159-S163 VanDerWaalsContact O-OG 3.11Å |
| 160 | S | 95.6 | Very high | 93.3 | Very high | 45 Ų | 45 | 69.8 Ų | 69.8 | 32% | 0.315 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.7 | -37.4 | 177.3 | -65.2 | 0 | 0 | 0 | 0 | 113 | G156 V157 R158 S163 S164 | G156-S160 WeakPolarHBondContact O-CB 3.29Å; G156-S160 PolarHBondContact O-N 3.49Å; G156-S160 PolarHBondContact O-OG 3.43Å; G156-S160 VanDerWaalsContact O-OG 3.06Å; V157-S160 PolarHBondContact O-N 2.88Å; R158-S160 VanDerWaalsContact C-N 3.33Å; R158-S160 PolarHBondContact O-N 3.5Å; S160-S163 WeakPolarHBondContact CA-OG 3.4Å; S160-S163 PolarHBondContact O-OG 3.38Å; S160-S163 VanDerWaalsContact O-OG 3.09Å; S160-S164 VanDerWaalsContact O-CB 3.28Å; S160-S164 WeakPolarHBondContact O-CB 3.16Å; S160-S164 PolarHBondContact O-N 3Å; S160-S164 PolarHBondContact O-OG 3.41Å |
| 161 | Q | 95.3 | Very high | 94 | Very high | 7 Ų | 7 | 69.3 Ų | 69.3 | 3% | 0.033 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.7 | -51.6 | 175.7 | -73.4 | 173 | -37.1 | 0 | 0 | 111.1 | S77 W78 H81 V157 R158 V159 S163 S164 W165 | S77-Q161 PolarHBondContact O-NE2 3.49Å; S77-Q161 PolarHBondContact OG-NE2 2.86Å; S77-Q161 PolarHBondContact OG-OE1 3.44Å; W78-Q161 HydrophobicContact CE3-CG 3.89Å; W78-Q161 HydrophobicContact CH2-CG 3.88Å; W78-Q161 HydrophobicContact CZ3-CG 3.51Å; H81-Q161 PolarHBondContact CD2-NE2 2.83Å; V157-Q161 HydrophobicContact CG1-CG 4.42Å; V157-Q161 VanDerWaalsContact O-CG 3.27Å; V157-Q161 WeakPolarHBondContact O-CG 3.42Å; V157-Q161 PolarHBondContact O-N 3.35Å; R158-Q161 PolarHBondContact O-N 3.44Å; V159-Q161 PolarHBondContact O-N 2.96Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 2.82Å; Q161-S164 PolarHBondContact O-N 2.88Å; Q161-W165 VanDerWaalsContact O-CD1 3.27Å; Q161-W165 PolarHBondContact O-N 3.19Å; Q161-W165 VanDerWaalsContact O-N 3.12Å |
| 162 | V | 97.1 | Very high | 94.7 | Very high | 94 Ų | 94 | 62.5 Ų | 62.5 | 57% | 0.57 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -60.7 | -45.9 | 178.4 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | R158 V159 S164 W165 M166 | R158-V162 WeakPolarHBondContact O-CG2 3.32Å; R158-V162 PolarHBondContact O-N 3.39Å; V159-V162 PolarHBondContact O-N 3.49Å; V162-S164 VanDerWaalsContact C-N 3.31Å; V162-S164 PolarHBondContact O-N 2.96Å; V162-W165 PolarHBondContact O-N 3.43Å; V162-M166 HydrophobicContact CG1-CG 4.18Å; V162-M166 VanDerWaalsContact O-CG 3.29Å; V162-M166 WeakPolarHBondContact O-CG 3.4Å; V162-M166 PolarHBondContact O-N 3.42Å |
| 163 | S | 97.3 | Very high | 95.2 | Very high | 59 Ų | 59 | 59.7 Ų | 59.7 | 41% | 0.413 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.9 | -36.9 | 179.3 | 71.1 | 0 | 0 | 0 | 0 | 112.3 | V159 S160 Q161 M166 L167 | V159-S163 VanDerWaalsContact O-CB 3.26Å; V159-S163 WeakPolarHBondContact O-CB 3.49Å; V159-S163 PolarHBondContact O-N 3.3Å; V159-S163 PolarHBondContact O-OG 2.95Å; V159-S163 VanDerWaalsContact O-OG 3.11Å; S160-S163 WeakPolarHBondContact CA-OG 3.4Å; S160-S163 PolarHBondContact O-OG 3.38Å; S160-S163 VanDerWaalsContact O-OG 3.09Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 2.82Å; S163-M166 PolarHBondContact O-N 2.74Å; S163-L167 WeakPolarHBondContact O-CB 3.47Å; S163-L167 PolarHBondContact O-N 3.22Å |
| 164 | S | 97.5 | Very high | 95.4 | Very high | 9 Ų | 9 | 60.3 Ų | 60.3 | 6% | 0.063 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -61.8 | -45.2 | 175.2 | -61.7 | 0 | 0 | 0 | 0 | 111.6 | S160 Q161 V162 A168 | S160-S164 VanDerWaalsContact O-CB 3.28Å; S160-S164 WeakPolarHBondContact O-CB 3.16Å; S160-S164 PolarHBondContact O-N 3Å; S160-S164 PolarHBondContact O-OG 3.41Å; Q161-S164 PolarHBondContact O-N 2.88Å; V162-S164 VanDerWaalsContact C-N 3.31Å; V162-S164 PolarHBondContact O-N 2.96Å; S164-A168 VanDerWaalsContact O-CB 3.23Å; S164-A168 WeakPolarHBondContact O-CB 3.47Å; S164-A168 PolarHBondContact O-N 3.48Å |
| 165 | W | 98.1 | Very high | 95.5 | Very high | 42 Ų | 42 | 55.5 Ų | 55.5 | 16% | 0.159 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66 | -45.7 | 176.8 | -81.4 | 100.5 | 0 | 0 | 0 | 112.5 | H81 V84 A85 L88 A126 L130 Q161 V162 L167 A168 L169 | H81-W165 AromaticContact CG-NE1 3.89Å; H81-W165 AromaticContact ND1-CD1 3.72Å; H81-W165 AromaticContact ND1-NE1 3.07Å; H81-W165 PolarHBondContact ND1-NE1 3.33Å; V84-W165 HydrophobicContact CG1-CH2 4.31Å; V84-W165 HydrophobicContact CG1-CZ2 4.24Å; A85-W165 HydrophobicContact CB-CH2 4.11Å; A85-W165 HydrophobicContact CB-CZ2 4.24Å; L88-W165 HydrophobicContact CD1-CH2 3.97Å; L88-W165 HydrophobicContact CD1-CZ3 4.17Å; A126-W165 HydrophobicContact CB-CE3 4.27Å; A126-W165 HydrophobicContact CB-CH2 4.07Å; A126-W165 HydrophobicContact CB-CZ2 4.46Å; A126-W165 HydrophobicContact CB-CZ3 3.96Å; L130-W165 HydrophobicContact CD1-CZ2 4.34Å; Q161-W165 VanDerWaalsContact O-CD1 3.27Å; Q161-W165 PolarHBondContact O-N 3.19Å; Q161-W165 VanDerWaalsContact O-N 3.12Å; V162-W165 PolarHBondContact O-N 3.43Å; W165-L167 VanDerWaalsContact C-N 3.34Å; W165-L167 PolarHBondContact O-N 3.22Å; W165-A168 PolarHBondContact O-N 2.89Å; W165-L169 WeakPolarHBondContact O-CB 3.49Å; W165-L169 WeakPolarHBondContact O-CG 3.44Å; W165-L169 PolarHBondContact O-N 3.24Å |
| 166 | M | 98.1 | Very high | 95.6 | Very high | 119 Ų | 119 | 52 Ų | 52 | 59% | 0.586 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -63.1 | -42.1 | 178.6 | -67.5 | -54.6 | -63.3 | 0 | 0 | 111.8 | V162 S163 L169 L170 | V162-M166 HydrophobicContact CG1-CG 4.18Å; V162-M166 VanDerWaalsContact O-CG 3.29Å; V162-M166 WeakPolarHBondContact O-CG 3.4Å; V162-M166 PolarHBondContact O-N 3.42Å; S163-M166 PolarHBondContact O-N 2.74Å; M166-L169 PolarHBondContact O-N 3.22Å; M166-L169 HydrophobicContact SD-CD1 4.4Å; M166-L170 WeakPolarHBondContact O-CB 3.32Å; M166-L170 PolarHBondContact O-N 3.15Å |
| 167 | L | 97.6 | Very high | 95.6 | Very high | 70 Ų | 70 | 54.3 Ų | 54.3 | 37% | 0.366 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -67.4 | -40.3 | 176.2 | -176.8 | 60.1 | 0 | 0 | 0 | 111.4 | L129 S163 W165 L169 L170 L171 | L129-L167 HydrophobicContact CD1-CB 4.03Å; L129-L167 HydrophobicContact CD1-CD2 3.97Å; L129-L167 HydrophobicContact CD1-CG 3.92Å; L129-L167 HydrophobicContact CD2-CD2 4.05Å; S163-L167 WeakPolarHBondContact O-CB 3.47Å; S163-L167 PolarHBondContact O-N 3.22Å; W165-L167 VanDerWaalsContact C-N 3.34Å; W165-L167 PolarHBondContact O-N 3.22Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-L169 PolarHBondContact O-N 3.48Å; L167-L170 HydrophobicContact CD1-CD2 4.41Å; L167-L170 PolarHBondContact O-N 3.44Å; L167-L171 HydrophobicContact CD1-CD1 4.18Å; L167-L171 HydrophobicContact CD1-CG 4.12Å; L167-L171 HydrophobicContact CG-CD1 3.95Å; L167-L171 HydrophobicContact CG-CG 4.33Å; L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 VanDerWaalsContact O-CG 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.32Å; L167-L171 PolarHBondContact O-N 3.09Å |
| 168 | A | 97.8 | Very high | 95.8 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L122 A126 L129 S164 W165 L171 T172 | L122-A168 HydrophobicContact CD1-CB 3.79Å; A126-A168 HydrophobicContact CB-CB 4.15Å; L129-A168 HydrophobicContact CD1-CB 4.11Å; S164-A168 VanDerWaalsContact O-CB 3.23Å; S164-A168 WeakPolarHBondContact O-CB 3.47Å; S164-A168 PolarHBondContact O-N 3.48Å; W165-A168 PolarHBondContact O-N 2.89Å; A168-L171 PolarHBondContact O-N 3.42Å; A168-T172 WeakPolarHBondContact O-CB 3.43Å; A168-T172 PolarHBondContact O-N 3.14Å; A168-T172 VanDerWaalsContact O-N 3.07Å; A168-T172 PolarHBondContact O-OG1 3.17Å |
| 169 | L | 97.4 | Very high | 95.8 | Very high | 83 Ų | 83 | 51.1 Ų | 51.1 | 44% | 0.435 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.6 | -46.4 | 174.1 | -74.1 | 166 | 0 | 0 | 0 | 111.2 | L122 W165 M166 L167 T172 V173 | L122-L169 HydrophobicContact CD1-CD2 3.82Å; L122-L169 HydrophobicContact CD1-CG 3.99Å; L122-L169 HydrophobicContact CD2-CD2 3.89Å; W165-L169 WeakPolarHBondContact O-CB 3.49Å; W165-L169 WeakPolarHBondContact O-CG 3.44Å; W165-L169 PolarHBondContact O-N 3.24Å; M166-L169 PolarHBondContact O-N 3.22Å; M166-L169 HydrophobicContact SD-CD1 4.4Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-L169 PolarHBondContact O-N 3.48Å; L169-T172 WeakPolarHBondContact O-CB 3.32Å; L169-T172 PolarHBondContact O-N 3.47Å; L169-T172 VanDerWaalsContact O-N 3.16Å; L169-V173 PolarHBondContact O-N 3.49Å |
| 170 | L | 97.4 | Very high | 95.8 | Very high | 115 Ų | 115 | 50.2 Ų | 50.2 | 60% | 0.602 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -59.8 | -47.9 | 177.6 | -179.8 | 63.5 | 0 | 0 | 0 | 112 | M166 L167 T172 V173 | M166-L170 WeakPolarHBondContact O-CB 3.32Å; M166-L170 PolarHBondContact O-N 3.15Å; L167-L170 HydrophobicContact CD1-CD2 4.41Å; L167-L170 PolarHBondContact O-N 3.44Å; L170-T172 PolarHBondContact O-N 3.36Å; L170-V173 WeakPolarHBondContact O-CB 3.36Å; L170-V173 WeakPolarHBondContact O-CG2 3.22Å; L170-V173 PolarHBondContact O-N 2.9Å |
| 171 | L | 96.3 | Very high | 95.7 | Very high | 26 Ų | 26 | 50.5 Ų | 50.5 | 14% | 0.136 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.5 | -17.7 | 179 | -68.5 | 173.6 | 0 | 0 | 0 | 113.1 | Y125 L129 L167 A168 P174 V209 F213 | Y125-L171 HydrophobicContact CD1-CB 4.2Å; Y125-L171 HydrophobicContact CD1-CD1 3.81Å; Y125-L171 HydrophobicContact CD2-CB 3.68Å; Y125-L171 HydrophobicContact CE1-CB 4.12Å; Y125-L171 HydrophobicContact CE1-CD1 3.93Å; Y125-L171 HydrophobicContact CE2-CB 3.57Å; Y125-L171 VanDerWaalsContact CE2-O 3.3Å; Y125-L171 WeakPolarHBondContact CE2-O 3.5Å; Y125-L171 HydrophobicContact CG-CB 3.99Å; Y125-L171 HydrophobicContact CG-CD1 4.23Å; L129-L171 HydrophobicContact CD1-CD1 4.49Å; L167-L171 HydrophobicContact CD1-CD1 4.18Å; L167-L171 HydrophobicContact CD1-CG 4.12Å; L167-L171 HydrophobicContact CG-CD1 3.95Å; L167-L171 HydrophobicContact CG-CG 4.33Å; L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 VanDerWaalsContact O-CG 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.32Å; L167-L171 PolarHBondContact O-N 3.09Å; A168-L171 PolarHBondContact O-N 3.42Å; L171-P174 WeakPolarHBondContact O-CD 3.46Å; L171-V209 HydrophobicContact CD2-CG1 4.1Å; L171-F213 HydrophobicContact CD1-CB 4.11Å |
| 172 | T | 97 | Very high | 95.6 | Very high | 9 Ų | 9 | 53.5 Ų | 53.5 | 6% | 0.055 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -83.2 | -20.1 | 176.5 | -61.7 | 0 | 0 | 0 | 0 | 112.8 | S118 T121 L122 A168 L169 L170 P174 S175 A176 | S118-T172 VanDerWaalsContact O-CG2 3.22Å; S118-T172 WeakPolarHBondContact O-CG2 3.42Å; T121-T172 HydrophobicContact CG2-CG2 4.24Å; L122-T172 VanDerWaalsContact CA-OG1 3.28Å; L122-T172 WeakPolarHBondContact CA-OG1 3.45Å; L122-T172 HydrophobicContact CB-CG2 4.2Å; L122-T172 PolarHBondContact N-OG1 3.45Å; A168-T172 WeakPolarHBondContact O-CB 3.43Å; A168-T172 PolarHBondContact O-N 3.14Å; A168-T172 VanDerWaalsContact O-N 3.07Å; A168-T172 PolarHBondContact O-OG1 3.17Å; L169-T172 WeakPolarHBondContact O-CB 3.32Å; L169-T172 PolarHBondContact O-N 3.47Å; L169-T172 VanDerWaalsContact O-N 3.16Å; L170-T172 PolarHBondContact O-N 3.36Å; T172-P174 VanDerWaalsContact C-CD 3.48Å; T172-S175 WeakPolarHBondContact O-CA 3.22Å; T172-S175 WeakPolarHBondContact O-CB 3.49Å; T172-S175 PolarHBondContact O-N 2.96Å; T172-A176 PolarHBondContact O-N 3.3Å |
| 173 | V | 95.9 | Very high | 95.4 | Very high | 77 Ų | 77 | 53.1 Ų | 53.1 | 47% | 0.467 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -51 | -45.9 | -177.7 | 174 | 0 | 0 | 0 | 0 | 113.3 | L169 L170 S175 A176 V177 | L169-V173 PolarHBondContact O-N 3.49Å; L170-V173 WeakPolarHBondContact O-CB 3.36Å; L170-V173 WeakPolarHBondContact O-CG2 3.22Å; L170-V173 PolarHBondContact O-N 2.9Å; V173-S175 PolarHBondContact O-N 3.47Å; V173-A176 WeakPolarHBondContact O-CB 3.06Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-V177 HydrophobicContact CG1-CG2 4.07Å; V173-V177 WeakPolarHBondContact O-CG2 3.32Å; V173-V177 PolarHBondContact O-N 2.99Å |
| 174 | P | 93.1 | Very high | 95 | Very high | 43 Ų | 43 | 53.7 Ų | 53.7 | 28% | 0.279 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -57.5 | -36.7 | 177.3 | -25.1 | 35.6 | 0 | 0 | 0 | 112.9 | L171 T172 A176 V177 Y178 I206 | L171-P174 WeakPolarHBondContact O-CD 3.46Å; T172-P174 VanDerWaalsContact C-CD 3.48Å; P174-A176 VanDerWaalsContact C-N 3.35Å; P174-A176 PolarHBondContact O-N 3.48Å; P174-V177 PolarHBondContact O-N 3.41Å; P174-Y178 HydrophobicContact CB-CD2 4.15Å; P174-Y178 HydrophobicContact CB-CE2 4.38Å; P174-Y178 WeakPolarHBondContact O-CB 3.41Å; P174-Y178 WeakPolarHBondContact O-CD2 3.27Å; P174-Y178 PolarHBondContact O-N 3.12Å; P174-I206 HydrophobicContact CB-CD1 4.08Å; P174-I206 HydrophobicContact CB-CG1 4.24Å; P174-I206 HydrophobicContact CB-CG2 4.36Å |
| 175 | S | 91.6 | Very high | 94.4 | Very high | 4 Ų | 4 | 59.6 Ų | 59.6 | 3% | 0.028 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.6 | -45 | 176.2 | -170.7 | 0 | 0 | 0 | 0 | 111.3 | S117 T121 T172 V173 V177 H179 | S117-S175 PolarHBondContact O-OG 3.39Å; T121-S175 PolarHBondContact OG1-OG 3.47Å; T172-S175 WeakPolarHBondContact O-CA 3.22Å; T172-S175 WeakPolarHBondContact O-CB 3.49Å; T172-S175 PolarHBondContact O-N 2.96Å; V173-S175 PolarHBondContact O-N 3.47Å; S175-V177 VanDerWaalsContact C-N 3.32Å; S175-V177 PolarHBondContact O-N 3.38Å; S175-H179 WeakPolarHBondContact O-CB 3.38Å; S175-H179 PolarHBondContact O-N 2.92Å; S175-H179 PolarHBondContact O-ND1 3.24Å; S175-H179 PolarHBondContact OG-CE1 3.43Å; S175-H179 VanDerWaalsContact OG-CE1 3.29Å; S175-H179 PolarHBondContact OG-ND1 2.86Å |
| 176 | A | 91.9 | Very high | 93.6 | Very high | 35 Ų | 35 | 67 Ų | 67 | 29% | 0.289 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65 | -36.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | S118 T172 V173 P174 | S118-A176 WeakPolarHBondContact OG-CA 3.24Å; S118-A176 VanDerWaalsContact OG-CB 3.29Å; S118-A176 WeakPolarHBondContact OG-CB 3.44Å; S118-A176 PolarHBondContact OG-N 2.9Å; T172-A176 PolarHBondContact O-N 3.3Å; V173-A176 WeakPolarHBondContact O-CB 3.06Å; V173-A176 PolarHBondContact O-N 3.29Å; P174-A176 VanDerWaalsContact C-N 3.35Å; P174-A176 PolarHBondContact O-N 3.48Å |
| 177 | V | 94.1 | Very high | 92.9 | Very high | 69 Ų | 69 | 65.5 Ų | 65.5 | 42% | 0.418 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -76.2 | -44.6 | -175.4 | 172.7 | 0 | 0 | 0 | 0 | 111.8 | V173 P174 S175 R180 | V173-V177 HydrophobicContact CG1-CG2 4.07Å; V173-V177 WeakPolarHBondContact O-CG2 3.32Å; V173-V177 PolarHBondContact O-N 2.99Å; P174-V177 PolarHBondContact O-N 3.41Å; S175-V177 VanDerWaalsContact C-N 3.32Å; S175-V177 PolarHBondContact O-N 3.38Å; V177-R180 VanDerWaalsContact O-CZ 3.3Å; V177-R180 PolarHBondContact O-NH1 3.44Å; V177-R180 PolarHBondContact O-NH2 2.87Å |
| 178 | Y | 93.6 | Very high | 92.5 | Very high | 61 Ų | 61 | 66.5 Ų | 66.5 | 24% | 0.239 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -95.4 | -12.8 | -169.9 | -66.5 | -71.8 | 0 | 0 | 0 | 114.4 | P174 R180 D195 Y196 T202 I206 | P174-Y178 HydrophobicContact CB-CD2 4.15Å; P174-Y178 HydrophobicContact CB-CE2 4.38Å; P174-Y178 WeakPolarHBondContact O-CB 3.41Å; P174-Y178 WeakPolarHBondContact O-CD2 3.27Å; P174-Y178 PolarHBondContact O-N 3.12Å; Y178-R180 PolarHBondContact O-N 3.17Å; Y178-D195 WeakPolarHBondContact CD1-O 3.46Å; Y178-D195 PolarHBondContact O-N 3.49Å; Y178-Y196 AromaticContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD2-CD1 4.29Å; Y178-Y196 HydrophobicContact CD2-CE1 4.33Å; Y178-Y196 HydrophobicContact CE1-CD1 4.44Å; Y178-Y196 AromaticContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CE1 4.1Å; Y178-T202 HydrophobicContact CE1-CG2 4.06Å; Y178-T202 HydrophobicContact CE2-CG2 4.22Å; Y178-T202 WeakPolarHBondContact OH-CG2 3.46Å; Y178-I206 HydrophobicContact CD2-CD1 3.51Å; Y178-I206 HydrophobicContact CE2-CD1 3.41Å; Y178-I206 VanDerWaalsContact CE2-CD1 3.41Å; Y178-I206 HydrophobicContact CG-CD1 4.39Å |
| 179 | H | 94 | Very high | 92.2 | Very high | 22 Ų | 22 | 70.1 Ų | 70.1 | 10% | 0.102 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.1 | 130.7 | 170.2 | -77.7 | 83.6 | 0 | 0 | 0 | 111.2 | S117 S175 A193 T194 | S117-H179 PolarHBondContact OG-CD2 2.87Å; S117-H179 VanDerWaalsContact OG-CD2 3.3Å; S175-H179 WeakPolarHBondContact O-CB 3.38Å; S175-H179 PolarHBondContact O-N 2.92Å; S175-H179 PolarHBondContact O-ND1 3.24Å; S175-H179 PolarHBondContact OG-CE1 3.43Å; S175-H179 VanDerWaalsContact OG-CE1 3.29Å; S175-H179 PolarHBondContact OG-ND1 2.86Å; H179-A193 WeakPolarHBondContact CA-O 3.23Å; H179-T194 VanDerWaalsContact CE1-CG2 3.47Å; H179-T194 WeakPolarHBondContact CE1-CG2 3.17Å; H179-T194 WeakPolarHBondContact NE2-CG2 3.28Å |
| 180 | R | 94.3 | Very high | 92 | Very high | 65 Ų | 65 | 68.4 Ų | 68.4 | 25% | 0.245 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.2 | 149.6 | -177.3 | -71.9 | -68.3 | -176.8 | -89.5 | -3.6 | 110.2 | C113 V177 Y178 H182 A193 D195 | C113-R180 PolarHBondContact SG-O 3.26Å; V177-R180 VanDerWaalsContact O-CZ 3.3Å; V177-R180 PolarHBondContact O-NH1 3.44Å; V177-R180 PolarHBondContact O-NH2 2.87Å; Y178-R180 PolarHBondContact O-N 3.17Å; R180-H182 WeakPolarHBondContact CB-NE2 3.34Å; R180-A193 PolarHBondContact N-O 2.94Å; R180-A193 PolarHBondContact O-N 3.36Å; R180-D195 HydrophobicContact CB-CB 4.11Å; R180-D195 HydrophobicContact CG-CB 4Å |
| 181 | L | 95.2 | Very high | 91.8 | Very high | 51 Ų | 51 | 64.3 Ų | 64.3 | 27% | 0.267 | 33% | 0.333 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 123.2 | 172.8 | -170 | 72.6 | 0 | 0 | 0 | 107.7 | W106 A110 L190 V191 | W106-L181 HydrophobicContact CB-CD1 4.12Å; W106-L181 HydrophobicContact CG-CD1 3.95Å; A110-L181 HydrophobicContact CB-CB 4.22Å; A110-L181 HydrophobicContact CB-CD2 4.49Å; L181-L190 HydrophobicContact CD1-CB 4.12Å; L181-L190 HydrophobicContact CD2-CD1 4.4Å; L181-L190 HydrophobicContact CD2-CD2 3.92Å; L181-L190 HydrophobicContact CG-CD2 4.03Å; L181-V191 WeakPolarHBondContact CA-O 3.37Å |
| 182 | H | 92.6 | Very high | 91.7 | Very high | 71 Ų | 71 | 64.4 Ų | 64.4 | 33% | 0.329 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 144.7 | 178.3 | -66.1 | -81.7 | 0 | 0 | 0 | 110.2 | R180 L190 V191 D195 | R180-H182 WeakPolarHBondContact CB-NE2 3.34Å; H182-L190 CarbonylContact O-C 3.56Å; H182-L190 WeakPolarHBondContact O-CA 3.45Å; H182-V191 PolarHBondContact N-O 2.92Å; H182-V191 PolarHBondContact O-N 3.44Å; H182-D195 IonicContact CE1-OD2 2.74Å |
| 183 | Q | 92.6 | Very high | 91.4 | Very high | 85 Ų | 85 | 65.8 Ų | 65.8 | 40% | 0.397 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.7 | 112.9 | 169 | -175.7 | 71.4 | 31.4 | 0 | 0 | 108.2 | H185 S188 | Q183-H185 PolarHBondContact O-ND1 3.29Å; Q183-S188 PolarHBondContact NE2-OG 2.87Å |
| 184 | E | 88.3 | Confident | 91.1 | Very high | 71 Ų | 71 | 64.5 Ų | 64.5 | 33% | 0.332 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.7 | 137.5 | 163.2 | -67.7 | -175.5 | 177 | 0 | 0 | 108.2 | S188 R189 V191 | E184-S188 CarbonylContact O-C 3.59Å; E184-S188 VanDerWaalsContact O-CA 3.25Å; E184-S188 WeakPolarHBondContact O-CA 3.33Å; E184-R189 HydrophobicContact CB-CG 4.06Å; E184-R189 PolarHBondContact N-O 2.99Å; E184-R189 PolarHBondContact O-N 3.24Å; E184-R189 IonicContact OE2-CZ 3.19Å; E184-R189 IonicContact OE2-NE 2.76Å; E184-R189 PolarHBondContact OE2-NE 2.92Å; E184-R189 IonicContact OE2-NH2 3.19Å; E184-R189 PolarHBondContact OE2-NH2 3.27Å; E184-V191 HydrophobicContact CG-CG2 3.97Å |
| 185 | H | 85.3 | Confident | 90.9 | Very high | 133 Ų | 133 | 65.2 Ų | 65.2 | 62% | 0.616 | 34% | 0.341 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -97.6 | -20.1 | -176.1 | -65.7 | 78.9 | 0 | 0 | 0 | 112.4 | Q183 P187 S188 | Q183-H185 PolarHBondContact O-ND1 3.29Å; H185-P187 CarbonylContact O-C 3.55Å; H185-S188 PolarHBondContact O-N 2.96Å |
| 186 | F | 81.5 | Confident | 90.7 | Very high | 197 Ų | 197 | 65.9 Ų | 65.9 | 86% | 0.864 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -137.8 | 98.5 | -175.5 | -58.9 | -77.2 | 0 | 0 | 0 | 111.1 | ||
| 187 | P | 83.3 | Confident | 90.5 | Very high | 89 Ų | 89 | 73.5 Ų | 73.5 | 58% | 0.578 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -67.6 | 158.9 | -14 | 31.3 | -35.3 | 0 | 0 | 0 | 111.7 | H185 R189 | H185-P187 CarbonylContact O-C 3.55Å; P187-R189 PolarHBondContact O-N 3.44Å; P187-R189 VanDerWaalsContact O-N 3.09Å |
| 188 | S | 89.1 | Confident | 89.8 | Confident | 91 Ų | 91 | 73.5 Ų | 73.5 | 64% | 0.636 | 38% | 0.379 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66.1 | 110.5 | 179.3 | -173 | 0 | 0 | 0 | 0 | 111.3 | Q183 E184 H185 | Q183-S188 PolarHBondContact NE2-OG 2.87Å; E184-S188 CarbonylContact O-C 3.59Å; E184-S188 VanDerWaalsContact O-CA 3.25Å; E184-S188 WeakPolarHBondContact O-CA 3.33Å; H185-S188 PolarHBondContact O-N 2.96Å |
| 189 | R | 91.3 | Very high | 89.7 | Confident | 76 Ų | 76 | 72.7 Ų | 72.7 | 29% | 0.287 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -156.1 | 154.4 | 176.6 | 62.7 | -179.6 | -179.6 | -172.3 | -1.6 | 112.3 | K103 H105 E184 P187 V191 | K103-R189 PolarHBondContact O-NH1 3.35Å; H105-R189 HydrophobicContact CB-CB 4.38Å; E184-R189 HydrophobicContact CB-CG 4.06Å; E184-R189 PolarHBondContact N-O 2.99Å; E184-R189 PolarHBondContact O-N 3.24Å; E184-R189 IonicContact OE2-CZ 3.19Å; E184-R189 IonicContact OE2-NE 2.76Å; E184-R189 PolarHBondContact OE2-NE 2.92Å; E184-R189 IonicContact OE2-NH2 3.19Å; E184-R189 PolarHBondContact OE2-NH2 3.27Å; P187-R189 PolarHBondContact O-N 3.44Å; P187-R189 VanDerWaalsContact O-N 3.09Å; R189-V191 HydrophobicContact CG-CG2 3.94Å |
| 190 | L | 93.8 | Very high | 89.4 | Confident | 47 Ų | 47 | 78.3 Ų | 78.3 | 25% | 0.246 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 132.2 | 169.7 | -69.9 | 169 | 0 | 0 | 0 | 109.1 | H105 W106 L181 H182 | H105-L190 CarbonylContact C-O 3.52Å; H105-L190 WeakPolarHBondContact CA-O 3.29Å; H105-L190 PolarHBondContact ND1-N 3.1Å; W106-L190 HydrophobicContact CB-CB 4.41Å; W106-L190 WeakPolarHBondContact CB-O 3.5Å; W106-L190 PolarHBondContact N-O 3.2Å; L181-L190 HydrophobicContact CD1-CB 4.12Å; L181-L190 HydrophobicContact CD2-CD1 4.4Å; L181-L190 HydrophobicContact CD2-CD2 3.92Å; L181-L190 HydrophobicContact CG-CD2 4.03Å; H182-L190 CarbonylContact O-C 3.56Å; H182-L190 WeakPolarHBondContact O-CA 3.45Å |
| 191 | V | 92.7 | Very high | 89.3 | Confident | 29 Ų | 29 | 78.8 Ų | 78.8 | 18% | 0.176 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.9 | 136.2 | 178 | -176.9 | 0 | 0 | 0 | 0 | 109.3 | L181 H182 E184 R189 | L181-V191 WeakPolarHBondContact CA-O 3.37Å; H182-V191 PolarHBondContact N-O 2.92Å; H182-V191 PolarHBondContact O-N 3.44Å; E184-V191 HydrophobicContact CG-CG2 3.97Å; R189-V191 HydrophobicContact CG-CG2 3.94Å |
| 192 | C | 94.1 | Very high | 89.2 | Confident | 27 Ų | 27 | 78.2 Ų | 78.2 | 18% | 0.182 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.4 | 115.6 | 170.8 | 179.5 | 0 | 0 | 0 | 0 | 108.8 | W106 C113 | W106-C192 HydrophobicContact CB-CB 4.47Å; W106-C192 HydrophobicContact CD2-CB 3.61Å; W106-C192 HydrophobicContact CE3-CB 3.73Å; W106-C192 HydrophobicContact CG-CB 3.92Å; W106-C192 HydrophobicContact CZ3-CB 4.2Å; C113-C192 WeakPolarHBondContact CA-SG 3.22Å; C113-C192 HydrophobicContact CB-CB 3.73Å; C113-C192 WeakPolarHBondContact CB-SG 3.29Å; C113-C192 PolarHBondContact O-SG 2.86Å; C113-C192 VanDerWaalsContact SG-CA 3.54Å; C113-C192 WeakPolarHBondContact SG-CB 3.25Å; C113-C192 CovalentContact SG-SG 2.03Å; C113-C192 PolarHBondContact SG-SG 3Å |
| 193 | A | 90.8 | Very high | 89.1 | Confident | 38 Ų | 38 | 77 Ų | 77 | 31% | 0.314 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 164.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | H179 R180 | H179-A193 WeakPolarHBondContact CA-O 3.23Å; R180-A193 PolarHBondContact N-O 2.94Å; R180-A193 PolarHBondContact O-N 3.36Å |
| 194 | T | 89.9 | Confident | 89.1 | Confident | 51 Ų | 51 | 75.2 Ų | 75.2 | 31% | 0.313 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 125.2 | 171.9 | 49.5 | 0 | 0 | 0 | 0 | 110.5 | H179 | H179-T194 VanDerWaalsContact CE1-CG2 3.47Å; H179-T194 WeakPolarHBondContact CE1-CG2 3.17Å; H179-T194 WeakPolarHBondContact NE2-CG2 3.28Å |
| 195 | D | 89.6 | Confident | 89.4 | Confident | 57 Ų | 57 | 74.3 Ų | 74.3 | 31% | 0.305 | 43% | 0.427 | S | S | . | . | trans | -118.5 | 101.1 | 175.7 | 176.5 | 7.1 | 0 | 0 | 0 | 110.1 | Y178 R180 H182 R197 | Y178-D195 WeakPolarHBondContact CD1-O 3.46Å; Y178-D195 PolarHBondContact O-N 3.49Å; R180-D195 HydrophobicContact CB-CB 4.11Å; R180-D195 HydrophobicContact CG-CB 4Å; H182-D195 IonicContact CE1-OD2 2.74Å; D195-R197 PolarHBondContact O-N 3.35Å; D195-R197 WeakPolarHBondContact OD1-CA 3.22Å; D195-R197 PolarHBondContact OD1-N 3.45Å | ||
| 196 | Y | 87.4 | Confident | 89.8 | Confident | 19 Ų | 19 | 69.1 Ų | 69.1 | 8% | 0.075 | 40% | 0.404 | C | S | . | . | trans | -85.4 | 18 | 177 | -55.5 | -69.5 | 0 | 0 | 0 | 113.4 | Y178 G198 S199 T202 E203 I206 | Y178-Y196 AromaticContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD2-CD1 4.29Å; Y178-Y196 HydrophobicContact CD2-CE1 4.33Å; Y178-Y196 HydrophobicContact CE1-CD1 4.44Å; Y178-Y196 AromaticContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CE1 4.1Å; Y196-G198 PolarHBondContact O-N 3.04Å; Y196-G198 VanDerWaalsContact O-N 3.17Å; Y196-S199 WeakPolarHBondContact O-CB 3.15Å; Y196-S199 PolarHBondContact O-N 2.67Å; Y196-T202 HydrophobicContact CD1-CG2 4.27Å; Y196-E203 HydrophobicContact CD2-CB 3.52Å; Y196-E203 HydrophobicContact CD2-CG 3.56Å; Y196-E203 HydrophobicContact CE2-CB 3.91Å; Y196-E203 HydrophobicContact CE2-CG 3.49Å; Y196-E203 VanDerWaalsContact CE2-CG 3.49Å; Y196-E203 HydrophobicContact CG-CB 3.86Å; Y196-E203 HydrophobicContact CG-CG 4.36Å; Y196-I206 HydrophobicContact CD1-CD1 3.83Å; Y196-I206 HydrophobicContact CE1-CB 4.39Å; Y196-I206 HydrophobicContact CE1-CD1 3.52Å; Y196-I206 HydrophobicContact CE1-CG2 4.36Å | ||
| 197 | R | 86.1 | Confident | 90.3 | Very high | 195 Ų | 195 | 60.2 Ų | 60.2 | 74% | 0.736 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 32.9 | 179.4 | -57 | 177.5 | 174.1 | -89.7 | 7.3 | 113.4 | D195 S199 | D195-R197 PolarHBondContact O-N 3.35Å; D195-R197 WeakPolarHBondContact OD1-CA 3.22Å; D195-R197 PolarHBondContact OD1-N 3.45Å; R197-S199 VanDerWaalsContact C-N 3.27Å; R197-S199 PolarHBondContact O-N 2.91Å |
| 198 | G | 81.4 | Confident | 90.9 | Very high | 69 Ų | 69 | 58.1 Ų | 58.1 | 71% | 0.711 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.9 | 5.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | Y196 L200 | Y196-G198 PolarHBondContact O-N 3.04Å; Y196-G198 VanDerWaalsContact O-N 3.17Å; G198-L200 PolarHBondContact O-N 3.44Å |
| 199 | S | 90.6 | Very high | 91.1 | Very high | 43 Ų | 43 | 56.7 Ų | 56.7 | 30% | 0.301 | 34% | 0.343 | S | S | . | . | trans | -85.3 | 99 | 178.1 | 178 | 0 | 0 | 0 | 0 | 111.7 | Y196 R197 A201 T202 E203 | Y196-S199 WeakPolarHBondContact O-CB 3.15Å; Y196-S199 PolarHBondContact O-N 2.67Å; R197-S199 VanDerWaalsContact C-N 3.27Å; R197-S199 PolarHBondContact O-N 2.91Å; S199-A201 PolarHBondContact O-N 3.5Å; S199-T202 WeakPolarHBondContact CB-OG1 3.35Å; S199-T202 PolarHBondContact O-N 2.94Å; S199-T202 WeakPolarHBondContact OG-CB 3.48Å; S199-T202 PolarHBondContact OG-N 3.32Å; S199-T202 VanDerWaalsContact OG-N 3.16Å; S199-T202 PolarHBondContact OG-OG1 3.39Å; S199-E203 PolarHBondContact O-N 3.25Å; S199-E203 VanDerWaalsContact O-N 3.08Å | ||
| 200 | L | 88.4 | Confident | 91.3 | Very high | 140 Ų | 140 | 54 Ų | 54 | 73% | 0.733 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -58.6 | -36 | 173.7 | -71.8 | 99.2 | 0 | 0 | 0 | 112.1 | G198 T202 E203 A204 | G198-L200 PolarHBondContact O-N 3.44Å; L200-T202 PolarHBondContact O-N 3.3Å; L200-E203 PolarHBondContact O-N 3.49Å; L200-A204 VanDerWaalsContact O-CB 3.28Å; L200-A204 WeakPolarHBondContact O-CB 3.33Å; L200-A204 PolarHBondContact O-N 3.32Å |
| 201 | A | 91.6 | Very high | 91.3 | Very high | 75 Ų | 75 | 54.5 Ų | 54.5 | 62% | 0.62 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -64.8 | -40.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | S199 A205 | S199-A201 PolarHBondContact O-N 3.5Å; A201-A205 WeakPolarHBondContact O-CB 3.35Å; A201-A205 PolarHBondContact O-N 3.05Å |
| 202 | T | 91.9 | Very high | 91.4 | Very high | 39 Ų | 39 | 57.2 Ų | 57.2 | 24% | 0.239 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -67.7 | -44.1 | 177.4 | -59.5 | 0 | 0 | 0 | 0 | 111.1 | Y178 Y196 S199 L200 A205 I206 | Y178-T202 HydrophobicContact CE1-CG2 4.06Å; Y178-T202 HydrophobicContact CE2-CG2 4.22Å; Y178-T202 WeakPolarHBondContact OH-CG2 3.46Å; Y196-T202 HydrophobicContact CD1-CG2 4.27Å; S199-T202 WeakPolarHBondContact CB-OG1 3.35Å; S199-T202 PolarHBondContact O-N 2.94Å; S199-T202 WeakPolarHBondContact OG-CB 3.48Å; S199-T202 PolarHBondContact OG-N 3.32Å; S199-T202 VanDerWaalsContact OG-N 3.16Å; S199-T202 PolarHBondContact OG-OG1 3.39Å; L200-T202 PolarHBondContact O-N 3.3Å; T202-A205 PolarHBondContact O-N 3.48Å; T202-I206 HydrophobicContact CG2-CD1 3.73Å; T202-I206 WeakPolarHBondContact O-CB 3.23Å; T202-I206 VanDerWaalsContact O-CG1 3.29Å; T202-I206 WeakPolarHBondContact O-CG1 3.5Å; T202-I206 PolarHBondContact O-N 2.9Å |
| 203 | E | 92 | Very high | 91.3 | Very high | 46 Ų | 46 | 61 Ų | 61 | 22% | 0.215 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59 | -52.1 | 175.3 | -178.8 | 173 | 178.4 | 0 | 0 | 111.4 | Y196 S199 L200 A205 I206 T207 T263 | Y196-E203 HydrophobicContact CD2-CB 3.52Å; Y196-E203 HydrophobicContact CD2-CG 3.56Å; Y196-E203 HydrophobicContact CE2-CB 3.91Å; Y196-E203 HydrophobicContact CE2-CG 3.49Å; Y196-E203 VanDerWaalsContact CE2-CG 3.49Å; Y196-E203 HydrophobicContact CG-CB 3.86Å; Y196-E203 HydrophobicContact CG-CG 4.36Å; S199-E203 PolarHBondContact O-N 3.25Å; S199-E203 VanDerWaalsContact O-N 3.08Å; L200-E203 PolarHBondContact O-N 3.49Å; E203-A205 VanDerWaalsContact C-N 3.34Å; E203-A205 PolarHBondContact O-N 3.4Å; E203-I206 PolarHBondContact O-N 3.29Å; E203-T207 WeakPolarHBondContact O-CB 3.33Å; E203-T207 PolarHBondContact O-N 2.78Å; E203-T207 PolarHBondContact O-OG1 3.3Å; E203-T263 HydrophobicContact CG-CG2 3.88Å; E203-T263 WeakPolarHBondContact OE1-CA 3.32Å; E203-T263 PolarHBondContact OE1-OG1 3.18Å |
| 204 | A | 92.3 | Very high | 91.4 | Very high | 47 Ų | 47 | 59.2 Ų | 59.2 | 39% | 0.388 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.5 | -43.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L200 T207 A208 T263 | L200-A204 VanDerWaalsContact O-CB 3.28Å; L200-A204 WeakPolarHBondContact O-CB 3.33Å; L200-A204 PolarHBondContact O-N 3.32Å; A204-T207 PolarHBondContact O-N 3.44Å; A204-A208 WeakPolarHBondContact O-CB 3.28Å; A204-A208 PolarHBondContact O-N 2.98Å; A204-T263 HydrophobicContact CB-CG2 4.37Å |
| 205 | A | 94.1 | Very high | 91.5 | Very high | 53 Ų | 53 | 57.6 Ų | 57.6 | 44% | 0.438 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.3 | -44.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | A201 T202 E203 A208 V209 | A201-A205 WeakPolarHBondContact O-CB 3.35Å; A201-A205 PolarHBondContact O-N 3.05Å; T202-A205 PolarHBondContact O-N 3.48Å; E203-A205 VanDerWaalsContact C-N 3.34Å; E203-A205 PolarHBondContact O-N 3.4Å; A205-A208 PolarHBondContact O-N 3.48Å; A205-V209 WeakPolarHBondContact O-CB 3.28Å; A205-V209 VanDerWaalsContact O-CG2 3.27Å; A205-V209 WeakPolarHBondContact O-CG2 3.39Å; A205-V209 PolarHBondContact O-N 3.32Å |
| 206 | I | 93.3 | Very high | 91.7 | Very high | 23 Ų | 23 | 57.6 Ų | 57.6 | 12% | 0.118 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -66.4 | -43.4 | 179 | -70 | 166.8 | 0 | 0 | 0 | 110.8 | P174 Y178 Y196 T202 E203 V209 R210 | P174-I206 HydrophobicContact CB-CD1 4.08Å; P174-I206 HydrophobicContact CB-CG1 4.24Å; P174-I206 HydrophobicContact CB-CG2 4.36Å; Y178-I206 HydrophobicContact CD2-CD1 3.51Å; Y178-I206 HydrophobicContact CE2-CD1 3.41Å; Y178-I206 VanDerWaalsContact CE2-CD1 3.41Å; Y178-I206 HydrophobicContact CG-CD1 4.39Å; Y196-I206 HydrophobicContact CD1-CD1 3.83Å; Y196-I206 HydrophobicContact CE1-CB 4.39Å; Y196-I206 HydrophobicContact CE1-CD1 3.52Å; Y196-I206 HydrophobicContact CE1-CG2 4.36Å; T202-I206 HydrophobicContact CG2-CD1 3.73Å; T202-I206 WeakPolarHBondContact O-CB 3.23Å; T202-I206 VanDerWaalsContact O-CG1 3.29Å; T202-I206 WeakPolarHBondContact O-CG1 3.5Å; T202-I206 PolarHBondContact O-N 2.9Å; E203-I206 PolarHBondContact O-N 3.29Å; I206-V209 PolarHBondContact O-N 3.26Å; I206-R210 VanDerWaalsContact O-CB 3.27Å; I206-R210 WeakPolarHBondContact O-CB 3.28Å; I206-R210 PolarHBondContact O-N 3.38Å |
| 207 | T | 93.1 | Very high | 92.1 | Very high | 11 Ų | 11 | 58.4 Ų | 58.4 | 7% | 0.067 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -62.9 | -42.5 | 176 | -68.1 | 0 | 0 | 0 | 0 | 111.2 | E203 A204 R210 F211 V260 T263 | E203-T207 WeakPolarHBondContact O-CB 3.33Å; E203-T207 PolarHBondContact O-N 2.78Å; E203-T207 PolarHBondContact O-OG1 3.3Å; A204-T207 PolarHBondContact O-N 3.44Å; T207-R210 PolarHBondContact O-N 3.25Å; T207-F211 WeakPolarHBondContact O-CB 3.23Å; T207-F211 PolarHBondContact O-N 2.94Å; T207-V260 HydrophobicContact CG2-CG2 4.19Å; T207-T263 PolarHBondContact OG1-OG1 3.06Å |
| 208 | A | 94.3 | Very high | 92.5 | Very high | 45 Ų | 45 | 49.6 Ų | 49.6 | 37% | 0.372 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.8 | -46.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A204 A205 R210 F211 L212 | A204-A208 WeakPolarHBondContact O-CB 3.28Å; A204-A208 PolarHBondContact O-N 2.98Å; A205-A208 PolarHBondContact O-N 3.48Å; A208-R210 VanDerWaalsContact C-N 3.32Å; A208-R210 PolarHBondContact O-N 2.78Å; A208-F211 PolarHBondContact O-N 2.97Å; A208-L212 WeakPolarHBondContact O-CB 3.16Å; A208-L212 VanDerWaalsContact O-CG 3.28Å; A208-L212 WeakPolarHBondContact O-CG 3.29Å; A208-L212 PolarHBondContact O-N 2.87Å |
| 209 | V | 94.6 | Very high | 93.1 | Very high | 60 Ų | 60 | 48.7 Ų | 48.7 | 36% | 0.364 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.3 | -45.7 | 175.4 | 168.2 | 0 | 0 | 0 | 0 | 110.3 | L171 A205 I206 F211 L212 F213 | L171-V209 HydrophobicContact CD2-CG1 4.1Å; A205-V209 WeakPolarHBondContact O-CB 3.28Å; A205-V209 VanDerWaalsContact O-CG2 3.27Å; A205-V209 WeakPolarHBondContact O-CG2 3.39Å; A205-V209 PolarHBondContact O-N 3.32Å; I206-V209 PolarHBondContact O-N 3.26Å; V209-F211 VanDerWaalsContact C-N 3.33Å; V209-F211 PolarHBondContact O-N 3.13Å; V209-L212 PolarHBondContact O-N 3.25Å; V209-F213 HydrophobicContact CG1-CD2 3.92Å; V209-F213 HydrophobicContact CG1-CE2 4.46Å; V209-F213 WeakPolarHBondContact O-CB 3.5Å; V209-F213 WeakPolarHBondContact O-CD2 3.27Å; V209-F213 PolarHBondContact O-N 3.31Å |
| 210 | R | 94.5 | Very high | 93.2 | Very high | 20 Ų | 20 | 51.3 Ų | 51.3 | 8% | 0.075 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 176.4 | -174.4 | -175 | -66 | 135 | -2.9 | 112 | M124 Y125 I206 T207 A208 G214 | M124-R210 HydrophobicContact CE-CG 3.85Å; Y125-R210 VanDerWaalsContact OH-CA 3.31Å; Y125-R210 WeakPolarHBondContact OH-CA 3.18Å; I206-R210 VanDerWaalsContact O-CB 3.27Å; I206-R210 WeakPolarHBondContact O-CB 3.28Å; I206-R210 PolarHBondContact O-N 3.38Å; T207-R210 PolarHBondContact O-N 3.25Å; A208-R210 VanDerWaalsContact C-N 3.32Å; A208-R210 PolarHBondContact O-N 2.78Å; R210-G214 WeakPolarHBondContact O-CA 3.48Å; R210-G214 PolarHBondContact O-N 3.39Å |
| 211 | F | 94.2 | Very high | 93.5 | Very high | 58 Ų | 58 | 48.6 Ų | 48.6 | 25% | 0.254 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -67.3 | -44.4 | 178.9 | -177.1 | -106 | 0 | 0 | 0 | 112.2 | T207 A208 V209 F215 L216 H256 V260 | T207-F211 WeakPolarHBondContact O-CB 3.23Å; T207-F211 PolarHBondContact O-N 2.94Å; A208-F211 PolarHBondContact O-N 2.97Å; V209-F211 VanDerWaalsContact C-N 3.33Å; V209-F211 PolarHBondContact O-N 3.13Å; F211-F215 HydrophobicContact CD2-CD1 4.26Å; F211-F215 AromaticContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CE1 4.2Å; F211-F215 HydrophobicContact CZ-CD1 4.13Å; F211-F215 CarbonylContact O-C 3.58Å; F211-F215 WeakPolarHBondContact O-CA 3.37Å; F211-F215 WeakPolarHBondContact O-CB 3.39Å; F211-F215 PolarHBondContact O-N 2.87Å; F211-F215 VanDerWaalsContact O-N 3.15Å; F211-L216 HydrophobicContact CD1-CB 4.29Å; F211-L216 HydrophobicContact CE1-CB 3.92Å; F211-L216 HydrophobicContact CE1-CD2 3.91Å; F211-L216 HydrophobicContact CE1-CG 4.44Å; F211-L216 HydrophobicContact CZ-CB 4.31Å; F211-L216 PolarHBondContact O-N 2.84Å; F211-H256 HydrophobicContact CD2-CB 4Å; F211-H256 HydrophobicContact CE2-CB 4.24Å; F211-V260 HydrophobicContact CD2-CG2 4.19Å; F211-V260 HydrophobicContact CG-CG2 4.47Å |
| 212 | L | 94.4 | Very high | 93.5 | Very high | 86 Ų | 86 | 45 Ų | 45 | 45% | 0.45 | 26% | 0.257 | S | S | . | . | I | π-helix | trans | -69.2 | -49.7 | -178.1 | -70.3 | 171.4 | 0 | 0 | 0 | 112.1 | A208 V209 L216 G217 P218 | A208-L212 WeakPolarHBondContact O-CB 3.16Å; A208-L212 VanDerWaalsContact O-CG 3.28Å; A208-L212 WeakPolarHBondContact O-CG 3.29Å; A208-L212 PolarHBondContact O-N 2.87Å; V209-L212 PolarHBondContact O-N 3.25Å; L212-L216 HydrophobicContact CD2-CD2 4.12Å; L212-G217 WeakPolarHBondContact O-CA 3.14Å; L212-G217 PolarHBondContact O-N 2.92Å; L212-P218 WeakPolarHBondContact O-CD 3.15Å |
| 213 | F | 93.1 | Very high | 93.4 | Very high | 106 Ų | 106 | 45.9 Ų | 45.9 | 47% | 0.465 | 27% | 0.268 | S | S | . | . | I | π-helix | trans | -89.1 | -25.6 | -174.9 | -69.7 | -83.9 | 0 | 0 | 0 | 113.7 | L171 V209 P218 | L171-F213 HydrophobicContact CD1-CB 4.11Å; V209-F213 HydrophobicContact CG1-CD2 3.92Å; V209-F213 HydrophobicContact CG1-CE2 4.46Å; V209-F213 WeakPolarHBondContact O-CB 3.5Å; V209-F213 WeakPolarHBondContact O-CD2 3.27Å; V209-F213 PolarHBondContact O-N 3.31Å; F213-P218 VanDerWaalsContact O-CG 3.22Å; F213-P218 WeakPolarHBondContact O-CG 3.35Å |
| 214 | G | 91.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 29% | 0.285 | C | S | . | . | I | π-helix | trans | -87.8 | -18.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | R210 | R210-G214 WeakPolarHBondContact O-CA 3.48Å; R210-G214 PolarHBondContact O-N 3.39Å |
| 215 | F | 93.4 | Very high | 93 | Very high | 18 Ų | 18 | 47 Ų | 47 | 8% | 0.079 | 27% | 0.268 | C | S | . | . | I | π-helix | trans | -142.6 | -72.6 | -171.5 | -172.7 | -100.1 | 0 | 0 | 0 | 114.2 | F211 P218 L219 F249 T253 H256 | F211-F215 HydrophobicContact CD2-CD1 4.26Å; F211-F215 AromaticContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CE1 4.2Å; F211-F215 HydrophobicContact CZ-CD1 4.13Å; F211-F215 CarbonylContact O-C 3.58Å; F211-F215 WeakPolarHBondContact O-CA 3.37Å; F211-F215 WeakPolarHBondContact O-CB 3.39Å; F211-F215 PolarHBondContact O-N 2.87Å; F211-F215 VanDerWaalsContact O-N 3.15Å; F215-P218 WeakPolarHBondContact O-CD 3.45Å; F215-L219 HydrophobicContact CE1-CD2 4.02Å; F215-L219 HydrophobicContact CZ-CD2 4.16Å; F215-L219 WeakPolarHBondContact O-CB 3.45Å; F215-L219 PolarHBondContact O-N 3.49Å; F215-F249 AromaticContact CD2-CD1 3.72Å; F215-F249 HydrophobicContact CD2-CD1 3.72Å; F215-F249 AromaticContact CD2-CE1 3.93Å; F215-F249 HydrophobicContact CD2-CE1 3.93Å; F215-F249 AromaticContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CD1 3.5Å; F215-F249 VanDerWaalsContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CE1 4.16Å; F215-F249 HydrophobicContact CZ-CD1 4.2Å; F215-T253 VanDerWaalsContact CE2-OG1 3.28Å; F215-T253 WeakPolarHBondContact CE2-OG1 3.04Å; F215-T253 HydrophobicContact CZ-CG2 4.1Å; F215-T253 WeakPolarHBondContact CZ-OG1 3.01Å; F215-H256 HydrophobicContact CB-CB 4.44Å; F215-H256 HydrophobicContact CD2-CB 4.37Å; F215-H256 AromaticContact CD2-CD2 3.35Å; F215-H256 WeakPolarHBondContact CD2-CD2 3.14Å; F215-H256 AromaticContact CD2-CG 3.98Å; F215-H256 HydrophobicContact CG-CB 4.22Å; F215-H256 AromaticContact CG-CD2 3.65Å; F215-H256 AromaticContact CG-CG 3.87Å |
| 216 | L | 94.1 | Very high | 92.4 | Very high | 57 Ų | 57 | 45.1 Ų | 45.1 | 30% | 0.298 | 25% | 0.25 | S | S | . | . | I | π-helix | trans | -65.2 | -48.7 | -165.4 | -178.9 | 62.8 | 0 | 0 | 0 | 113 | F211 L212 L219 L220 | F211-L216 HydrophobicContact CD1-CB 4.29Å; F211-L216 HydrophobicContact CE1-CB 3.92Å; F211-L216 HydrophobicContact CE1-CD2 3.91Å; F211-L216 HydrophobicContact CE1-CG 4.44Å; F211-L216 HydrophobicContact CZ-CB 4.31Å; F211-L216 PolarHBondContact O-N 2.84Å; L212-L216 HydrophobicContact CD2-CD2 4.12Å; L216-L219 PolarHBondContact O-N 3.48Å; L216-L220 HydrophobicContact CD1-CD1 3.96Å; L216-L220 HydrophobicContact CD1-CD2 4.47Å; L216-L220 HydrophobicContact CD1-CG 4.02Å; L216-L220 HydrophobicContact CG-CD1 4.03Å; L216-L220 HydrophobicContact CG-CG 4.45Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.29Å |
| 217 | G | 94.8 | Very high | 91.9 | Very high | 36 Ų | 36 | 45.3 Ų | 45.3 | 37% | 0.371 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.2 | -55.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L212 L219 L220 F221 | L212-G217 WeakPolarHBondContact O-CA 3.14Å; L212-G217 PolarHBondContact O-N 2.92Å; G217-L219 VanDerWaalsContact C-N 3.31Å; G217-L219 PolarHBondContact O-N 3.44Å; G217-L220 PolarHBondContact O-N 3.47Å; G217-F221 WeakPolarHBondContact O-CB 3.33Å; G217-F221 PolarHBondContact O-N 3.26Å; G217-F221 VanDerWaalsContact O-N 3.07Å |
| 218 | P | 94.8 | Very high | 91.4 | Very high | 10 Ų | 10 | 47 Ų | 47 | 7% | 0.065 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -54.9 | -41.9 | 173 | -29.5 | 36.4 | 0 | 0 | 0 | 114.1 | V128 T132 L212 F213 F215 F221 M222 F249 | V128-P218 HydrophobicContact CG2-CB 3.43Å; V128-P218 VanDerWaalsContact CG2-CB 3.43Å; V128-P218 HydrophobicContact CG2-CG 3.69Å; T132-P218 WeakPolarHBondContact OG1-CB 3.28Å; L212-P218 WeakPolarHBondContact O-CD 3.15Å; F213-P218 VanDerWaalsContact O-CG 3.22Å; F213-P218 WeakPolarHBondContact O-CG 3.35Å; F215-P218 WeakPolarHBondContact O-CD 3.45Å; P218-F221 PolarHBondContact O-N 2.66Å; P218-M222 HydrophobicContact CB-CE 3.79Å; P218-M222 WeakPolarHBondContact O-CB 3.46Å; P218-M222 WeakPolarHBondContact O-CE 3.16Å; P218-M222 WeakPolarHBondContact O-CG 3.43Å; P218-M222 PolarHBondContact O-N 2.96Å; P218-F249 HydrophobicContact CB-CZ 4.35Å |
| 219 | L | 93.6 | Very high | 90.6 | Very high | 50 Ų | 50 | 45 Ų | 45 | 26% | 0.262 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60 | -52.8 | 179.3 | 175.4 | 62.2 | 0 | 0 | 0 | 111.5 | F215 L216 G217 F221 M222 A223 F249 | F215-L219 HydrophobicContact CE1-CD2 4.02Å; F215-L219 HydrophobicContact CZ-CD2 4.16Å; F215-L219 WeakPolarHBondContact O-CB 3.45Å; F215-L219 PolarHBondContact O-N 3.49Å; L216-L219 PolarHBondContact O-N 3.48Å; G217-L219 VanDerWaalsContact C-N 3.31Å; G217-L219 PolarHBondContact O-N 3.44Å; L219-F221 VanDerWaalsContact C-N 3.32Å; L219-F221 PolarHBondContact O-N 2.89Å; L219-M222 PolarHBondContact O-N 2.85Å; L219-A223 WeakPolarHBondContact O-CB 3.45Å; L219-A223 PolarHBondContact O-N 3.09Å; L219-F249 HydrophobicContact CB-CD1 4.05Å; L219-F249 HydrophobicContact CB-CE1 3.48Å; L219-F249 VanDerWaalsContact CB-CE1 3.48Å; L219-F249 HydrophobicContact CB-CE2 4.07Å; L219-F249 HydrophobicContact CB-CZ 3.49Å; L219-F249 VanDerWaalsContact CB-CZ 3.49Å; L219-F249 HydrophobicContact CD1-CB 4.24Å; L219-F249 HydrophobicContact CD1-CD1 3.78Å; L219-F249 HydrophobicContact CD1-CD2 3.4Å; L219-F249 VanDerWaalsContact CD1-CD2 3.4Å; L219-F249 HydrophobicContact CD1-CE1 3.97Å; L219-F249 HydrophobicContact CD1-CE2 3.59Å; L219-F249 HydrophobicContact CD1-CG 3.52Å; L219-F249 HydrophobicContact CD1-CZ 3.89Å; L219-F249 HydrophobicContact CG-CD1 4.32Å; L219-F249 HydrophobicContact CG-CE1 4.21Å; L219-F249 HydrophobicContact CG-CE2 4.44Å; L219-F249 HydrophobicContact CG-CZ 4.28Å |
| 220 | L | 94.1 | Very high | 89.7 | Confident | 97 Ų | 97 | 46.5 Ų | 46.5 | 51% | 0.508 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -61.1 | -45.3 | -179 | -67.3 | 174.7 | 0 | 0 | 0 | 110.6 | L216 G217 A223 I224 | L216-L220 HydrophobicContact CD1-CD1 3.96Å; L216-L220 HydrophobicContact CD1-CD2 4.47Å; L216-L220 HydrophobicContact CD1-CG 4.02Å; L216-L220 HydrophobicContact CG-CD1 4.03Å; L216-L220 HydrophobicContact CG-CG 4.45Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.29Å; G217-L220 PolarHBondContact O-N 3.47Å; L220-A223 PolarHBondContact O-N 3.11Å; L220-I224 WeakPolarHBondContact O-CD1 3.2Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 3.42Å |
| 221 | F | 94.3 | Very high | 88.9 | Confident | 84 Ų | 84 | 56.5 Ų | 56.5 | 37% | 0.368 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.9 | -52.8 | 177.8 | -179.9 | -94.4 | 0 | 0 | 0 | 112.1 | T132 A136 G217 P218 L219 A223 I224 C225 | T132-F221 HydrophobicContact CG2-CD1 3.55Å; T132-F221 HydrophobicContact CG2-CE1 3.94Å; T132-F221 HydrophobicContact CG2-CG 4.29Å; A136-F221 HydrophobicContact CB-CE1 3.9Å; A136-F221 HydrophobicContact CB-CZ 3.74Å; G217-F221 WeakPolarHBondContact O-CB 3.33Å; G217-F221 PolarHBondContact O-N 3.26Å; G217-F221 VanDerWaalsContact O-N 3.07Å; P218-F221 PolarHBondContact O-N 2.66Å; L219-F221 VanDerWaalsContact C-N 3.32Å; L219-F221 PolarHBondContact O-N 2.89Å; F221-A223 VanDerWaalsContact C-N 3.35Å; F221-A223 PolarHBondContact O-N 2.92Å; F221-I224 PolarHBondContact O-N 3.06Å; F221-C225 VanDerWaalsContact CE1-SG 3.59Å; F221-C225 VanDerWaalsContact CZ-SG 3.54Å; F221-C225 PolarHBondContact O-N 3.01Å; F221-C225 PolarHBondContact O-SG 3.4Å; F221-C225 VanDerWaalsContact O-SG 3.41Å |
| 222 | M | 90.5 | Very high | 87.8 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.8 | -38.3 | -179 | -71.7 | -170.1 | -86.1 | 0 | 0 | 111.9 | V128 L131 P218 L219 I224 C225 H226 V245 F249 | V128-M222 HydrophobicContact CG2-CE 4.23Å; L131-M222 HydrophobicContact CB-SD 4.02Å; P218-M222 HydrophobicContact CB-CE 3.79Å; P218-M222 WeakPolarHBondContact O-CB 3.46Å; P218-M222 WeakPolarHBondContact O-CE 3.16Å; P218-M222 WeakPolarHBondContact O-CG 3.43Å; P218-M222 PolarHBondContact O-N 2.96Å; L219-M222 PolarHBondContact O-N 2.85Å; M222-I224 PolarHBondContact O-N 3.46Å; M222-C225 PolarHBondContact O-N 2.99Å; M222-H226 WeakPolarHBondContact O-CB 3.49Å; M222-H226 PolarHBondContact O-CD2 3.27Å; M222-H226 VanDerWaalsContact O-CD2 3.27Å; M222-H226 PolarHBondContact O-N 3.36Å; M222-V245 HydrophobicContact CB-CG1 3.91Å; M222-V245 HydrophobicContact SD-CG1 4.06Å; M222-V245 HydrophobicContact SD-CG2 3.79Å; M222-F249 HydrophobicContact CE-CE2 3.38Å; M222-F249 HydrophobicContact CE-CZ 3.3Å; M222-F249 HydrophobicContact SD-CE2 4.41Å |
| 223 | A | 89.8 | Confident | 86.2 | Confident | 57 Ų | 57 | 58.7 Ų | 58.7 | 47% | 0.471 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.7 | -42.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L219 L220 F221 G227 | L219-A223 WeakPolarHBondContact O-CB 3.45Å; L219-A223 PolarHBondContact O-N 3.09Å; L220-A223 PolarHBondContact O-N 3.11Å; F221-A223 VanDerWaalsContact C-N 3.35Å; F221-A223 PolarHBondContact O-N 2.92Å; A223-G227 WeakPolarHBondContact O-CA 3.03Å; A223-G227 PolarHBondContact O-N 3.48Å |
| 224 | I | 90.2 | Very high | 84.5 | Confident | 111 Ų | 111 | 58.3 Ų | 58.3 | 57% | 0.569 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -63.3 | -52.2 | 174.7 | -67.6 | 163.8 | 0 | 0 | 0 | 110 | L220 F221 M222 H226 G227 V228 | L220-I224 WeakPolarHBondContact O-CD1 3.2Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 3.42Å; F221-I224 PolarHBondContact O-N 3.06Å; M222-I224 PolarHBondContact O-N 3.46Å; I224-H226 PolarHBondContact O-N 3.07Å; I224-G227 PolarHBondContact O-N 2.56Å; I224-V228 HydrophobicContact CG2-CG2 4.48Å; I224-V228 WeakPolarHBondContact O-CB 3.35Å; I224-V228 VanDerWaalsContact O-CG2 3.22Å; I224-V228 WeakPolarHBondContact O-CG2 3.22Å; I224-V228 PolarHBondContact O-N 2.89Å |
| 225 | C | 86 | Confident | 82.8 | Confident | 6 Ų | 6 | 68.9 Ų | 68.9 | 4% | 0.041 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.9 | -50.4 | -178.6 | -72.3 | 0 | 0 | 0 | 0 | 112.2 | F139 F221 M222 L229 | F139-C225 HydrophobicContact CB-CB 4.31Å; F139-C225 HydrophobicContact CD2-CB 4.11Å; F139-C225 HydrophobicContact CG-CB 4.46Å; F221-C225 VanDerWaalsContact CE1-SG 3.59Å; F221-C225 VanDerWaalsContact CZ-SG 3.54Å; F221-C225 PolarHBondContact O-N 3.01Å; F221-C225 PolarHBondContact O-SG 3.4Å; F221-C225 VanDerWaalsContact O-SG 3.41Å; M222-C225 PolarHBondContact O-N 2.99Å; C225-L229 VanDerWaalsContact O-CB 3.29Å; C225-L229 WeakPolarHBondContact O-CB 3.36Å; C225-L229 PolarHBondContact O-N 3.21Å |
| 226 | H | 82.4 | Confident | 80.9 | Confident | 12 Ų | 12 | 79.1 Ų | 79.1 | 6% | 0.056 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -72.8 | -36.7 | -178.6 | -78.8 | -83.1 | 0 | 0 | 0 | 112.8 | S135 M222 I224 V228 L229 Q230 T242 | S135-H226 PolarHBondContact OG-NE2 3.12Å; M222-H226 WeakPolarHBondContact O-CB 3.49Å; M222-H226 PolarHBondContact O-CD2 3.27Å; M222-H226 VanDerWaalsContact O-CD2 3.27Å; M222-H226 PolarHBondContact O-N 3.36Å; I224-H226 PolarHBondContact O-N 3.07Å; H226-V228 VanDerWaalsContact C-N 3.32Å; H226-V228 PolarHBondContact O-N 2.73Å; H226-L229 PolarHBondContact O-N 3.26Å; H226-Q230 WeakPolarHBondContact O-CB 3.05Å; H226-Q230 VanDerWaalsContact O-CG 3.24Å; H226-Q230 WeakPolarHBondContact O-CG 3.49Å; H226-Q230 PolarHBondContact O-N 3.13Å; H226-T242 PolarHBondContact ND1-OG1 3.37Å |
| 227 | G | 83.2 | Confident | 79 | Confident | 28 Ų | 28 | 83.4 Ų | 83.4 | 29% | 0.289 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A223 I224 R231 | A223-G227 WeakPolarHBondContact O-CA 3.03Å; A223-G227 PolarHBondContact O-N 3.48Å; I224-G227 PolarHBondContact O-N 2.56Å; G227-R231 WeakPolarHBondContact O-CG 3.21Å; G227-R231 PolarHBondContact O-N 2.96Å |
| 228 | V | 81.4 | Confident | 77.5 | Confident | 45 Ų | 45 | 84.2 Ų | 84.2 | 27% | 0.273 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.2 | -45.4 | 173.5 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | F139 F143 I224 H226 Q230 R231 Q232 | F139-V228 HydrophobicContact CE2-CB 4.26Å; F139-V228 HydrophobicContact CE2-CG1 3.97Å; F143-V228 HydrophobicContact CE1-CG1 4.3Å; F143-V228 HydrophobicContact CE2-CG1 3.53Å; F143-V228 HydrophobicContact CZ-CG1 3.18Å; I224-V228 HydrophobicContact CG2-CG2 4.48Å; I224-V228 WeakPolarHBondContact O-CB 3.35Å; I224-V228 VanDerWaalsContact O-CG2 3.22Å; I224-V228 WeakPolarHBondContact O-CG2 3.22Å; I224-V228 PolarHBondContact O-N 2.89Å; H226-V228 VanDerWaalsContact C-N 3.32Å; H226-V228 PolarHBondContact O-N 2.73Å; V228-Q230 VanDerWaalsContact C-N 3.32Å; V228-Q230 PolarHBondContact O-N 2.8Å; V228-R231 PolarHBondContact O-N 3.35Å; V228-R231 VanDerWaalsContact O-N 3.13Å; V228-Q232 PolarHBondContact O-N 2.82Å |
| 229 | L | 77.1 | Confident | 76.3 | Confident | 4 Ų | 4 | 85.8 Ų | 85.8 | 2% | 0.021 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -61.5 | -38.2 | -179.1 | -169.9 | 58 | 0 | 0 | 0 | 112.9 | A142 C225 H226 R231 Q232 M233 W238 | A142-L229 HydrophobicContact CB-CD1 3.57Å; C225-L229 VanDerWaalsContact O-CB 3.29Å; C225-L229 WeakPolarHBondContact O-CB 3.36Å; C225-L229 PolarHBondContact O-N 3.21Å; H226-L229 PolarHBondContact O-N 3.26Å; L229-R231 VanDerWaalsContact C-N 3.32Å; L229-R231 PolarHBondContact O-N 3.16Å; L229-Q232 PolarHBondContact O-N 3.44Å; L229-M233 HydrophobicContact CD1-CG 3.88Å; L229-M233 WeakPolarHBondContact O-CB 3.38Å; L229-M233 PolarHBondContact O-N 3.08Å; L229-M233 VanDerWaalsContact O-N 3.11Å; L229-W238 HydrophobicContact CD1-CD2 4.13Å; L229-W238 HydrophobicContact CD1-CG 4.4Å; L229-W238 HydrophobicContact CD1-CZ2 3.85Å; L229-W238 HydrophobicContact CD2-CB 4.24Å; L229-W238 HydrophobicContact CD2-CD2 3.28Å; L229-W238 HydrophobicContact CD2-CE3 3.4Å; L229-W238 VanDerWaalsContact CD2-CE3 3.4Å; L229-W238 HydrophobicContact CD2-CG 3.68Å; L229-W238 HydrophobicContact CD2-CH2 4.11Å; L229-W238 HydrophobicContact CD2-CZ2 4.04Å; L229-W238 HydrophobicContact CD2-CZ3 3.83Å; L229-W238 HydrophobicContact CG-CB 4.4Å; L229-W238 HydrophobicContact CG-CD2 3.72Å; L229-W238 HydrophobicContact CG-CE3 4.35Å; L229-W238 HydrophobicContact CG-CG 3.73Å; L229-W238 HydrophobicContact CG-CZ2 4.34Å |
| 230 | Q | 76 | Confident | 75.2 | Confident | 92 Ų | 92 | 85.2 Ų | 85.2 | 43% | 0.43 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -67.5 | -29.2 | 176.3 | -75.1 | 175.1 | 8.9 | 0 | 0 | 113.8 | H226 V228 T242 | H226-Q230 WeakPolarHBondContact O-CB 3.05Å; H226-Q230 VanDerWaalsContact O-CG 3.24Å; H226-Q230 WeakPolarHBondContact O-CG 3.49Å; H226-Q230 PolarHBondContact O-N 3.13Å; V228-Q230 VanDerWaalsContact C-N 3.32Å; V228-Q230 PolarHBondContact O-N 2.8Å; Q230-T242 PolarHBondContact NE2-OG1 3.26Å |
| 231 | R | 78.2 | Confident | 74 | Confident | 230 Ų | 230 | 81.7 Ų | 81.7 | 87% | 0.868 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -77.5 | -30.9 | 179 | -74.2 | 178.6 | 178.4 | -175.1 | 0.3 | 112.5 | G227 V228 L229 | G227-R231 WeakPolarHBondContact O-CG 3.21Å; G227-R231 PolarHBondContact O-N 2.96Å; V228-R231 PolarHBondContact O-N 3.35Å; V228-R231 VanDerWaalsContact O-N 3.13Å; L229-R231 VanDerWaalsContact C-N 3.32Å; L229-R231 PolarHBondContact O-N 3.16Å |
| 232 | Q | 69.9 | Low | 73.1 | Confident | 116 Ų | 116 | 78.9 Ų | 78.9 | 54% | 0.542 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -99.9 | -23.2 | -172.5 | -65 | -168.4 | -2.3 | 0 | 0 | 114.4 | V228 L229 | V228-Q232 PolarHBondContact O-N 2.82Å; L229-Q232 PolarHBondContact O-N 3.44Å |
| 233 | M | 62.7 | Low | 72.5 | Confident | 73 Ų | 73 | 80.1 Ų | 80.1 | 36% | 0.36 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -113.9 | 151.1 | -175.8 | -63.2 | -72.6 | 176.7 | 0 | 0 | 111.1 | A142 L229 R235 | A142-M233 HydrophobicContact CB-CE 3.98Å; L229-M233 HydrophobicContact CD1-CG 3.88Å; L229-M233 WeakPolarHBondContact O-CB 3.38Å; L229-M233 PolarHBondContact O-N 3.08Å; L229-M233 VanDerWaalsContact O-N 3.11Å; M233-R235 PolarHBondContact O-N 3.08Å |
| 234 | T | 56.9 | Low | 71.9 | Confident | 99 Ų | 99 | 77.8 Ų | 77.8 | 61% | 0.607 | 37% | 0.374 | S | S | * | . | trans | -57 | 125.3 | 174.3 | 51.3 | 0 | 0 | 0 | 0 | 110 | R236 H237 | T234-R236 PolarHBondContact O-N 2.85Å; T234-H237 PolarHBondContact O-N 2.83Å; T234-H237 PolarHBondContact OG1-ND1 3.44Å; T234-H237 VanDerWaalsContact OG1-ND1 3.14Å | ||
| 235 | R | 55.2 | Low | 71.5 | Confident | 222 Ų | 222 | 73.1 Ų | 73.1 | 84% | 0.838 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -47.5 | -25.1 | -170.9 | -72.6 | -173 | 177.1 | -179.8 | -0.5 | 115.2 | M233 H237 | M233-R235 PolarHBondContact O-N 3.08Å; R235-H237 PolarHBondContact O-N 3.23Å |
| 236 | R | 54.3 | Low | 71.4 | Confident | 232 Ų | 232 | 76.3 Ų | 76.3 | 88% | 0.875 | 37% | 0.37 | S | S | * | . | G | 310 helix | trans | -72.2 | -25.2 | -172.6 | -158.8 | 168.1 | -172.7 | 164.2 | 3 | 114.5 | T234 | T234-R236 PolarHBondContact O-N 2.85Š|
| 237 | H | 54.1 | Low | 71.6 | Confident | 147 Ų | 147 | 76.3 Ų | 76.3 | 68% | 0.681 | 37% | 0.373 | S | S | * | . | G | 310 helix | trans | -85.8 | -18.8 | -174.2 | -69.5 | 93.8 | 0 | 0 | 0 | 114.4 | T234 R235 | T234-H237 PolarHBondContact O-N 2.83Å; T234-H237 PolarHBondContact OG1-ND1 3.44Å; T234-H237 VanDerWaalsContact OG1-ND1 3.14Å; R235-H237 PolarHBondContact O-N 3.23Å |
| 238 | W | 63.6 | Low | 71.6 | Confident | 53 Ų | 53 | 75 Ų | 75 | 20% | 0.201 | 36% | 0.359 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -119.7 | 3 | -170.3 | -61.9 | 107.6 | 0 | 0 | 0 | 115 | L138 L229 L240 G241 T242 | L138-W238 HydrophobicContact CB-CH2 4Å; L138-W238 HydrophobicContact CB-CZ3 3.75Å; L138-W238 HydrophobicContact CD1-CE3 4.45Å; L138-W238 HydrophobicContact CD1-CZ3 3.8Å; L138-W238 HydrophobicContact CD2-CH2 3.96Å; L138-W238 HydrophobicContact CD2-CZ3 3.65Å; L138-W238 HydrophobicContact CG-CH2 4.4Å; L138-W238 HydrophobicContact CG-CZ3 3.87Å; L229-W238 HydrophobicContact CD1-CD2 4.13Å; L229-W238 HydrophobicContact CD1-CG 4.4Å; L229-W238 HydrophobicContact CD1-CZ2 3.85Å; L229-W238 HydrophobicContact CD2-CB 4.24Å; L229-W238 HydrophobicContact CD2-CD2 3.28Å; L229-W238 HydrophobicContact CD2-CE3 3.4Å; L229-W238 VanDerWaalsContact CD2-CE3 3.4Å; L229-W238 HydrophobicContact CD2-CG 3.68Å; L229-W238 HydrophobicContact CD2-CH2 4.11Å; L229-W238 HydrophobicContact CD2-CZ2 4.04Å; L229-W238 HydrophobicContact CD2-CZ3 3.83Å; L229-W238 HydrophobicContact CG-CB 4.4Å; L229-W238 HydrophobicContact CG-CD2 3.72Å; L229-W238 HydrophobicContact CG-CE3 4.35Å; L229-W238 HydrophobicContact CG-CG 3.73Å; L229-W238 HydrophobicContact CG-CZ2 4.34Å; W238-L240 VanDerWaalsContact C-N 3.32Å; W238-L240 PolarHBondContact O-N 3.45Å; W238-G241 PolarHBondContact O-N 3.49Å; W238-T242 PolarHBondContact O-N 3.42Å |
| 239 | A | 68.6 | Low | 72 | Confident | 43 Ų | 43 | 73.5 Ų | 73.5 | 36% | 0.355 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.3 | -38.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A243 F300 | A239-A243 WeakPolarHBondContact O-CB 3.3Å; A239-A243 PolarHBondContact O-N 2.86Å; A239-F300 HydrophobicContact CB-CE1 4.46Å |
| 240 | L | 70.4 | Confident | 72.8 | Confident | 39 Ų | 39 | 78.5 Ų | 78.5 | 20% | 0.204 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.1 | -49.5 | 178.2 | 172.4 | 55 | 0 | 0 | 0 | 112.1 | W238 T242 A243 V244 M296 F297 F300 | W238-L240 VanDerWaalsContact C-N 3.32Å; W238-L240 PolarHBondContact O-N 3.45Å; L240-T242 VanDerWaalsContact C-N 3.33Å; L240-T242 PolarHBondContact O-N 3.45Å; L240-A243 PolarHBondContact O-N 3.07Å; L240-A243 VanDerWaalsContact O-N 3.11Å; L240-V244 HydrophobicContact CD1-CG2 3.91Å; L240-V244 WeakPolarHBondContact O-CG2 3.33Å; L240-V244 PolarHBondContact O-N 2.97Å; L240-M296 HydrophobicContact CD1-CB 3.78Å; L240-F297 HydrophobicContact CD2-CD1 4.25Å; L240-F297 HydrophobicContact CD2-CE1 4.42Å; L240-F300 HydrophobicContact CB-CB 3.71Å; L240-F300 HydrophobicContact CB-CD2 4.35Å; L240-F300 HydrophobicContact CB-CG 4.01Å; L240-F300 HydrophobicContact CD1-CB 3.84Å; L240-F300 HydrophobicContact CD1-CD2 3.67Å; L240-F300 HydrophobicContact CD1-CG 4.06Å; L240-F300 HydrophobicContact CD2-CB 4.01Å; L240-F300 HydrophobicContact CG-CB 4.03Å |
| 241 | G | 69.8 | Low | 73.5 | Confident | 22 Ų | 22 | 74.7 Ų | 74.7 | 23% | 0.227 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.6 | -43.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | W238 V244 V245 | W238-G241 PolarHBondContact O-N 3.49Å; G241-V244 PolarHBondContact O-N 3.41Å; G241-V245 WeakPolarHBondContact O-CG2 3.49Å; G241-V245 PolarHBondContact O-N 2.75Å; G241-V245 VanDerWaalsContact O-N 3.14Å |
| 242 | T | 74.8 | Confident | 74.3 | Confident | 26 Ų | 26 | 64.1 Ų | 64.1 | 16% | 0.16 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.3 | -43 | 173 | -64.1 | 0 | 0 | 0 | 0 | 112 | H226 Q230 W238 L240 V244 V245 V246 | H226-T242 PolarHBondContact ND1-OG1 3.37Å; Q230-T242 PolarHBondContact NE2-OG1 3.26Å; W238-T242 PolarHBondContact O-N 3.42Å; L240-T242 VanDerWaalsContact C-N 3.33Å; L240-T242 PolarHBondContact O-N 3.45Å; T242-V244 VanDerWaalsContact C-N 3.35Å; T242-V244 PolarHBondContact O-N 3.42Å; T242-V245 PolarHBondContact O-N 3.4Å; T242-V246 HydrophobicContact CG2-CG2 4.1Å; T242-V246 WeakPolarHBondContact O-CB 3.26Å; T242-V246 VanDerWaalsContact O-CG2 3.27Å; T242-V246 WeakPolarHBondContact O-CG2 3.36Å; T242-V246 PolarHBondContact O-N 3.32Å |
| 243 | A | 77.6 | Confident | 75.4 | Confident | 25 Ų | 25 | 60.7 Ų | 60.7 | 21% | 0.207 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.7 | -42.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A239 L240 V246 G247 M296 F300 | A239-A243 WeakPolarHBondContact O-CB 3.3Å; A239-A243 PolarHBondContact O-N 2.86Å; L240-A243 PolarHBondContact O-N 3.07Å; L240-A243 VanDerWaalsContact O-N 3.11Å; A243-V246 PolarHBondContact O-N 3.02Å; A243-G247 PolarHBondContact O-N 3.46Å; A243-M296 VanDerWaalsContact C-SD 3.6Å; A243-M296 HydrophobicContact CB-CE 4.4Å; A243-M296 HydrophobicContact CB-SD 4.03Å; A243-M296 WeakPolarHBondContact O-CE 3.39Å; A243-F300 HydrophobicContact CB-CE2 3.93Å; A243-F300 HydrophobicContact CB-CZ 4.22Å |
| 244 | V | 77.3 | Confident | 77 | Confident | 9 Ų | 9 | 59.2 Ų | 59.2 | 6% | 0.055 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.5 | -47.5 | 176.7 | 173 | 0 | 0 | 0 | 0 | 110.9 | L131 L240 G241 T242 V246 G247 F248 M296 | L131-V244 HydrophobicContact CD1-CG1 4.46Å; L131-V244 HydrophobicContact CD2-CG1 3.61Å; L240-V244 HydrophobicContact CD1-CG2 3.91Å; L240-V244 WeakPolarHBondContact O-CG2 3.33Å; L240-V244 PolarHBondContact O-N 2.97Å; G241-V244 PolarHBondContact O-N 3.41Å; T242-V244 VanDerWaalsContact C-N 3.35Å; T242-V244 PolarHBondContact O-N 3.42Å; V244-V246 PolarHBondContact O-N 2.03Å; V244-G247 PolarHBondContact O-N 2.96Å; V244-F248 PolarHBondContact O-N 2.69Å; V244-M296 VanDerWaalsContact CA-SD 3.57Å; V244-M296 HydrophobicContact CB-SD 4.19Å; V244-M296 HydrophobicContact CG2-CB 4.25Å; V244-M296 HydrophobicContact CG2-SD 3.58Å; V244-M296 VanDerWaalsContact CG2-SD 3.58Å |
| 245 | V | 81.1 | Confident | 78.8 | Confident | 13 Ų | 13 | 55.4 Ų | 55.4 | 8% | 0.079 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.7 | -45.4 | 178.3 | 171 | 0 | 0 | 0 | 0 | 111.5 | M222 G241 T242 F248 F249 | M222-V245 HydrophobicContact CB-CG1 3.91Å; M222-V245 HydrophobicContact SD-CG1 4.06Å; M222-V245 HydrophobicContact SD-CG2 3.79Å; G241-V245 WeakPolarHBondContact O-CG2 3.49Å; G241-V245 PolarHBondContact O-N 2.75Å; G241-V245 VanDerWaalsContact O-N 3.14Å; T242-V245 PolarHBondContact O-N 3.4Å; V245-F248 WeakPolarHBondContact O-CB 3.29Å; V245-F248 PolarHBondContact O-N 3.3Å; V245-F249 HydrophobicContact CG1-CD2 3.94Å; V245-F249 HydrophobicContact CG1-CE2 3.85Å; V245-F249 WeakPolarHBondContact O-CD2 3.22Å; V245-F249 PolarHBondContact O-N 3.17Å; V245-F249 VanDerWaalsContact O-N 3.17Å |
| 246 | V | 85.5 | Confident | 80.7 | Confident | 73 Ų | 73 | 45 Ų | 45 | 44% | 0.442 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.9 | -43.7 | 177.6 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | T242 A243 V244 F248 F249 I250 | T242-V246 HydrophobicContact CG2-CG2 4.1Å; T242-V246 WeakPolarHBondContact O-CB 3.26Å; T242-V246 VanDerWaalsContact O-CG2 3.27Å; T242-V246 WeakPolarHBondContact O-CG2 3.36Å; T242-V246 PolarHBondContact O-N 3.32Å; A243-V246 PolarHBondContact O-N 3.02Å; V244-V246 PolarHBondContact O-N 2.03Å; V246-F248 PolarHBondContact O-N 3.48Å; V246-F249 PolarHBondContact O-N 3.29Å; V246-I250 HydrophobicContact CG1-CD1 3.59Å; V246-I250 HydrophobicContact CG1-CG1 4.28Å; V246-I250 VanDerWaalsContact O-CG1 3.29Å; V246-I250 WeakPolarHBondContact O-CG1 3.43Å; V246-I250 PolarHBondContact O-N 2.76Å |
| 247 | G | 85.1 | Confident | 82.6 | Confident | 11 Ų | 11 | 38.2 Ų | 38.2 | 11% | 0.113 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.2 | -44.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A243 V244 I250 C251 | A243-G247 PolarHBondContact O-N 3.46Å; V244-G247 PolarHBondContact O-N 2.96Å; G247-I250 PolarHBondContact O-N 3.22Å; G247-C251 WeakPolarHBondContact O-CB 3.36Å; G247-C251 PolarHBondContact O-N 2.89Å; G247-C251 VanDerWaalsContact O-N 3.09Å; G247-C251 PolarHBondContact O-SG 3.05Å |
| 248 | F | 84.8 | Confident | 84.5 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -53.7 | -57.4 | 173.4 | -179.1 | -88 | 0 | 0 | 0 | 110.5 | V128 L131 V244 V245 V246 I250 C251 W252 H289 | V128-F248 HydrophobicContact CB-CE1 4.06Å; V128-F248 HydrophobicContact CB-CE2 4.1Å; V128-F248 HydrophobicContact CB-CZ 3.51Å; V128-F248 HydrophobicContact CG2-CE1 3.63Å; V128-F248 HydrophobicContact CG2-CZ 3.65Å; L131-F248 HydrophobicContact CD1-CB 4.14Å; L131-F248 HydrophobicContact CD1-CD2 3.75Å; L131-F248 HydrophobicContact CD1-CE2 4.47Å; L131-F248 HydrophobicContact CD1-CG 4.02Å; V244-F248 PolarHBondContact O-N 2.69Å; V245-F248 WeakPolarHBondContact O-CB 3.29Å; V245-F248 PolarHBondContact O-N 3.3Å; V246-F248 PolarHBondContact O-N 3.48Å; F248-I250 PolarHBondContact O-N 2.99Å; F248-C251 PolarHBondContact O-N 3.21Å; F248-C251 VanDerWaalsContact O-N 3.14Å; F248-W252 AromaticContact CD1-CD1 3.93Å; F248-W252 HydrophobicContact CD1-CG 4.45Å; F248-W252 AromaticContact CD2-CD1 3.42Å; F248-W252 VanDerWaalsContact CD2-CD1 3.42Å; F248-W252 HydrophobicContact CD2-CG 4.46Å; F248-W252 AromaticContact CD2-NE1 3.54Å; F248-W252 HydrophobicContact CE1-CB 4.2Å; F248-W252 AromaticContact CE1-CD1 3.78Å; F248-W252 AromaticContact CE1-CG 4Å; F248-W252 HydrophobicContact CE1-CG 4Å; F248-W252 AromaticContact CE2-CD1 3.27Å; F248-W252 HydrophobicContact CE2-CD2 4.36Å; F248-W252 AromaticContact CE2-CE2 3.91Å; F248-W252 HydrophobicContact CE2-CG 4.04Å; F248-W252 AromaticContact CE2-NE1 3.19Å; F248-W252 AromaticContact CG-CD1 3.74Å; F248-W252 HydrophobicContact CZ-CB 4.4Å; F248-W252 AromaticContact CZ-CD1 3.42Å; F248-W252 VanDerWaalsContact CZ-CD1 3.42Å; F248-W252 HydrophobicContact CZ-CD2 4.15Å; F248-W252 AromaticContact CZ-CG 3.74Å; F248-W252 HydrophobicContact CZ-CG 3.74Å; F248-W252 AromaticContact CZ-NE1 3.69Å; F248-W252 WeakPolarHBondContact O-CB 3.47Å; F248-W252 PolarHBondContact O-N 3.17Å; F248-H289 WeakPolarHBondContact CA-CD2 3.42Å; F248-H289 AromaticContact CD2-CD2 3.98Å; F248-H289 AromaticContact CD2-CE1 3.56Å; F248-H289 AromaticContact CD2-ND1 3.84Å; F248-H289 AromaticContact CD2-NE2 3.63Å; F248-H289 PolarHBondContact N-CD2 3.48Å |
| 249 | F | 89.7 | Confident | 85.9 | Confident | 14 Ų | 14 | 31.2 Ų | 31.2 | 6% | 0.061 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67.1 | -35.2 | -174.7 | -72.2 | -64.6 | 0 | 0 | 0 | 113.5 | F215 P218 L219 M222 V245 V246 C251 W252 T253 | F215-F249 AromaticContact CD2-CD1 3.72Å; F215-F249 HydrophobicContact CD2-CD1 3.72Å; F215-F249 AromaticContact CD2-CE1 3.93Å; F215-F249 HydrophobicContact CD2-CE1 3.93Å; F215-F249 AromaticContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CD1 3.5Å; F215-F249 VanDerWaalsContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CE1 4.16Å; F215-F249 HydrophobicContact CZ-CD1 4.2Å; P218-F249 HydrophobicContact CB-CZ 4.35Å; L219-F249 HydrophobicContact CB-CD1 4.05Å; L219-F249 HydrophobicContact CB-CE1 3.48Å; L219-F249 VanDerWaalsContact CB-CE1 3.48Å; L219-F249 HydrophobicContact CB-CE2 4.07Å; L219-F249 HydrophobicContact CB-CZ 3.49Å; L219-F249 VanDerWaalsContact CB-CZ 3.49Å; L219-F249 HydrophobicContact CD1-CB 4.24Å; L219-F249 HydrophobicContact CD1-CD1 3.78Å; L219-F249 HydrophobicContact CD1-CD2 3.4Å; L219-F249 VanDerWaalsContact CD1-CD2 3.4Å; L219-F249 HydrophobicContact CD1-CE1 3.97Å; L219-F249 HydrophobicContact CD1-CE2 3.59Å; L219-F249 HydrophobicContact CD1-CG 3.52Å; L219-F249 HydrophobicContact CD1-CZ 3.89Å; L219-F249 HydrophobicContact CG-CD1 4.32Å; L219-F249 HydrophobicContact CG-CE1 4.21Å; L219-F249 HydrophobicContact CG-CE2 4.44Å; L219-F249 HydrophobicContact CG-CZ 4.28Å; M222-F249 HydrophobicContact CE-CE2 3.38Å; M222-F249 HydrophobicContact CE-CZ 3.3Å; M222-F249 HydrophobicContact SD-CE2 4.41Å; V245-F249 HydrophobicContact CG1-CD2 3.94Å; V245-F249 HydrophobicContact CG1-CE2 3.85Å; V245-F249 WeakPolarHBondContact O-CD2 3.22Å; V245-F249 PolarHBondContact O-N 3.17Å; V245-F249 VanDerWaalsContact O-N 3.17Å; V246-F249 PolarHBondContact O-N 3.29Å; F249-C251 VanDerWaalsContact C-N 3.31Å; F249-C251 PolarHBondContact O-N 3.43Å; F249-W252 PolarHBondContact O-N 3.27Å; F249-T253 VanDerWaalsContact O-CB 3.23Å; F249-T253 WeakPolarHBondContact O-CB 3.28Å; F249-T253 PolarHBondContact O-N 3.18Å; F249-T253 PolarHBondContact O-OG1 3.36Å |
| 250 | I | 92.1 | Very high | 87.1 | Confident | 110 Ų | 110 | 31.8 Ų | 31.8 | 56% | 0.564 | 18% | 0.184 | S | C | * | . | H | α-helix | trans | -59.6 | -44.1 | 173.5 | -70.8 | 170.6 | 0 | 0 | 0 | 111 | V246 G247 F248 P254 | V246-I250 HydrophobicContact CG1-CD1 3.59Å; V246-I250 HydrophobicContact CG1-CG1 4.28Å; V246-I250 VanDerWaalsContact O-CG1 3.29Å; V246-I250 WeakPolarHBondContact O-CG1 3.43Å; V246-I250 PolarHBondContact O-N 2.76Å; G247-I250 PolarHBondContact O-N 3.22Å; F248-I250 PolarHBondContact O-N 2.99Å; I250-P254 VanDerWaalsContact O-CD 3.27Å; I250-P254 WeakPolarHBondContact O-CD 3.45Å |
| 251 | C | 92.4 | Very high | 88.2 | Confident | 11 Ų | 11 | 32.4 Ų | 32.4 | 7% | 0.074 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -71.1 | -39.5 | -178.9 | -65.2 | 0 | 0 | 0 | 0 | 112.6 | G247 F248 F249 L285 A286 H289 | G247-C251 WeakPolarHBondContact O-CB 3.36Å; G247-C251 PolarHBondContact O-N 2.89Å; G247-C251 VanDerWaalsContact O-N 3.09Å; G247-C251 PolarHBondContact O-SG 3.05Å; F248-C251 PolarHBondContact O-N 3.21Å; F248-C251 VanDerWaalsContact O-N 3.14Å; F249-C251 VanDerWaalsContact C-N 3.31Å; F249-C251 PolarHBondContact O-N 3.43Å; C251-L285 WeakPolarHBondContact CB-O 3.49Å; C251-A286 WeakPolarHBondContact O-CA 3.42Å; C251-A286 PolarHBondContact O-N 3.4Å; C251-H289 HydrophobicContact CB-CB 3.82Å |
| 252 | W | 93.4 | Very high | 89.2 | Confident | 8 Ų | 8 | 32.8 Ų | 32.8 | 3% | 0.03 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -88 | -24 | -173.4 | -75.2 | 94.5 | 0 | 0 | 0 | 114.2 | M124 F248 F249 F255 H256 A286 | M124-W252 HydrophobicContact CB-CH2 3.34Å; M124-W252 HydrophobicContact CB-CZ2 3.99Å; M124-W252 HydrophobicContact CB-CZ3 3.64Å; M124-W252 HydrophobicContact CG-CD2 4.34Å; M124-W252 HydrophobicContact CG-CE3 3.72Å; M124-W252 HydrophobicContact CG-CH2 3.5Å; M124-W252 VanDerWaalsContact CG-CH2 3.5Å; M124-W252 HydrophobicContact CG-CZ2 4.09Å; M124-W252 HydrophobicContact CG-CZ3 3.27Å; M124-W252 HydrophobicContact SD-CE3 3.97Å; M124-W252 HydrophobicContact SD-CH2 4.26Å; M124-W252 HydrophobicContact SD-CZ3 3.52Å; M124-W252 VanDerWaalsContact SD-CZ3 3.52Å; F248-W252 AromaticContact CD1-CD1 3.93Å; F248-W252 HydrophobicContact CD1-CG 4.45Å; F248-W252 AromaticContact CD2-CD1 3.42Å; F248-W252 VanDerWaalsContact CD2-CD1 3.42Å; F248-W252 HydrophobicContact CD2-CG 4.46Å; F248-W252 AromaticContact CD2-NE1 3.54Å; F248-W252 HydrophobicContact CE1-CB 4.2Å; F248-W252 AromaticContact CE1-CD1 3.78Å; F248-W252 AromaticContact CE1-CG 4Å; F248-W252 HydrophobicContact CE1-CG 4Å; F248-W252 AromaticContact CE2-CD1 3.27Å; F248-W252 HydrophobicContact CE2-CD2 4.36Å; F248-W252 AromaticContact CE2-CE2 3.91Å; F248-W252 HydrophobicContact CE2-CG 4.04Å; F248-W252 AromaticContact CE2-NE1 3.19Å; F248-W252 AromaticContact CG-CD1 3.74Å; F248-W252 HydrophobicContact CZ-CB 4.4Å; F248-W252 AromaticContact CZ-CD1 3.42Å; F248-W252 VanDerWaalsContact CZ-CD1 3.42Å; F248-W252 HydrophobicContact CZ-CD2 4.15Å; F248-W252 AromaticContact CZ-CG 3.74Å; F248-W252 HydrophobicContact CZ-CG 3.74Å; F248-W252 AromaticContact CZ-NE1 3.69Å; F248-W252 WeakPolarHBondContact O-CB 3.47Å; F248-W252 PolarHBondContact O-N 3.17Å; F249-W252 PolarHBondContact O-N 3.27Å; W252-F255 HydrophobicContact CE3-CD1 4.02Å; W252-F255 HydrophobicContact CE3-CG 4.49Å; W252-F255 HydrophobicContact CZ3-CD1 4.05Å; W252-F255 HydrophobicContact CZ3-CE1 4.26Å; W252-F255 WeakPolarHBondContact O-CB 3.45Å; W252-F255 PolarHBondContact O-N 3.18Å; W252-F255 VanDerWaalsContact O-N 3.12Å; W252-H256 PolarHBondContact O-CD2 3.34Å; W252-H256 VanDerWaalsContact O-CD2 3.23Å; W252-H256 PolarHBondContact O-N 2.91Å; W252-H256 VanDerWaalsContact O-N 3.08Å; W252-A286 HydrophobicContact CD2-CB 3.89Å; W252-A286 HydrophobicContact CE3-CB 3.75Å; W252-A286 HydrophobicContact CH2-CB 4.11Å; W252-A286 HydrophobicContact CZ2-CB 4.3Å; W252-A286 HydrophobicContact CZ3-CB 3.84Å; W252-A286 PolarHBondContact NE1-O 3.29Å |
| 253 | T | 94.8 | Very high | 89.9 | Confident | 44 Ų | 44 | 33 Ų | 33 | 27% | 0.27 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -54.7 | -48.8 | -178.7 | -62.8 | 0 | 0 | 0 | 0 | 112.6 | F215 F249 F255 H256 I257 | F215-T253 VanDerWaalsContact CE2-OG1 3.28Å; F215-T253 WeakPolarHBondContact CE2-OG1 3.04Å; F215-T253 HydrophobicContact CZ-CG2 4.1Å; F215-T253 WeakPolarHBondContact CZ-OG1 3.01Å; F249-T253 VanDerWaalsContact O-CB 3.23Å; F249-T253 WeakPolarHBondContact O-CB 3.28Å; F249-T253 PolarHBondContact O-N 3.18Å; F249-T253 PolarHBondContact O-OG1 3.36Å; T253-F255 PolarHBondContact O-N 2.7Å; T253-H256 PolarHBondContact O-N 2.95Å; T253-I257 HydrophobicContact CG2-CD1 3.59Å; T253-I257 HydrophobicContact CG2-CG1 4.2Å; T253-I257 WeakPolarHBondContact O-CG1 3.43Å; T253-I257 PolarHBondContact O-N 3.44Å |
| 254 | P | 95.5 | Very high | 90.6 | Very high | 42 Ų | 42 | 37.2 Ų | 37.2 | 27% | 0.273 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60 | -37 | -179.8 | -26.1 | 39 | 0 | 0 | 0 | 112.1 | I250 L258 V282 L285 | I250-P254 VanDerWaalsContact O-CD 3.27Å; I250-P254 WeakPolarHBondContact O-CD 3.45Å; P254-L258 WeakPolarHBondContact O-CB 3.38Å; P254-L258 PolarHBondContact O-N 3.07Å; P254-V282 HydrophobicContact CB-CG1 3.94Å; P254-V282 HydrophobicContact CB-CG2 4.27Å; P254-L285 HydrophobicContact CB-CD2 4.35Å; P254-L285 HydrophobicContact CG-CD2 3.81Å |
| 255 | F | 94.6 | Very high | 91.1 | Very high | 20 Ų | 20 | 37.6 Ų | 37.6 | 9% | 0.088 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.5 | -46.3 | 177.9 | 178 | -95.7 | 0 | 0 | 0 | 112.4 | M124 W252 T253 L258 R259 V282 A286 | M124-F255 HydrophobicContact SD-CE1 4.18Å; W252-F255 HydrophobicContact CE3-CD1 4.02Å; W252-F255 HydrophobicContact CE3-CG 4.49Å; W252-F255 HydrophobicContact CZ3-CD1 4.05Å; W252-F255 HydrophobicContact CZ3-CE1 4.26Å; W252-F255 WeakPolarHBondContact O-CB 3.45Å; W252-F255 PolarHBondContact O-N 3.18Å; W252-F255 VanDerWaalsContact O-N 3.12Å; T253-F255 PolarHBondContact O-N 2.7Å; F255-L258 PolarHBondContact O-N 3.48Å; F255-R259 HydrophobicContact CD1-CG 4.34Å; F255-R259 HydrophobicContact CE1-CG 3.98Å; F255-R259 HydrophobicContact CE2-CG 4.31Å; F255-R259 HydrophobicContact CZ-CG 3.97Å; F255-R259 WeakPolarHBondContact O-CG 3.44Å; F255-R259 PolarHBondContact O-N 3.27Å; F255-V282 HydrophobicContact CB-CG1 3.73Å; F255-V282 HydrophobicContact CD2-CG1 4.37Å; F255-A286 HydrophobicContact CB-CB 4.03Å; F255-A286 HydrophobicContact CG-CB 4.4Å |
| 256 | H | 94.4 | Very high | 91.3 | Very high | 3 Ų | 3 | 39.9 Ų | 39.9 | 1% | 0.014 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -66.7 | -40.6 | 179.2 | -76.4 | -69.4 | 0 | 0 | 0 | 112.6 | F211 F215 W252 T253 R259 V260 | F211-H256 HydrophobicContact CD2-CB 4Å; F211-H256 HydrophobicContact CE2-CB 4.24Å; F215-H256 HydrophobicContact CB-CB 4.44Å; F215-H256 HydrophobicContact CD2-CB 4.37Å; F215-H256 AromaticContact CD2-CD2 3.35Å; F215-H256 WeakPolarHBondContact CD2-CD2 3.14Å; F215-H256 AromaticContact CD2-CG 3.98Å; F215-H256 HydrophobicContact CG-CB 4.22Å; F215-H256 AromaticContact CG-CD2 3.65Å; F215-H256 AromaticContact CG-CG 3.87Å; W252-H256 PolarHBondContact O-CD2 3.34Å; W252-H256 VanDerWaalsContact O-CD2 3.23Å; W252-H256 PolarHBondContact O-N 2.91Å; W252-H256 VanDerWaalsContact O-N 3.08Å; T253-H256 PolarHBondContact O-N 2.95Å; H256-R259 PolarHBondContact O-N 2.96Å; H256-V260 WeakPolarHBondContact O-CG2 3.47Å; H256-V260 PolarHBondContact O-N 3.35Å; H256-V260 VanDerWaalsContact O-N 3.09Å |
| 257 | I | 94.6 | Very high | 91.3 | Very high | 89 Ų | 89 | 41.1 Ų | 41.1 | 46% | 0.456 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60.3 | -48.6 | 173.5 | -68.4 | 173.4 | 0 | 0 | 0 | 110 | T253 R259 V260 I261 | T253-I257 HydrophobicContact CG2-CD1 3.59Å; T253-I257 HydrophobicContact CG2-CG1 4.2Å; T253-I257 WeakPolarHBondContact O-CG1 3.43Å; T253-I257 PolarHBondContact O-N 3.44Å; I257-R259 VanDerWaalsContact C-N 3.33Å; I257-R259 PolarHBondContact O-N 2.92Å; I257-V260 PolarHBondContact O-N 3.16Å; I257-I261 HydrophobicContact CG2-CD1 3.71Å; I257-I261 HydrophobicContact CG2-CG1 4.37Å; I257-I261 WeakPolarHBondContact O-CG1 3.34Å; I257-I261 PolarHBondContact O-N 3.24Å |
| 258 | L | 94.8 | Very high | 91.2 | Very high | 11 Ų | 11 | 50.5 Ų | 50.5 | 6% | 0.058 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -57.9 | -44.5 | -179.7 | -172.2 | 145.1 | 0 | 0 | 0 | 111.7 | P254 F255 I261 I262 V275 A278 E279 V282 | P254-L258 WeakPolarHBondContact O-CB 3.38Å; P254-L258 PolarHBondContact O-N 3.07Å; F255-L258 PolarHBondContact O-N 3.48Å; L258-I261 PolarHBondContact O-N 2.87Å; L258-I262 HydrophobicContact CD2-CD1 3.53Å; L258-I262 HydrophobicContact CD2-CG1 4.2Å; L258-I262 WeakPolarHBondContact O-CG1 3.39Å; L258-I262 PolarHBondContact O-N 3.02Å; L258-V275 HydrophobicContact CD1-CG1 4.22Å; L258-V275 HydrophobicContact CD2-CG1 3.88Å; L258-V275 HydrophobicContact CG-CG1 3.65Å; L258-A278 HydrophobicContact CD1-CB 4.18Å; L258-E279 HydrophobicContact CD2-CB 4.18Å; L258-E279 HydrophobicContact CD2-CG 4.28Å; L258-V282 HydrophobicContact CB-CG1 4.22Å; L258-V282 HydrophobicContact CD1-CB 3.91Å; L258-V282 HydrophobicContact CD1-CG1 4.1Å; L258-V282 HydrophobicContact CD1-CG2 3.76Å |
| 259 | R | 93.2 | Very high | 91.4 | Very high | 43 Ų | 43 | 52 Ų | 52 | 16% | 0.162 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 177 | -70.2 | -60.3 | -172.3 | -161.7 | -4.6 | 113.3 | F255 H256 I257 I261 I262 T263 E279 | F255-R259 HydrophobicContact CD1-CG 4.34Å; F255-R259 HydrophobicContact CE1-CG 3.98Å; F255-R259 HydrophobicContact CE2-CG 4.31Å; F255-R259 HydrophobicContact CZ-CG 3.97Å; F255-R259 WeakPolarHBondContact O-CG 3.44Å; F255-R259 PolarHBondContact O-N 3.27Å; H256-R259 PolarHBondContact O-N 2.96Å; I257-R259 VanDerWaalsContact C-N 3.33Å; I257-R259 PolarHBondContact O-N 2.92Å; R259-I261 VanDerWaalsContact C-N 3.33Å; R259-I262 PolarHBondContact O-N 2.01Å; R259-T263 PolarHBondContact O-N 3.28Å; R259-T263 PolarHBondContact O-OG1 3.27Å; R259-E279 IonicContact CZ-OE1 2.68Å; R259-E279 IonicContact NH1-OE1 3.74Å; R259-E279 PolarHBondContact NH1-OE1 3.02Å; R259-E279 IonicContact NH1-OE2 3.05Å; R259-E279 IonicContact NH2-OE1 2.71Å; R259-E279 PolarHBondContact NH2-OE1 3.43Å |
| 260 | V | 93.6 | Very high | 91.3 | Very high | 55 Ų | 55 | 57 Ų | 57 | 33% | 0.333 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.5 | -43 | 174.5 | 171.4 | 0 | 0 | 0 | 0 | 110.2 | T207 F211 H256 I257 T263 V264 | T207-V260 HydrophobicContact CG2-CG2 4.19Å; F211-V260 HydrophobicContact CD2-CG2 4.19Å; F211-V260 HydrophobicContact CG-CG2 4.47Å; H256-V260 WeakPolarHBondContact O-CG2 3.47Å; H256-V260 PolarHBondContact O-N 3.35Å; H256-V260 VanDerWaalsContact O-N 3.09Å; I257-V260 PolarHBondContact O-N 3.16Å; V260-T263 PolarHBondContact O-N 3.04Å; V260-V264 WeakPolarHBondContact O-CG2 3.28Å; V260-V264 PolarHBondContact O-N 3.46Å |
| 261 | I | 93.3 | Very high | 91.1 | Very high | 51 Ų | 51 | 56.2 Ų | 56.2 | 26% | 0.262 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 178.1 | -63.4 | 166.8 | 0 | 0 | 0 | 111.1 | I257 L258 R259 T263 V264 A265 L271 V275 | I257-I261 HydrophobicContact CG2-CD1 3.71Å; I257-I261 HydrophobicContact CG2-CG1 4.37Å; I257-I261 WeakPolarHBondContact O-CG1 3.34Å; I257-I261 PolarHBondContact O-N 3.24Å; L258-I261 PolarHBondContact O-N 2.87Å; R259-I261 VanDerWaalsContact C-N 3.33Å; I261-T263 PolarHBondContact O-N 3.36Å; I261-V264 PolarHBondContact O-N 3.43Å; I261-V264 VanDerWaalsContact O-N 3.17Å; I261-A265 WeakPolarHBondContact O-CB 3.25Å; I261-A265 PolarHBondContact O-N 3.02Å; I261-L271 HydrophobicContact CG2-CD1 4.21Å; I261-L271 HydrophobicContact CG2-CD2 3.94Å; I261-L271 HydrophobicContact CG2-CG 4Å; I261-V275 HydrophobicContact CB-CG2 4.43Å; I261-V275 HydrophobicContact CG2-CG2 3.77Å |
| 262 | I | 90.9 | Very high | 90.9 | Very high | 30 Ų | 30 | 57.4 Ų | 57.4 | 15% | 0.154 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -52.9 | -45.9 | 176.8 | -71.8 | 175.2 | 0 | 0 | 0 | 110.9 | L258 R259 V264 V275 L276 | L258-I262 HydrophobicContact CD2-CD1 3.53Å; L258-I262 HydrophobicContact CD2-CG1 4.2Å; L258-I262 WeakPolarHBondContact O-CG1 3.39Å; L258-I262 PolarHBondContact O-N 3.02Å; R259-I262 PolarHBondContact O-N 2.01Å; I262-V264 VanDerWaalsContact C-N 3.35Å; I262-V264 PolarHBondContact O-N 3.46Å; I262-V275 HydrophobicContact CD1-CG1 3.92Å; I262-V275 HydrophobicContact CG1-CG1 3.32Å; I262-L276 HydrophobicContact CD1-CD2 4.26Å |
| 263 | T | 89.8 | Confident | 90.6 | Very high | 32 Ų | 32 | 59.8 Ų | 59.8 | 20% | 0.196 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -70.4 | -26.8 | -176.5 | -66 | 0 | 0 | 0 | 0 | 114 | E203 A204 T207 R259 V260 I261 | E203-T263 HydrophobicContact CG-CG2 3.88Å; E203-T263 WeakPolarHBondContact OE1-CA 3.32Å; E203-T263 PolarHBondContact OE1-OG1 3.18Å; A204-T263 HydrophobicContact CB-CG2 4.37Å; T207-T263 PolarHBondContact OG1-OG1 3.06Å; R259-T263 PolarHBondContact O-N 3.28Å; R259-T263 PolarHBondContact O-OG1 3.27Å; V260-T263 PolarHBondContact O-N 3.04Å; I261-T263 PolarHBondContact O-N 3.36Å |
| 264 | V | 91.3 | Very high | 90.3 | Very high | 112 Ų | 112 | 65.7 Ų | 65.7 | 68% | 0.679 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -103.6 | -12.3 | -178.8 | -54.7 | 0 | 0 | 0 | 0 | 113.8 | V260 I261 I262 | V260-V264 WeakPolarHBondContact O-CG2 3.28Å; V260-V264 PolarHBondContact O-N 3.46Å; I261-V264 PolarHBondContact O-N 3.43Å; I261-V264 VanDerWaalsContact O-N 3.17Å; I262-V264 VanDerWaalsContact C-N 3.35Å; I262-V264 PolarHBondContact O-N 3.46Å |
| 265 | A | 89.4 | Confident | 90.1 | Very high | 18 Ų | 18 | 64.4 Ų | 64.4 | 15% | 0.149 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -67.7 | 139.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | I261 L271 L272 | I261-A265 WeakPolarHBondContact O-CB 3.25Å; I261-A265 PolarHBondContact O-N 3.02Å; A265-L271 HydrophobicContact CB-CD2 4.48Å; A265-L272 HydrophobicContact CB-CB 4.12Å; A265-L272 HydrophobicContact CB-CD1 4.38Å |
| 266 | A | 85.3 | Confident | 89.9 | Confident | 61 Ų | 61 | 67.5 Ų | 67.5 | 50% | 0.504 | 37% | 0.366 | S | S | . | . | P | Polyproline II helix | trans | -62.8 | 141.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | S269 | A266-S269 VanDerWaalsContact O-CB 3.25Å; A266-S269 WeakPolarHBondContact O-CB 3.39Å; A266-S269 PolarHBondContact O-N 2.92Å; A266-S269 PolarHBondContact O-OG 2.99Å |
| 267 | P | 84.1 | Confident | 89.6 | Confident | 99 Ų | 99 | 73.1 Ų | 73.1 | 64% | 0.643 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | 143 | 175.8 | 26.2 | -34.2 | 0 | 0 | 0 | 109.8 | S269 | P267-S269 PolarHBondContact O-N 3.34Å; P267-S269 VanDerWaalsContact O-N 3.1Å |
| 268 | F | 82.7 | Confident | 89.5 | Confident | 208 Ų | 208 | 70.4 Ų | 70.4 | 91% | 0.912 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.7 | 15.6 | -178.9 | -44.9 | -69.6 | 0 | 0 | 0 | 115.7 | ||
| 269 | S | 88.9 | Confident | 89.4 | Confident | 32 Ų | 32 | 72.2 Ų | 72.2 | 22% | 0.224 | 39% | 0.39 | C | S | . | . | trans | -76.6 | 150.5 | 176.2 | 65.6 | 0 | 0 | 0 | 0 | 112.7 | A266 P267 L271 L272 A273 | A266-S269 VanDerWaalsContact O-CB 3.25Å; A266-S269 WeakPolarHBondContact O-CB 3.39Å; A266-S269 PolarHBondContact O-N 2.92Å; A266-S269 PolarHBondContact O-OG 2.99Å; P267-S269 PolarHBondContact O-N 3.34Å; P267-S269 VanDerWaalsContact O-N 3.1Å; S269-L271 PolarHBondContact O-N 2.74Å; S269-L272 WeakPolarHBondContact O-CB 3.4Å; S269-L272 PolarHBondContact O-N 3.42Å; S269-L272 VanDerWaalsContact O-N 3.11Å; S269-L272 WeakPolarHBondContact OG-CB 3.38Å; S269-L272 PolarHBondContact OG-N 2.95Å; S269-A273 PolarHBondContact O-N 3.09Å; S269-A273 VanDerWaalsContact O-N 3.12Å | ||
| 270 | L | 88 | Confident | 89.4 | Confident | 118 Ų | 118 | 71.9 Ų | 71.9 | 62% | 0.618 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -57 | -33.5 | 171.9 | 179.5 | 63.2 | 0 | 0 | 0 | 112 | A273 R274 | L270-A273 PolarHBondContact O-N 3.24Å; L270-R274 HydrophobicContact CD1-CG 4.46Å; L270-R274 WeakPolarHBondContact O-CG 3.44Å; L270-R274 PolarHBondContact O-N 2.76Å |
| 271 | L | 89 | Confident | 89.5 | Confident | 94 Ų | 94 | 73 Ų | 73 | 49% | 0.492 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.4 | -48.2 | 175.9 | 177.9 | 61.6 | 0 | 0 | 0 | 111.2 | I261 A265 S269 A273 R274 V275 | I261-L271 HydrophobicContact CG2-CD1 4.21Å; I261-L271 HydrophobicContact CG2-CD2 3.94Å; I261-L271 HydrophobicContact CG2-CG 4Å; A265-L271 HydrophobicContact CB-CD2 4.48Å; S269-L271 PolarHBondContact O-N 2.74Å; L271-A273 VanDerWaalsContact C-N 3.34Å; L271-A273 PolarHBondContact O-N 2.86Å; L271-R274 PolarHBondContact O-N 2.85Å; L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CB 3.47Å; L271-V275 WeakPolarHBondContact O-CG2 3.27Å; L271-V275 PolarHBondContact O-N 2.98Å |
| 272 | L | 87.7 | Confident | 89.6 | Confident | 35 Ų | 35 | 71.5 Ų | 71.5 | 18% | 0.183 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 177.7 | 179.9 | 61.2 | 0 | 0 | 0 | 111 | A265 S269 R274 V275 L276 | A265-L272 HydrophobicContact CB-CB 4.12Å; A265-L272 HydrophobicContact CB-CD1 4.38Å; S269-L272 WeakPolarHBondContact O-CB 3.4Å; S269-L272 PolarHBondContact O-N 3.42Å; S269-L272 VanDerWaalsContact O-N 3.11Å; S269-L272 WeakPolarHBondContact OG-CB 3.38Å; S269-L272 PolarHBondContact OG-N 2.95Å; L272-R274 PolarHBondContact O-N 3.09Å; L272-V275 PolarHBondContact O-N 2.68Å; L272-L276 HydrophobicContact CD1-CD1 4.06Å; L272-L276 HydrophobicContact CD1-CG 4.1Å; L272-L276 HydrophobicContact CG-CD1 3.97Å; L272-L276 HydrophobicContact CG-CG 4.42Å; L272-L276 VanDerWaalsContact O-CG 3.31Å; L272-L276 WeakPolarHBondContact O-CG 3.49Å; L272-L276 PolarHBondContact O-N 2.71Å |
| 273 | A | 86.8 | Confident | 89.7 | Confident | 59 Ų | 59 | 71.2 Ų | 71.2 | 49% | 0.488 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.8 | -46.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | S269 L270 L271 V275 L276 F277 | S269-A273 PolarHBondContact O-N 3.09Å; S269-A273 VanDerWaalsContact O-N 3.12Å; L270-A273 PolarHBondContact O-N 3.24Å; L271-A273 VanDerWaalsContact C-N 3.34Å; L271-A273 PolarHBondContact O-N 2.86Å; A273-V275 VanDerWaalsContact C-N 3.33Å; A273-V275 PolarHBondContact O-N 3.07Å; A273-L276 PolarHBondContact O-N 3.33Å; A273-F277 WeakPolarHBondContact O-CB 3.48Å; A273-F277 PolarHBondContact O-N 3.15Å |
| 274 | R | 89.4 | Confident | 90 | Very high | 168 Ų | 168 | 69.7 Ų | 69.7 | 63% | 0.634 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.2 | -39.1 | 177.7 | -73.5 | 179.8 | -178.5 | -149.1 | 0.3 | 112.6 | L270 L271 L272 F277 A278 | L270-R274 HydrophobicContact CD1-CG 4.46Å; L270-R274 WeakPolarHBondContact O-CG 3.44Å; L270-R274 PolarHBondContact O-N 2.76Å; L271-R274 PolarHBondContact O-N 2.85Å; L272-R274 PolarHBondContact O-N 3.09Å; R274-F277 PolarHBondContact O-N 2.86Å; R274-A278 WeakPolarHBondContact O-CB 3.41Å; R274-A278 PolarHBondContact O-N 3.37Å |
| 275 | V | 90.7 | Very high | 90.2 | Very high | 14 Ų | 14 | 67.6 Ų | 67.6 | 9% | 0.085 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -69.5 | -44.2 | -179.7 | 160.4 | 0 | 0 | 0 | 0 | 111.5 | L258 I261 I262 L271 L272 A273 F277 A278 E279 | L258-V275 HydrophobicContact CD1-CG1 4.22Å; L258-V275 HydrophobicContact CD2-CG1 3.88Å; L258-V275 HydrophobicContact CG-CG1 3.65Å; I261-V275 HydrophobicContact CB-CG2 4.43Å; I261-V275 HydrophobicContact CG2-CG2 3.77Å; I262-V275 HydrophobicContact CD1-CG1 3.92Å; I262-V275 HydrophobicContact CG1-CG1 3.32Å; L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CB 3.47Å; L271-V275 WeakPolarHBondContact O-CG2 3.27Å; L271-V275 PolarHBondContact O-N 2.98Å; L272-V275 PolarHBondContact O-N 2.68Å; A273-V275 VanDerWaalsContact C-N 3.33Å; A273-V275 PolarHBondContact O-N 3.07Å; V275-F277 VanDerWaalsContact C-N 3.29Å; V275-F277 PolarHBondContact O-N 2.84Å; V275-A278 PolarHBondContact O-N 3.22Å; V275-E279 PolarHBondContact O-N 2.83Å |
| 276 | L | 89.1 | Confident | 90.4 | Very high | 85 Ų | 85 | 66.8 Ų | 66.8 | 45% | 0.445 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62 | -38.4 | 174.4 | -68.5 | 172.5 | 0 | 0 | 0 | 111.4 | I262 L272 A273 A278 E279 | I262-L276 HydrophobicContact CD1-CD2 4.26Å; L272-L276 HydrophobicContact CD1-CD1 4.06Å; L272-L276 HydrophobicContact CD1-CG 4.1Å; L272-L276 HydrophobicContact CG-CD1 3.97Å; L272-L276 HydrophobicContact CG-CG 4.42Å; L272-L276 VanDerWaalsContact O-CG 3.31Å; L272-L276 WeakPolarHBondContact O-CG 3.49Å; L272-L276 PolarHBondContact O-N 2.71Å; A273-L276 PolarHBondContact O-N 3.33Å; L276-A278 VanDerWaalsContact C-N 3.34Å; L276-A278 PolarHBondContact O-N 2.87Å; L276-E279 WeakPolarHBondContact O-CB 3.44Å; L276-E279 PolarHBondContact O-N 2.92Å |
| 277 | F | 89.3 | Confident | 90.8 | Very high | 122 Ų | 122 | 64.1 Ų | 64.1 | 54% | 0.535 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.2 | -37.8 | 174.4 | -176.7 | -96.3 | 0 | 0 | 0 | 112.9 | Y40 A273 R274 V275 P280 | Y40-F277 HydrophobicContact CD1-CE1 4.06Å; Y40-F277 AromaticContact CD1-CE2 3.95Å; Y40-F277 HydrophobicContact CD1-CE2 3.95Å; Y40-F277 AromaticContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD1-CZ 3.46Å; Y40-F277 VanDerWaalsContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD2-CE1 4.41Å; Y40-F277 HydrophobicContact CD2-CZ 4.43Å; Y40-F277 HydrophobicContact CE1-CD1 4.4Å; Y40-F277 HydrophobicContact CE1-CD2 4.5Å; Y40-F277 AromaticContact CE1-CE1 3.84Å; Y40-F277 HydrophobicContact CE1-CE1 3.84Å; Y40-F277 AromaticContact CE1-CE2 3.96Å; Y40-F277 HydrophobicContact CE1-CE2 3.96Å; Y40-F277 AromaticContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE2-CE1 4.25Å; Y40-F277 HydrophobicContact CG-CE1 4.32Å; Y40-F277 AromaticContact CG-CZ 3.89Å; Y40-F277 HydrophobicContact CG-CZ 3.89Å; Y40-F277 AromaticContact CZ-CE1 3.95Å; Y40-F277 PolarHBondContact OH-O 2.89Å; A273-F277 WeakPolarHBondContact O-CB 3.48Å; A273-F277 PolarHBondContact O-N 3.15Å; R274-F277 PolarHBondContact O-N 2.86Å; V275-F277 VanDerWaalsContact C-N 3.29Å; V275-F277 PolarHBondContact O-N 2.84Å; F277-P280 WeakPolarHBondContact O-CD 3.31Å |
| 278 | A | 91.9 | Very high | 91.3 | Very high | 31 Ų | 31 | 60.1 Ų | 60.1 | 26% | 0.256 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -80.7 | -13.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | L258 R274 V275 L276 L281 V282 | L258-A278 HydrophobicContact CD1-CB 4.18Å; R274-A278 WeakPolarHBondContact O-CB 3.41Å; R274-A278 PolarHBondContact O-N 3.37Å; V275-A278 PolarHBondContact O-N 3.22Å; L276-A278 VanDerWaalsContact C-N 3.34Å; L276-A278 PolarHBondContact O-N 2.87Å; A278-L281 PolarHBondContact O-N 2.9Å; A278-V282 WeakPolarHBondContact O-CG2 3.47Å; A278-V282 PolarHBondContact O-N 3.42Å; A278-V282 VanDerWaalsContact O-N 3.07Å |
| 279 | E | 92.1 | Very high | 91.7 | Very high | 49 Ų | 49 | 50.2 Ų | 50.2 | 23% | 0.229 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -54.8 | -47.9 | -175 | -179.9 | 175.8 | -179.7 | 0 | 0 | 113.4 | L258 R259 V275 L276 L281 V282 T283 | L258-E279 HydrophobicContact CD2-CB 4.18Å; L258-E279 HydrophobicContact CD2-CG 4.28Å; R259-E279 IonicContact CZ-OE1 2.68Å; R259-E279 IonicContact NH1-OE1 3.74Å; R259-E279 PolarHBondContact NH1-OE1 3.02Å; R259-E279 IonicContact NH1-OE2 3.05Å; R259-E279 IonicContact NH2-OE1 2.71Å; R259-E279 PolarHBondContact NH2-OE1 3.43Å; V275-E279 PolarHBondContact O-N 2.83Å; L276-E279 WeakPolarHBondContact O-CB 3.44Å; L276-E279 PolarHBondContact O-N 2.92Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 2.79Å; E279-V282 PolarHBondContact O-N 3.46Å; E279-T283 WeakPolarHBondContact O-CB 3.21Å; E279-T283 PolarHBondContact O-N 2.83Å; E279-T283 PolarHBondContact O-OG1 2.82Å |
| 280 | P | 93.8 | Very high | 91.8 | Very high | 37 Ų | 37 | 48.8 Ų | 48.8 | 24% | 0.24 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.6 | -39.3 | 179.4 | -23.2 | 34.9 | 0 | 0 | 0 | 113 | L44 Y48 I100 F277 G284 | L44-P280 HydrophobicContact CD1-CB 3.81Å; L44-P280 HydrophobicContact CD2-CB 4.33Å; Y48-P280 PolarHBondContact OH-O 3.2Å; I100-P280 HydrophobicContact CD1-CB 4.11Å; I100-P280 HydrophobicContact CG1-CB 4.44Å; F277-P280 WeakPolarHBondContact O-CD 3.31Å; P280-G284 PolarHBondContact O-N 2.95Å |
| 281 | L | 95.3 | Very high | 91.9 | Very high | 77 Ų | 77 | 43.5 Ų | 43.5 | 40% | 0.403 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63 | -47.8 | 177.3 | 177.3 | 62 | 0 | 0 | 0 | 111.1 | Y40 L44 L47 A278 E279 G284 L285 | Y40-L281 HydrophobicContact CE2-CB 4.4Å; L44-L281 VanDerWaalsContact CD2-CA 3.46Å; L44-L281 HydrophobicContact CD2-CB 3.83Å; L44-L281 HydrophobicContact CD2-CD1 4.06Å; L47-L281 HydrophobicContact CD2-CD1 4.13Å; A278-L281 PolarHBondContact O-N 2.9Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 2.79Å; L281-G284 PolarHBondContact O-N 2.9Å; L281-L285 PolarHBondContact O-N 3.42Å |
| 282 | V | 95.4 | Very high | 91.7 | Very high | 20 Ų | 20 | 41.1 Ų | 41.1 | 12% | 0.121 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -68.7 | -36.7 | -178 | 167.4 | 0 | 0 | 0 | 0 | 111.5 | P254 F255 L258 A278 E279 L285 A286 | P254-V282 HydrophobicContact CB-CG1 3.94Å; P254-V282 HydrophobicContact CB-CG2 4.27Å; F255-V282 HydrophobicContact CB-CG1 3.73Å; F255-V282 HydrophobicContact CD2-CG1 4.37Å; L258-V282 HydrophobicContact CB-CG1 4.22Å; L258-V282 HydrophobicContact CD1-CB 3.91Å; L258-V282 HydrophobicContact CD1-CG1 4.1Å; L258-V282 HydrophobicContact CD1-CG2 3.76Å; A278-V282 WeakPolarHBondContact O-CG2 3.47Å; A278-V282 PolarHBondContact O-N 3.42Å; A278-V282 VanDerWaalsContact O-N 3.07Å; E279-V282 PolarHBondContact O-N 3.46Å; V282-L285 PolarHBondContact O-N 3.27Å; V282-A286 PolarHBondContact O-N 3.22Å |
| 283 | T | 94.6 | Very high | 91.3 | Very high | 25 Ų | 25 | 39.4 Ų | 39.4 | 15% | 0.153 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.7 | -44.1 | 170 | -67.6 | 0 | 0 | 0 | 0 | 111.4 | E279 L285 A286 L287 | E279-T283 WeakPolarHBondContact O-CB 3.21Å; E279-T283 PolarHBondContact O-N 2.83Å; E279-T283 PolarHBondContact O-OG1 2.82Å; T283-L285 VanDerWaalsContact C-N 3.33Å; T283-L285 PolarHBondContact O-N 3.05Å; T283-A286 PolarHBondContact O-N 3.18Å; T283-L287 HydrophobicContact CG2-CD1 3.92Å; T283-L287 HydrophobicContact CG2-CG 4.43Å; T283-L287 WeakPolarHBondContact O-CG 3.47Å; T283-L287 PolarHBondContact O-N 3.29Å |
| 284 | G | 95.2 | Very high | 90.9 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -57.1 | -45 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y48 I51 P280 L281 L287 A288 | Y48-G284 VanDerWaalsContact CE1-CA 3.48Å; I51-G284 VanDerWaalsContact CD1-O 3.27Å; I51-G284 WeakPolarHBondContact CD1-O 3.48Å; P280-G284 PolarHBondContact O-N 2.95Å; L281-G284 PolarHBondContact O-N 2.9Å; G284-L287 PolarHBondContact O-N 2.66Å; G284-A288 WeakPolarHBondContact O-CB 3.43Å; G284-A288 PolarHBondContact O-N 3.35Å |
| 285 | L | 95.1 | Very high | 90.1 | Very high | 68 Ų | 68 | 33.2 Ų | 33.2 | 36% | 0.356 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -62.3 | -42.7 | 176.3 | -179.3 | 60.2 | 0 | 0 | 0 | 112.3 | C251 P254 L281 V282 T283 L287 A288 | C251-L285 WeakPolarHBondContact CB-O 3.49Å; P254-L285 HydrophobicContact CB-CD2 4.35Å; P254-L285 HydrophobicContact CG-CD2 3.81Å; L281-L285 PolarHBondContact O-N 3.42Å; V282-L285 PolarHBondContact O-N 3.27Å; T283-L285 VanDerWaalsContact C-N 3.33Å; T283-L285 PolarHBondContact O-N 3.05Å; L285-L287 VanDerWaalsContact C-N 3.34Å; L285-L287 PolarHBondContact O-N 3.45Å; L285-A288 VanDerWaalsContact O-CB 3.3Å; L285-A288 WeakPolarHBondContact O-CB 3.38Å; L285-A288 PolarHBondContact O-N 3.06Å |
| 286 | A | 94.7 | Very high | 89.1 | Confident | 1 Ų | 1 | 33.9 Ų | 33.9 | 1% | 0.008 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | C251 W252 F255 V282 T283 A288 H289 | C251-A286 WeakPolarHBondContact O-CA 3.42Å; C251-A286 PolarHBondContact O-N 3.4Å; W252-A286 HydrophobicContact CD2-CB 3.89Å; W252-A286 HydrophobicContact CE3-CB 3.75Å; W252-A286 HydrophobicContact CH2-CB 4.11Å; W252-A286 HydrophobicContact CZ2-CB 4.3Å; W252-A286 HydrophobicContact CZ3-CB 3.84Å; W252-A286 PolarHBondContact NE1-O 3.29Å; F255-A286 HydrophobicContact CB-CB 4.03Å; F255-A286 HydrophobicContact CG-CB 4.4Å; V282-A286 PolarHBondContact O-N 3.22Å; T283-A286 PolarHBondContact O-N 3.18Å; A286-A288 VanDerWaalsContact C-N 3.3Å; A286-A288 PolarHBondContact O-N 2.98Å; A286-H289 WeakPolarHBondContact O-CB 3.38Å; A286-H289 PolarHBondContact O-N 2.88Å |
| 287 | L | 93.9 | Very high | 88.1 | Confident | 4 Ų | 4 | 31 Ų | 31 | 2% | 0.021 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -71.6 | -23.4 | 177.4 | -64.9 | 172.4 | 0 | 0 | 0 | 112.9 | C89 L93 L96 T283 G284 L285 H289 S290 | C89-L287 HydrophobicContact CB-CD2 4.1Å; L93-L287 HydrophobicContact CD2-CB 4.1Å; L93-L287 HydrophobicContact CD2-CD1 3.54Å; L93-L287 HydrophobicContact CD2-CG 4.45Å; L93-L287 HydrophobicContact CG-CD1 4.43Å; L96-L287 HydrophobicContact CD1-CD1 3.71Å; T283-L287 HydrophobicContact CG2-CD1 3.92Å; T283-L287 HydrophobicContact CG2-CG 4.43Å; T283-L287 WeakPolarHBondContact O-CG 3.47Å; T283-L287 PolarHBondContact O-N 3.29Å; G284-L287 PolarHBondContact O-N 2.66Å; L285-L287 VanDerWaalsContact C-N 3.34Å; L285-L287 PolarHBondContact O-N 3.45Å; L287-H289 PolarHBondContact O-N 3.2Å; L287-S290 WeakPolarHBondContact O-CB 3.4Å; L287-S290 PolarHBondContact O-N 3.47Å; L287-S290 VanDerWaalsContact O-N 3.09Å |
| 288 | A | 93.6 | Very high | 87 | Confident | 16 Ų | 16 | 28.9 Ų | 28.9 | 13% | 0.132 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -60.2 | -28.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | I51 G284 L285 A286 S290 A291 V292 | I51-A288 HydrophobicContact CD1-CB 3.72Å; I51-A288 HydrophobicContact CG1-CB 3.97Å; G284-A288 WeakPolarHBondContact O-CB 3.43Å; G284-A288 PolarHBondContact O-N 3.35Å; L285-A288 VanDerWaalsContact O-CB 3.3Å; L285-A288 WeakPolarHBondContact O-CB 3.38Å; L285-A288 PolarHBondContact O-N 3.06Å; A286-A288 VanDerWaalsContact C-N 3.3Å; A286-A288 PolarHBondContact O-N 2.98Å; A288-S290 PolarHBondContact O-N 3.44Å; A288-A291 PolarHBondContact O-N 2.98Å; A288-V292 WeakPolarHBondContact O-CG2 3.34Å; A288-V292 PolarHBondContact O-N 3.33Å |
| 289 | H | 90.7 | Very high | 85.6 | Confident | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -49.6 | -41.5 | 172.7 | 165 | -95.7 | 0 | 0 | 0 | 112.4 | F248 C251 A286 L287 A291 V292 N293 | F248-H289 WeakPolarHBondContact CA-CD2 3.42Å; F248-H289 AromaticContact CD2-CD2 3.98Å; F248-H289 AromaticContact CD2-CE1 3.56Å; F248-H289 AromaticContact CD2-ND1 3.84Å; F248-H289 AromaticContact CD2-NE2 3.63Å; F248-H289 PolarHBondContact N-CD2 3.48Å; C251-H289 HydrophobicContact CB-CB 3.82Å; A286-H289 WeakPolarHBondContact O-CB 3.38Å; A286-H289 PolarHBondContact O-N 2.88Å; L287-H289 PolarHBondContact O-N 3.2Å; H289-A291 PolarHBondContact O-N 3.45Å; H289-V292 WeakPolarHBondContact O-CB 3.33Å; H289-V292 PolarHBondContact O-N 3.47Å; H289-N293 PolarHBondContact CE1-ND2 3.18Å; H289-N293 PolarHBondContact NE2-ND2 3.37Å; H289-N293 PolarHBondContact NE2-OD1 2.95Å; H289-N293 PolarHBondContact O-N 3.12Å |
| 290 | S | 91 | Very high | 83.9 | Confident | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.007 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64 | -27.5 | -179.1 | -64.9 | 0 | 0 | 0 | 0 | 112.9 | N59 D86 L287 A288 P294 | N59-S290 PolarHBondContact ND2-O 2.92Å; D86-S290 WeakPolarHBondContact OD1-CA 3.34Å; D86-S290 WeakPolarHBondContact OD1-CB 3.37Å; D86-S290 PolarHBondContact OD1-OG 3.26Å; L287-S290 WeakPolarHBondContact O-CB 3.4Å; L287-S290 PolarHBondContact O-N 3.47Å; L287-S290 VanDerWaalsContact O-N 3.09Å; A288-S290 PolarHBondContact O-N 3.44Å; S290-P294 WeakPolarHBondContact O-CD 3.31Å |
| 291 | A | 90.1 | Very high | 82.1 | Confident | 7 Ų | 7 | 37 Ų | 37 | 6% | 0.058 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -84.6 | -21.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | I51 V54 A288 H289 | I51-A291 HydrophobicContact CB-CB 4.45Å; I51-A291 HydrophobicContact CG2-CB 3.81Å; V54-A291 HydrophobicContact CB-CB 4.27Å; V54-A291 HydrophobicContact CG1-CB 4.15Å; A288-A291 PolarHBondContact O-N 2.98Å; H289-A291 PolarHBondContact O-N 3.45Å |
| 292 | V | 85.3 | Confident | 79.9 | Confident | 44 Ų | 44 | 42.1 Ų | 42.1 | 27% | 0.267 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -74 | -33.5 | 178.3 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | A288 H289 I295 M296 | A288-V292 WeakPolarHBondContact O-CG2 3.34Å; A288-V292 PolarHBondContact O-N 3.33Å; H289-V292 WeakPolarHBondContact O-CB 3.33Å; H289-V292 PolarHBondContact O-N 3.47Å; V292-I295 WeakPolarHBondContact O-CB 3.43Å; V292-I295 PolarHBondContact O-N 3.24Å; V292-I295 VanDerWaalsContact O-N 3.12Å; V292-M296 HydrophobicContact CG1-CE 3.26Å; V292-M296 HydrophobicContact CG1-CG 3.96Å; V292-M296 HydrophobicContact CG1-SD 4.08Å; V292-M296 WeakPolarHBondContact O-CG 3.28Å; V292-M296 PolarHBondContact O-N 2.88Å |
| 293 | N | 80.2 | Confident | 77.5 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -55.4 | -52.6 | -177.5 | -76 | -13.4 | 0 | 0 | 0 | 113.7 | D86 H289 I295 M296 F297 | D86-N293 PolarHBondContact OD2-ND2 2.95Å; H289-N293 PolarHBondContact CE1-ND2 3.18Å; H289-N293 PolarHBondContact NE2-ND2 3.37Å; H289-N293 PolarHBondContact NE2-OD1 2.95Å; H289-N293 PolarHBondContact O-N 3.12Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.29Å; N293-M296 PolarHBondContact O-N 3.26Å; N293-F297 HydrophobicContact CB-CE2 4.22Å; N293-F297 WeakPolarHBondContact O-CD2 3.43Å; N293-F297 PolarHBondContact O-N 3.44Å |
| 294 | P | 78.1 | Confident | 75.2 | Confident | 3 Ų | 3 | 53.4 Ų | 53.4 | 2% | 0.019 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.3 | -39.1 | 173.8 | -27.5 | 35.2 | 0 | 0 | 0 | 114.4 | G58 N59 V62 S290 M296 F297 L298 | G58-P294 VanDerWaalsContact C-CG 3.46Å; N59-P294 HydrophobicContact CB-CG 4.37Å; N59-P294 VanDerWaalsContact CG-CG 3.49Å; N59-P294 VanDerWaalsContact OD1-CG 3.31Å; N59-P294 WeakPolarHBondContact OD1-CG 3.43Å; V62-P294 HydrophobicContact CG2-CB 4.26Å; V62-P294 HydrophobicContact CG2-CG 4.46Å; S290-P294 WeakPolarHBondContact O-CD 3.31Å; P294-M296 VanDerWaalsContact C-N 3.34Å; P294-F297 PolarHBondContact O-N 3.46Å; P294-L298 WeakPolarHBondContact O-CG 3.29Å; P294-L298 PolarHBondContact O-N 3.39Å |
| 295 | I | 73.3 | Confident | 72.8 | Confident | 93 Ų | 93 | 55.1 Ų | 55.1 | 48% | 0.477 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 178.7 | -58.3 | 173.6 | 0 | 0 | 0 | 109.8 | V54 V292 N293 F297 L298 Y299 | V54-I295 HydrophobicContact CG1-CD1 4.15Å; V54-I295 HydrophobicContact CG1-CG1 4.36Å; V292-I295 WeakPolarHBondContact O-CB 3.43Å; V292-I295 PolarHBondContact O-N 3.24Å; V292-I295 VanDerWaalsContact O-N 3.12Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.29Å; I295-F297 VanDerWaalsContact C-N 3.34Å; I295-F297 PolarHBondContact O-N 3.38Å; I295-L298 PolarHBondContact O-N 2.83Å; I295-Y299 WeakPolarHBondContact O-CB 3.47Å; I295-Y299 PolarHBondContact O-N 3.22Å |
| 296 | M | 69.4 | Low | 70.5 | Confident | 28 Ų | 28 | 54.5 Ų | 54.5 | 14% | 0.138 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.7 | -39.4 | 176.3 | -68.1 | -168.2 | -177.2 | 0 | 0 | 111.7 | L240 A243 V244 V292 N293 P294 L298 Y299 F300 | L240-M296 HydrophobicContact CD1-CB 3.78Å; A243-M296 VanDerWaalsContact C-SD 3.6Å; A243-M296 HydrophobicContact CB-CE 4.4Å; A243-M296 HydrophobicContact CB-SD 4.03Å; A243-M296 WeakPolarHBondContact O-CE 3.39Å; V244-M296 VanDerWaalsContact CA-SD 3.57Å; V244-M296 HydrophobicContact CB-SD 4.19Å; V244-M296 HydrophobicContact CG2-CB 4.25Å; V244-M296 HydrophobicContact CG2-SD 3.58Å; V244-M296 VanDerWaalsContact CG2-SD 3.58Å; V292-M296 HydrophobicContact CG1-CE 3.26Å; V292-M296 HydrophobicContact CG1-CG 3.96Å; V292-M296 HydrophobicContact CG1-SD 4.08Å; V292-M296 WeakPolarHBondContact O-CG 3.28Å; V292-M296 PolarHBondContact O-N 2.88Å; N293-M296 PolarHBondContact O-N 3.26Å; P294-M296 VanDerWaalsContact C-N 3.34Å; M296-L298 PolarHBondContact O-N 3.4Å; M296-Y299 PolarHBondContact O-N 3.44Å; M296-F300 HydrophobicContact CB-CD2 4.38Å; M296-F300 WeakPolarHBondContact O-CD2 3.33Å; M296-F300 PolarHBondContact O-N 2.86Å |
| 297 | F | 66.7 | Low | 68.2 | Low | 24 Ų | 24 | 60 Ų | 60 | 11% | 0.105 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63 | -39.6 | 173.7 | -70.9 | -59.3 | 0 | 0 | 0 | 112.9 | V62 F79 L240 N293 P294 I295 G301 | V62-F297 HydrophobicContact CG1-CD2 4.26Å; V62-F297 HydrophobicContact CG1-CE2 4.4Å; V62-F297 HydrophobicContact CG2-CD2 3.99Å; F79-F297 AromaticContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE2 4.32Å; F79-F297 AromaticContact CD1-CZ 3.19Å; F79-F297 HydrophobicContact CD1-CZ 3.19Å; F79-F297 AromaticContact CE1-CE1 3.31Å; F79-F297 HydrophobicContact CE1-CE1 3.31Å; F79-F297 AromaticContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CG-CE1 4Å; F79-F297 HydrophobicContact CG-CZ 4.05Å; F79-F297 AromaticContact CZ-CE1 3.97Å; F79-F297 HydrophobicContact CZ-CE1 3.97Å; L240-F297 HydrophobicContact CD2-CD1 4.25Å; L240-F297 HydrophobicContact CD2-CE1 4.42Å; N293-F297 HydrophobicContact CB-CE2 4.22Å; N293-F297 WeakPolarHBondContact O-CD2 3.43Å; N293-F297 PolarHBondContact O-N 3.44Å; P294-F297 PolarHBondContact O-N 3.46Å; I295-F297 VanDerWaalsContact C-N 3.34Å; I295-F297 PolarHBondContact O-N 3.38Å; F297-G301 WeakPolarHBondContact O-CA 3.27Å; F297-G301 PolarHBondContact O-N 3.47Å |
| 298 | L | 67.3 | Low | 65.8 | Low | 79 Ų | 79 | 61.5 Ų | 61.5 | 41% | 0.414 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -68.9 | -43 | 176.9 | -72.6 | 166.1 | 0 | 0 | 0 | 112.2 | M61 P294 I295 M296 L305 | M61-L298 HydrophobicContact CE-CD1 4.2Å; M61-L298 HydrophobicContact CE-CD2 3.95Å; M61-L298 HydrophobicContact CE-CG 4.31Å; P294-L298 WeakPolarHBondContact O-CG 3.29Å; P294-L298 PolarHBondContact O-N 3.39Å; I295-L298 PolarHBondContact O-N 2.83Å; M296-L298 PolarHBondContact O-N 3.4Å; L298-L305 HydrophobicContact CD2-CD2 3.6Å |
| 299 | Y | 63 | Low | 63.2 | Low | 175 Ų | 175 | 64.2 Ų | 64.2 | 69% | 0.686 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -72 | -49.4 | -176.1 | -173.1 | -101.1 | 0 | 0 | 0 | 112.5 | I295 M296 | I295-Y299 WeakPolarHBondContact O-CB 3.47Å; I295-Y299 PolarHBondContact O-N 3.22Å; M296-Y299 PolarHBondContact O-N 3.44Å |
| 300 | F | 56.4 | Low | 60.6 | Low | 94 Ų | 94 | 70.1 Ų | 70.1 | 41% | 0.412 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -93.2 | -24 | -177.7 | -64 | -78.8 | 0 | 0 | 0 | 113.6 | A239 L240 A243 M296 R302 | A239-F300 HydrophobicContact CB-CE1 4.46Å; L240-F300 HydrophobicContact CB-CB 3.71Å; L240-F300 HydrophobicContact CB-CD2 4.35Å; L240-F300 HydrophobicContact CB-CG 4.01Å; L240-F300 HydrophobicContact CD1-CB 3.84Å; L240-F300 HydrophobicContact CD1-CD2 3.67Å; L240-F300 HydrophobicContact CD1-CG 4.06Å; L240-F300 HydrophobicContact CD2-CB 4.01Å; L240-F300 HydrophobicContact CG-CB 4.03Å; A243-F300 HydrophobicContact CB-CE2 3.93Å; A243-F300 HydrophobicContact CB-CZ 4.22Å; M296-F300 HydrophobicContact CB-CD2 4.38Å; M296-F300 WeakPolarHBondContact O-CD2 3.33Å; M296-F300 PolarHBondContact O-N 2.86Å; F300-R302 VanDerWaalsContact C-N 3.33Å |
| 301 | G | 55 | Low | 58 | Low | 17 Ų | 17 | 72.8 Ų | 72.8 | 18% | 0.175 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -87 | 2.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | F297 K303 Q304 L305 | F297-G301 WeakPolarHBondContact O-CA 3.27Å; F297-G301 PolarHBondContact O-N 3.47Å; G301-K303 PolarHBondContact O-N 3.28Å; G301-Q304 PolarHBondContact O-N 2.9Å; G301-L305 WeakPolarHBondContact O-CB 3.42Å; G301-L305 PolarHBondContact O-N 3.36Å |
| 302 | R | 49.1 | Very low | 55.2 | Low | 185 Ų | 185 | 74.7 Ų | 74.7 | 70% | 0.698 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -47.9 | -32.2 | -175.1 | -145.3 | 174.6 | 175.6 | -173.2 | -1.4 | 114.3 | F300 C306 | F300-R302 VanDerWaalsContact C-N 3.33Å; R302-C306 WeakPolarHBondContact O-CB 3.38Å; R302-C306 PolarHBondContact O-N 3.48Å; R302-C306 PolarHBondContact O-SG 2.77Å |
| 303 | K | 46.1 | Very low | 52.5 | Low | 176 Ų | 176 | 80 Ų | 80 | 77% | 0.765 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -75.9 | -37.3 | 175.4 | -95.1 | -174 | 173.2 | -172.8 | 0 | 114.4 | G301 Q307 | G301-K303 PolarHBondContact O-N 3.28Å; K303-Q307 VanDerWaalsContact O-CG 3.29Å; K303-Q307 WeakPolarHBondContact O-CG 3.43Å |
| 304 | Q | 44.2 | Very low | 50.1 | Low | 106 Ų | 106 | 86.5 Ų | 86.5 | 50% | 0.495 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -87.9 | -38.5 | -176.5 | -134 | 77.2 | 13.4 | 0 | 0 | 111.4 | G301 S308 | G301-Q304 PolarHBondContact O-N 2.9Å; Q304-S308 PolarHBondContact O-N 2.97Å; Q304-S308 PolarHBondContact O-OG 2.87Å |
| 305 | L | 45 | Very low | 47.8 | Very low | 36 Ų | 36 | 95.6 Ų | 95.6 | 19% | 0.188 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -76.1 | -36.5 | 179.5 | -156.3 | 79.3 | 0 | 0 | 0 | 112 | V65 L298 G301 Q307 S308 L309 | V65-L305 HydrophobicContact CG1-CD1 3.89Å; L298-L305 HydrophobicContact CD2-CD2 3.6Å; G301-L305 WeakPolarHBondContact O-CB 3.42Å; G301-L305 PolarHBondContact O-N 3.36Å; L305-Q307 VanDerWaalsContact C-N 3.27Å; L305-Q307 PolarHBondContact O-N 3.4Å; L305-S308 PolarHBondContact O-N 3.29Å; L305-L309 HydrophobicContact CD2-CD1 4Å; L305-L309 HydrophobicContact CG-CD1 3.98Å; L305-L309 HydrophobicContact CG-CG 4.33Å; L305-L309 VanDerWaalsContact O-CB 3.31Å; L305-L309 WeakPolarHBondContact O-CB 3.44Å; L305-L309 WeakPolarHBondContact O-CG 3.5Å; L305-L309 PolarHBondContact O-N 3.23Å |
| 306 | C | 48 | Very low | 45.6 | Very low | 55 Ų | 55 | 94.9 Ų | 94.9 | 37% | 0.372 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.1 | -32.9 | 172.9 | -73.2 | 0 | 0 | 0 | 0 | 111.8 | R302 Q310 | R302-C306 WeakPolarHBondContact O-CB 3.38Å; R302-C306 PolarHBondContact O-N 3.48Å; R302-C306 PolarHBondContact O-SG 2.77Å; C306-Q310 WeakPolarHBondContact O-CB 3.2Å; C306-Q310 WeakPolarHBondContact O-CG 3.42Å; C306-Q310 PolarHBondContact O-N 3.22Å; C306-Q310 PolarHBondContact O-OE1 2.84Å |
| 307 | Q | 45.6 | Very low | 43.8 | Very low | 116 Ų | 116 | 98.8 Ų | 98.8 | 54% | 0.542 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 173.1 | -72.6 | 173.4 | -8.1 | 0 | 0 | 111.5 | K303 L305 A311 | K303-Q307 VanDerWaalsContact O-CG 3.29Å; K303-Q307 WeakPolarHBondContact O-CG 3.43Å; L305-Q307 VanDerWaalsContact C-N 3.27Å; L305-Q307 PolarHBondContact O-N 3.4Å; Q307-A311 VanDerWaalsContact O-CB 3.28Å; Q307-A311 WeakPolarHBondContact O-CB 3.28Å; Q307-A311 PolarHBondContact O-N 3.44Å |
| 308 | S | 43.4 | Very low | 42.1 | Very low | 36 Ų | 36 | 106.7 Ų | 106.7 | 25% | 0.252 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -71.8 | -34.2 | 177.4 | -58.3 | 0 | 0 | 0 | 0 | 113.6 | Q304 L305 A312 | Q304-S308 PolarHBondContact O-N 2.97Å; Q304-S308 PolarHBondContact O-OG 2.87Å; L305-S308 PolarHBondContact O-N 3.29Å; S308-A312 WeakPolarHBondContact O-CB 3.21Å; S308-A312 PolarHBondContact O-N 3.17Å |
| 309 | L | 39.3 | Very low | 40.5 | Very low | 73 Ų | 73 | 108.3 Ų | 108.3 | 38% | 0.382 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -76.1 | -38.3 | 176.6 | -73.6 | 169.8 | 0 | 0 | 0 | 112 | L305 A311 A312 Y313 | L305-L309 HydrophobicContact CD2-CD1 4Å; L305-L309 HydrophobicContact CG-CD1 3.98Å; L305-L309 HydrophobicContact CG-CG 4.33Å; L305-L309 VanDerWaalsContact O-CB 3.31Å; L305-L309 WeakPolarHBondContact O-CB 3.44Å; L305-L309 WeakPolarHBondContact O-CG 3.5Å; L305-L309 PolarHBondContact O-N 3.23Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A312 PolarHBondContact O-N 3.04Å; L309-Y313 VanDerWaalsContact O-CB 3.26Å; L309-Y313 WeakPolarHBondContact O-CB 3.4Å; L309-Y313 PolarHBondContact O-N 3.48Å |
| 310 | Q | 36.1 | Very low | 39.4 | Very low | 124 Ų | 124 | 105.1 Ų | 105.1 | 58% | 0.579 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.6 | -40.2 | 170.5 | -76.7 | 174.8 | -30.5 | 0 | 0 | 110.9 | C306 Y313 H314 | C306-Q310 WeakPolarHBondContact O-CB 3.2Å; C306-Q310 WeakPolarHBondContact O-CG 3.42Å; C306-Q310 PolarHBondContact O-N 3.22Å; C306-Q310 PolarHBondContact O-OE1 2.84Å; Q310-Y313 PolarHBondContact O-N 3.11Å; Q310-H314 WeakPolarHBondContact O-CB 3.47Å; Q310-H314 PolarHBondContact O-CD2 3.23Å; Q310-H314 VanDerWaalsContact O-CD2 3.31Å; Q310-H314 PolarHBondContact O-N 2.74Å |
| 311 | A | 37.3 | Very low | 38.4 | Very low | 58 Ų | 58 | 107.7 Ų | 107.7 | 48% | 0.479 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.7 | -39.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q307 L309 W315 | Q307-A311 VanDerWaalsContact O-CB 3.28Å; Q307-A311 WeakPolarHBondContact O-CB 3.28Å; Q307-A311 PolarHBondContact O-N 3.44Å; L309-A311 VanDerWaalsContact C-N 3.33Å; A311-W315 WeakPolarHBondContact O-CB 3.19Å; A311-W315 PolarHBondContact O-N 3.28Å |
| 312 | A | 31.2 | Very low | 37.6 | Very low | 47 Ų | 47 | 112.2 Ų | 112.2 | 39% | 0.388 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -70.2 | -35.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | S308 L309 W315 A316 | S308-A312 WeakPolarHBondContact O-CB 3.21Å; S308-A312 PolarHBondContact O-N 3.17Å; L309-A312 PolarHBondContact O-N 3.04Å; A312-W315 PolarHBondContact O-N 3.29Å; A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 3.44Å |
| 313 | Y | 27.1 | Very low | 37.1 | Very low | 156 Ų | 156 | 110.8 Ų | 110.8 | 61% | 0.612 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -68.6 | -43.8 | 173.9 | -179.2 | -102.6 | 0 | 0 | 0 | 111.8 | L309 Q310 W315 A316 L317 | L309-Y313 VanDerWaalsContact O-CB 3.26Å; L309-Y313 WeakPolarHBondContact O-CB 3.4Å; L309-Y313 PolarHBondContact O-N 3.48Å; Q310-Y313 PolarHBondContact O-N 3.11Å; Y313-W315 VanDerWaalsContact C-N 3.3Å; Y313-W315 PolarHBondContact O-N 3.08Å; Y313-A316 PolarHBondContact O-N 3.31Å; Y313-L317 HydrophobicContact CD1-CD1 3.82Å; Y313-L317 HydrophobicContact CD2-CD1 4.36Å; Y313-L317 HydrophobicContact CE1-CD1 3.32Å; Y313-L317 HydrophobicContact CE2-CD1 3.93Å; Y313-L317 HydrophobicContact CG-CD1 4.32Å; Y313-L317 PolarHBondContact O-N 3.18Å; Y313-L317 VanDerWaalsContact O-N 3.16Å |
| 314 | H | 30.6 | Very low | 36.9 | Very low | 136 Ų | 136 | 110 Ų | 110 | 63% | 0.63 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.7 | -31.5 | 173.6 | -90.2 | -69.5 | 0 | 0 | 0 | 113.2 | Q310 | Q310-H314 WeakPolarHBondContact O-CB 3.47Å; Q310-H314 PolarHBondContact O-CD2 3.23Å; Q310-H314 VanDerWaalsContact O-CD2 3.31Å; Q310-H314 PolarHBondContact O-N 2.74Å |
| 315 | W | 28.8 | Very low | 36.7 | Very low | 193 Ų | 193 | 108.5 Ų | 108.5 | 73% | 0.731 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -74.6 | -34.1 | 175.3 | -172.7 | 84.1 | 0 | 0 | 0 | 112.3 | A311 A312 Y313 L317 | A311-W315 WeakPolarHBondContact O-CB 3.19Å; A311-W315 PolarHBondContact O-N 3.28Å; A312-W315 PolarHBondContact O-N 3.29Å; Y313-W315 VanDerWaalsContact C-N 3.3Å; Y313-W315 PolarHBondContact O-N 3.08Å; W315-L317 VanDerWaalsContact C-N 3.32Å |
| 316 | A | 29.1 | Very low | 36.4 | Very low | 78 Ų | 78 | 113.8 Ų | 113.8 | 65% | 0.645 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -76.2 | -15.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | A312 Y313 | A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 3.44Å; Y313-A316 PolarHBondContact O-N 3.31Å |
| 317 | L | 30.8 | Very low | 36.2 | Very low | 111 Ų | 111 | 116.2 Ų | 116.2 | 58% | 0.581 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | 2.5 | 176.2 | -81.6 | 165 | 0 | 0 | 0 | 113.8 | Y313 W315 D319 | Y313-L317 HydrophobicContact CD1-CD1 3.82Å; Y313-L317 HydrophobicContact CD2-CD1 4.36Å; Y313-L317 HydrophobicContact CE1-CD1 3.32Å; Y313-L317 HydrophobicContact CE2-CD1 3.93Å; Y313-L317 HydrophobicContact CG-CD1 4.32Å; Y313-L317 PolarHBondContact O-N 3.18Å; Y313-L317 VanDerWaalsContact O-N 3.16Å; W315-L317 VanDerWaalsContact C-N 3.32Å; L317-D319 PolarHBondContact O-N 3.4Å |
| 318 | R | 31.3 | Very low | 36 | Very low | 190 Ų | 190 | 114.2 Ų | 114.2 | 72% | 0.717 | 59% | 0.59 | S | S | * | * | trans | -78.5 | 110.4 | 166.9 | -93.2 | -175.5 | -179.2 | -178.7 | -0.4 | 108.5 | ||||
| 319 | D | 32.7 | Very low | 36 | Very low | 113 Ų | 113 | 119.3 Ų | 119.3 | 60% | 0.604 | 61% | 0.608 | S | S | * | * | trans | -64.8 | 140.8 | 171.9 | -132.3 | -14.4 | 0 | 0 | 0 | 109.2 | L317 Q321 | L317-D319 PolarHBondContact O-N 3.4Å; D319-Q321 PolarHBondContact O-N 3.43Å | ||
| 320 | P | 40.2 | Very low | 36.2 | Very low | 107 Ų | 107 | 119.8 Ų | 119.8 | 70% | 0.695 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.1 | -8.8 | -176.1 | -21.3 | 32.8 | 0 | 0 | 0 | 115.2 | D322 | P320-D322 PolarHBondContact O-N 2.92Š|
| 321 | Q | 35.1 | Very low | 36.5 | Very low | 148 Ų | 148 | 117 Ų | 117 | 69% | 0.692 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | -13.3 | -176 | -79.6 | -178 | -28 | 0 | 0 | 114.6 | D319 T325 | D319-Q321 PolarHBondContact O-N 3.43Å; Q321-T325 PolarHBondContact O-OG1 2.9Å |
| 322 | D | 37.8 | Very low | 37 | Very low | 113 Ų | 113 | 118.5 Ų | 118.5 | 60% | 0.604 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -82.8 | -16.1 | -179 | -80.9 | -27.4 | 0 | 0 | 0 | 114.3 | P320 | P320-D322 PolarHBondContact O-N 2.92Å |
| 323 | E | 40.5 | Very low | 37.7 | Very low | 155 Ų | 155 | 119.5 Ų | 119.5 | 72% | 0.724 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -80.8 | -30.3 | 179.9 | -83.7 | -171.9 | 165.3 | 0 | 0 | 113.6 | V327 | E323-V327 PolarHBondContact O-N 3.16Å |
| 324 | E | 40.3 | Very low | 38.4 | Very low | 160 Ų | 160 | 118.7 Ų | 118.7 | 75% | 0.748 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -71 | -32.1 | 177 | -76.9 | -172.8 | 159.3 | 0 | 0 | 112.5 | M326 S328 | E324-M326 PolarHBondContact O-N 3.5Å; E324-S328 WeakPolarHBondContact O-CB 3.38Å; E324-S328 PolarHBondContact O-N 2.76Å |
| 325 | T | 40.1 | Very low | 38.9 | Very low | 73 Ų | 73 | 119.6 Ų | 119.6 | 45% | 0.448 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -74.9 | -22.9 | -178.1 | -20.8 | 0 | 0 | 0 | 0 | 113.6 | Q321 K329 | Q321-T325 PolarHBondContact O-OG1 2.9Å; T325-K329 WeakPolarHBondContact O-CG 3.46Å |
| 326 | M | 38.9 | Very low | 39.7 | Very low | 147 Ų | 147 | 113.8 Ų | 113.8 | 72% | 0.724 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -84.9 | -35.9 | 175.1 | -84.7 | -159 | 166.3 | 0 | 0 | 112.7 | E324 V330 | E324-M326 PolarHBondContact O-N 3.5Å; M326-V330 WeakPolarHBondContact O-CG2 3.25Å; M326-V330 PolarHBondContact O-N 3.23Å |
| 327 | V | 44.4 | Very low | 40.4 | Very low | 107 Ų | 107 | 115.4 Ų | 115.4 | 65% | 0.648 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -71 | -37.8 | 178.2 | 178.2 | 0 | 0 | 0 | 0 | 111.3 | E323 K329 V330 S331 | E323-V327 PolarHBondContact O-N 3.16Å; V327-K329 PolarHBondContact O-N 3.1Å; V327-V330 PolarHBondContact O-N 3.32Å; V327-S331 PolarHBondContact O-N 2.84Å |
| 328 | S | 41.6 | Very low | 41 | Very low | 73 Ų | 73 | 115.3 Ų | 115.3 | 51% | 0.51 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64.3 | -35.7 | 176.1 | 170.3 | 0 | 0 | 0 | 0 | 113.5 | E324 S331 T332 | E324-S328 WeakPolarHBondContact O-CB 3.38Å; E324-S328 PolarHBondContact O-N 2.76Å; S328-S331 PolarHBondContact O-OG 3.04Å; S328-T332 PolarHBondContact O-N 3.31Å; S328-T332 PolarHBondContact O-OG1 3.01Å |
| 329 | K | 41.9 | Very low | 41.8 | Very low | 143 Ų | 143 | 115 Ų | 115 | 62% | 0.622 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -76.8 | -26.3 | 179.9 | -74.6 | -180 | -179.6 | 177.3 | 0 | 113.7 | T325 V327 S333 | T325-K329 WeakPolarHBondContact O-CG 3.46Å; V327-K329 PolarHBondContact O-N 3.1Å; K329-S333 PolarHBondContact O-OG 3.1Å |
| 330 | V | 44.3 | Very low | 42.5 | Very low | 83 Ų | 83 | 115.7 Ų | 115.7 | 50% | 0.503 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -77.4 | -35.4 | 176.8 | 174.4 | 0 | 0 | 0 | 0 | 111.1 | M326 V327 S333 Q334 | M326-V330 WeakPolarHBondContact O-CG2 3.25Å; M326-V330 PolarHBondContact O-N 3.23Å; V327-V330 PolarHBondContact O-N 3.32Å; V330-S333 PolarHBondContact O-OG 3.35Å; V330-Q334 PolarHBondContact O-N 3.35Å |
| 331 | S | 43.2 | Very low | 42.8 | Very low | 66 Ų | 66 | 116.9 Ų | 116.9 | 46% | 0.462 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -70.8 | -39.1 | 177.4 | 71 | 0 | 0 | 0 | 0 | 112.9 | V327 S328 S333 Q334 E335 | V327-S331 PolarHBondContact O-N 2.84Å; S328-S331 PolarHBondContact O-OG 3.04Å; S331-S333 VanDerWaalsContact C-N 3.3Å; S331-S333 PolarHBondContact O-N 3.36Å; S331-Q334 PolarHBondContact O-N 3.17Å; S331-E335 PolarHBondContact O-N 3.42Å |
| 332 | T | 46.8 | Very low | 42.9 | Very low | 90 Ų | 90 | 121.7 Ų | 121.7 | 55% | 0.552 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -70.4 | -24.6 | 178.6 | 13.6 | 0 | 0 | 0 | 0 | 113.5 | S328 | S328-T332 PolarHBondContact O-N 3.31Å; S328-T332 PolarHBondContact O-OG1 3.01Å |
| 333 | S | 46.3 | Very low | 43.1 | Very low | 67 Ų | 67 | 122.1 Ų | 122.1 | 47% | 0.469 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -87.3 | -19.6 | 178.9 | 44.9 | 0 | 0 | 0 | 0 | 113.6 | K329 V330 S331 V337 | K329-S333 PolarHBondContact O-OG 3.1Å; V330-S333 PolarHBondContact O-OG 3.35Å; S331-S333 VanDerWaalsContact C-N 3.3Å; S331-S333 PolarHBondContact O-N 3.36Å; S333-V337 WeakPolarHBondContact O-CG2 3.13Å |
| 334 | Q | 42.5 | Very low | 43.3 | Very low | 139 Ų | 139 | 120.4 Ų | 120.4 | 65% | 0.65 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -84.5 | -29.7 | 173.5 | -83.1 | 176.9 | -46.5 | 0 | 0 | 113.6 | V330 S331 | V330-Q334 PolarHBondContact O-N 3.35Å; S331-Q334 PolarHBondContact O-N 3.17Å |
| 335 | E | 41.2 | Very low | 43.4 | Very low | 155 Ų | 155 | 118.2 Ų | 118.2 | 72% | 0.724 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -73.5 | -33.5 | 174.3 | -80.4 | -179.6 | 157.8 | 0 | 0 | 112.7 | S331 V337 | S331-E335 PolarHBondContact O-N 3.42Å; E335-V337 VanDerWaalsContact C-N 3.28Å; E335-V337 PolarHBondContact O-N 3.39Å |
| 336 | A | 43.8 | Very low | 43.6 | Very low | 71 Ų | 71 | 120.8 Ų | 120.8 | 59% | 0.587 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | -13.2 | -179 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 337 | V | 45.7 | Very low | 43.9 | Very low | 112 Ų | 112 | 119.2 Ų | 119.2 | 68% | 0.679 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -13 | -176.2 | 178.4 | 0 | 0 | 0 | 0 | 112.7 | S333 E335 | S333-V337 WeakPolarHBondContact O-CG2 3.13Å; E335-V337 VanDerWaalsContact C-N 3.28Å; E335-V337 PolarHBondContact O-N 3.39Å |
| 338 | S | 43 | Very low | 43.9 | Very low | 109 Ų | 109 | 120 Ų | 120 | 76% | 0.762 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -90.1 | -4.7 | -179.4 | -70.2 | 0 | 0 | 0 | 0 | 115.3 | ||
| 339 | E | 47.9 | Very low | 44.1 | Very low | 184 Ų | 184 | 123.4 Ų | 123.4 | 86% | 0.86 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -100.3 | 7.4 | -177 | -104.3 | -174 | 173.4 | 0 | 0 | 115.9 | ||
| 340 | V | 46.8 | Very low | 44.2 | Very low | 127 Ų | 127 | 121.8 Ų | 121.8 | 77% | 0.77 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -117.8 | 24 | -176.3 | -170 | 0 | 0 | 0 | 0 | 113.8 | ||
| 341 | V | 46 | Very low | 44.2 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 81% | 0.806 | 72% | 0.718 | S | S | * | * | trans | -128.6 | 80.3 | 168.6 | -171.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 342 | L | 37.6 | Very low | 44.3 | Very low | 248 Ų | 248 | 130.5 Ų | 130.5 | 100% | 1.298 | 74% | 0.741 | S | S | * | * | trans | -154.5 | 0 | 146.5 | -128 | 132 | 0 | 0 | 0 | 110.9 |
Retrieved 342 of 342 residues in 89.7 ms
(Link to these results)