| 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 | 42 | Very low | 50.9 | Low | 249 Ų | 249 | 151.6 Ų | 151.6 | 100% | 1.227 | 83% | 0.833 | S | S | * | * | 0 | 118.4 | 0 | -116.2 | 172.2 | -177.3 | 0 | 0 | 106.5 | |||||
| 2 | A | 48.4 | Very low | 50.3 | Low | 83 Ų | 83 | 149.3 Ų | 149.3 | 69% | 0.686 | 83% | 0.827 | S | S | * | * | trans | 57.4 | 85 | 171.7 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 3 | D | 50 | Low | 49.4 | Very low | 171 Ų | 171 | 146.2 Ų | 146.2 | 91% | 0.914 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 123.3 | 148.2 | -78.6 | -45.5 | 0 | 0 | 0 | 108.6 | ||
| 4 | F | 53 | Low | 49.1 | Very low | 191 Ų | 191 | 142.9 Ų | 142.9 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 139.9 | 176.7 | -82.1 | -93.8 | 0 | 0 | 0 | 111.1 | ||
| 5 | P | 57.3 | Low | 48.6 | Very low | 125 Ų | 125 | 141.6 Ų | 141.6 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 126.7 | 172.9 | 34.4 | -27.2 | 0 | 0 | 0 | 110.7 | ||
| 6 | S | 57.2 | Low | 47.8 | Very low | 111 Ų | 111 | 144.3 Ų | 144.3 | 78% | 0.776 | 82% | 0.816 | S | S | * | * | trans | -145.5 | 101.5 | 165.2 | 60.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 7 | K | 52.2 | Low | 47.8 | Very low | 201 Ų | 201 | 142.2 Ų | 142.2 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -175.7 | 94.4 | 153.1 | -105.5 | 173.6 | -176.9 | -165.4 | 0 | 107.5 | ||||
| 8 | V | 51.9 | Low | 47.7 | Very low | 126 Ų | 126 | 144.9 Ų | 144.9 | 76% | 0.764 | 81% | 0.814 | S | S | * | * | 62.9 | 98.5 | 90.3 | -177.5 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 9 | T | 49.7 | Very low | 47.7 | Very low | 110 Ų | 110 | 145 Ų | 145 | 68% | 0.675 | 81% | 0.807 | S | S | * | * | trans | 30 | 114.6 | 136.7 | -25.2 | 0 | 0 | 0 | 0 | 118.4 | E11 | T9-E11 HydrophobicContact CG2-CG 4.04Š| ||
| 10 | T | 52.9 | Low | 47.8 | Very low | 132 Ų | 132 | 140.7 Ų | 140.7 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | -115.2 | 90.6 | 159.4 | -49.6 | 0 | 0 | 0 | 0 | 108.6 | T12 | T10-T12 PolarHBondContact O-N 3.35Š| ||
| 11 | E | 45 | Very low | 47.7 | Very low | 169 Ų | 169 | 138.2 Ų | 138.2 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | trans | -67 | 112.7 | 164.6 | -69.1 | -81.9 | 125.5 | 0 | 0 | 108.1 | T9 | T9-E11 HydrophobicContact CG2-CG 4.04Š| ||
| 12 | T | 44.1 | Very low | 48 | Very low | 123 Ų | 123 | 129 Ų | 129 | 76% | 0.755 | 76% | 0.762 | S | S | * | * | trans | -101.7 | 91.6 | 166.3 | -55.4 | 0 | 0 | 0 | 0 | 108 | T10 | T10-T12 PolarHBondContact O-N 3.35Š| ||
| 13 | S | 38.6 | Very low | 48.1 | Very low | 109 Ų | 109 | 132.9 Ų | 132.9 | 76% | 0.762 | 76% | 0.759 | S | S | * | * | trans | -72.3 | 121.9 | 169.1 | 177.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 14 | S | 45.7 | Very low | 48.2 | Very low | 100 Ų | 100 | 130.9 Ų | 130.9 | 70% | 0.699 | 75% | 0.748 | S | S | * | * | trans | -104.8 | 129.3 | 166.2 | 38.9 | 0 | 0 | 0 | 0 | 108.6 | Q16 | S14-Q16 PolarHBondContact O-N 3.31Š| ||
| 15 | P | 40.3 | Very low | 48.2 | Very low | 124 Ų | 124 | 131.7 Ų | 131.7 | 81% | 0.805 | 75% | 0.745 | S | S | * | * | trans | -80.2 | 110.6 | 178.8 | 29.1 | -29.7 | 0 | 0 | 0 | 109.8 | P17 | P15-P17 WeakPolarHBondContact O-CD 3.45Š| ||
| 16 | Q | 36.9 | Very low | 47.9 | Very low | 185 Ų | 185 | 127 Ų | 127 | 86% | 0.864 | 72% | 0.721 | S | S | * | * | trans | -94.5 | 114.1 | 169.4 | -170.4 | 146.9 | -28.2 | 0 | 0 | 110.1 | S14 | S14-Q16 PolarHBondContact O-N 3.31Š| ||
| 17 | P | 47.5 | Very low | 47.8 | Very low | 109 Ų | 109 | 127 Ų | 127 | 71% | 0.708 | 71% | 0.711 | S | S | * | * | trans | -91.3 | 113.2 | 174.7 | 32.6 | -25.2 | 0 | 0 | 0 | 109.3 | P15 | P15-P17 WeakPolarHBondContact O-CD 3.45Š| ||
| 18 | Q | 45.6 | Very low | 47.7 | Very low | 191 Ų | 191 | 120.3 Ų | 120.3 | 89% | 0.893 | 69% | 0.693 | S | S | * | * | trans | 172.9 | 76.6 | 149.6 | -96.3 | 162.1 | 15.4 | 0 | 0 | 110.9 | ||||
| 19 | Q | 48 | Very low | 47.5 | Very low | 146 Ų | 146 | 118.2 Ų | 118.2 | 68% | 0.682 | 68% | 0.684 | S | S | * | * | trans | -115.7 | 13 | 171.8 | -80.7 | -168.7 | 15 | 0 | 0 | 114.2 | R23 | Q19-R23 VanDerWaalsContact OE1-NH2 3.17Š| ||
| 20 | G | 48.7 | Very low | 47.5 | Very low | 59 Ų | 59 | 117.4 Ų | 117.4 | 61% | 0.608 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -87.5 | -40.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 21 | A | 47.2 | Very low | 47.1 | Very low | 88 Ų | 88 | 115.1 Ų | 115.1 | 73% | 0.727 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -88.3 | -21.5 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 22 | G | 48.1 | Very low | 47.1 | Very low | 55 Ų | 55 | 111.8 Ų | 111.8 | 57% | 0.567 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -78.5 | -25.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | G26 | G22-G26 PolarHBondContact O-N 2.87Å |
| 23 | R | 50.2 | Low | 47.2 | Very low | 165 Ų | 165 | 109.9 Ų | 109.9 | 62% | 0.623 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -74.4 | -36.8 | -176.9 | -66.7 | -170.7 | -176.7 | -158.7 | 3.3 | 112.5 | Q19 G26 L27 | Q19-R23 VanDerWaalsContact OE1-NH2 3.17Å; R23-G26 PolarHBondContact O-N 2.94Å; R23-L27 WeakPolarHBondContact O-CB 3.44Å; R23-L27 WeakPolarHBondContact O-CD1 3.5Å; R23-L27 WeakPolarHBondContact O-CG 3.43Å; R23-L27 PolarHBondContact O-N 3.04Å |
| 24 | L | 53.2 | Low | 47.6 | Very low | 129 Ų | 129 | 116 Ų | 116 | 68% | 0.675 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -74.2 | -36.5 | 176.7 | -66.2 | 173.3 | 0 | 0 | 0 | 112.2 | G26 L27 A28 | L24-G26 VanDerWaalsContact C-N 3.34Å; L24-L27 HydrophobicContact CD2-CD1 4.36Å; L24-L27 PolarHBondContact O-N 2.75Å; L24-A28 WeakPolarHBondContact O-CB 3.43Å; L24-A28 PolarHBondContact O-N 3.49Å |
| 25 | R | 51.6 | Low | 47.4 | Very low | 208 Ų | 208 | 117 Ų | 117 | 79% | 0.785 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -67.9 | -36.2 | 171.8 | -167.6 | 170.2 | 177.7 | 170.3 | -1.5 | 111.7 | S29 | R25-S29 WeakPolarHBondContact O-CB 3.35Å; R25-S29 PolarHBondContact O-N 3.46Å; R25-S29 PolarHBondContact O-OG 3.46Å |
| 26 | G | 51.6 | Low | 48.1 | Very low | 28 Ų | 28 | 113.8 Ų | 113.8 | 29% | 0.289 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -63.4 | -42.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113 | G22 R23 L24 S29 S30 | G22-G26 PolarHBondContact O-N 2.87Å; R23-G26 PolarHBondContact O-N 2.94Å; L24-G26 VanDerWaalsContact C-N 3.34Å; G26-S29 VanDerWaalsContact C-OG 3.29Å; G26-S29 VanDerWaalsContact CA-OG 3.23Å; G26-S29 WeakPolarHBondContact CA-OG 3.23Å; G26-S29 PolarHBondContact O-N 3.1Å; G26-S29 PolarHBondContact O-OG 3.11Å; G26-S30 WeakPolarHBondContact O-CB 3.42Å; G26-S30 PolarHBondContact O-N 3.07Å; G26-S30 PolarHBondContact O-OG 3.21Å |
| 27 | L | 54 | Low | 48.6 | Very low | 110 Ų | 110 | 109.8 Ų | 109.8 | 58% | 0.576 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -69.6 | -38.3 | 176.3 | -73.3 | 163.3 | 0 | 0 | 0 | 112.3 | R23 L24 S30 A31 | R23-L27 WeakPolarHBondContact O-CB 3.44Å; R23-L27 WeakPolarHBondContact O-CD1 3.5Å; R23-L27 WeakPolarHBondContact O-CG 3.43Å; R23-L27 PolarHBondContact O-N 3.04Å; L24-L27 HydrophobicContact CD2-CD1 4.36Å; L24-L27 PolarHBondContact O-N 2.75Å; L27-S30 PolarHBondContact O-N 2.51Å; L27-A31 WeakPolarHBondContact O-CB 3.35Å; L27-A31 PolarHBondContact O-N 2.91Å |
| 28 | A | 50.2 | Low | 48.8 | Very low | 61 Ų | 61 | 108.8 Ų | 108.8 | 50% | 0.504 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67.6 | -34.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L24 S30 A31 T32 | L24-A28 WeakPolarHBondContact O-CB 3.43Å; L24-A28 PolarHBondContact O-N 3.49Å; A28-S30 VanDerWaalsContact C-N 3.31Å; A28-A31 PolarHBondContact O-N 2.94Å; A28-T32 PolarHBondContact O-N 3.38Å; A28-T32 VanDerWaalsContact O-N 3.15Å; A28-T32 PolarHBondContact O-OG1 2.86Å |
| 29 | S | 49.3 | Very low | 49.1 | Very low | 82 Ų | 82 | 102.6 Ų | 102.6 | 57% | 0.573 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -72.6 | -22 | 171.3 | 57.6 | 0 | 0 | 0 | 0 | 113.8 | R25 G26 | R25-S29 WeakPolarHBondContact O-CB 3.35Å; R25-S29 PolarHBondContact O-N 3.46Å; R25-S29 PolarHBondContact O-OG 3.46Å; G26-S29 VanDerWaalsContact C-OG 3.29Å; G26-S29 VanDerWaalsContact CA-OG 3.23Å; G26-S29 WeakPolarHBondContact CA-OG 3.23Å; G26-S29 PolarHBondContact O-N 3.1Å; G26-S29 PolarHBondContact O-OG 3.11Å |
| 30 | S | 48.4 | Very low | 49.2 | Very low | 93 Ų | 93 | 98.8 Ų | 98.8 | 65% | 0.65 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -86.2 | -21.1 | 173.9 | -59.3 | 0 | 0 | 0 | 0 | 113.2 | G26 L27 A28 | G26-S30 WeakPolarHBondContact O-CB 3.42Å; G26-S30 PolarHBondContact O-N 3.07Å; G26-S30 PolarHBondContact O-OG 3.21Å; L27-S30 PolarHBondContact O-N 2.51Å; A28-S30 VanDerWaalsContact C-N 3.31Å |
| 31 | A | 44.5 | Very low | 49.2 | Very low | 83 Ų | 83 | 106.6 Ų | 106.6 | 69% | 0.686 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -94.3 | -11.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | L27 A28 S33 | L27-A31 WeakPolarHBondContact O-CB 3.35Å; L27-A31 PolarHBondContact O-N 2.91Å; A28-A31 PolarHBondContact O-N 2.94Å; A31-S33 PolarHBondContact O-N 3.45Å |
| 32 | T | 45.6 | Very low | 50.2 | Low | 99 Ų | 99 | 104.1 Ų | 104.1 | 61% | 0.607 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -66.9 | 100.6 | 155.8 | -48.9 | 0 | 0 | 0 | 0 | 104.4 | A28 R34 | A28-T32 PolarHBondContact O-N 3.38Å; A28-T32 VanDerWaalsContact O-N 3.15Å; A28-T32 PolarHBondContact O-OG1 2.86Å; T32-R34 VanDerWaalsContact C-N 3.3Å; T32-R34 PolarHBondContact O-N 3.15Å |
| 33 | S | 45.8 | Very low | 51.1 | Low | 84 Ų | 84 | 106.2 Ų | 106.2 | 59% | 0.587 | 57% | 0.566 | S | S | * | * | trans | -33.2 | 103.6 | 166.6 | 177.7 | 0 | 0 | 0 | 0 | 107.1 | A31 M35 | A31-S33 PolarHBondContact O-N 3.45Å; S33-M35 PolarHBondContact O-N 2.92Å; S33-M35 PolarHBondContact OG-N 2.93Å | ||
| 34 | R | 46.6 | Very low | 51.9 | Low | 238 Ų | 238 | 101.7 Ų | 101.7 | 90% | 0.898 | 56% | 0.558 | S | S | * | * | trans | -71.8 | 59 | 166.3 | -156.8 | -174.7 | -161.1 | -179.9 | 4.2 | 104.1 | T32 D36 | T32-R34 VanDerWaalsContact C-N 3.3Å; T32-R34 PolarHBondContact O-N 3.15Å; R34-D36 PolarHBondContact O-N 3.39Å | ||
| 35 | M | 43 | Very low | 52.7 | Low | 120 Ų | 120 | 95.9 Ų | 95.9 | 59% | 0.591 | 53% | 0.528 | S | S | * | . | trans | -52.5 | 107.9 | 160.1 | -147.8 | -175.8 | -58.3 | 0 | 0 | 101 | S33 V37 | S33-M35 PolarHBondContact O-N 2.92Å; S33-M35 PolarHBondContact OG-N 2.93Å; M35-V37 WeakPolarHBondContact O-CG2 3.43Å; M35-V37 PolarHBondContact O-N 3.2Å | ||
| 36 | D | 53.7 | Low | 53.7 | Low | 57 Ų | 57 | 88.4 Ų | 88.4 | 31% | 0.305 | 51% | 0.511 | S | S | . | . | trans | -70.8 | 77.9 | -170.2 | -158.8 | -21.4 | 0 | 0 | 0 | 106.1 | R34 S38 F39 L40 | R34-D36 PolarHBondContact O-N 3.39Å; D36-S38 PolarHBondContact O-N 2.87Å; D36-S38 WeakPolarHBondContact OD1-CB 3.19Å; D36-S38 PolarHBondContact OD1-OG 2.73Å; D36-F39 HydrophobicContact CB-CB 3.76Å; D36-F39 WeakPolarHBondContact O-CA 3.44Å; D36-F39 WeakPolarHBondContact O-CB 3.37Å; D36-F39 PolarHBondContact O-N 2.83Å; D36-F39 PolarHBondContact OD1-N 2.94Å; D36-L40 PolarHBondContact O-N 2.66Å | ||
| 37 | V | 48.1 | Very low | 54.7 | Low | 101 Ų | 101 | 88.9 Ų | 88.9 | 61% | 0.612 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.2 | -23 | 180 | -147.1 | 0 | 0 | 0 | 0 | 109 | M35 L40 R41 | M35-V37 WeakPolarHBondContact O-CG2 3.43Å; M35-V37 PolarHBondContact O-N 3.2Å; V37-L40 HydrophobicContact CG1-CD1 4.34Å; V37-L40 PolarHBondContact O-N 3.44Å; V37-R41 PolarHBondContact O-N 3.37Å |
| 38 | S | 52 | Low | 55.8 | Low | 88 Ų | 88 | 83.9 Ų | 83.9 | 62% | 0.615 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.8 | -36.2 | 166 | 18.7 | 0 | 0 | 0 | 0 | 112.8 | D36 R41 S42 | D36-S38 PolarHBondContact O-N 2.87Å; D36-S38 WeakPolarHBondContact OD1-CB 3.19Å; D36-S38 PolarHBondContact OD1-OG 2.73Å; S38-R41 WeakPolarHBondContact O-CB 3.44Å; S38-R41 PolarHBondContact O-N 3.18Å; S38-S42 PolarHBondContact O-N 3.2Å |
| 39 | F | 52.3 | Low | 57 | Low | 61 Ų | 61 | 82.8 Ų | 82.8 | 27% | 0.268 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -70.2 | -37.8 | 173.8 | -162.3 | -96.1 | 0 | 0 | 0 | 112 | D36 R41 S42 A45 L94 | D36-F39 HydrophobicContact CB-CB 3.76Å; D36-F39 WeakPolarHBondContact O-CA 3.44Å; D36-F39 WeakPolarHBondContact O-CB 3.37Å; D36-F39 PolarHBondContact O-N 2.83Å; D36-F39 PolarHBondContact OD1-N 2.94Å; F39-R41 PolarHBondContact O-N 3.23Å; F39-S42 VanDerWaalsContact O-CB 3.26Å; F39-S42 WeakPolarHBondContact O-CB 3.09Å; F39-S42 PolarHBondContact O-N 3.23Å; F39-S42 PolarHBondContact O-OG 3.03Å; F39-A45 WeakPolarHBondContact O-CB 3.42Å; F39-L94 HydrophobicContact CE1-CB 4.12Å; F39-L94 WeakPolarHBondContact CE1-O 3.29Å |
| 40 | L | 49.2 | Very low | 58.4 | Low | 66 Ų | 66 | 80.8 Ų | 80.8 | 35% | 0.346 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62 | -22 | 170 | -72.8 | 172.1 | 0 | 0 | 0 | 113.1 | D36 V37 F91 L95 | D36-L40 PolarHBondContact O-N 2.66Å; V37-L40 HydrophobicContact CG1-CD1 4.34Å; V37-L40 PolarHBondContact O-N 3.44Å; L40-F91 HydrophobicContact CD2-CE2 4.42Å; L40-F91 HydrophobicContact CD2-CZ 4.03Å; L40-L95 HydrophobicContact CD2-CD1 4.07Å; L40-L95 HydrophobicContact CG-CD1 4.45Å |
| 41 | R | 49.8 | Very low | 60 | Low | 223 Ų | 223 | 76.5 Ų | 76.5 | 84% | 0.842 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.6 | -4 | 175.8 | -150.6 | 176.1 | -174.4 | 169.7 | 1.7 | 113.3 | V37 S38 F39 | V37-R41 PolarHBondContact O-N 3.37Å; S38-R41 WeakPolarHBondContact O-CB 3.44Å; S38-R41 PolarHBondContact O-N 3.18Å; F39-R41 PolarHBondContact O-N 3.23Å |
| 42 | S | 66.5 | Low | 61.9 | Low | 35 Ų | 35 | 74.3 Ų | 74.3 | 25% | 0.245 | 41% | 0.406 | C | S | . | . | S | Bend | trans | -68.9 | 137.9 | 171.9 | 72.5 | 0 | 0 | 0 | 0 | 109.7 | S38 F39 A45 A46 | S38-S42 PolarHBondContact O-N 3.2Å; F39-S42 VanDerWaalsContact O-CB 3.26Å; F39-S42 WeakPolarHBondContact O-CB 3.09Å; F39-S42 PolarHBondContact O-N 3.23Å; F39-S42 PolarHBondContact O-OG 3.03Å; S42-A45 PolarHBondContact O-N 2.83Å; S42-A45 WeakPolarHBondContact OG-CB 3.22Å; S42-A45 PolarHBondContact OG-N 2.65Å; S42-A46 PolarHBondContact O-N 3.03Å |
| 43 | V | 67.4 | Low | 63.6 | Low | 99 Ų | 99 | 74.4 Ų | 74.4 | 60% | 0.6 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -49.5 | -40.7 | 178.4 | 177.3 | 0 | 0 | 0 | 0 | 112.4 | A46 L47 L164 | V43-A46 PolarHBondContact O-N 3.4Å; V43-L47 HydrophobicContact CG1-CD1 4.07Å; V43-L47 WeakPolarHBondContact O-CG 3.36Å; V43-L47 PolarHBondContact O-N 3.45Å; V43-L164 HydrophobicContact CG1-CD1 4.46Å |
| 44 | P | 67.9 | Low | 65.3 | Low | 70 Ų | 70 | 72.5 Ų | 72.5 | 46% | 0.455 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.9 | -39.9 | 176.6 | -20.7 | 33.4 | 0 | 0 | 0 | 113.8 | L47 M48 | P44-L47 PolarHBondContact O-N 3.2Å; P44-M48 PolarHBondContact O-N 2.88Å |
| 45 | A | 69.3 | Low | 66.9 | Low | 7 Ų | 7 | 61.2 Ų | 61.2 | 6% | 0.058 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -69.3 | -37.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F39 S42 M48 A49 | F39-A45 WeakPolarHBondContact O-CB 3.42Å; S42-A45 PolarHBondContact O-N 2.83Å; S42-A45 WeakPolarHBondContact OG-CB 3.22Å; S42-A45 PolarHBondContact OG-N 2.65Å; A45-M48 PolarHBondContact O-N 3.02Å; A45-A49 WeakPolarHBondContact O-CB 3.26Å; A45-A49 PolarHBondContact O-N 2.95Å |
| 46 | A | 72.3 | Confident | 68.8 | Low | 52 Ų | 52 | 59.2 Ų | 59.2 | 43% | 0.43 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65 | -40.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S42 V43 A49 A50 | S42-A46 PolarHBondContact O-N 3.03Å; V43-A46 PolarHBondContact O-N 3.4Å; A46-A49 PolarHBondContact O-N 3.21Å; A46-A50 PolarHBondContact O-N 3.28Å |
| 47 | L | 73.4 | Confident | 70.1 | Confident | 37 Ų | 37 | 60 Ų | 60 | 19% | 0.194 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.9 | -48.5 | 174 | -76.4 | 167.5 | 0 | 0 | 0 | 111.5 | V43 P44 A49 A50 E51 L157 L164 | V43-L47 HydrophobicContact CG1-CD1 4.07Å; V43-L47 WeakPolarHBondContact O-CG 3.36Å; V43-L47 PolarHBondContact O-N 3.45Å; P44-L47 PolarHBondContact O-N 3.2Å; L47-A49 VanDerWaalsContact C-N 3.32Å; L47-A49 PolarHBondContact O-N 2.98Å; L47-A50 WeakPolarHBondContact O-CB 3.14Å; L47-A50 PolarHBondContact O-N 2.86Å; L47-A50 VanDerWaalsContact O-N 3.13Å; L47-E51 WeakPolarHBondContact O-CG 3.33Å; L47-E51 PolarHBondContact O-N 3.04Å; L47-L157 HydrophobicContact CD2-CD1 3.6Å; L47-L157 HydrophobicContact CD2-CG 4.4Å; L47-L164 HydrophobicContact CD1-CD1 3.65Å |
| 48 | M | 75.6 | Confident | 71.5 | Confident | 6 Ų | 6 | 55.2 Ų | 55.2 | 3% | 0.03 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.2 | -34.6 | 178 | -72 | -162.4 | -171.6 | 0 | 0 | 113.3 | P44 A45 A50 E51 M52 L90 F91 L94 V111 | P44-M48 PolarHBondContact O-N 2.88Å; A45-M48 PolarHBondContact O-N 3.02Å; M48-A50 VanDerWaalsContact C-N 3.34Å; M48-E51 PolarHBondContact O-N 3.21Å; M48-M52 WeakPolarHBondContact O-CB 3.47Å; M48-M52 WeakPolarHBondContact O-CG 3.3Å; M48-M52 PolarHBondContact O-N 3.49Å; M48-L90 HydrophobicContact CE-CD2 3.57Å; M48-L90 HydrophobicContact CE-CG 4Å; M48-L90 HydrophobicContact SD-CD2 4.16Å; M48-L90 HydrophobicContact SD-CG 4.15Å; M48-F91 HydrophobicContact CB-CD2 3.96Å; M48-L94 HydrophobicContact CE-CD1 3.42Å; M48-L94 VanDerWaalsContact CE-CD1 3.42Å; M48-L94 HydrophobicContact SD-CD1 3.22Å; M48-L94 WeakPolarHBondContact SD-CD1 3.49Å; M48-V111 HydrophobicContact CE-CG1 3.97Å; M48-V111 HydrophobicContact CE-CG2 4.34Å |
| 49 | A | 76.5 | Confident | 72.8 | Confident | 38 Ų | 38 | 55 Ų | 55 | 31% | 0.314 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | A45 A46 L47 M52 V53 F91 | A45-A49 WeakPolarHBondContact O-CB 3.26Å; A45-A49 PolarHBondContact O-N 2.95Å; A46-A49 PolarHBondContact O-N 3.21Å; L47-A49 VanDerWaalsContact C-N 3.32Å; L47-A49 PolarHBondContact O-N 2.98Å; A49-M52 PolarHBondContact O-N 3.02Å; A49-V53 WeakPolarHBondContact O-CG2 3.38Å; A49-V53 PolarHBondContact O-N 2.96Å; A49-V53 VanDerWaalsContact O-N 3.16Å; A49-F91 HydrophobicContact CB-CE2 4.33Å |
| 50 | A | 79.6 | Confident | 74.2 | Confident | 40 Ų | 40 | 54.5 Ų | 54.5 | 33% | 0.331 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.6 | -43.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A46 L47 M48 M52 V53 L54 L157 | A46-A50 PolarHBondContact O-N 3.28Å; L47-A50 WeakPolarHBondContact O-CB 3.14Å; L47-A50 PolarHBondContact O-N 2.86Å; L47-A50 VanDerWaalsContact O-N 3.13Å; M48-A50 VanDerWaalsContact C-N 3.34Å; A50-M52 VanDerWaalsContact C-N 3.3Å; A50-M52 PolarHBondContact O-N 3.32Å; A50-V53 PolarHBondContact O-N 3.46Å; A50-L54 WeakPolarHBondContact O-CB 3.33Å; A50-L54 VanDerWaalsContact O-CG 3.27Å; A50-L54 WeakPolarHBondContact O-CG 3.35Å; A50-L54 PolarHBondContact O-N 2.89Å; A50-L157 HydrophobicContact CB-CD2 4.08Å |
| 51 | E | 81.8 | Confident | 75.4 | Confident | 2 Ų | 2 | 53.1 Ų | 53.1 | 1% | 0.009 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58 | -40.9 | 174.6 | -71.1 | 166.3 | -177.5 | 0 | 0 | 111.8 | L47 M48 G55 T87 L157 Y158 | L47-E51 WeakPolarHBondContact O-CG 3.33Å; L47-E51 PolarHBondContact O-N 3.04Å; M48-E51 PolarHBondContact O-N 3.21Å; E51-G55 WeakPolarHBondContact O-CA 3.47Å; E51-G55 PolarHBondContact O-N 3.12Å; E51-T87 HydrophobicContact CB-CG2 4.17Å; E51-L157 HydrophobicContact CB-CD2 4.36Å; E51-L157 HydrophobicContact CG-CB 4.49Å; E51-L157 HydrophobicContact CG-CD2 3.49Å; E51-L157 VanDerWaalsContact CG-CD2 3.49Å; E51-L157 HydrophobicContact CG-CG 3.84Å; E51-Y158 HydrophobicContact CB-CE1 4.19Å; E51-Y158 HydrophobicContact CG-CD1 4.26Å; E51-Y158 HydrophobicContact CG-CE1 3.89Å; E51-Y158 WeakPolarHBondContact OE2-CE1 3.41Å |
| 52 | M | 82.6 | Confident | 76.5 | Confident | 37 Ų | 37 | 42.6 Ų | 42.6 | 18% | 0.182 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 177.2 | -81.9 | -68.5 | -79.8 | 0 | 0 | 113.1 | M48 A49 A50 L56 W84 T87 A88 | M48-M52 WeakPolarHBondContact O-CB 3.47Å; M48-M52 WeakPolarHBondContact O-CG 3.3Å; M48-M52 PolarHBondContact O-N 3.49Å; A49-M52 PolarHBondContact O-N 3.02Å; A50-M52 VanDerWaalsContact C-N 3.3Å; A50-M52 PolarHBondContact O-N 3.32Å; M52-L56 WeakPolarHBondContact O-CB 3.39Å; M52-L56 PolarHBondContact O-N 2.93Å; M52-W84 HydrophobicContact CE-CZ2 4.25Å; M52-W84 PolarHBondContact O-NE1 3.48Å; M52-T87 HydrophobicContact CG-CG2 3.93Å; M52-T87 HydrophobicContact SD-CG2 4Å; M52-A88 VanDerWaalsContact CE-CA 3.48Å; M52-A88 HydrophobicContact CE-CB 3.31Å; M52-A88 WeakPolarHBondContact SD-CA 3.41Å; M52-A88 HydrophobicContact SD-CB 3.72Å; M52-A88 PolarHBondContact SD-N 3.12Å |
| 53 | V | 82.8 | Confident | 77.1 | Confident | 101 Ų | 101 | 42.8 Ų | 42.8 | 61% | 0.612 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -68 | -45.2 | 179 | 174.6 | 0 | 0 | 0 | 0 | 110.5 | A49 A50 L56 L57 | A49-V53 WeakPolarHBondContact O-CG2 3.38Å; A49-V53 PolarHBondContact O-N 2.96Å; A49-V53 VanDerWaalsContact O-N 3.16Å; A50-V53 PolarHBondContact O-N 3.46Å; V53-L56 PolarHBondContact O-N 3.35Å; V53-L57 WeakPolarHBondContact O-CB 3.34Å; V53-L57 PolarHBondContact O-N 3.15Å |
| 54 | L | 80.5 | Confident | 77.2 | Confident | 45 Ų | 45 | 40.6 Ų | 40.6 | 24% | 0.236 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67.2 | -39.1 | 179 | -69.5 | 171.4 | 0 | 0 | 0 | 111.8 | A50 L57 H58 F150 L154 L157 | A50-L54 WeakPolarHBondContact O-CB 3.33Å; A50-L54 VanDerWaalsContact O-CG 3.27Å; A50-L54 WeakPolarHBondContact O-CG 3.35Å; A50-L54 PolarHBondContact O-N 2.89Å; L54-L57 PolarHBondContact O-N 2.73Å; L54-H58 WeakPolarHBondContact O-CB 3.44Å; L54-H58 PolarHBondContact O-N 3.13Å; L54-F150 HydrophobicContact CD2-CD1 3.83Å; L54-F150 HydrophobicContact CD2-CE1 3.95Å; L54-L154 HydrophobicContact CB-CD1 4.47Å; L54-L154 HydrophobicContact CB-CD2 3.64Å; L54-L154 HydrophobicContact CB-CG 4.06Å; L54-L157 HydrophobicContact CD1-CD2 3.71Å |
| 55 | G | 80.4 | Confident | 77 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | E51 L57 H58 W59 | E51-G55 WeakPolarHBondContact O-CA 3.47Å; E51-G55 PolarHBondContact O-N 3.12Å; G55-L57 VanDerWaalsContact C-N 3.34Å; G55-L57 PolarHBondContact O-N 2.91Å; G55-H58 PolarHBondContact O-N 3.44Å; G55-W59 PolarHBondContact O-N 2.8Å |
| 56 | L | 83.1 | Confident | 76.6 | Confident | 79 Ų | 79 | 39.4 Ų | 39.4 | 41% | 0.414 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60.5 | -46 | 174.1 | -177.2 | 70.8 | 0 | 0 | 0 | 110.6 | M52 V53 W59 A60 W84 | M52-L56 WeakPolarHBondContact O-CB 3.39Å; M52-L56 PolarHBondContact O-N 2.93Å; V53-L56 PolarHBondContact O-N 3.35Å; L56-W59 HydrophobicContact CD1-CE3 4Å; L56-W59 HydrophobicContact CD1-CZ3 4Å; L56-A60 WeakPolarHBondContact O-CB 3.46Å; L56-A60 PolarHBondContact O-N 3.47Å; L56-W84 HydrophobicContact CD1-CZ2 3.82Å; L56-W84 VanDerWaalsContact N-CD1 3.32Å |
| 57 | L | 81.6 | Confident | 76 | Confident | 73 Ų | 73 | 40.6 Ų | 40.6 | 38% | 0.382 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.1 | -43.6 | 179.9 | -172.8 | 62.8 | 0 | 0 | 0 | 111.7 | V53 L54 G55 A60 L61 F150 | V53-L57 WeakPolarHBondContact O-CB 3.34Å; V53-L57 PolarHBondContact O-N 3.15Å; L54-L57 PolarHBondContact O-N 2.73Å; G55-L57 VanDerWaalsContact C-N 3.34Å; G55-L57 PolarHBondContact O-N 2.91Å; L57-A60 PolarHBondContact O-N 3.26Å; L57-L61 HydrophobicContact CD1-CD1 4.4Å; L57-L61 HydrophobicContact CD1-CG 4.47Å; L57-L61 HydrophobicContact CG-CD1 4.05Å; L57-L61 WeakPolarHBondContact O-CB 3.37Å; L57-L61 WeakPolarHBondContact O-CD1 3.37Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 3.01Å; L57-F150 HydrophobicContact CD2-CD1 4.17Å; L57-F150 HydrophobicContact CD2-CD2 4.25Å; L57-F150 HydrophobicContact CD2-CE1 3.58Å; L57-F150 HydrophobicContact CD2-CE2 3.68Å; L57-F150 HydrophobicContact CD2-CG 4.49Å; L57-F150 HydrophobicContact CD2-CZ 3.31Å; L57-F150 HydrophobicContact CG-CD2 4.45Å; L57-F150 HydrophobicContact CG-CE2 4.2Å; L57-F150 HydrophobicContact CG-CZ 4.3Å |
| 58 | H | 77.3 | Confident | 75.3 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60 | -50 | 177.3 | 178.6 | -113.6 | 0 | 0 | 0 | 111.5 | L54 G55 L61 I62 Y122 A147 F150 L154 | L54-H58 WeakPolarHBondContact O-CB 3.44Å; L54-H58 PolarHBondContact O-N 3.13Å; G55-H58 PolarHBondContact O-N 3.44Å; H58-L61 PolarHBondContact O-N 3Å; H58-I62 WeakPolarHBondContact CE1-CD1 3.42Å; H58-I62 WeakPolarHBondContact NE2-CD1 3.49Å; H58-I62 WeakPolarHBondContact O-CD1 3.49Å; H58-I62 VanDerWaalsContact O-CG1 3.27Å; H58-I62 WeakPolarHBondContact O-CG1 3.38Å; H58-I62 PolarHBondContact O-N 2.86Å; H58-I62 VanDerWaalsContact O-N 3.16Å; H58-Y122 AromaticContact CE1-CE1 3.87Å; H58-Y122 AromaticContact ND1-CE1 3.6Å; H58-A147 PolarHBondContact CD2-O 2.95Å; H58-A147 PolarHBondContact NE2-O 3.17Å; H58-F150 HydrophobicContact CB-CB 4.18Å; H58-L154 HydrophobicContact CB-CD1 3.77Å |
| 59 | W | 79 | Confident | 74.6 | Confident | 85 Ų | 85 | 57.9 Ų | 57.9 | 32% | 0.322 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.2 | -45.3 | 176.7 | 165.4 | 61 | 0 | 0 | 0 | 112.4 | G55 L56 L61 I62 A63 M77 A80 V81 | G55-W59 PolarHBondContact O-N 2.8Å; L56-W59 HydrophobicContact CD1-CE3 4Å; L56-W59 HydrophobicContact CD1-CZ3 4Å; W59-L61 VanDerWaalsContact C-N 3.29Å; W59-L61 PolarHBondContact O-N 2.95Å; W59-I62 PolarHBondContact O-N 3.39Å; W59-I62 VanDerWaalsContact O-N 3.17Å; W59-A63 WeakPolarHBondContact O-CB 3.32Å; W59-A63 PolarHBondContact O-N 3.49Å; W59-M77 VanDerWaalsContact NE1-CE 3.28Å; W59-A80 HydrophobicContact CB-CB 4.23Å; W59-V81 HydrophobicContact CD2-CG2 4.29Å; W59-V81 HydrophobicContact CG-CG2 3.88Å |
| 60 | A | 81.6 | Confident | 74 | Confident | 49 Ų | 49 | 57.1 Ų | 57.1 | 41% | 0.405 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.2 | -38.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L56 L57 G64 | L56-A60 WeakPolarHBondContact O-CB 3.46Å; L56-A60 PolarHBondContact O-N 3.47Å; L57-A60 PolarHBondContact O-N 3.26Å; A60-G64 PolarHBondContact O-N 3.46Å |
| 61 | L | 75.5 | Confident | 73.6 | Confident | 38 Ų | 38 | 61 Ų | 61 | 20% | 0.199 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.8 | -40.7 | 175.5 | -76.7 | 168.1 | 0 | 0 | 0 | 112.3 | L57 H58 W59 A65 A146 F150 | L57-L61 HydrophobicContact CD1-CD1 4.4Å; L57-L61 HydrophobicContact CD1-CG 4.47Å; L57-L61 HydrophobicContact CG-CD1 4.05Å; L57-L61 WeakPolarHBondContact O-CB 3.37Å; L57-L61 WeakPolarHBondContact O-CD1 3.37Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 3.01Å; H58-L61 PolarHBondContact O-N 3Å; W59-L61 VanDerWaalsContact C-N 3.29Å; W59-L61 PolarHBondContact O-N 2.95Å; L61-A65 PolarHBondContact O-N 3.01Å; L61-A146 HydrophobicContact CD1-CB 4.2Å; L61-F150 HydrophobicContact CD1-CD2 3.42Å; L61-F150 VanDerWaalsContact CD1-CD2 3.42Å; L61-F150 HydrophobicContact CD1-CE2 3.65Å |
| 62 | I | 72.7 | Confident | 73 | Confident | 1 Ų | 1 | 62.7 Ų | 62.7 | 1% | 0.005 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -72.5 | -42.1 | 178.2 | -59.5 | 159.9 | 0 | 0 | 0 | 110.9 | H58 W59 G64 A65 Y73 V76 M77 A80 A147 | H58-I62 WeakPolarHBondContact CE1-CD1 3.42Å; H58-I62 WeakPolarHBondContact NE2-CD1 3.49Å; H58-I62 WeakPolarHBondContact O-CD1 3.49Å; H58-I62 VanDerWaalsContact O-CG1 3.27Å; H58-I62 WeakPolarHBondContact O-CG1 3.38Å; H58-I62 PolarHBondContact O-N 2.86Å; H58-I62 VanDerWaalsContact O-N 3.16Å; W59-I62 PolarHBondContact O-N 3.39Å; W59-I62 VanDerWaalsContact O-N 3.17Å; I62-G64 VanDerWaalsContact C-N 3.28Å; I62-G64 PolarHBondContact O-N 3.02Å; I62-A65 PolarHBondContact O-N 3.41Å; I62-A65 VanDerWaalsContact O-N 3.13Å; I62-Y73 HydrophobicContact CG2-CD1 4.01Å; I62-V76 HydrophobicContact CD1-CG1 3.49Å; I62-V76 VanDerWaalsContact CD1-CG1 3.49Å; I62-V76 HydrophobicContact CG1-CG1 4.43Å; I62-M77 HydrophobicContact CB-SD 3.67Å; I62-M77 HydrophobicContact CG2-CG 3.58Å; I62-M77 HydrophobicContact CG2-SD 3.36Å; I62-M77 WeakPolarHBondContact CG2-SD 3.38Å; I62-A80 HydrophobicContact CD1-CB 4.35Å; I62-A147 HydrophobicContact CG1-CB 3.93Å |
| 63 | A | 77.3 | Confident | 72.5 | Confident | 40 Ų | 40 | 61 Ų | 61 | 33% | 0.331 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.7 | -35.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | W59 M77 | W59-A63 WeakPolarHBondContact O-CB 3.32Å; W59-A63 PolarHBondContact O-N 3.49Å; A63-M77 HydrophobicContact CB-CE 3.96Å; A63-M77 HydrophobicContact CB-SD 4.42Å |
| 64 | G | 69.6 | Low | 72.1 | Confident | 52 Ų | 52 | 58.3 Ų | 58.3 | 54% | 0.536 | 32% | 0.323 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -12.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | A60 I62 Q143 | A60-G64 PolarHBondContact O-N 3.46Å; I62-G64 VanDerWaalsContact C-N 3.28Å; I62-G64 PolarHBondContact O-N 3.02Å; G64-Q143 PolarHBondContact O-NE2 3.23Å |
| 65 | A | 65.7 | Low | 72.1 | Confident | 7 Ų | 7 | 61.6 Ų | 61.6 | 6% | 0.058 | 33% | 0.333 | C | S | . | . | S | Bend | trans | -84.4 | 151.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | L61 I62 Y67 | L61-A65 PolarHBondContact O-N 3.01Å; I62-A65 PolarHBondContact O-N 3.41Å; I62-A65 VanDerWaalsContact O-N 3.13Å; A65-Y67 PolarHBondContact O-N 3.19Å |
| 66 | S | 60.6 | Low | 72 | Confident | 45 Ų | 45 | 61.6 Ų | 61.6 | 32% | 0.315 | 33% | 0.333 | S | S | . | . | trans | -70 | 67.8 | 178.3 | -44.6 | 0 | 0 | 0 | 0 | 112.2 | W68 R69 F140 | S66-W68 PolarHBondContact O-N 2.91Å; S66-W68 VanDerWaalsContact O-N 3.11Å; S66-R69 PolarHBondContact O-N 3.17Å; S66-F140 WeakPolarHBondContact OG-CZ 3.44Å | ||
| 67 | Y | 60.2 | Low | 71.9 | Confident | 78 Ų | 78 | 59.3 Ų | 59.3 | 31% | 0.306 | 32% | 0.32 | S | S | . | . | G | 310 helix | trans | -61.4 | -21.1 | -171.9 | 67.8 | -93.3 | 0 | 0 | 0 | 113.8 | A65 R69 | A65-Y67 PolarHBondContact O-N 3.19Å; Y67-R69 PolarHBondContact O-N 3.43Å; Y67-R69 VanDerWaalsContact O-N 3.13Å |
| 68 | W | 58 | Low | 71.9 | Confident | 212 Ų | 212 | 62.2 Ų | 62.2 | 80% | 0.803 | 33% | 0.33 | S | S | * | . | G | 310 helix | trans | -62 | -16.4 | 177.4 | -70.2 | 93 | 0 | 0 | 0 | 114.8 | S66 | S66-W68 PolarHBondContact O-N 2.91Å; S66-W68 VanDerWaalsContact O-N 3.11Å |
| 69 | R | 59.7 | Low | 72.1 | Confident | 193 Ų | 193 | 62.4 Ų | 62.4 | 73% | 0.728 | 33% | 0.331 | S | S | * | . | G | 310 helix | trans | -79.4 | -20.2 | -172 | -151.5 | 174.5 | -78 | -109.6 | 3 | 113.1 | S66 Y67 | S66-R69 PolarHBondContact O-N 3.17Å; Y67-R69 PolarHBondContact O-N 3.43Å; Y67-R69 VanDerWaalsContact O-N 3.13Å |
| 70 | V | 64.2 | Low | 72.3 | Confident | 23 Ų | 23 | 58.3 Ų | 58.3 | 14% | 0.139 | 32% | 0.316 | C | S | . | . | trans | -140.3 | 117 | -176.9 | -179.5 | 0 | 0 | 0 | 0 | 109.6 | A72 Y73 T132 F136 | V70-A72 HydrophobicContact CG1-CB 3.94Å; V70-A72 PolarHBondContact O-N 3.24Å; V70-Y73 HydrophobicContact CB-CD2 3.87Å; V70-Y73 HydrophobicContact CB-CE2 4.44Å; V70-Y73 HydrophobicContact CG1-CD2 4.15Å; V70-Y73 WeakPolarHBondContact O-CB 3.24Å; V70-Y73 PolarHBondContact O-N 3.04Å; V70-T132 HydrophobicContact CG1-CG2 3.98Å; V70-F136 HydrophobicContact CB-CE2 4.38Å; V70-F136 HydrophobicContact CB-CZ 4.32Å; V70-F136 HydrophobicContact CG2-CE2 3.68Å; V70-F136 HydrophobicContact CG2-CZ 3.69Å | ||
| 71 | S | 70.9 | Confident | 72.5 | Confident | 121 Ų | 121 | 58.2 Ų | 58.2 | 85% | 0.846 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.2 | -32.9 | -178.7 | -178.9 | 0 | 0 | 0 | 0 | 113.5 | Y73 G74 | S71-Y73 PolarHBondContact O-N 3.24Å; S71-G74 PolarHBondContact O-N 3.37Å |
| 72 | A | 70.4 | Confident | 72.9 | Confident | 38 Ų | 38 | 58 Ų | 58 | 31% | 0.314 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61 | -25.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114 | V70 G74 W75 T128 T132 | V70-A72 HydrophobicContact CG1-CB 3.94Å; V70-A72 PolarHBondContact O-N 3.24Å; A72-G74 PolarHBondContact O-N 2.86Å; A72-W75 WeakPolarHBondContact O-CB 3.3Å; A72-W75 PolarHBondContact O-N 3.31Å; A72-T128 HydrophobicContact CB-CG2 3.74Å; A72-T132 HydrophobicContact CB-CG2 4.08Å |
| 73 | Y | 71.7 | Confident | 73.4 | Confident | 2 Ų | 2 | 58.2 Ų | 58.2 | 1% | 0.008 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -70.9 | -20.1 | 175.8 | -84.9 | -102.5 | 0 | 0 | 0 | 113.1 | I62 V70 S71 W75 V76 M77 T132 F136 I144 | I62-Y73 HydrophobicContact CG2-CD1 4.01Å; V70-Y73 HydrophobicContact CB-CD2 3.87Å; V70-Y73 HydrophobicContact CB-CE2 4.44Å; V70-Y73 HydrophobicContact CG1-CD2 4.15Å; V70-Y73 WeakPolarHBondContact O-CB 3.24Å; V70-Y73 PolarHBondContact O-N 3.04Å; S71-Y73 PolarHBondContact O-N 3.24Å; Y73-W75 VanDerWaalsContact C-N 3.29Å; Y73-W75 PolarHBondContact O-N 3.4Å; Y73-V76 PolarHBondContact O-N 2.82Å; Y73-M77 WeakPolarHBondContact O-CB 3.43Å; Y73-M77 WeakPolarHBondContact O-CG 3.35Å; Y73-M77 PolarHBondContact O-N 2.98Å; Y73-T132 HydrophobicContact CE2-CG2 4.11Å; Y73-T132 VanDerWaalsContact CE2-OG1 3.27Å; Y73-T132 WeakPolarHBondContact CE2-OG1 3.47Å; Y73-T132 PolarHBondContact OH-OG1 3.39Å; Y73-F136 HydrophobicContact CD2-CE2 4.13Å; Y73-F136 HydrophobicContact CD2-CZ 4.16Å; Y73-F136 HydrophobicContact CE2-CD2 4.39Å; Y73-F136 AromaticContact CE2-CE2 3.34Å; Y73-F136 HydrophobicContact CE2-CE2 3.34Å; Y73-F136 AromaticContact CE2-CZ 3.72Å; Y73-F136 HydrophobicContact CE2-CZ 3.72Å; Y73-F136 AromaticContact CZ-CE2 3.75Å; Y73-I144 HydrophobicContact CE1-CG1 4.48Å; Y73-I144 WeakPolarHBondContact OH-CD1 3.25Å; Y73-I144 WeakPolarHBondContact OH-CG2 3.27Å |
| 74 | G | 74.8 | Confident | 73.7 | Confident | 43 Ų | 43 | 59.5 Ų | 59.5 | 44% | 0.443 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62 | -38.4 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S71 A72 F78 | S71-G74 PolarHBondContact O-N 3.37Å; A72-G74 PolarHBondContact O-N 2.86Å; G74-F78 WeakPolarHBondContact O-CB 3.33Å; G74-F78 PolarHBondContact O-N 3.02Å |
| 75 | W | 80.6 | Confident | 74.5 | Confident | 115 Ų | 115 | 60.9 Ų | 60.9 | 44% | 0.436 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64 | -47.8 | 174.4 | 176 | -111.2 | 0 | 0 | 0 | 111.7 | A72 Y73 M77 F78 V79 L121 T124 | A72-W75 WeakPolarHBondContact O-CB 3.3Å; A72-W75 PolarHBondContact O-N 3.31Å; Y73-W75 VanDerWaalsContact C-N 3.29Å; Y73-W75 PolarHBondContact O-N 3.4Å; W75-M77 VanDerWaalsContact C-N 3.32Å; W75-M77 PolarHBondContact O-N 2.86Å; W75-F78 HydrophobicContact CE3-CD1 4.29Å; W75-F78 HydrophobicContact CZ3-CD1 4.02Å; W75-F78 HydrophobicContact CZ3-CE1 4.34Å; W75-F78 PolarHBondContact O-N 2.91Å; W75-V79 HydrophobicContact CD2-CG2 4.05Å; W75-V79 HydrophobicContact CE3-CG2 4.49Å; W75-V79 HydrophobicContact CH2-CG2 4.19Å; W75-V79 HydrophobicContact CZ2-CG2 3.7Å; W75-V79 WeakPolarHBondContact O-CG2 3.49Å; W75-V79 PolarHBondContact O-N 3.21Å; W75-L121 HydrophobicContact CZ2-CD2 4.27Å; W75-T124 PolarHBondContact NE1-OG1 3.48Å; W75-T124 VanDerWaalsContact NE1-OG1 3.16Å |
| 76 | V | 76.9 | Confident | 75.3 | Confident | 0 Ų | 0 | 64.7 Ų | 64.7 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -61 | -42.6 | -179.8 | -174 | 0 | 0 | 0 | 0 | 110.9 | I62 Y73 V79 A80 A125 T128 | I62-V76 HydrophobicContact CD1-CG1 3.49Å; I62-V76 VanDerWaalsContact CD1-CG1 3.49Å; I62-V76 HydrophobicContact CG1-CG1 4.43Å; Y73-V76 PolarHBondContact O-N 2.82Å; V76-V79 PolarHBondContact O-N 2.92Å; V76-A80 VanDerWaalsContact O-CB 3.25Å; V76-A80 WeakPolarHBondContact O-CB 3.3Å; V76-A80 PolarHBondContact O-N 3.47Å; V76-A125 HydrophobicContact CG1-CB 4.04Å; V76-T128 HydrophobicContact CG2-CG2 3.57Å |
| 77 | M | 81.1 | Confident | 76.4 | Confident | 30 Ų | 30 | 62.5 Ų | 62.5 | 15% | 0.148 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 176.1 | -80.4 | -66.6 | -71.8 | 0 | 0 | 112.8 | W59 I62 A63 Y73 W75 A80 V81 | W59-M77 VanDerWaalsContact NE1-CE 3.28Å; I62-M77 HydrophobicContact CB-SD 3.67Å; I62-M77 HydrophobicContact CG2-CG 3.58Å; I62-M77 HydrophobicContact CG2-SD 3.36Å; I62-M77 WeakPolarHBondContact CG2-SD 3.38Å; A63-M77 HydrophobicContact CB-CE 3.96Å; A63-M77 HydrophobicContact CB-SD 4.42Å; Y73-M77 WeakPolarHBondContact O-CB 3.43Å; Y73-M77 WeakPolarHBondContact O-CG 3.35Å; Y73-M77 PolarHBondContact O-N 2.98Å; W75-M77 VanDerWaalsContact C-N 3.32Å; W75-M77 PolarHBondContact O-N 2.86Å; M77-A80 PolarHBondContact O-N 3.05Å; M77-V81 WeakPolarHBondContact O-CB 3.44Å; M77-V81 WeakPolarHBondContact O-CG2 3.27Å; M77-V81 PolarHBondContact O-N 2.93Å |
| 78 | F | 82.4 | Confident | 77.4 | Confident | 135 Ų | 135 | 59.7 Ų | 59.7 | 59% | 0.592 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -59.3 | -49.9 | 176.3 | 172.6 | -103.3 | 0 | 0 | 0 | 111 | G74 W75 A80 A82 | G74-F78 WeakPolarHBondContact O-CB 3.33Å; G74-F78 PolarHBondContact O-N 3.02Å; W75-F78 HydrophobicContact CE3-CD1 4.29Å; W75-F78 HydrophobicContact CZ3-CD1 4.02Å; W75-F78 HydrophobicContact CZ3-CE1 4.34Å; W75-F78 PolarHBondContact O-N 2.91Å; F78-A80 PolarHBondContact O-N 3.47Å; F78-A82 WeakPolarHBondContact O-CB 3.24Å; F78-A82 PolarHBondContact O-N 3.45Å |
| 79 | V | 82.4 | Confident | 78.6 | Confident | 3 Ų | 3 | 54.1 Ų | 54.1 | 2% | 0.018 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.6 | -47.3 | 178.6 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | W75 V76 L83 L121 A125 | W75-V79 HydrophobicContact CD2-CG2 4.05Å; W75-V79 HydrophobicContact CE3-CG2 4.49Å; W75-V79 HydrophobicContact CH2-CG2 4.19Å; W75-V79 HydrophobicContact CZ2-CG2 3.7Å; W75-V79 WeakPolarHBondContact O-CG2 3.49Å; W75-V79 PolarHBondContact O-N 3.21Å; V76-V79 PolarHBondContact O-N 2.92Å; V79-L83 HydrophobicContact CG1-CD1 3.71Å; V79-L83 HydrophobicContact CG1-CG 4.43Å; V79-L83 VanDerWaalsContact O-CB 3.27Å; V79-L83 WeakPolarHBondContact O-CB 3.31Å; V79-L83 WeakPolarHBondContact O-CG 3.1Å; V79-L83 PolarHBondContact O-N 3.3Å; V79-L121 HydrophobicContact CG1-CB 3.87Å; V79-A125 HydrophobicContact CG1-CB 4.42Å |
| 80 | A | 82.8 | Confident | 79.4 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.4 | -48.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | W59 I62 V76 M77 F78 W84 | W59-A80 HydrophobicContact CB-CB 4.23Å; I62-A80 HydrophobicContact CD1-CB 4.35Å; V76-A80 VanDerWaalsContact O-CB 3.25Å; V76-A80 WeakPolarHBondContact O-CB 3.3Å; V76-A80 PolarHBondContact O-N 3.47Å; M77-A80 PolarHBondContact O-N 3.05Å; F78-A80 PolarHBondContact O-N 3.47Å; A80-W84 WeakPolarHBondContact O-CB 3.32Å; A80-W84 PolarHBondContact O-N 3.4Å |
| 81 | V | 84.6 | Confident | 80.1 | Confident | 47 Ų | 47 | 46.8 Ų | 46.8 | 29% | 0.285 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -69 | -46.4 | -179.3 | 176.9 | 0 | 0 | 0 | 0 | 111.3 | W59 M77 L83 W84 I85 | W59-V81 HydrophobicContact CD2-CG2 4.29Å; W59-V81 HydrophobicContact CG-CG2 3.88Å; M77-V81 WeakPolarHBondContact O-CB 3.44Å; M77-V81 WeakPolarHBondContact O-CG2 3.27Å; M77-V81 PolarHBondContact O-N 2.93Å; V81-L83 PolarHBondContact O-N 3.16Å; V81-W84 PolarHBondContact O-N 3.23Å; V81-I85 HydrophobicContact CG1-CD1 3.78Å; V81-I85 HydrophobicContact CG1-CG1 4.37Å; V81-I85 WeakPolarHBondContact O-CG1 3.46Å; V81-I85 PolarHBondContact O-N 3.05Å |
| 82 | A | 84.6 | Confident | 80.4 | Confident | 33 Ų | 33 | 44.7 Ų | 44.7 | 27% | 0.273 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.9 | -46.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | F78 I85 L86 | F78-A82 WeakPolarHBondContact O-CB 3.24Å; F78-A82 PolarHBondContact O-N 3.45Å; A82-I85 PolarHBondContact O-N 2.81Å; A82-L86 WeakPolarHBondContact O-CB 3.21Å; A82-L86 VanDerWaalsContact O-CG 3.24Å; A82-L86 WeakPolarHBondContact O-CG 3.22Å; A82-L86 PolarHBondContact O-N 3.36Å |
| 83 | L | 82 | Confident | 80.7 | Confident | 5 Ų | 5 | 45.1 Ų | 45.1 | 3% | 0.026 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.1 | -40.2 | 177.6 | -72.3 | 176.4 | 0 | 0 | 0 | 112 | V79 V81 I85 L86 T87 Y114 A118 L121 Y122 | V79-L83 HydrophobicContact CG1-CD1 3.71Å; V79-L83 HydrophobicContact CG1-CG 4.43Å; V79-L83 VanDerWaalsContact O-CB 3.27Å; V79-L83 WeakPolarHBondContact O-CB 3.31Å; V79-L83 WeakPolarHBondContact O-CG 3.1Å; V79-L83 PolarHBondContact O-N 3.3Å; V81-L83 PolarHBondContact O-N 3.16Å; L83-I85 PolarHBondContact O-N 3.39Å; L83-L86 HydrophobicContact CD2-CD1 4.45Å; L83-L86 PolarHBondContact O-N 3.39Å; L83-T87 PolarHBondContact O-N 3.46Å; L83-T87 PolarHBondContact O-OG1 2.98Å; L83-Y114 PolarHBondContact O-OH 2.93Å; L83-A118 HydrophobicContact CD1-CB 4.4Å; L83-A118 HydrophobicContact CD2-CB 4.03Å; L83-L121 HydrophobicContact CD1-CB 3.74Å; L83-L121 HydrophobicContact CD1-CD1 4.25Å; L83-L121 HydrophobicContact CD2-CD1 4.04Å; L83-L121 HydrophobicContact CG-CD1 4.38Å; L83-Y122 HydrophobicContact CB-CE2 3.8Å; L83-Y122 HydrophobicContact CD1-CD2 3.4Å; L83-Y122 VanDerWaalsContact CD1-CD2 3.4Å; L83-Y122 HydrophobicContact CD1-CE2 3.34Å; L83-Y122 HydrophobicContact CD1-CG 4.27Å; L83-Y122 HydrophobicContact CG-CE2 4.22Å |
| 84 | W | 85.2 | Confident | 80.7 | Confident | 67 Ų | 67 | 46.1 Ų | 46.1 | 25% | 0.254 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59.9 | -45.7 | 176 | -176.9 | 78.8 | 0 | 0 | 0 | 112.1 | M52 L56 A80 V81 L86 T87 A88 | M52-W84 HydrophobicContact CE-CZ2 4.25Å; M52-W84 PolarHBondContact O-NE1 3.48Å; L56-W84 HydrophobicContact CD1-CZ2 3.82Å; L56-W84 VanDerWaalsContact N-CD1 3.32Å; A80-W84 WeakPolarHBondContact O-CB 3.32Å; A80-W84 PolarHBondContact O-N 3.4Å; V81-W84 PolarHBondContact O-N 3.23Å; W84-L86 PolarHBondContact O-N 2.91Å; W84-T87 PolarHBondContact O-N 3.39Å; W84-A88 WeakPolarHBondContact O-CB 3.49Å; W84-A88 PolarHBondContact O-N 3.42Å |
| 85 | I | 84.8 | Confident | 80.4 | Confident | 81 Ų | 81 | 47.1 Ų | 47.1 | 42% | 0.415 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.8 | -45 | 175.3 | -67.2 | 171.2 | 0 | 0 | 0 | 110.6 | V81 A82 L83 T87 A88 L89 | V81-I85 HydrophobicContact CG1-CD1 3.78Å; V81-I85 HydrophobicContact CG1-CG1 4.37Å; V81-I85 WeakPolarHBondContact O-CG1 3.46Å; V81-I85 PolarHBondContact O-N 3.05Å; A82-I85 PolarHBondContact O-N 2.81Å; L83-I85 PolarHBondContact O-N 3.39Å; I85-T87 PolarHBondContact O-N 2.82Å; I85-A88 WeakPolarHBondContact O-CB 3.47Å; I85-A88 PolarHBondContact O-N 2.94Å; I85-L89 HydrophobicContact CG2-CD1 4.05Å; I85-L89 HydrophobicContact CG2-CG 4.41Å; I85-L89 WeakPolarHBondContact O-CG 3.49Å; I85-L89 PolarHBondContact O-N 2.78Å |
| 86 | L | 83.9 | Confident | 80.1 | Confident | 87 Ų | 87 | 48.3 Ų | 48.3 | 46% | 0.455 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.6 | -39.8 | 178.5 | -71.7 | 167.7 | 0 | 0 | 0 | 112.1 | A82 L83 W84 A88 L89 L90 Y114 | A82-L86 WeakPolarHBondContact O-CB 3.21Å; A82-L86 VanDerWaalsContact O-CG 3.24Å; A82-L86 WeakPolarHBondContact O-CG 3.22Å; A82-L86 PolarHBondContact O-N 3.36Å; L83-L86 HydrophobicContact CD2-CD1 4.45Å; L83-L86 PolarHBondContact O-N 3.39Å; W84-L86 PolarHBondContact O-N 2.91Å; L86-A88 VanDerWaalsContact C-N 3.32Å; L86-L89 PolarHBondContact O-N 3.45Å; L86-L90 WeakPolarHBondContact O-CB 3.39Å; L86-L90 PolarHBondContact O-N 3.27Å; L86-Y114 HydrophobicContact CB-CE2 3.75Å |
| 87 | T | 82.6 | Confident | 79.6 | Confident | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.3 | -40.5 | 175.4 | -50.6 | 0 | 0 | 0 | 0 | 109.7 | E51 M52 L83 W84 I85 L89 L90 F91 Y114 Y158 | E51-T87 HydrophobicContact CB-CG2 4.17Å; M52-T87 HydrophobicContact CG-CG2 3.93Å; M52-T87 HydrophobicContact SD-CG2 4Å; L83-T87 PolarHBondContact O-N 3.46Å; L83-T87 PolarHBondContact O-OG1 2.98Å; W84-T87 PolarHBondContact O-N 3.39Å; I85-T87 PolarHBondContact O-N 2.82Å; T87-L89 PolarHBondContact O-N 2.81Å; T87-L90 PolarHBondContact O-N 3.36Å; T87-F91 VanDerWaalsContact O-CB 3.24Å; T87-F91 WeakPolarHBondContact O-CB 3.32Å; T87-F91 PolarHBondContact O-N 2.89Å; T87-Y114 VanDerWaalsContact CA-OH 3.29Å; T87-Y114 WeakPolarHBondContact CA-OH 3.29Å; T87-Y114 WeakPolarHBondContact CB-OH 3.47Å; T87-Y114 PolarHBondContact N-OH 3.17Å; T87-Y114 PolarHBondContact OG1-OH 3.14Å; T87-Y158 PolarHBondContact OG1-OH 3.34Å |
| 88 | A | 81.4 | Confident | 78.6 | Confident | 18 Ų | 18 | 49.6 Ų | 49.6 | 15% | 0.149 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.1 | -46 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | M52 W84 I85 L86 F91 L92 | M52-A88 VanDerWaalsContact CE-CA 3.48Å; M52-A88 HydrophobicContact CE-CB 3.31Å; M52-A88 WeakPolarHBondContact SD-CA 3.41Å; M52-A88 HydrophobicContact SD-CB 3.72Å; M52-A88 PolarHBondContact SD-N 3.12Å; W84-A88 WeakPolarHBondContact O-CB 3.49Å; W84-A88 PolarHBondContact O-N 3.42Å; I85-A88 WeakPolarHBondContact O-CB 3.47Å; I85-A88 PolarHBondContact O-N 2.94Å; L86-A88 VanDerWaalsContact C-N 3.32Å; A88-F91 PolarHBondContact O-N 3.36Å; A88-L92 VanDerWaalsContact O-CG 3.29Å; A88-L92 WeakPolarHBondContact O-CG 3.47Å; A88-L92 PolarHBondContact O-N 3.3Å |
| 89 | L | 83.6 | Confident | 77.6 | Confident | 96 Ų | 96 | 44.6 Ų | 44.6 | 50% | 0.503 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62.6 | -46.3 | 177 | -70.3 | 171.7 | 0 | 0 | 0 | 111.3 | I85 L86 T87 F91 L92 V93 | I85-L89 HydrophobicContact CG2-CD1 4.05Å; I85-L89 HydrophobicContact CG2-CG 4.41Å; I85-L89 WeakPolarHBondContact O-CG 3.49Å; I85-L89 PolarHBondContact O-N 2.78Å; L86-L89 PolarHBondContact O-N 3.45Å; T87-L89 PolarHBondContact O-N 2.81Å; L89-F91 VanDerWaalsContact C-N 3.33Å; L89-F91 PolarHBondContact O-N 3.27Å; L89-L92 PolarHBondContact O-N 2.97Å; L89-V93 VanDerWaalsContact O-CG2 3.27Å; L89-V93 WeakPolarHBondContact O-CG2 3.12Å; L89-V93 PolarHBondContact O-N 2.95Å |
| 90 | L | 77.1 | Confident | 76.6 | Confident | 21 Ų | 21 | 50.6 Ų | 50.6 | 11% | 0.11 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.2 | -42.2 | 177.9 | -171.9 | 62.2 | 0 | 0 | 0 | 111.5 | M48 L86 T87 L92 V93 L94 Y114 | M48-L90 HydrophobicContact CE-CD2 3.57Å; M48-L90 HydrophobicContact CE-CG 4Å; M48-L90 HydrophobicContact SD-CD2 4.16Å; M48-L90 HydrophobicContact SD-CG 4.15Å; L86-L90 WeakPolarHBondContact O-CB 3.39Å; L86-L90 PolarHBondContact O-N 3.27Å; T87-L90 PolarHBondContact O-N 3.36Å; L90-L92 PolarHBondContact O-N 3.5Å; L90-V93 PolarHBondContact O-N 2.89Å; L90-L94 HydrophobicContact CG-CD1 4.32Å; L90-L94 WeakPolarHBondContact O-CB 3.49Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.3Å; L90-L94 PolarHBondContact O-N 3.31Å; L90-Y114 HydrophobicContact CD2-CD1 3.48Å; L90-Y114 VanDerWaalsContact CD2-CD1 3.48Å; L90-Y114 HydrophobicContact CD2-CE1 3.86Å; L90-Y114 HydrophobicContact CD2-CG 3.93Å |
| 91 | F | 77.8 | Confident | 75.6 | Confident | 41 Ų | 41 | 60.8 Ų | 60.8 | 18% | 0.18 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.7 | -43.3 | 174.7 | -177.9 | -100.7 | 0 | 0 | 0 | 111.8 | L40 M48 A49 T87 A88 L89 L94 L95 | L40-F91 HydrophobicContact CD2-CE2 4.42Å; L40-F91 HydrophobicContact CD2-CZ 4.03Å; M48-F91 HydrophobicContact CB-CD2 3.96Å; A49-F91 HydrophobicContact CB-CE2 4.33Å; T87-F91 VanDerWaalsContact O-CB 3.24Å; T87-F91 WeakPolarHBondContact O-CB 3.32Å; T87-F91 PolarHBondContact O-N 2.89Å; A88-F91 PolarHBondContact O-N 3.36Å; L89-F91 VanDerWaalsContact C-N 3.33Å; L89-F91 PolarHBondContact O-N 3.27Å; F91-L94 PolarHBondContact O-N 2.95Å; F91-L95 HydrophobicContact CE1-CD2 4.4Å; F91-L95 VanDerWaalsContact O-CB 3.24Å; F91-L95 WeakPolarHBondContact O-CB 3.22Å; F91-L95 PolarHBondContact O-N 3.49Å |
| 92 | L | 78.7 | Confident | 74.4 | Confident | 77 Ų | 77 | 63 Ų | 63 | 40% | 0.403 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63 | -44.9 | 175.4 | -71 | 176.1 | 0 | 0 | 0 | 111.8 | A88 L89 L90 L94 L95 F96 | A88-L92 VanDerWaalsContact O-CG 3.29Å; A88-L92 WeakPolarHBondContact O-CG 3.47Å; A88-L92 PolarHBondContact O-N 3.3Å; L89-L92 PolarHBondContact O-N 2.97Å; L90-L92 PolarHBondContact O-N 3.5Å; L92-L94 VanDerWaalsContact C-N 3.27Å; L92-L94 PolarHBondContact O-N 3.05Å; L92-L95 HydrophobicContact CD2-CD2 4.45Å; L92-L95 PolarHBondContact O-N 3.35Å; L92-F96 HydrophobicContact CB-CD2 4.39Å; L92-F96 HydrophobicContact CB-CE2 4.23Å; L92-F96 HydrophobicContact CD2-CE2 4.28Å; L92-F96 WeakPolarHBondContact O-CD2 3.36Å; L92-F96 PolarHBondContact O-N 3.4Å |
| 93 | V | 75 | Confident | 73.3 | Confident | 47 Ų | 47 | 66.9 Ų | 66.9 | 29% | 0.285 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -57.9 | -42.3 | 177.1 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | L89 L90 V98 W107 | L89-V93 VanDerWaalsContact O-CG2 3.27Å; L89-V93 WeakPolarHBondContact O-CG2 3.12Å; L89-V93 PolarHBondContact O-N 2.95Å; L90-V93 PolarHBondContact O-N 2.89Å; V93-V98 HydrophobicContact CG1-CB 3.74Å; V93-V98 HydrophobicContact CG1-CG1 4.06Å; V93-V98 HydrophobicContact CG1-CG2 4.12Å; V93-V98 VanDerWaalsContact O-CB 3.31Å; V93-V98 WeakPolarHBondContact O-CB 3.44Å; V93-V98 VanDerWaalsContact O-CG2 3.3Å; V93-V98 WeakPolarHBondContact O-CG2 3.45Å; V93-V98 PolarHBondContact O-N 3.38Å; V93-V98 VanDerWaalsContact O-N 3.14Å; V93-W107 HydrophobicContact CG1-CH2 3.66Å; V93-W107 HydrophobicContact CG1-CZ3 3.67Å |
| 94 | L | 71.7 | Confident | 72.6 | Confident | 22 Ų | 22 | 71.2 Ų | 71.2 | 12% | 0.115 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -69.9 | -40.3 | 175.7 | -69.3 | 172.8 | 0 | 0 | 0 | 112.5 | F39 M48 L90 F91 L92 F96 S97 P99 | F39-L94 HydrophobicContact CE1-CB 4.12Å; F39-L94 WeakPolarHBondContact CE1-O 3.29Å; M48-L94 HydrophobicContact CE-CD1 3.42Å; M48-L94 VanDerWaalsContact CE-CD1 3.42Å; M48-L94 HydrophobicContact SD-CD1 3.22Å; M48-L94 WeakPolarHBondContact SD-CD1 3.49Å; L90-L94 HydrophobicContact CG-CD1 4.32Å; L90-L94 WeakPolarHBondContact O-CB 3.49Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.3Å; L90-L94 PolarHBondContact O-N 3.31Å; F91-L94 PolarHBondContact O-N 2.95Å; L92-L94 VanDerWaalsContact C-N 3.27Å; L92-L94 PolarHBondContact O-N 3.05Å; L94-F96 VanDerWaalsContact C-N 3.35Å; L94-F96 PolarHBondContact O-N 2.9Å; L94-S97 WeakPolarHBondContact O-CA 3.01Å; L94-S97 PolarHBondContact O-N 2.91Å; L94-P99 HydrophobicContact CD2-CG 3.69Å |
| 95 | L | 69.8 | Low | 71.9 | Confident | 64 Ų | 64 | 71 Ų | 71 | 34% | 0.335 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -63.5 | -38.2 | 178.3 | -175.5 | 69.1 | 0 | 0 | 0 | 112.3 | L40 F91 L92 S97 | L40-L95 HydrophobicContact CD2-CD1 4.07Å; L40-L95 HydrophobicContact CG-CD1 4.45Å; F91-L95 HydrophobicContact CE1-CD2 4.4Å; F91-L95 VanDerWaalsContact O-CB 3.24Å; F91-L95 WeakPolarHBondContact O-CB 3.22Å; F91-L95 PolarHBondContact O-N 3.49Å; L92-L95 HydrophobicContact CD2-CD2 4.45Å; L92-L95 PolarHBondContact O-N 3.35Å; L95-S97 PolarHBondContact O-N 3.3Å |
| 96 | F | 73.5 | Confident | 71.6 | Confident | 140 Ų | 140 | 71 Ų | 71 | 61% | 0.614 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | 5.2 | 174.1 | -69.1 | -62 | 0 | 0 | 0 | 113.4 | L92 L94 V98 | L92-F96 HydrophobicContact CB-CD2 4.39Å; L92-F96 HydrophobicContact CB-CE2 4.23Å; L92-F96 HydrophobicContact CD2-CE2 4.28Å; L92-F96 WeakPolarHBondContact O-CD2 3.36Å; L92-F96 PolarHBondContact O-N 3.4Å; L94-F96 VanDerWaalsContact C-N 3.35Å; L94-F96 PolarHBondContact O-N 2.9Å; F96-V98 HydrophobicContact CB-CG2 4.02Å; F96-V98 PolarHBondContact O-N 3.48Å; F96-V98 VanDerWaalsContact O-N 3.12Å |
| 97 | S | 65.8 | Low | 71.1 | Confident | 19 Ų | 19 | 69.2 Ų | 69.2 | 13% | 0.133 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 53.8 | 32.1 | -179.4 | -48.1 | 0 | 0 | 0 | 0 | 112.9 | L94 L95 Q100 | L94-S97 WeakPolarHBondContact O-CA 3.01Å; L94-S97 PolarHBondContact O-N 2.91Å; L95-S97 PolarHBondContact O-N 3.3Å; S97-Q100 VanDerWaalsContact CB-OE1 3.28Å; S97-Q100 WeakPolarHBondContact O-CB 3.21Å; S97-Q100 PolarHBondContact O-N 2.94Å |
| 98 | V | 61 | Low | 70.7 | Confident | 39 Ų | 39 | 71.6 Ų | 71.6 | 24% | 0.236 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -53.6 | -34.7 | 175.6 | 179.1 | 0 | 0 | 0 | 0 | 112.4 | V93 F96 Q100 R101 L102 W107 | V93-V98 HydrophobicContact CG1-CB 3.74Å; V93-V98 HydrophobicContact CG1-CG1 4.06Å; V93-V98 HydrophobicContact CG1-CG2 4.12Å; V93-V98 VanDerWaalsContact O-CB 3.31Å; V93-V98 WeakPolarHBondContact O-CB 3.44Å; V93-V98 VanDerWaalsContact O-CG2 3.3Å; V93-V98 WeakPolarHBondContact O-CG2 3.45Å; V93-V98 PolarHBondContact O-N 3.38Å; V93-V98 VanDerWaalsContact O-N 3.14Å; F96-V98 HydrophobicContact CB-CG2 4.02Å; F96-V98 PolarHBondContact O-N 3.48Å; F96-V98 VanDerWaalsContact O-N 3.12Å; V98-Q100 PolarHBondContact O-N 3.4Å; V98-R101 PolarHBondContact O-N 2.87Å; V98-L102 HydrophobicContact CG1-CD1 3.78Å; V98-L102 HydrophobicContact CG1-CG 4.4Å; V98-L102 PolarHBondContact O-N 3.2Å; V98-W107 HydrophobicContact CG1-CH2 3.96Å; V98-W107 HydrophobicContact CG1-CZ2 3.97Å |
| 99 | P | 60.9 | Low | 70.2 | Confident | 30 Ų | 30 | 74.7 Ų | 74.7 | 20% | 0.195 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -57.7 | -30.9 | 174.2 | -25.4 | 33.4 | 0 | 0 | 0 | 114.9 | L94 R101 W107 | L94-P99 HydrophobicContact CD2-CG 3.69Å; P99-R101 VanDerWaalsContact C-N 3.33Å; P99-W107 HydrophobicContact CB-CD2 3.98Å; P99-W107 HydrophobicContact CB-CG 3.89Å; P99-W107 HydrophobicContact CG-CD2 3.91Å; P99-W107 HydrophobicContact CG-CE3 4.17Å; P99-W107 HydrophobicContact CG-CG 4.22Å |
| 100 | Q | 61.2 | Low | 70 | Confident | 128 Ų | 128 | 72.9 Ų | 72.9 | 60% | 0.598 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -76.6 | -23.8 | 178.6 | -60.6 | 169.5 | -4.4 | 0 | 0 | 112 | S97 V98 | S97-Q100 VanDerWaalsContact CB-OE1 3.28Å; S97-Q100 WeakPolarHBondContact O-CB 3.21Å; S97-Q100 PolarHBondContact O-N 2.94Å; V98-Q100 PolarHBondContact O-N 3.4Å |
| 101 | R | 62.2 | Low | 70.1 | Confident | 215 Ų | 215 | 72.8 Ų | 72.8 | 81% | 0.811 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -92.5 | -24.8 | 178.8 | -63 | -162.9 | -177.1 | -99.5 | 2.7 | 113.3 | V98 P99 | V98-R101 PolarHBondContact O-N 2.87Å; P99-R101 VanDerWaalsContact C-N 3.33Å |
| 102 | L | 60.2 | Low | 70 | Confident | 94 Ų | 94 | 73.1 Ų | 73.1 | 49% | 0.492 | 40% | 0.396 | S | S | . | . | trans | -123.8 | 73.2 | -178.1 | -68.1 | 175 | 0 | 0 | 0 | 110.2 | V98 A104 W107 | V98-L102 HydrophobicContact CG1-CD1 3.78Å; V98-L102 HydrophobicContact CG1-CG 4.4Å; V98-L102 PolarHBondContact O-N 3.2Å; L102-A104 PolarHBondContact O-N 3.28Å; L102-W107 HydrophobicContact CB-CZ2 4.24Å; L102-W107 PolarHBondContact O-NE1 2.91Å | ||
| 103 | S | 61.4 | Low | 70.1 | Confident | 114 Ų | 114 | 76 Ų | 76 | 80% | 0.797 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | -7.9 | 176.2 | 52.3 | 0 | 0 | 0 | 0 | 114.2 | V105 | S103-V105 VanDerWaalsContact C-N 3.26Å; S103-V105 PolarHBondContact O-N 2.93Å |
| 104 | A | 67.3 | Low | 70.5 | Confident | 96 Ų | 96 | 75.4 Ų | 75.4 | 79% | 0.793 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -18.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L102 | L102-A104 PolarHBondContact O-N 3.28Š|
| 105 | V | 70.4 | Confident | 70.9 | Confident | 62 Ų | 62 | 74.6 Ų | 74.6 | 38% | 0.376 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -99.8 | 130.7 | -179 | -179.8 | 0 | 0 | 0 | 0 | 109.6 | S103 W107 | S103-V105 VanDerWaalsContact C-N 3.26Å; S103-V105 PolarHBondContact O-N 2.93Å; V105-W107 VanDerWaalsContact C-N 3.28Å; V105-W107 HydrophobicContact CB-CZ2 4.43Å; V105-W107 PolarHBondContact O-N 3.4Å; V105-W107 PolarHBondContact O-NE1 3.49Å |
| 106 | P | 78.3 | Confident | 71.5 | Confident | 80 Ų | 80 | 72.8 Ų | 72.8 | 52% | 0.519 | 39% | 0.394 | S | S | . | . | trans | -73.1 | 82 | 173.5 | 30.8 | -34.6 | 0 | 0 | 0 | 110.4 | T108 M109 T110 | P106-T108 VanDerWaalsContact C-N 3.27Å; P106-T108 PolarHBondContact O-N 3.49Å; P106-M109 HydrophobicContact CB-CB 4.31Å; P106-M109 HydrophobicContact CB-CG 4.49Å; P106-M109 HydrophobicContact CG-CB 4.45Å; P106-M109 WeakPolarHBondContact O-CB 3.39Å; P106-M109 PolarHBondContact O-N 3.41Å; P106-T110 PolarHBondContact O-N 2.94Å; P106-T110 PolarHBondContact O-OG1 2.94Å | ||
| 107 | W | 74.1 | Confident | 72 | Confident | 51 Ų | 51 | 70 Ų | 70 | 19% | 0.193 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -56.4 | -36.7 | -175.6 | -69.2 | 98 | 0 | 0 | 0 | 113.8 | V93 V98 P99 L102 V105 M109 T110 V111 | V93-W107 HydrophobicContact CG1-CH2 3.66Å; V93-W107 HydrophobicContact CG1-CZ3 3.67Å; V98-W107 HydrophobicContact CG1-CH2 3.96Å; V98-W107 HydrophobicContact CG1-CZ2 3.97Å; P99-W107 HydrophobicContact CB-CD2 3.98Å; P99-W107 HydrophobicContact CB-CG 3.89Å; P99-W107 HydrophobicContact CG-CD2 3.91Å; P99-W107 HydrophobicContact CG-CE3 4.17Å; P99-W107 HydrophobicContact CG-CG 4.22Å; L102-W107 HydrophobicContact CB-CZ2 4.24Å; L102-W107 PolarHBondContact O-NE1 2.91Å; V105-W107 VanDerWaalsContact C-N 3.28Å; V105-W107 HydrophobicContact CB-CZ2 4.43Å; V105-W107 PolarHBondContact O-N 3.4Å; V105-W107 PolarHBondContact O-NE1 3.49Å; W107-M109 VanDerWaalsContact C-N 3.31Å; W107-M109 PolarHBondContact O-N 3.37Å; W107-T110 PolarHBondContact O-N 2.95Å; W107-V111 WeakPolarHBondContact O-CG2 3.39Å; W107-V111 PolarHBondContact O-N 3.41Å |
| 108 | T | 73.8 | Confident | 72.7 | Confident | 50 Ų | 50 | 69.1 Ų | 69.1 | 31% | 0.307 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -59.7 | -40.9 | 176.5 | -45.7 | 0 | 0 | 0 | 0 | 111.7 | P106 M112 S165 D168 W169 | P106-T108 VanDerWaalsContact C-N 3.27Å; P106-T108 PolarHBondContact O-N 3.49Å; T108-M112 VanDerWaalsContact O-CB 3.3Å; T108-M112 WeakPolarHBondContact O-CB 3.39Å; T108-M112 PolarHBondContact O-N 2.92Å; T108-S165 WeakPolarHBondContact CG2-O 3.48Å; T108-D168 HydrophobicContact CG2-CB 4.19Å; T108-W169 HydrophobicContact CG2-CB 4.14Å |
| 109 | M | 71.3 | Confident | 73.6 | Confident | 83 Ų | 83 | 68 Ų | 68 | 41% | 0.409 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -68.5 | -41.1 | 175.8 | -79 | -169.3 | 155.4 | 0 | 0 | 112 | P106 W107 M112 M113 | P106-M109 HydrophobicContact CB-CB 4.31Å; P106-M109 HydrophobicContact CB-CG 4.49Å; P106-M109 HydrophobicContact CG-CB 4.45Å; P106-M109 WeakPolarHBondContact O-CB 3.39Å; P106-M109 PolarHBondContact O-N 3.41Å; W107-M109 VanDerWaalsContact C-N 3.31Å; W107-M109 PolarHBondContact O-N 3.37Å; M109-M112 PolarHBondContact O-N 3.49Å; M109-M113 WeakPolarHBondContact O-CB 3.38Å; M109-M113 WeakPolarHBondContact O-CG 3.49Å; M109-M113 PolarHBondContact O-N 3.35Å |
| 110 | T | 78.6 | Confident | 74.7 | Confident | 58 Ų | 58 | 72 Ų | 72 | 36% | 0.356 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 177.3 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | P106 W107 M113 Y114 | P106-T110 PolarHBondContact O-N 2.94Å; P106-T110 PolarHBondContact O-OG1 2.94Å; W107-T110 PolarHBondContact O-N 2.95Å; T110-M113 PolarHBondContact O-N 2.9Å; T110-Y114 VanDerWaalsContact O-CB 3.28Å; T110-Y114 WeakPolarHBondContact O-CB 3.34Å; T110-Y114 PolarHBondContact O-N 3.22Å |
| 111 | V | 79.6 | Confident | 75.7 | Confident | 19 Ų | 19 | 68.4 Ų | 68.4 | 12% | 0.115 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -66 | -42.1 | 178.9 | 175.3 | 0 | 0 | 0 | 0 | 111 | M48 W107 Y114 N115 | M48-V111 HydrophobicContact CE-CG1 3.97Å; M48-V111 HydrophobicContact CE-CG2 4.34Å; W107-V111 WeakPolarHBondContact O-CG2 3.39Å; W107-V111 PolarHBondContact O-N 3.41Å; V111-Y114 PolarHBondContact O-N 3.41Å; V111-N115 WeakPolarHBondContact CG1-ND2 3.27Å; V111-N115 VanDerWaalsContact O-CB 3.3Å; V111-N115 WeakPolarHBondContact O-CB 3.45Å; V111-N115 VanDerWaalsContact O-CG 3.3Å; V111-N115 PolarHBondContact O-N 2.85Å; V111-N115 PolarHBondContact O-ND2 3.35Å |
| 112 | M | 75.2 | Confident | 76.5 | Confident | 47 Ų | 47 | 58.1 Ų | 58.1 | 23% | 0.232 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.5 | -48.3 | 176.2 | -175.3 | -177.4 | 69.9 | 0 | 0 | 112.2 | T108 M109 N115 G116 Y166 | T108-M112 VanDerWaalsContact O-CB 3.3Å; T108-M112 WeakPolarHBondContact O-CB 3.39Å; T108-M112 PolarHBondContact O-N 2.92Å; M109-M112 PolarHBondContact O-N 3.49Å; M112-N115 PolarHBondContact O-N 3.02Å; M112-G116 PolarHBondContact O-N 3.23Å; M112-Y166 HydrophobicContact SD-CD2 4.15Å |
| 113 | M | 81.2 | Confident | 77.4 | Confident | 137 Ų | 137 | 57.1 Ų | 57.1 | 68% | 0.675 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -63.3 | -44 | 177.9 | -77.7 | -172.8 | 145 | 0 | 0 | 111.7 | M109 T110 G116 V117 | M109-M113 WeakPolarHBondContact O-CB 3.38Å; M109-M113 WeakPolarHBondContact O-CG 3.49Å; M109-M113 PolarHBondContact O-N 3.35Å; T110-M113 PolarHBondContact O-N 2.9Å; M113-G116 PolarHBondContact O-N 2.89Å; M113-V117 WeakPolarHBondContact O-CG2 3.49Å; M113-V117 PolarHBondContact O-N 3.38Å |
| 114 | Y | 82.8 | Confident | 78.3 | Confident | 36 Ų | 36 | 54.2 Ų | 54.2 | 14% | 0.141 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.7 | -51.9 | 177.4 | 176.4 | -101.6 | 0 | 0 | 0 | 111.5 | L83 L86 T87 L90 T110 V111 G116 V117 A118 Y158 | L83-Y114 PolarHBondContact O-OH 2.93Å; L86-Y114 HydrophobicContact CB-CE2 3.75Å; T87-Y114 VanDerWaalsContact CA-OH 3.29Å; T87-Y114 WeakPolarHBondContact CA-OH 3.29Å; T87-Y114 WeakPolarHBondContact CB-OH 3.47Å; T87-Y114 PolarHBondContact N-OH 3.17Å; T87-Y114 PolarHBondContact OG1-OH 3.14Å; L90-Y114 HydrophobicContact CD2-CD1 3.48Å; L90-Y114 VanDerWaalsContact CD2-CD1 3.48Å; L90-Y114 HydrophobicContact CD2-CE1 3.86Å; L90-Y114 HydrophobicContact CD2-CG 3.93Å; T110-Y114 VanDerWaalsContact O-CB 3.28Å; T110-Y114 WeakPolarHBondContact O-CB 3.34Å; T110-Y114 PolarHBondContact O-N 3.22Å; V111-Y114 PolarHBondContact O-N 3.41Å; Y114-G116 VanDerWaalsContact C-N 3.32Å; Y114-G116 PolarHBondContact O-N 2.94Å; Y114-V117 PolarHBondContact O-N 2.9Å; Y114-A118 VanDerWaalsContact O-CB 3.25Å; Y114-A118 WeakPolarHBondContact O-CB 3.35Å; Y114-A118 PolarHBondContact O-N 3.49Å; Y114-Y158 HydrophobicContact CE1-CE1 4.09Å |
| 115 | N | 81.4 | Confident | 78.8 | Confident | 4 Ų | 4 | 49.6 Ų | 49.6 | 2% | 0.021 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.5 | -39.7 | 179.3 | -76.3 | -24 | 0 | 0 | 0 | 112 | V111 M112 A119 Y158 A162 | V111-N115 WeakPolarHBondContact CG1-ND2 3.27Å; V111-N115 VanDerWaalsContact O-CB 3.3Å; V111-N115 WeakPolarHBondContact O-CB 3.45Å; V111-N115 VanDerWaalsContact O-CG 3.3Å; V111-N115 PolarHBondContact O-N 2.85Å; V111-N115 PolarHBondContact O-ND2 3.35Å; M112-N115 PolarHBondContact O-N 3.02Å; N115-A119 WeakPolarHBondContact O-CB 3.41Å; N115-A119 PolarHBondContact O-N 3.18Å; N115-Y158 WeakPolarHBondContact CB-O 3.26Å; N115-Y158 WeakPolarHBondContact OD1-CD1 3.43Å; N115-A162 HydrophobicContact CB-CB 3.78Å |
| 116 | G | 80.5 | Confident | 79.2 | Confident | 26 Ų | 26 | 50 Ų | 50 | 27% | 0.268 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.3 | -47.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | M112 M113 Y114 A119 L120 | M112-G116 PolarHBondContact O-N 3.23Å; M113-G116 PolarHBondContact O-N 2.89Å; Y114-G116 VanDerWaalsContact C-N 3.32Å; Y114-G116 PolarHBondContact O-N 2.94Å; G116-A119 PolarHBondContact O-N 3.3Å; G116-L120 WeakPolarHBondContact O-CG 3.48Å; G116-L120 PolarHBondContact O-N 3.49Å; G116-L120 VanDerWaalsContact O-N 3.14Å |
| 117 | V | 84.2 | Confident | 79.3 | Confident | 81 Ų | 81 | 50.9 Ų | 50.9 | 49% | 0.491 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.6 | -42.2 | 177.7 | 173.2 | 0 | 0 | 0 | 0 | 111 | M113 Y114 A119 L120 L121 | M113-V117 WeakPolarHBondContact O-CG2 3.49Å; M113-V117 PolarHBondContact O-N 3.38Å; Y114-V117 PolarHBondContact O-N 2.9Å; V117-A119 PolarHBondContact O-N 2.97Å; V117-L120 PolarHBondContact O-N 2.95Å; V117-L121 HydrophobicContact CG1-CD1 3.84Å; V117-L121 HydrophobicContact CG1-CG 4.38Å; V117-L121 WeakPolarHBondContact O-CB 3.29Å; V117-L121 WeakPolarHBondContact O-CG 3.42Å; V117-L121 PolarHBondContact O-N 3.2Å |
| 118 | A | 80.3 | Confident | 79.5 | Confident | 1 Ų | 1 | 49.9 Ų | 49.9 | 1% | 0.008 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L83 Y114 L120 L121 Y122 Y158 | L83-A118 HydrophobicContact CD1-CB 4.4Å; L83-A118 HydrophobicContact CD2-CB 4.03Å; Y114-A118 VanDerWaalsContact O-CB 3.25Å; Y114-A118 WeakPolarHBondContact O-CB 3.35Å; Y114-A118 PolarHBondContact O-N 3.49Å; A118-L120 PolarHBondContact O-N 2.91Å; A118-L121 PolarHBondContact O-N 3.44Å; A118-Y122 WeakPolarHBondContact O-CB 3.4Å; A118-Y122 WeakPolarHBondContact O-CD2 3.28Å; A118-Y122 PolarHBondContact O-N 3.43Å; A118-Y158 HydrophobicContact CB-CD1 3.75Å; A118-Y158 HydrophobicContact CB-CD2 4.05Å; A118-Y158 HydrophobicContact CB-CE1 4.01Å; A118-Y158 HydrophobicContact CB-CE2 4.33Å; A118-Y158 HydrophobicContact CB-CG 3.77Å |
| 119 | A | 79.9 | Confident | 79.5 | Confident | 16 Ų | 16 | 47.5 Ų | 47.5 | 13% | 0.132 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.9 | -44.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | N115 G116 V117 L123 | N115-A119 WeakPolarHBondContact O-CB 3.41Å; N115-A119 PolarHBondContact O-N 3.18Å; G116-A119 PolarHBondContact O-N 3.3Å; V117-A119 PolarHBondContact O-N 2.97Å; A119-L123 VanDerWaalsContact O-CB 3.32Å; A119-L123 WeakPolarHBondContact O-CB 3.48Å; A119-L123 PolarHBondContact O-N 2.98Å |
| 120 | L | 83.9 | Confident | 79.6 | Confident | 114 Ų | 114 | 46 Ų | 46 | 60% | 0.597 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -62.8 | -44.9 | 177.1 | -71.4 | 176 | 0 | 0 | 0 | 112.1 | G116 V117 A118 L123 T124 | G116-L120 WeakPolarHBondContact O-CG 3.48Å; G116-L120 PolarHBondContact O-N 3.49Å; G116-L120 VanDerWaalsContact O-N 3.14Å; V117-L120 PolarHBondContact O-N 2.95Å; A118-L120 PolarHBondContact O-N 2.91Å; L120-L123 WeakPolarHBondContact O-CB 3.25Å; L120-L123 PolarHBondContact O-N 2.77Å; L120-T124 WeakPolarHBondContact O-CG2 3.45Å; L120-T124 PolarHBondContact O-N 3.37Å |
| 121 | L | 82.4 | Confident | 79.5 | Confident | 52 Ų | 52 | 47 Ų | 47 | 27% | 0.272 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.8 | -44 | 179.7 | -74.1 | 173.1 | 0 | 0 | 0 | 111.7 | W75 V79 L83 V117 A118 L123 T124 A125 | W75-L121 HydrophobicContact CZ2-CD2 4.27Å; V79-L121 HydrophobicContact CG1-CB 3.87Å; L83-L121 HydrophobicContact CD1-CB 3.74Å; L83-L121 HydrophobicContact CD1-CD1 4.25Å; L83-L121 HydrophobicContact CD2-CD1 4.04Å; L83-L121 HydrophobicContact CG-CD1 4.38Å; V117-L121 HydrophobicContact CG1-CD1 3.84Å; V117-L121 HydrophobicContact CG1-CG 4.38Å; V117-L121 WeakPolarHBondContact O-CB 3.29Å; V117-L121 WeakPolarHBondContact O-CG 3.42Å; V117-L121 PolarHBondContact O-N 3.2Å; A118-L121 PolarHBondContact O-N 3.44Å; L121-L123 VanDerWaalsContact C-N 3.27Å; L121-L123 PolarHBondContact O-N 2.88Å; L121-T124 PolarHBondContact O-N 3.33Å; L121-T124 VanDerWaalsContact O-N 3.11Å; L121-T124 PolarHBondContact O-OG1 2.98Å; L121-A125 PolarHBondContact O-N 3.49Å; L121-A125 VanDerWaalsContact O-N 3.07Å |
| 122 | Y | 79.4 | Confident | 79 | Confident | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.3 | -32.5 | 173 | -89.5 | -72.5 | 0 | 0 | 0 | 112.7 | H58 L83 A118 A125 F126 L154 T155 Y158 | H58-Y122 AromaticContact CE1-CE1 3.87Å; H58-Y122 AromaticContact ND1-CE1 3.6Å; L83-Y122 HydrophobicContact CB-CE2 3.8Å; L83-Y122 HydrophobicContact CD1-CD2 3.4Å; L83-Y122 VanDerWaalsContact CD1-CD2 3.4Å; L83-Y122 HydrophobicContact CD1-CE2 3.34Å; L83-Y122 HydrophobicContact CD1-CG 4.27Å; L83-Y122 HydrophobicContact CG-CE2 4.22Å; A118-Y122 WeakPolarHBondContact O-CB 3.4Å; A118-Y122 WeakPolarHBondContact O-CD2 3.28Å; A118-Y122 PolarHBondContact O-N 3.43Å; Y122-A125 WeakPolarHBondContact O-CB 3.32Å; Y122-A125 PolarHBondContact O-N 3.16Å; Y122-F126 PolarHBondContact O-N 3.23Å; Y122-L154 HydrophobicContact CD1-CB 3.85Å; Y122-L154 HydrophobicContact CD1-CD1 4.03Å; Y122-L154 HydrophobicContact CD2-CB 4.28Å; Y122-L154 HydrophobicContact CE1-CB 4.01Å; Y122-L154 HydrophobicContact CE1-CD1 3.38Å; Y122-L154 HydrophobicContact CE1-CG 4.26Å; Y122-L154 HydrophobicContact CE2-CB 4.43Å; Y122-L154 HydrophobicContact CG-CB 4.01Å; Y122-T155 VanDerWaalsContact C-OG1 3.31Å; Y122-T155 WeakPolarHBondContact CB-OG1 3.25Å; Y122-Y158 AromaticContact CD2-CD2 3.67Å; Y122-Y158 HydrophobicContact CD2-CD2 3.67Å; Y122-Y158 AromaticContact CD2-CE2 3.48Å; Y122-Y158 HydrophobicContact CD2-CE2 3.48Å; Y122-Y158 VanDerWaalsContact CD2-CE2 3.48Å; Y122-Y158 AromaticContact CE2-CD2 3.98Å; Y122-Y158 HydrophobicContact CE2-CD2 3.98Å; Y122-Y158 AromaticContact CE2-CE2 3.27Å; Y122-Y158 HydrophobicContact CE2-CE2 3.27Å |
| 123 | L | 79.9 | Confident | 78.6 | Confident | 73 Ų | 73 | 47.5 Ų | 47.5 | 38% | 0.382 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 171.8 | 179.9 | 64.4 | 0 | 0 | 0 | 111.1 | A119 L120 L121 A125 F126 L127 T155 | A119-L123 VanDerWaalsContact O-CB 3.32Å; A119-L123 WeakPolarHBondContact O-CB 3.48Å; A119-L123 PolarHBondContact O-N 2.98Å; L120-L123 WeakPolarHBondContact O-CB 3.25Å; L120-L123 PolarHBondContact O-N 2.77Å; L121-L123 VanDerWaalsContact C-N 3.27Å; L121-L123 PolarHBondContact O-N 2.88Å; L123-A125 VanDerWaalsContact C-N 3.3Å; L123-A125 PolarHBondContact O-N 2.65Å; L123-F126 HydrophobicContact CD1-CD1 4.46Å; L123-F126 PolarHBondContact O-N 3.47Å; L123-L127 HydrophobicContact CD1-CD1 3.62Å; L123-L127 HydrophobicContact CG-CD1 3.98Å; L123-L127 VanDerWaalsContact O-CD1 3.25Å; L123-L127 WeakPolarHBondContact O-CD1 3.37Å; L123-L127 PolarHBondContact O-N 3.34Å; L123-T155 HydrophobicContact CB-CG2 4.12Å; L123-T155 PolarHBondContact N-OG1 3.48Å |
| 124 | T | 80.3 | Confident | 77.7 | Confident | 52 Ų | 52 | 51.2 Ų | 51.2 | 32% | 0.319 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.9 | -35.7 | 175.2 | 73.7 | 0 | 0 | 0 | 0 | 112.7 | W75 L120 L121 L127 T128 | W75-T124 PolarHBondContact NE1-OG1 3.48Å; W75-T124 VanDerWaalsContact NE1-OG1 3.16Å; L120-T124 WeakPolarHBondContact O-CG2 3.45Å; L120-T124 PolarHBondContact O-N 3.37Å; L121-T124 PolarHBondContact O-N 3.33Å; L121-T124 VanDerWaalsContact O-N 3.11Å; L121-T124 PolarHBondContact O-OG1 2.98Å; T124-L127 PolarHBondContact O-N 3.48Å; T124-T128 WeakPolarHBondContact O-CB 3.34Å; T124-T128 PolarHBondContact O-N 3.37Å; T124-T128 PolarHBondContact O-OG1 2.79Å |
| 125 | A | 78 | Confident | 76.6 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | V76 V79 L121 Y122 L123 T128 N129 | V76-A125 HydrophobicContact CG1-CB 4.04Å; V79-A125 HydrophobicContact CG1-CB 4.42Å; L121-A125 PolarHBondContact O-N 3.49Å; L121-A125 VanDerWaalsContact O-N 3.07Å; Y122-A125 WeakPolarHBondContact O-CB 3.32Å; Y122-A125 PolarHBondContact O-N 3.16Å; L123-A125 VanDerWaalsContact C-N 3.3Å; L123-A125 PolarHBondContact O-N 2.65Å; A125-T128 PolarHBondContact O-N 2.92Å; A125-N129 PolarHBondContact O-N 3.35Å |
| 126 | F | 77.6 | Confident | 75.5 | Confident | 71 Ų | 71 | 56.4 Ų | 56.4 | 31% | 0.311 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 173.8 | 172.9 | -109.4 | 0 | 0 | 0 | 112.3 | Y122 L123 T128 N129 A130 A148 A152 | Y122-F126 PolarHBondContact O-N 3.23Å; L123-F126 HydrophobicContact CD1-CD1 4.46Å; L123-F126 PolarHBondContact O-N 3.47Å; F126-T128 VanDerWaalsContact C-N 3.27Å; F126-T128 PolarHBondContact O-N 3.17Å; F126-N129 PolarHBondContact O-N 2.93Å; F126-A130 WeakPolarHBondContact O-CB 3.46Å; F126-A130 PolarHBondContact O-N 3Å; F126-A148 HydrophobicContact CD2-CB 4.3Å; F126-A148 WeakPolarHBondContact CD2-O 3.44Å; F126-A148 HydrophobicContact CE2-CB 4.32Å; F126-A152 HydrophobicContact CD2-CB 3.91Å; F126-A152 HydrophobicContact CE2-CB 4.01Å; F126-A152 HydrophobicContact CG-CB 4.41Å |
| 127 | L | 80.7 | Confident | 74.1 | Confident | 98 Ų | 98 | 62.7 Ų | 62.7 | 51% | 0.513 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -60.4 | -38.8 | 177.3 | -96.7 | 69.7 | 0 | 0 | 0 | 111.8 | L123 T124 A130 A131 | L123-L127 HydrophobicContact CD1-CD1 3.62Å; L123-L127 HydrophobicContact CG-CD1 3.98Å; L123-L127 VanDerWaalsContact O-CD1 3.25Å; L123-L127 WeakPolarHBondContact O-CD1 3.37Å; L123-L127 PolarHBondContact O-N 3.34Å; T124-L127 PolarHBondContact O-N 3.48Å; L127-A130 PolarHBondContact O-N 3.35Å; L127-A131 WeakPolarHBondContact O-CB 3.35Å; L127-A131 PolarHBondContact O-N 3.28Å |
| 128 | T | 78.4 | Confident | 73 | Confident | 29 Ų | 29 | 61.3 Ų | 61.3 | 18% | 0.178 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -67.4 | -41.5 | 177.8 | -58.6 | 0 | 0 | 0 | 0 | 111.3 | A72 V76 T124 A125 F126 A131 T132 | A72-T128 HydrophobicContact CB-CG2 3.74Å; V76-T128 HydrophobicContact CG2-CG2 3.57Å; T124-T128 WeakPolarHBondContact O-CB 3.34Å; T124-T128 PolarHBondContact O-N 3.37Å; T124-T128 PolarHBondContact O-OG1 2.79Å; A125-T128 PolarHBondContact O-N 2.92Å; F126-T128 VanDerWaalsContact C-N 3.27Å; F126-T128 PolarHBondContact O-N 3.17Å; T128-A131 PolarHBondContact O-N 2.89Å; T128-T132 WeakPolarHBondContact O-CB 3.39Å; T128-T132 VanDerWaalsContact O-CG2 3.26Å; T128-T132 WeakPolarHBondContact O-CG2 3.48Å; T128-T132 PolarHBondContact O-N 3.4Å; T128-T132 VanDerWaalsContact O-N 3.08Å; T128-T132 PolarHBondContact O-OG1 2.87Å |
| 129 | N | 73.9 | Confident | 71.8 | Confident | 1 Ų | 1 | 67.2 Ų | 67.2 | 1% | 0.005 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -63 | -41.3 | 172.9 | -71.9 | -15.9 | 0 | 0 | 0 | 111.4 | A125 F126 T132 V133 A148 | A125-N129 PolarHBondContact O-N 3.35Å; F126-N129 PolarHBondContact O-N 2.93Å; N129-T132 PolarHBondContact O-N 3.13Å; N129-T132 PolarHBondContact O-OG1 3.21Å; N129-V133 PolarHBondContact O-N 3.42Å; N129-A148 HydrophobicContact CB-CB 4.02Å |
| 130 | A | 74.2 | Confident | 70.7 | Confident | 51 Ų | 51 | 70 Ų | 70 | 42% | 0.421 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.8 | -41.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | F126 L127 T132 V133 | F126-A130 WeakPolarHBondContact O-CB 3.46Å; F126-A130 PolarHBondContact O-N 3Å; L127-A130 PolarHBondContact O-N 3.35Å; A130-T132 VanDerWaalsContact C-N 3.34Å; A130-T132 PolarHBondContact O-N 2.88Å; A130-V133 VanDerWaalsContact O-CG1 3.26Å; A130-V133 WeakPolarHBondContact O-CG1 3.33Å |
| 131 | A | 75.5 | Confident | 69.6 | Low | 78 Ų | 78 | 68.3 Ų | 68.3 | 65% | 0.645 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -68.8 | -32.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L127 T128 | L127-A131 WeakPolarHBondContact O-CB 3.35Å; L127-A131 PolarHBondContact O-N 3.28Å; T128-A131 PolarHBondContact O-N 2.89Å |
| 132 | T | 69.5 | Low | 68.7 | Low | 6 Ų | 6 | 68.8 Ų | 68.8 | 4% | 0.037 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -89.3 | -7.4 | -177 | 56.7 | 0 | 0 | 0 | 0 | 113.6 | V70 A72 Y73 T128 N129 A130 R134 Q135 F136 | V70-T132 HydrophobicContact CG1-CG2 3.98Å; A72-T132 HydrophobicContact CB-CG2 4.08Å; Y73-T132 HydrophobicContact CE2-CG2 4.11Å; Y73-T132 VanDerWaalsContact CE2-OG1 3.27Å; Y73-T132 WeakPolarHBondContact CE2-OG1 3.47Å; Y73-T132 PolarHBondContact OH-OG1 3.39Å; T128-T132 WeakPolarHBondContact O-CB 3.39Å; T128-T132 VanDerWaalsContact O-CG2 3.26Å; T128-T132 WeakPolarHBondContact O-CG2 3.48Å; T128-T132 PolarHBondContact O-N 3.4Å; T128-T132 VanDerWaalsContact O-N 3.08Å; T128-T132 PolarHBondContact O-OG1 2.87Å; N129-T132 PolarHBondContact O-N 3.13Å; N129-T132 PolarHBondContact O-OG1 3.21Å; A130-T132 VanDerWaalsContact C-N 3.34Å; A130-T132 PolarHBondContact O-N 2.88Å; T132-R134 PolarHBondContact O-N 2.9Å; T132-Q135 WeakPolarHBondContact O-CB 3.33Å; T132-Q135 PolarHBondContact O-N 3.39Å; T132-F136 WeakPolarHBondContact O-CD2 3.33Å |
| 133 | V | 65.7 | Low | 68.1 | Low | 72 Ų | 72 | 72.1 Ų | 72.1 | 44% | 0.436 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56 | -29.2 | -178.4 | 82.1 | 0 | 0 | 0 | 0 | 113.3 | N129 A130 F136 | N129-V133 PolarHBondContact O-N 3.42Å; A130-V133 VanDerWaalsContact O-CG1 3.26Å; A130-V133 WeakPolarHBondContact O-CG1 3.33Å; V133-F136 VanDerWaalsContact O-O 3.05Å |
| 134 | R | 62.3 | Low | 67.6 | Low | 215 Ų | 215 | 68.9 Ų | 68.9 | 81% | 0.811 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.7 | -20.8 | 177.5 | -72.6 | -170.6 | 147.8 | -154.6 | -6.8 | 114 | T132 | T132-R134 PolarHBondContact O-N 2.9Š|
| 135 | Q | 60.5 | Low | 67.1 | Low | 129 Ų | 129 | 68.4 Ų | 68.4 | 60% | 0.603 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | -21.3 | -177.2 | -66 | 177.7 | -36.7 | 0 | 0 | 112.4 | T132 | T132-Q135 WeakPolarHBondContact O-CB 3.33Å; T132-Q135 PolarHBondContact O-N 3.39Å |
| 136 | F | 59.3 | Low | 67 | Low | 20 Ų | 20 | 69.9 Ų | 69.9 | 9% | 0.088 | 41% | 0.407 | C | S | . | . | trans | -93.2 | 107.5 | 166.8 | -63.3 | -94.5 | 0 | 0 | 0 | 105.6 | V70 Y73 T132 V133 H141 I144 | V70-F136 HydrophobicContact CB-CE2 4.38Å; V70-F136 HydrophobicContact CB-CZ 4.32Å; V70-F136 HydrophobicContact CG2-CE2 3.68Å; V70-F136 HydrophobicContact CG2-CZ 3.69Å; Y73-F136 HydrophobicContact CD2-CE2 4.13Å; Y73-F136 HydrophobicContact CD2-CZ 4.16Å; Y73-F136 HydrophobicContact CE2-CD2 4.39Å; Y73-F136 AromaticContact CE2-CE2 3.34Å; Y73-F136 HydrophobicContact CE2-CE2 3.34Å; Y73-F136 AromaticContact CE2-CZ 3.72Å; Y73-F136 HydrophobicContact CE2-CZ 3.72Å; Y73-F136 AromaticContact CZ-CE2 3.75Å; T132-F136 WeakPolarHBondContact O-CD2 3.33Å; V133-F136 VanDerWaalsContact O-O 3.05Å; F136-H141 PolarHBondContact O-CE1 3.32Å; F136-H141 PolarHBondContact O-NE2 3.4Å; F136-I144 HydrophobicContact CB-CD1 3.76Å; F136-I144 HydrophobicContact CD1-CD1 3.31Å; F136-I144 HydrophobicContact CD2-CD1 3.37Å; F136-I144 HydrophobicContact CE1-CD1 3.63Å; F136-I144 HydrophobicContact CE2-CD1 3.73Å; F136-I144 HydrophobicContact CG-CD1 3.15Å; F136-I144 HydrophobicContact CZ-CD1 3.83Å | ||
| 137 | Q | 50.8 | Low | 66.9 | Low | 158 Ų | 158 | 66.6 Ų | 66.6 | 74% | 0.738 | 39% | 0.393 | S | S | * | . | trans | -119.4 | 112.9 | 166.6 | -68.4 | -72 | -67.5 | 0 | 0 | 105.5 | H141 | Q137-H141 VanDerWaalsContact C-CE1 3.45Å; Q137-H141 WeakPolarHBondContact CA-CE1 3.41Å; Q137-H141 PolarHBondContact N-CE1 3.14Å; Q137-H141 PolarHBondContact NE2-NE2 2.83Å | ||
| 138 | G | 61.3 | Low | 66.7 | Low | 51 Ų | 51 | 62.7 Ų | 62.7 | 53% | 0.526 | 38% | 0.376 | S | S | . | . | S | Bend | trans | 128.5 | -161.9 | -170.6 | 0 | 0 | 0 | 0 | 0 | 117.7 | F140 H141 | G138-F140 PolarHBondContact O-N 2.87Å; G138-H141 PolarHBondContact N-CE1 3.49Å; G138-H141 PolarHBondContact N-ND1 3.45Å; G138-H141 PolarHBondContact O-CE1 3.26Å; G138-H141 PolarHBondContact O-N 3.27Å; G138-H141 PolarHBondContact O-ND1 2.9Å |
| 139 | S | 55 | Low | 66.8 | Low | 126 Ų | 126 | 67.9 Ų | 67.9 | 88% | 0.881 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -8.6 | -163.9 | -53.4 | 0 | 0 | 0 | 0 | 119.1 | ||
| 140 | F | 56.1 | Low | 67.1 | Low | 75 Ų | 75 | 69.8 Ų | 69.8 | 33% | 0.329 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | 10.4 | -176.3 | -66.9 | -80.2 | 0 | 0 | 0 | 115.2 | S66 G138 G142 I144 | S66-F140 WeakPolarHBondContact OG-CZ 3.44Å; G138-F140 PolarHBondContact O-N 2.87Å; F140-G142 VanDerWaalsContact C-N 3.35Å; F140-G142 PolarHBondContact O-N 3.3Å; F140-I144 PolarHBondContact O-N 3.32Å |
| 141 | H | 60.1 | Low | 67.1 | Low | 78 Ų | 78 | 67.4 Ų | 67.4 | 36% | 0.361 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.3 | -40.1 | -177.9 | -75.3 | 48.7 | 0 | 0 | 0 | 113 | F136 Q137 G138 I144 G145 | F136-H141 PolarHBondContact O-CE1 3.32Å; F136-H141 PolarHBondContact O-NE2 3.4Å; Q137-H141 VanDerWaalsContact C-CE1 3.45Å; Q137-H141 WeakPolarHBondContact CA-CE1 3.41Å; Q137-H141 PolarHBondContact N-CE1 3.14Å; Q137-H141 PolarHBondContact NE2-NE2 2.83Å; G138-H141 PolarHBondContact N-CE1 3.49Å; G138-H141 PolarHBondContact N-ND1 3.45Å; G138-H141 PolarHBondContact O-CE1 3.26Å; G138-H141 PolarHBondContact O-N 3.27Å; G138-H141 PolarHBondContact O-ND1 2.9Å; H141-I144 PolarHBondContact O-N 2.98Å; H141-G145 PolarHBondContact O-N 3.06Å |
| 142 | G | 63.7 | Low | 67.3 | Low | 62 Ų | 62 | 65 Ų | 65 | 64% | 0.639 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -63.6 | -43.8 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F140 A146 | F140-G142 VanDerWaalsContact C-N 3.35Å; F140-G142 PolarHBondContact O-N 3.3Å; G142-A146 WeakPolarHBondContact O-CB 3.47Å; G142-A146 PolarHBondContact O-N 2.95Å |
| 143 | Q | 67.6 | Low | 67.8 | Low | 69 Ų | 69 | 66.1 Ų | 66.1 | 32% | 0.322 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -68.2 | -40.3 | -179.9 | -83.6 | 171.6 | -110.5 | 0 | 0 | 112.6 | G64 A146 A147 | G64-Q143 PolarHBondContact O-NE2 3.23Å; Q143-A146 PolarHBondContact O-N 3.18Å; Q143-A147 WeakPolarHBondContact O-CB 3.34Å; Q143-A147 PolarHBondContact O-N 2.94Å |
| 144 | I | 68.8 | Low | 68.5 | Low | 6 Ų | 6 | 62.7 Ų | 62.7 | 3% | 0.031 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -71.6 | -38.4 | 179.2 | -67.1 | 173.9 | 0 | 0 | 0 | 111 | Y73 F136 F140 H141 A147 A148 | Y73-I144 HydrophobicContact CE1-CG1 4.48Å; Y73-I144 WeakPolarHBondContact OH-CD1 3.25Å; Y73-I144 WeakPolarHBondContact OH-CG2 3.27Å; F136-I144 HydrophobicContact CB-CD1 3.76Å; F136-I144 HydrophobicContact CD1-CD1 3.31Å; F136-I144 HydrophobicContact CD2-CD1 3.37Å; F136-I144 HydrophobicContact CE1-CD1 3.63Å; F136-I144 HydrophobicContact CE2-CD1 3.73Å; F136-I144 HydrophobicContact CG-CD1 3.15Å; F136-I144 HydrophobicContact CZ-CD1 3.83Å; F140-I144 PolarHBondContact O-N 3.32Å; H141-I144 PolarHBondContact O-N 2.98Å; I144-A147 PolarHBondContact O-N 2.83Å; I144-A148 WeakPolarHBondContact O-CB 3.24Å; I144-A148 PolarHBondContact O-N 2.87Å |
| 145 | G | 70 | Confident | 69.3 | Low | 41 Ų | 41 | 53.6 Ų | 53.6 | 42% | 0.423 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | H141 A148 F149 | H141-G145 PolarHBondContact O-N 3.06Å; G145-A148 PolarHBondContact O-N 3.32Å; G145-F149 PolarHBondContact O-N 2.62Å |
| 146 | A | 76.1 | Confident | 70.4 | Confident | 31 Ų | 31 | 53.7 Ų | 53.7 | 26% | 0.256 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.3 | -44.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L61 G142 Q143 A148 F149 F150 | L61-A146 HydrophobicContact CD1-CB 4.2Å; G142-A146 WeakPolarHBondContact O-CB 3.47Å; G142-A146 PolarHBondContact O-N 2.95Å; Q143-A146 PolarHBondContact O-N 3.18Å; A146-A148 VanDerWaalsContact C-N 3.34Å; A146-A148 PolarHBondContact O-N 3.43Å; A146-F149 WeakPolarHBondContact O-CB 3.18Å; A146-F149 PolarHBondContact O-N 3.35Å; A146-F150 HydrophobicContact CB-CE2 4.46Å; A146-F150 WeakPolarHBondContact O-CD2 3.18Å; A146-F150 PolarHBondContact O-N 3.35Å |
| 147 | A | 75.9 | Confident | 71.5 | Confident | 2 Ų | 2 | 54.4 Ų | 54.4 | 2% | 0.017 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | H58 I62 Q143 I144 F149 F150 G151 | H58-A147 PolarHBondContact CD2-O 2.95Å; H58-A147 PolarHBondContact NE2-O 3.17Å; I62-A147 HydrophobicContact CG1-CB 3.93Å; Q143-A147 WeakPolarHBondContact O-CB 3.34Å; Q143-A147 PolarHBondContact O-N 2.94Å; I144-A147 PolarHBondContact O-N 2.83Å; A147-F149 PolarHBondContact O-N 3.43Å; A147-F150 PolarHBondContact O-N 3.16Å; A147-G151 PolarHBondContact O-N 3.33Å |
| 148 | A | 76.4 | Confident | 72.9 | Confident | 17 Ų | 17 | 47 Ų | 47 | 14% | 0.14 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F126 N129 I144 G145 A146 G151 A152 | F126-A148 HydrophobicContact CD2-CB 4.3Å; F126-A148 WeakPolarHBondContact CD2-O 3.44Å; F126-A148 HydrophobicContact CE2-CB 4.32Å; N129-A148 HydrophobicContact CB-CB 4.02Å; I144-A148 WeakPolarHBondContact O-CB 3.24Å; I144-A148 PolarHBondContact O-N 2.87Å; G145-A148 PolarHBondContact O-N 3.32Å; A146-A148 VanDerWaalsContact C-N 3.34Å; A146-A148 PolarHBondContact O-N 3.43Å; A148-G151 PolarHBondContact O-N 2.99Å; A148-A152 PolarHBondContact O-N 2.98Å |
| 149 | F | 80.7 | Confident | 73.6 | Confident | 137 Ų | 137 | 46 Ų | 46 | 60% | 0.601 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -61 | -48.6 | 176.5 | 175.1 | -96.1 | 0 | 0 | 0 | 112.1 | G145 A146 A147 G151 A152 A153 | G145-F149 PolarHBondContact O-N 2.62Å; A146-F149 WeakPolarHBondContact O-CB 3.18Å; A146-F149 PolarHBondContact O-N 3.35Å; A147-F149 PolarHBondContact O-N 3.43Å; F149-G151 VanDerWaalsContact C-N 3.35Å; F149-G151 PolarHBondContact O-N 3.41Å; F149-A152 PolarHBondContact O-N 2.92Å; F149-A153 WeakPolarHBondContact O-CB 3.35Å; F149-A153 PolarHBondContact O-N 2.97Å |
| 150 | F | 79 | Confident | 74.9 | Confident | 42 Ų | 42 | 42.1 Ų | 42.1 | 18% | 0.184 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.8 | -35.8 | 178.4 | -72.9 | -63.6 | 0 | 0 | 0 | 112.4 | L54 L57 H58 L61 A146 A147 A153 L154 | L54-F150 HydrophobicContact CD2-CD1 3.83Å; L54-F150 HydrophobicContact CD2-CE1 3.95Å; L57-F150 HydrophobicContact CD2-CD1 4.17Å; L57-F150 HydrophobicContact CD2-CD2 4.25Å; L57-F150 HydrophobicContact CD2-CE1 3.58Å; L57-F150 HydrophobicContact CD2-CE2 3.68Å; L57-F150 HydrophobicContact CD2-CG 4.49Å; L57-F150 HydrophobicContact CD2-CZ 3.31Å; L57-F150 HydrophobicContact CG-CD2 4.45Å; L57-F150 HydrophobicContact CG-CE2 4.2Å; L57-F150 HydrophobicContact CG-CZ 4.3Å; H58-F150 HydrophobicContact CB-CB 4.18Å; L61-F150 HydrophobicContact CD1-CD2 3.42Å; L61-F150 VanDerWaalsContact CD1-CD2 3.42Å; L61-F150 HydrophobicContact CD1-CE2 3.65Å; A146-F150 HydrophobicContact CB-CE2 4.46Å; A146-F150 WeakPolarHBondContact O-CD2 3.18Å; A146-F150 PolarHBondContact O-N 3.35Å; A147-F150 PolarHBondContact O-N 3.16Å; F150-A153 PolarHBondContact O-N 2.96Å; F150-L154 WeakPolarHBondContact O-CB 3.27Å; F150-L154 WeakPolarHBondContact O-CG 3.4Å; F150-L154 PolarHBondContact O-N 2.87Å |
| 151 | G | 74.4 | Confident | 75.9 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.1 | -45.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A147 A148 F149 L154 T155 | A147-G151 PolarHBondContact O-N 3.33Å; A148-G151 PolarHBondContact O-N 2.99Å; F149-G151 VanDerWaalsContact C-N 3.35Å; F149-G151 PolarHBondContact O-N 3.41Å; G151-L154 PolarHBondContact O-N 3.48Å; G151-T155 PolarHBondContact O-N 2.79Å; G151-T155 PolarHBondContact O-OG1 3.48Å; G151-T155 VanDerWaalsContact O-OG1 3.13Å |
| 152 | A | 79.4 | Confident | 76.8 | Confident | 28 Ų | 28 | 36 Ų | 36 | 23% | 0.231 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.1 | -41.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | F126 A148 F149 L154 T155 L156 | F126-A152 HydrophobicContact CD2-CB 3.91Å; F126-A152 HydrophobicContact CE2-CB 4.01Å; F126-A152 HydrophobicContact CG-CB 4.41Å; A148-A152 PolarHBondContact O-N 2.98Å; F149-A152 PolarHBondContact O-N 2.92Å; A152-L154 VanDerWaalsContact C-N 3.35Å; A152-L154 PolarHBondContact O-N 2.98Å; A152-T155 WeakPolarHBondContact O-CB 3.13Å; A152-T155 PolarHBondContact O-N 3.5Å; A152-L156 WeakPolarHBondContact O-CG 3.43Å; A152-L156 PolarHBondContact O-N 2.93Å |
| 153 | A | 81.5 | Confident | 77.5 | Confident | 29 Ų | 29 | 39.7 Ų | 39.7 | 24% | 0.24 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.6 | -42.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F149 F150 L156 L157 | F149-A153 WeakPolarHBondContact O-CB 3.35Å; F149-A153 PolarHBondContact O-N 2.97Å; F150-A153 PolarHBondContact O-N 2.96Å; A153-L156 PolarHBondContact O-N 3.45Å; A153-L157 WeakPolarHBondContact O-CB 3.26Å; A153-L157 PolarHBondContact O-N 3.49Å |
| 154 | L | 79.1 | Confident | 78.1 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.2 | -43.6 | 174.8 | -76.3 | 162.8 | 0 | 0 | 0 | 111.5 | L54 H58 Y122 F150 G151 A152 L156 L157 Y158 | L54-L154 HydrophobicContact CB-CD1 4.47Å; L54-L154 HydrophobicContact CB-CD2 3.64Å; L54-L154 HydrophobicContact CB-CG 4.06Å; H58-L154 HydrophobicContact CB-CD1 3.77Å; Y122-L154 HydrophobicContact CD1-CB 3.85Å; Y122-L154 HydrophobicContact CD1-CD1 4.03Å; Y122-L154 HydrophobicContact CD2-CB 4.28Å; Y122-L154 HydrophobicContact CE1-CB 4.01Å; Y122-L154 HydrophobicContact CE1-CD1 3.38Å; Y122-L154 HydrophobicContact CE1-CG 4.26Å; Y122-L154 HydrophobicContact CE2-CB 4.43Å; Y122-L154 HydrophobicContact CG-CB 4.01Å; F150-L154 WeakPolarHBondContact O-CB 3.27Å; F150-L154 WeakPolarHBondContact O-CG 3.4Å; F150-L154 PolarHBondContact O-N 2.87Å; G151-L154 PolarHBondContact O-N 3.48Å; A152-L154 VanDerWaalsContact C-N 3.35Å; A152-L154 PolarHBondContact O-N 2.98Å; L154-L156 VanDerWaalsContact C-N 3.3Å; L154-L156 PolarHBondContact O-N 3.48Å; L154-L157 PolarHBondContact O-N 3.06Å; L154-Y158 HydrophobicContact CB-CD2 4.33Å; L154-Y158 HydrophobicContact CB-CE2 4.24Å; L154-Y158 HydrophobicContact CD2-CE2 3.92Å; L154-Y158 WeakPolarHBondContact O-CD2 3.38Å; L154-Y158 PolarHBondContact O-N 3.49Å |
| 155 | T | 80.5 | Confident | 78.4 | Confident | 24 Ų | 24 | 40.1 Ų | 40.1 | 15% | 0.147 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -55.5 | -45.4 | 174.1 | -61.2 | 0 | 0 | 0 | 0 | 112 | Y122 L123 G151 A152 G159 | Y122-T155 VanDerWaalsContact C-OG1 3.31Å; Y122-T155 WeakPolarHBondContact CB-OG1 3.25Å; L123-T155 HydrophobicContact CB-CG2 4.12Å; L123-T155 PolarHBondContact N-OG1 3.48Å; G151-T155 PolarHBondContact O-N 2.79Å; G151-T155 PolarHBondContact O-OG1 3.48Å; G151-T155 VanDerWaalsContact O-OG1 3.13Å; A152-T155 WeakPolarHBondContact O-CB 3.13Å; A152-T155 PolarHBondContact O-N 3.5Å; T155-G159 PolarHBondContact O-N 3.25Å |
| 156 | L | 82.5 | Confident | 78.7 | Confident | 131 Ų | 131 | 42.7 Ų | 42.7 | 69% | 0.686 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -67.7 | -38.8 | 178.3 | -69 | 174.8 | 0 | 0 | 0 | 112 | A152 A153 L154 G159 A160 | A152-L156 WeakPolarHBondContact O-CG 3.43Å; A152-L156 PolarHBondContact O-N 2.93Å; A153-L156 PolarHBondContact O-N 3.45Å; L154-L156 VanDerWaalsContact C-N 3.3Å; L154-L156 PolarHBondContact O-N 3.48Å; L156-G159 PolarHBondContact O-N 2.9Å; L156-A160 WeakPolarHBondContact O-CB 3.35Å; L156-A160 PolarHBondContact O-N 3.08Å |
| 157 | L | 81.9 | Confident | 78.9 | Confident | 36 Ų | 36 | 44.6 Ų | 44.6 | 19% | 0.188 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68 | -48.6 | -178.3 | -162.6 | 63.1 | 0 | 0 | 0 | 111.4 | L47 A50 E51 L54 A153 L154 G159 A160 G161 | L47-L157 HydrophobicContact CD2-CD1 3.6Å; L47-L157 HydrophobicContact CD2-CG 4.4Å; A50-L157 HydrophobicContact CB-CD2 4.08Å; E51-L157 HydrophobicContact CB-CD2 4.36Å; E51-L157 HydrophobicContact CG-CB 4.49Å; E51-L157 HydrophobicContact CG-CD2 3.49Å; E51-L157 VanDerWaalsContact CG-CD2 3.49Å; E51-L157 HydrophobicContact CG-CG 3.84Å; L54-L157 HydrophobicContact CD1-CD2 3.71Å; A153-L157 WeakPolarHBondContact O-CB 3.26Å; A153-L157 PolarHBondContact O-N 3.49Å; L154-L157 PolarHBondContact O-N 3.06Å; L157-G159 VanDerWaalsContact C-N 3.3Å; L157-G159 PolarHBondContact O-N 3.19Å; L157-A160 PolarHBondContact O-N 3.44Å; L157-G161 PolarHBondContact O-N 2.87Å |
| 158 | Y | 80.3 | Confident | 79 | Confident | 1 Ų | 1 | 48.6 Ų | 48.6 | 0% | 0.004 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.6 | -37 | 172.8 | -72.7 | -64.3 | 0 | 0 | 0 | 111.6 | E51 T87 Y114 N115 A118 Y122 L154 G161 A162 | E51-Y158 HydrophobicContact CB-CE1 4.19Å; E51-Y158 HydrophobicContact CG-CD1 4.26Å; E51-Y158 HydrophobicContact CG-CE1 3.89Å; E51-Y158 WeakPolarHBondContact OE2-CE1 3.41Å; T87-Y158 PolarHBondContact OG1-OH 3.34Å; Y114-Y158 HydrophobicContact CE1-CE1 4.09Å; N115-Y158 WeakPolarHBondContact CB-O 3.26Å; N115-Y158 WeakPolarHBondContact OD1-CD1 3.43Å; A118-Y158 HydrophobicContact CB-CD1 3.75Å; A118-Y158 HydrophobicContact CB-CD2 4.05Å; A118-Y158 HydrophobicContact CB-CE1 4.01Å; A118-Y158 HydrophobicContact CB-CE2 4.33Å; A118-Y158 HydrophobicContact CB-CG 3.77Å; Y122-Y158 AromaticContact CD2-CD2 3.67Å; Y122-Y158 HydrophobicContact CD2-CD2 3.67Å; Y122-Y158 AromaticContact CD2-CE2 3.48Å; Y122-Y158 HydrophobicContact CD2-CE2 3.48Å; Y122-Y158 VanDerWaalsContact CD2-CE2 3.48Å; Y122-Y158 AromaticContact CE2-CD2 3.98Å; Y122-Y158 HydrophobicContact CE2-CD2 3.98Å; Y122-Y158 AromaticContact CE2-CE2 3.27Å; Y122-Y158 HydrophobicContact CE2-CE2 3.27Å; L154-Y158 HydrophobicContact CB-CD2 4.33Å; L154-Y158 HydrophobicContact CB-CE2 4.24Å; L154-Y158 HydrophobicContact CD2-CE2 3.92Å; L154-Y158 WeakPolarHBondContact O-CD2 3.38Å; L154-Y158 PolarHBondContact O-N 3.49Å; Y158-G161 PolarHBondContact O-N 2.97Å; Y158-A162 WeakPolarHBondContact O-CB 3.47Å; Y158-A162 PolarHBondContact O-N 3.31Å |
| 159 | G | 77.1 | Confident | 79 | Confident | 31 Ų | 31 | 52.8 Ų | 52.8 | 32% | 0.32 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | T155 L156 L157 A162 Y163 | T155-G159 PolarHBondContact O-N 3.25Å; L156-G159 PolarHBondContact O-N 2.9Å; L157-G159 VanDerWaalsContact C-N 3.3Å; L157-G159 PolarHBondContact O-N 3.19Å; G159-A162 PolarHBondContact O-N 3.47Å; G159-Y163 PolarHBondContact O-N 2.78Å |
| 160 | A | 81.3 | Confident | 78.8 | Confident | 44 Ų | 44 | 53.5 Ų | 53.5 | 36% | 0.364 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65.3 | -41.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | L156 L157 A162 Y163 L164 | L156-A160 WeakPolarHBondContact O-CB 3.35Å; L156-A160 PolarHBondContact O-N 3.08Å; L157-A160 PolarHBondContact O-N 3.44Å; A160-A162 PolarHBondContact O-N 2.98Å; A160-Y163 PolarHBondContact O-N 3.07Å; A160-L164 WeakPolarHBondContact O-CG 3.33Å; A160-L164 PolarHBondContact O-N 2.77Å |
| 161 | G | 78.8 | Confident | 78.6 | Confident | 5 Ų | 5 | 53.8 Ų | 53.8 | 5% | 0.052 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.3 | -44.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L157 Y158 S165 | L157-G161 PolarHBondContact O-N 2.87Å; Y158-G161 PolarHBondContact O-N 2.97Å; G161-S165 PolarHBondContact O-N 2.7Å; G161-S165 PolarHBondContact O-OG 3.4Å; G161-S165 VanDerWaalsContact O-OG 3.04Å |
| 162 | A | 78.3 | Confident | 78.3 | Confident | 19 Ų | 19 | 58.6 Ų | 58.6 | 16% | 0.157 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.1 | -41.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | N115 Y158 G159 A160 S165 Y166 | N115-A162 HydrophobicContact CB-CB 3.78Å; Y158-A162 WeakPolarHBondContact O-CB 3.47Å; Y158-A162 PolarHBondContact O-N 3.31Å; G159-A162 PolarHBondContact O-N 3.47Å; A160-A162 PolarHBondContact O-N 2.98Å; A162-S165 PolarHBondContact O-N 3.13Å; A162-Y166 WeakPolarHBondContact O-CB 3.36Å; A162-Y166 PolarHBondContact O-N 3.49Å |
| 163 | Y | 77.8 | Confident | 77.3 | Confident | 141 Ų | 141 | 59.6 Ų | 59.6 | 55% | 0.553 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -66.2 | -43.8 | 178.7 | -177.5 | -107.6 | 0 | 0 | 0 | 112.5 | G159 A160 Y166 L167 | G159-Y163 PolarHBondContact O-N 2.78Å; A160-Y163 PolarHBondContact O-N 3.07Å; Y163-Y166 WeakPolarHBondContact O-CB 3.48Å; Y163-Y166 PolarHBondContact O-N 2.7Å; Y163-L167 HydrophobicContact CD1-CD1 4.11Å; Y163-L167 HydrophobicContact CD1-CG 4.47Å; Y163-L167 HydrophobicContact CE1-CD1 3.61Å; Y163-L167 HydrophobicContact CE1-CG 4.11Å; Y163-L167 WeakPolarHBondContact O-CG 3.5Å; Y163-L167 PolarHBondContact O-N 3.16Å |
| 164 | L | 80.6 | Confident | 76 | Confident | 70 Ų | 70 | 60.8 Ų | 60.8 | 37% | 0.366 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 175.6 | -68.9 | 174.1 | 0 | 0 | 0 | 111.1 | V43 L47 A160 Y166 L167 D168 | V43-L164 HydrophobicContact CG1-CD1 4.46Å; L47-L164 HydrophobicContact CD1-CD1 3.65Å; A160-L164 WeakPolarHBondContact O-CG 3.33Å; A160-L164 PolarHBondContact O-N 2.77Å; L164-Y166 VanDerWaalsContact C-N 3.26Å; L164-Y166 PolarHBondContact O-N 3.11Å; L164-L167 WeakPolarHBondContact O-CB 3.47Å; L164-L167 PolarHBondContact O-N 3.25Å; L164-L167 VanDerWaalsContact O-N 3.12Å; L164-D168 PolarHBondContact O-N 3.48Å |
| 165 | S | 76 | Confident | 74.8 | Confident | 14 Ų | 14 | 66 Ų | 66 | 10% | 0.098 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.5 | -32.5 | 174.7 | -59.1 | 0 | 0 | 0 | 0 | 113 | T108 G161 A162 W169 | T108-S165 WeakPolarHBondContact CG2-O 3.48Å; G161-S165 PolarHBondContact O-N 2.7Å; G161-S165 PolarHBondContact O-OG 3.4Å; G161-S165 VanDerWaalsContact O-OG 3.04Å; A162-S165 PolarHBondContact O-N 3.13Å; S165-W169 WeakPolarHBondContact O-CB 3.48Å; S165-W169 PolarHBondContact O-N 3.38Å |
| 166 | Y | 75.2 | Confident | 73.3 | Confident | 95 Ų | 95 | 68 Ų | 68 | 37% | 0.373 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 173.4 | 175.2 | -98.8 | 0 | 0 | 0 | 112.3 | M112 A162 Y163 L164 W169 R170 | M112-Y166 HydrophobicContact SD-CD2 4.15Å; A162-Y166 WeakPolarHBondContact O-CB 3.36Å; A162-Y166 PolarHBondContact O-N 3.49Å; Y163-Y166 WeakPolarHBondContact O-CB 3.48Å; Y163-Y166 PolarHBondContact O-N 2.7Å; L164-Y166 VanDerWaalsContact C-N 3.26Å; L164-Y166 PolarHBondContact O-N 3.11Å; Y166-W169 AromaticContact CD2-CE3 3.92Å; Y166-W169 HydrophobicContact CD2-CE3 3.92Å; Y166-W169 HydrophobicContact CD2-CZ3 4.26Å; Y166-W169 AromaticContact CE2-CE3 3.83Å; Y166-W169 HydrophobicContact CE2-CE3 3.83Å; Y166-W169 AromaticContact CE2-CZ3 3.72Å; Y166-W169 HydrophobicContact CE2-CZ3 3.72Å; Y166-W169 PolarHBondContact O-N 3.26Å; Y166-R170 HydrophobicContact CD1-CG 4.19Å; Y166-R170 HydrophobicContact CE1-CG 3.71Å; Y166-R170 HydrophobicContact CE2-CG 4.07Å; Y166-R170 WeakPolarHBondContact O-CB 3.27Å; Y166-R170 VanDerWaalsContact O-CG 3.3Å; Y166-R170 WeakPolarHBondContact O-CG 3.49Å; Y166-R170 PolarHBondContact O-N 3.42Å |
| 167 | L | 79.9 | Confident | 71.7 | Confident | 71 Ų | 71 | 66 Ų | 66 | 37% | 0.372 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 174.1 | -70.4 | 179.5 | 0 | 0 | 0 | 111.5 | Y163 L164 R170 A171 | Y163-L167 HydrophobicContact CD1-CD1 4.11Å; Y163-L167 HydrophobicContact CD1-CG 4.47Å; Y163-L167 HydrophobicContact CE1-CD1 3.61Å; Y163-L167 HydrophobicContact CE1-CG 4.11Å; Y163-L167 WeakPolarHBondContact O-CG 3.5Å; Y163-L167 PolarHBondContact O-N 3.16Å; L164-L167 WeakPolarHBondContact O-CB 3.47Å; L164-L167 PolarHBondContact O-N 3.25Å; L164-L167 VanDerWaalsContact O-N 3.12Å; L167-R170 PolarHBondContact O-N 2.98Å; L167-A171 WeakPolarHBondContact O-CB 3.45Å; L167-A171 PolarHBondContact O-N 3.35Å |
| 168 | D | 78.3 | Confident | 70 | Confident | 85 Ų | 85 | 69.5 Ų | 69.5 | 46% | 0.455 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.9 | -47.1 | 175.6 | -69.2 | -20.7 | 0 | 0 | 0 | 110.9 | T108 L164 R170 A171 D172 | T108-D168 HydrophobicContact CG2-CB 4.19Å; L164-D168 PolarHBondContact O-N 3.48Å; D168-R170 VanDerWaalsContact C-N 3.31Å; D168-R170 PolarHBondContact O-N 3.19Å; D168-A171 WeakPolarHBondContact O-CB 3.11Å; D168-A171 PolarHBondContact O-N 2.95Å; D168-A171 VanDerWaalsContact O-N 3.15Å; D168-D172 PolarHBondContact O-N 2.89Å |
| 169 | W | 76.3 | Confident | 68.4 | Low | 106 Ų | 106 | 74.4 Ų | 74.4 | 40% | 0.402 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.2 | -39 | 175.3 | 173.9 | 71.8 | 0 | 0 | 0 | 112.9 | T108 S165 Y166 D172 G173 | T108-W169 HydrophobicContact CG2-CB 4.14Å; S165-W169 WeakPolarHBondContact O-CB 3.48Å; S165-W169 PolarHBondContact O-N 3.38Å; Y166-W169 AromaticContact CD2-CE3 3.92Å; Y166-W169 HydrophobicContact CD2-CE3 3.92Å; Y166-W169 HydrophobicContact CD2-CZ3 4.26Å; Y166-W169 AromaticContact CE2-CE3 3.83Å; Y166-W169 HydrophobicContact CE2-CE3 3.83Å; Y166-W169 AromaticContact CE2-CZ3 3.72Å; Y166-W169 HydrophobicContact CE2-CZ3 3.72Å; Y166-W169 PolarHBondContact O-N 3.26Å; W169-D172 PolarHBondContact O-N 3.27Å; W169-G173 PolarHBondContact O-N 3.24Å |
| 170 | R | 77.5 | Confident | 67.1 | Low | 152 Ų | 152 | 78.8 Ų | 78.8 | 57% | 0.574 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -67.6 | -37.3 | 175.1 | -81.5 | -96.9 | -64.3 | -162.8 | 1.3 | 112.3 | Y166 L167 D168 G174 | Y166-R170 HydrophobicContact CD1-CG 4.19Å; Y166-R170 HydrophobicContact CE1-CG 3.71Å; Y166-R170 HydrophobicContact CE2-CG 4.07Å; Y166-R170 WeakPolarHBondContact O-CB 3.27Å; Y166-R170 VanDerWaalsContact O-CG 3.3Å; Y166-R170 WeakPolarHBondContact O-CG 3.49Å; Y166-R170 PolarHBondContact O-N 3.42Å; L167-R170 PolarHBondContact O-N 2.98Å; D168-R170 VanDerWaalsContact C-N 3.31Å; D168-R170 PolarHBondContact O-N 3.19Å; R170-G174 PolarHBondContact O-N 3.03Å |
| 171 | A | 74.2 | Confident | 65.3 | Low | 48 Ų | 48 | 82 Ų | 82 | 40% | 0.397 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | L167 D168 N175 | L167-A171 WeakPolarHBondContact O-CB 3.45Å; L167-A171 PolarHBondContact O-N 3.35Å; D168-A171 WeakPolarHBondContact O-CB 3.11Å; D168-A171 PolarHBondContact O-N 2.95Å; D168-A171 VanDerWaalsContact O-N 3.15Å; A171-N175 WeakPolarHBondContact O-CB 3.47Å; A171-N175 VanDerWaalsContact O-CG 3.25Å; A171-N175 PolarHBondContact O-N 3.4Å; A171-N175 PolarHBondContact O-ND2 2.96Å |
| 172 | D | 68.3 | Low | 63.7 | Low | 100 Ų | 100 | 87.7 Ų | 87.7 | 54% | 0.535 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -71.2 | -41.2 | 177.1 | -66.3 | -21.4 | 0 | 0 | 0 | 111.8 | D168 W169 A176 | D168-D172 PolarHBondContact O-N 2.89Å; W169-D172 PolarHBondContact O-N 3.27Å; D172-A176 PolarHBondContact O-N 3.13Å; D172-A176 VanDerWaalsContact O-N 3.1Å |
| 173 | G | 58.9 | Low | 62.3 | Low | 49 Ų | 49 | 96.4 Ų | 96.4 | 51% | 0.505 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -77.5 | -21.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115 | W169 | W169-G173 PolarHBondContact O-N 3.24Å |
| 174 | G | 52.8 | Low | 61.5 | Low | 54 Ų | 54 | 94.2 Ų | 94.2 | 56% | 0.557 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -81.5 | -22.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | R170 | R170-G174 PolarHBondContact O-N 3.03Å |
| 175 | N | 54.1 | Low | 60.5 | Low | 111 Ų | 111 | 95.5 Ų | 95.5 | 59% | 0.594 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -104.4 | -5.2 | -179.1 | -63.3 | -28.3 | 0 | 0 | 0 | 113.4 | A171 A177 T178 | A171-N175 WeakPolarHBondContact O-CB 3.47Å; A171-N175 VanDerWaalsContact O-CG 3.25Å; A171-N175 PolarHBondContact O-N 3.4Å; A171-N175 PolarHBondContact O-ND2 2.96Å; N175-A177 PolarHBondContact O-N 3.11Å; N175-T178 PolarHBondContact O-N 3.03Å; N175-T178 VanDerWaalsContact O-N 3.11Å; N175-T178 PolarHBondContact O-OG1 3.06Å |
| 176 | A | 50.2 | Low | 59.6 | Low | 65 Ų | 65 | 100 Ų | 100 | 54% | 0.537 | 61% | 0.606 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.2 | -10.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | D172 T178 | D172-A176 PolarHBondContact O-N 3.13Å; D172-A176 VanDerWaalsContact O-N 3.1Å; A176-T178 VanDerWaalsContact C-N 3.31Å |
| 177 | A | 47.3 | Very low | 58.7 | Low | 88 Ų | 88 | 100.3 Ų | 100.3 | 73% | 0.727 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | -2.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | N175 | N175-A177 PolarHBondContact O-N 3.11Š|
| 178 | T | 47.8 | Very low | 57.4 | Low | 111 Ų | 111 | 102.1 Ų | 102.1 | 68% | 0.681 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -115.8 | -0.9 | -172.2 | -24.3 | 0 | 0 | 0 | 0 | 115.2 | N175 A176 | N175-T178 PolarHBondContact O-N 3.03Å; N175-T178 VanDerWaalsContact O-N 3.11Å; N175-T178 PolarHBondContact O-OG1 3.06Å; A176-T178 VanDerWaalsContact C-N 3.31Å |
| 179 | S | 46 | Very low | 56 | Low | 104 Ų | 104 | 103.3 Ų | 103.3 | 73% | 0.727 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.6 | 16.2 | -178.7 | 66.8 | 0 | 0 | 0 | 0 | 115.4 | ||
| 180 | T | 50 | Low | 54.5 | Low | 123 Ų | 123 | 103.1 Ų | 103.1 | 76% | 0.755 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.9 | 14.4 | 175.9 | 52.9 | 0 | 0 | 0 | 0 | 114.7 | P182 | T180-P182 WeakPolarHBondContact O-CD 3.43Š|
| 181 | V | 43.9 | Very low | 52.8 | Low | 112 Ų | 112 | 99.3 Ų | 99.3 | 68% | 0.679 | 67% | 0.672 | S | S | * | * | trans | -106.7 | 103.9 | 170.5 | -169.5 | 0 | 0 | 0 | 0 | 109.7 | T183 | V181-T183 HydrophobicContact CG1-CG2 4.37Š| ||
| 182 | P | 45.1 | Very low | 51 | Low | 124 Ų | 124 | 103.6 Ų | 103.6 | 81% | 0.805 | 70% | 0.695 | S | S | * | * | trans | -70.9 | 125.7 | 161.9 | 6.1 | 9.3 | 0 | 0 | 0 | 108.2 | T180 | T180-P182 WeakPolarHBondContact O-CD 3.43Š| ||
| 183 | T | 47.6 | Very low | 49.4 | Very low | 202 Ų | 202 | 103.9 Ų | 103.9 | 100% | 1.239 | 71% | 0.71 | S | S | * | * | trans | -112.1 | 0 | 160 | 54.5 | 0 | 0 | 0 | 0 | 109.1 | V181 | V181-T183 HydrophobicContact CG1-CG2 4.37Š|
Retrieved 183 of 183 residues in 104.6 ms
(Link to these results)