| 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 | 40 | Very low | 48.1 | Very low | 231 Ų | 231 | 149.8 Ų | 149.8 | 100% | 1.138 | 79% | 0.794 | S | S | * | * | 0 | 109.8 | 0 | -73 | 153.4 | 75.9 | 0 | 0 | 105.1 | |||||
| 2 | D | 40.7 | Very low | 48.6 | Very low | 145 Ų | 145 | 148 Ų | 148 | 78% | 0.775 | 78% | 0.784 | S | S | * | * | cis | -155.1 | 128.7 | 13.3 | -87.3 | -68.7 | 0 | 0 | 0 | 106.5 | ||||
| 3 | S | 45.7 | Very low | 49.1 | Very low | 98 Ų | 98 | 144.3 Ų | 144.3 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | 62.7 | 95.5 | 83.4 | -160.4 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 4 | K | 49.6 | Very low | 49.7 | Very low | 182 Ų | 182 | 145.1 Ų | 145.1 | 79% | 0.791 | 76% | 0.764 | S | S | * | * | trans | 50.1 | 123.3 | 134.2 | -58.5 | -176.8 | 179.3 | -179.8 | 0 | 121 | ||||
| 5 | N | 43.9 | Very low | 49.9 | Very low | 146 Ų | 146 | 142.1 Ų | 142.1 | 78% | 0.781 | 76% | 0.757 | S | S | * | * | -171.2 | 104.9 | 115.2 | -105.4 | -30.1 | 0 | 0 | 0 | 109.9 | |||||
| 6 | V | 49.6 | Very low | 50.6 | Low | 106 Ų | 106 | 139.6 Ų | 139.6 | 64% | 0.642 | 75% | 0.75 | S | S | * | * | 64.6 | 98.7 | 90.7 | -178 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 7 | H | 47.9 | Very low | 50.7 | Low | 197 Ų | 197 | 139.9 Ų | 139.9 | 91% | 0.912 | 75% | 0.746 | S | S | * | * | trans | -144.1 | 128.3 | 142.7 | -88.2 | -62.2 | 0 | 0 | 0 | 110 | ||||
| 8 | S | 54.8 | Low | 50.6 | Low | 101 Ų | 101 | 139.6 Ų | 139.6 | 71% | 0.706 | 75% | 0.75 | S | S | * | * | trans | -49.6 | 148.1 | -162.2 | -64.4 | 0 | 0 | 0 | 0 | 117.6 | L10 | S8-L10 PolarHBondContact O-N 2.94Š| ||
| 9 | P | 51.7 | Low | 50.4 | Low | 107 Ų | 107 | 137.4 Ų | 137.4 | 70% | 0.695 | 74% | 0.742 | S | S | * | * | trans | -68.3 | 120.2 | 156.8 | 30.5 | -29.7 | 0 | 0 | 0 | 108.2 | F11 | P9-F11 PolarHBondContact O-N 3.33Š| ||
| 10 | L | 52.2 | Low | 50.3 | Low | 167 Ų | 167 | 134.3 Ų | 134.3 | 87% | 0.874 | 73% | 0.728 | S | S | * | * | trans | -67.2 | 86.4 | 168.9 | -112.3 | 148.8 | 0 | 0 | 0 | 107.6 | S8 L12 | S8-L10 PolarHBondContact O-N 2.94Å; L10-L12 VanDerWaalsContact C-N 3.3Å; L10-L12 PolarHBondContact O-N 2.94Å | ||
| 11 | F | 52.8 | Low | 50.2 | Low | 168 Ų | 168 | 135.2 Ų | 135.2 | 74% | 0.737 | 73% | 0.727 | S | S | * | * | trans | -55.6 | 99.7 | 159.1 | -108.9 | -82 | 0 | 0 | 0 | 106.7 | P9 V13 | P9-F11 PolarHBondContact O-N 3.33Å; F11-V13 HydrophobicContact CB-CG2 4.04Å; F11-V13 HydrophobicContact CD1-CG2 3.41Å; F11-V13 VanDerWaalsContact CD1-CG2 3.41Å; F11-V13 HydrophobicContact CE1-CG2 4.18Å; F11-V13 HydrophobicContact CG-CG2 4.07Å; F11-V13 PolarHBondContact O-N 2.84Å | ||
| 12 | L | 54.7 | Low | 50.6 | Low | 128 Ų | 128 | 131.6 Ų | 131.6 | 67% | 0.67 | 71% | 0.708 | S | S | * | * | trans | -67.9 | 65.6 | 151.4 | -79 | 161.2 | 0 | 0 | 0 | 106.9 | L10 F14 | L10-L12 VanDerWaalsContact C-N 3.3Å; L10-L12 PolarHBondContact O-N 2.94Å; L12-F14 HydrophobicContact CB-CD2 4.16Å; L12-F14 HydrophobicContact CB-CE2 3.84Å; L12-F14 HydrophobicContact CB-CZ 4.48Å; L12-F14 HydrophobicContact CD1-CE2 4.41Å; L12-F14 HydrophobicContact CD2-CE1 4.37Å; L12-F14 HydrophobicContact CD2-CE2 4.05Å; L12-F14 HydrophobicContact CD2-CZ 3.84Å; L12-F14 HydrophobicContact CG-CE2 4.32Å; L12-F14 PolarHBondContact O-N 2.81Å | ||
| 13 | V | 54.3 | Low | 51.2 | Low | 100 Ų | 100 | 132.8 Ų | 132.8 | 61% | 0.606 | 70% | 0.703 | S | S | * | * | trans | -65.9 | 89.6 | 152.1 | 172.9 | 0 | 0 | 0 | 0 | 103.6 | F11 P15 | F11-V13 HydrophobicContact CB-CG2 4.04Å; F11-V13 HydrophobicContact CD1-CG2 3.41Å; F11-V13 VanDerWaalsContact CD1-CG2 3.41Å; F11-V13 HydrophobicContact CE1-CG2 4.18Å; F11-V13 HydrophobicContact CG-CG2 4.07Å; F11-V13 PolarHBondContact O-N 2.84Å; V13-P15 WeakPolarHBondContact O-CD 3.18Å | ||
| 14 | F | 58.2 | Low | 51.5 | Low | 155 Ų | 155 | 134.5 Ų | 134.5 | 68% | 0.68 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 124.6 | 158.6 | -73.2 | -79.7 | 0 | 0 | 0 | 106.1 | L12 P16 | L12-F14 HydrophobicContact CB-CD2 4.16Å; L12-F14 HydrophobicContact CB-CE2 3.84Å; L12-F14 HydrophobicContact CB-CZ 4.48Å; L12-F14 HydrophobicContact CD1-CE2 4.41Å; L12-F14 HydrophobicContact CD2-CE1 4.37Å; L12-F14 HydrophobicContact CD2-CE2 4.05Å; L12-F14 HydrophobicContact CD2-CZ 3.84Å; L12-F14 HydrophobicContact CG-CE2 4.32Å; L12-F14 PolarHBondContact O-N 2.81Å; F14-P16 VanDerWaalsContact O-CD 3.31Å; F14-P16 WeakPolarHBondContact O-CD 3.31Å; F14-P16 VanDerWaalsContact O-N 3.17Å |
| 15 | P | 52.9 | Low | 51.6 | Low | 101 Ų | 101 | 129.8 Ų | 129.8 | 66% | 0.656 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 123.3 | 172.5 | 23.5 | -30 | 0 | 0 | 0 | 107.4 | V13 | V13-P15 WeakPolarHBondContact O-CD 3.18Š|
| 16 | P | 61.4 | Low | 51.8 | Low | 101 Ų | 101 | 127.2 Ų | 127.2 | 66% | 0.656 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -62.8 | 163.1 | 153.4 | 31.9 | -29.2 | 0 | 0 | 0 | 107 | F14 | F14-P16 VanDerWaalsContact O-CD 3.31Å; F14-P16 WeakPolarHBondContact O-CD 3.31Å; F14-P16 VanDerWaalsContact O-N 3.17Å |
| 17 | E | 51 | Low | 52 | Low | 146 Ų | 146 | 128.6 Ų | 128.6 | 68% | 0.682 | 68% | 0.676 | S | S | * | * | trans | 90.9 | 42.2 | 171.4 | -113.4 | 86.6 | -174.4 | 0 | 0 | 119.1 | ||||
| 18 | V | 49.2 | Very low | 52.2 | Low | 133 Ų | 133 | 125.1 Ų | 125.1 | 81% | 0.806 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -138.1 | 40 | 153.3 | -158.1 | 0 | 0 | 0 | 0 | 112.1 | ||
| 19 | T | 47.6 | Very low | 52 | Low | 99 Ų | 99 | 124.3 Ų | 124.3 | 61% | 0.607 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -119.5 | -8 | 171.5 | 41 | 0 | 0 | 0 | 0 | 113.5 | Y23 | T19-Y23 WeakPolarHBondContact O-CD2 3.29Š|
| 20 | T | 47.8 | Very low | 51.9 | Low | 75 Ų | 75 | 122.1 Ų | 122.1 | 46% | 0.46 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -83.8 | -23 | -172 | 47.6 | 0 | 0 | 0 | 0 | 114.7 | Q24 | T20-Q24 WeakPolarHBondContact O-CB 3.08Å; T20-Q24 WeakPolarHBondContact O-CG 3.47Å; T20-Q24 PolarHBondContact O-N 3.41Å; T20-Q24 VanDerWaalsContact O-N 3.08Å |
| 21 | Q | 47.8 | Very low | 51.9 | Low | 153 Ų | 153 | 118.9 Ų | 118.9 | 72% | 0.715 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -73.4 | -34.5 | -174.8 | -123 | 173.6 | -5 | 0 | 0 | 113.7 | T25 | Q21-T25 WeakPolarHBondContact O-CB 3.48Å; Q21-T25 PolarHBondContact O-N 2.83Å; Q21-T25 PolarHBondContact O-OG1 2.87Å |
| 22 | E | 49.8 | Very low | 51.7 | Low | 156 Ų | 156 | 112.8 Ų | 112.8 | 73% | 0.729 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -77.5 | -35.6 | -178.2 | -161.3 | 170.9 | 165 | 0 | 0 | 112.1 | T26 | E22-T26 VanDerWaalsContact O-CB 3.29Å; E22-T26 WeakPolarHBondContact O-CB 3.35Å; E22-T26 PolarHBondContact O-N 3.43Å; E22-T26 PolarHBondContact O-OG1 2.89Å |
| 23 | Y | 51.3 | Low | 51.6 | Low | 169 Ų | 169 | 115.1 Ų | 115.1 | 66% | 0.663 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -69.4 | -43.3 | 171.1 | -65.9 | -71.8 | 0 | 0 | 0 | 111.7 | T19 T25 T26 E27 | T19-Y23 WeakPolarHBondContact O-CD2 3.29Å; Y23-T25 PolarHBondContact O-N 3.38Å; Y23-T26 PolarHBondContact O-N 2.63Å; Y23-E27 WeakPolarHBondContact O-CB 3.17Å; Y23-E27 WeakPolarHBondContact O-CG 3.13Å; Y23-E27 PolarHBondContact O-N 2.83Å |
| 24 | Q | 52.8 | Low | 51.6 | Low | 135 Ų | 135 | 115.4 Ų | 115.4 | 63% | 0.631 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.3 | -36.5 | 176.8 | -72.4 | -158.7 | -58 | 0 | 0 | 112.4 | T20 L28 | T20-Q24 WeakPolarHBondContact O-CB 3.08Å; T20-Q24 WeakPolarHBondContact O-CG 3.47Å; T20-Q24 PolarHBondContact O-N 3.41Å; T20-Q24 VanDerWaalsContact O-N 3.08Å; Q24-L28 WeakPolarHBondContact O-CB 3.22Å; Q24-L28 PolarHBondContact O-N 3.49Å |
| 25 | T | 50.8 | Low | 51.6 | Low | 83 Ų | 83 | 111.2 Ų | 111.2 | 51% | 0.509 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -70.8 | -37.9 | 177.8 | -56.9 | 0 | 0 | 0 | 0 | 111.3 | Q21 Y23 T29 | Q21-T25 WeakPolarHBondContact O-CB 3.48Å; Q21-T25 PolarHBondContact O-N 2.83Å; Q21-T25 PolarHBondContact O-OG1 2.87Å; Y23-T25 PolarHBondContact O-N 3.38Å; T25-T29 WeakPolarHBondContact O-CB 2.76Å; T25-T29 PolarHBondContact O-N 2.77Å; T25-T29 PolarHBondContact O-OG1 3.02Å |
| 26 | T | 50.1 | Low | 51.9 | Low | 91 Ų | 91 | 112.1 Ų | 112.1 | 56% | 0.558 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -73.5 | -39.8 | 178.1 | -55.1 | 0 | 0 | 0 | 0 | 111.9 | E22 Y23 A30 | E22-T26 VanDerWaalsContact O-CB 3.29Å; E22-T26 WeakPolarHBondContact O-CB 3.35Å; E22-T26 PolarHBondContact O-N 3.43Å; E22-T26 PolarHBondContact O-OG1 2.89Å; Y23-T26 PolarHBondContact O-N 2.63Å; T26-A30 WeakPolarHBondContact O-CB 3.12Å; T26-A30 PolarHBondContact O-N 3.41Å |
| 27 | E | 52.2 | Low | 52.2 | Low | 136 Ų | 136 | 110.9 Ų | 110.9 | 64% | 0.636 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -70.5 | -38.7 | 173.8 | -76.6 | -166.5 | 123.4 | 0 | 0 | 112.5 | Y23 T29 A30 T31 | Y23-E27 WeakPolarHBondContact O-CB 3.17Å; Y23-E27 WeakPolarHBondContact O-CG 3.13Å; Y23-E27 PolarHBondContact O-N 2.83Å; E27-T29 VanDerWaalsContact C-N 3.34Å; E27-A30 PolarHBondContact O-N 3.34Å; E27-T31 VanDerWaalsContact O-CB 3.3Å; E27-T31 WeakPolarHBondContact O-CB 3.3Å; E27-T31 WeakPolarHBondContact O-CG2 3.38Å; E27-T31 PolarHBondContact O-N 3.4Å; E27-T31 PolarHBondContact O-OG1 3.12Å |
| 28 | L | 53.7 | Low | 53 | Low | 123 Ų | 123 | 112.6 Ų | 112.6 | 64% | 0.644 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -72.1 | -31 | 177.6 | -158.2 | 144.5 | 0 | 0 | 0 | 111.2 | Q24 T31 A32 | Q24-L28 WeakPolarHBondContact O-CB 3.22Å; Q24-L28 PolarHBondContact O-N 3.49Å; L28-T31 WeakPolarHBondContact CA-OG1 3.05Å; L28-T31 PolarHBondContact O-OG1 2.91Å; L28-A32 WeakPolarHBondContact O-CB 3.24Å; L28-A32 PolarHBondContact O-N 2.8Å |
| 29 | T | 50.1 | Low | 54.2 | Low | 85 Ų | 85 | 110.2 Ų | 110.2 | 52% | 0.521 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -74.4 | -39.1 | 170.6 | -56.2 | 0 | 0 | 0 | 0 | 111.7 | T25 E27 A32 Y33 | T25-T29 WeakPolarHBondContact O-CB 2.76Å; T25-T29 PolarHBondContact O-N 2.77Å; T25-T29 PolarHBondContact O-OG1 3.02Å; E27-T29 VanDerWaalsContact C-N 3.34Å; T29-A32 PolarHBondContact O-N 2.9Å; T29-Y33 WeakPolarHBondContact O-CB 3.39Å; T29-Y33 PolarHBondContact O-N 2.66Å |
| 30 | A | 50 | Low | 55.6 | Low | 61 Ų | 61 | 110.4 Ų | 110.4 | 50% | 0.504 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.5 | -37.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | T26 E27 | T26-A30 WeakPolarHBondContact O-CB 3.12Å; T26-A30 PolarHBondContact O-N 3.41Å; E27-A30 PolarHBondContact O-N 3.34Å |
| 31 | T | 50.7 | Low | 57 | Low | 98 Ų | 98 | 113.1 Ų | 113.1 | 60% | 0.601 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -79.9 | -19.6 | 175 | 52.2 | 0 | 0 | 0 | 0 | 113.5 | E27 L28 P35 | E27-T31 VanDerWaalsContact O-CB 3.3Å; E27-T31 WeakPolarHBondContact O-CB 3.3Å; E27-T31 WeakPolarHBondContact O-CG2 3.38Å; E27-T31 PolarHBondContact O-N 3.4Å; E27-T31 PolarHBondContact O-OG1 3.12Å; L28-T31 WeakPolarHBondContact CA-OG1 3.05Å; L28-T31 PolarHBondContact O-OG1 2.91Å; T31-P35 WeakPolarHBondContact O-CD 3.19Å; T31-P35 WeakPolarHBondContact O-CG 3.36Å |
| 32 | A | 50.1 | Low | 58.6 | Low | 41 Ų | 41 | 110 Ų | 110 | 34% | 0.339 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -84.9 | -32.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L28 T29 N34 P35 Q36 | L28-A32 WeakPolarHBondContact O-CB 3.24Å; L28-A32 PolarHBondContact O-N 2.8Å; T29-A32 PolarHBondContact O-N 2.9Å; A32-N34 VanDerWaalsContact C-N 3.31Å; A32-N34 PolarHBondContact O-N 2.62Å; A32-P35 VanDerWaalsContact O-CD 3.24Å; A32-P35 WeakPolarHBondContact O-CD 3.41Å; A32-P35 WeakPolarHBondContact O-CG 2.95Å; A32-Q36 VanDerWaalsContact O-CB 3.3Å; A32-Q36 WeakPolarHBondContact O-CB 3.24Å; A32-Q36 PolarHBondContact O-N 3.39Å; A32-Q36 VanDerWaalsContact O-N 3.14Å |
| 33 | Y | 51.2 | Low | 59.9 | Low | 177 Ų | 177 | 107 Ų | 107 | 69% | 0.694 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.8 | -35.9 | 178 | -174 | -102.8 | 0 | 0 | 0 | 112.6 | T29 N37 | T29-Y33 WeakPolarHBondContact O-CB 3.39Å; T29-Y33 PolarHBondContact O-N 2.66Å; Y33-N37 PolarHBondContact O-N 3.41Å; Y33-N37 VanDerWaalsContact O-N 3.12Å |
| 34 | N | 55.2 | Low | 61.3 | Low | 105 Ų | 105 | 104.2 Ų | 104.2 | 56% | 0.561 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.2 | -50.7 | 179.6 | -162.6 | -15.7 | 0 | 0 | 0 | 114.2 | A32 N37 R38 | A32-N34 VanDerWaalsContact C-N 3.31Å; A32-N34 PolarHBondContact O-N 2.62Å; N34-N37 PolarHBondContact O-N 2.85Å; N34-R38 PolarHBondContact O-N 3.08Å |
| 35 | P | 56.8 | Low | 62.5 | Low | 67 Ų | 67 | 105.7 Ų | 105.7 | 44% | 0.435 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.5 | -33.6 | 175.5 | 26 | -33.2 | 0 | 0 | 0 | 112.3 | T31 A32 N37 R38 V39 | T31-P35 WeakPolarHBondContact O-CD 3.19Å; T31-P35 WeakPolarHBondContact O-CG 3.36Å; A32-P35 VanDerWaalsContact O-CD 3.24Å; A32-P35 WeakPolarHBondContact O-CD 3.41Å; A32-P35 WeakPolarHBondContact O-CG 2.95Å; P35-N37 VanDerWaalsContact C-N 3.35Å; P35-N37 PolarHBondContact O-N 3.2Å; P35-R38 PolarHBondContact O-N 3.07Å; P35-V39 WeakPolarHBondContact O-CG2 3.33Å; P35-V39 PolarHBondContact O-N 3.44Å |
| 36 | Q | 60.3 | Low | 63.7 | Low | 121 Ų | 121 | 108 Ų | 108 | 57% | 0.565 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.4 | -43.1 | 175.5 | -155.7 | 104.9 | 5.2 | 0 | 0 | 111.1 | A32 R38 Q40 | A32-Q36 VanDerWaalsContact O-CB 3.3Å; A32-Q36 WeakPolarHBondContact O-CB 3.24Å; A32-Q36 PolarHBondContact O-N 3.39Å; A32-Q36 VanDerWaalsContact O-N 3.14Å; Q36-R38 VanDerWaalsContact C-N 3.29Å; Q36-R38 PolarHBondContact O-N 3.15Å; Q36-Q40 HydrophobicContact CG-CG 4.49Å; Q36-Q40 WeakPolarHBondContact O-CB 3.14Å; Q36-Q40 WeakPolarHBondContact O-CG 3.21Å; Q36-Q40 PolarHBondContact O-N 2.88Å |
| 37 | N | 67.1 | Low | 65.2 | Low | 75 Ų | 75 | 109.4 Ų | 109.4 | 40% | 0.401 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.5 | -39.1 | 176.6 | 103.5 | 29.5 | 0 | 0 | 0 | 111.5 | Y33 N34 P35 K41 | Y33-N37 PolarHBondContact O-N 3.41Å; Y33-N37 VanDerWaalsContact O-N 3.12Å; N34-N37 PolarHBondContact O-N 2.85Å; P35-N37 VanDerWaalsContact C-N 3.35Å; P35-N37 PolarHBondContact O-N 3.2Å; N37-K41 WeakPolarHBondContact O-CB 3.33Å; N37-K41 PolarHBondContact O-N 3.44Å |
| 38 | R | 69.2 | Low | 66.7 | Low | 181 Ų | 181 | 109.2 Ų | 109.2 | 68% | 0.683 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.9 | -44 | -174.8 | -170.4 | 177 | -179.8 | -174.3 | 0.2 | 110.6 | N34 P35 Q36 K41 I42 | N34-R38 PolarHBondContact O-N 3.08Å; P35-R38 PolarHBondContact O-N 3.07Å; Q36-R38 VanDerWaalsContact C-N 3.29Å; Q36-R38 PolarHBondContact O-N 3.15Å; R38-K41 PolarHBondContact O-N 2.89Å; R38-I42 HydrophobicContact CG-CD1 4.36Å; R38-I42 WeakPolarHBondContact O-CD1 3.34Å; R38-I42 VanDerWaalsContact O-CG1 3.24Å; R38-I42 WeakPolarHBondContact O-CG1 3.3Å; R38-I42 PolarHBondContact O-N 3.2Å; R38-I42 VanDerWaalsContact O-N 3.07Å |
| 39 | V | 73.9 | Confident | 68.2 | Low | 83 Ų | 83 | 108.5 Ų | 108.5 | 50% | 0.503 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.9 | -42.8 | 177.2 | 178.9 | 0 | 0 | 0 | 0 | 110.5 | P35 K41 I42 I43 | P35-V39 WeakPolarHBondContact O-CG2 3.33Å; P35-V39 PolarHBondContact O-N 3.44Å; V39-K41 PolarHBondContact O-N 3Å; V39-I42 PolarHBondContact O-N 3.47Å; V39-I43 HydrophobicContact CG1-CD1 3.83Å; V39-I43 HydrophobicContact CG1-CG1 4.39Å; V39-I43 VanDerWaalsContact O-CG1 3.28Å; V39-I43 WeakPolarHBondContact O-CG1 3.45Å; V39-I43 PolarHBondContact O-N 3.19Å |
| 40 | Q | 76.3 | Confident | 70 | Confident | 103 Ų | 103 | 109.7 Ų | 109.7 | 48% | 0.481 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 174.2 | -75.9 | 177 | -10.2 | 0 | 0 | 112.1 | Q36 I42 I43 I44 | Q36-Q40 HydrophobicContact CG-CG 4.49Å; Q36-Q40 WeakPolarHBondContact O-CB 3.14Å; Q36-Q40 WeakPolarHBondContact O-CG 3.21Å; Q36-Q40 PolarHBondContact O-N 2.88Å; Q40-I42 VanDerWaalsContact C-N 3.29Å; Q40-I42 PolarHBondContact O-N 3.14Å; Q40-I43 PolarHBondContact O-N 3.13Å; Q40-I44 WeakPolarHBondContact O-CB 3.38Å; Q40-I44 VanDerWaalsContact O-CG1 3.23Å; Q40-I44 WeakPolarHBondContact O-CG1 3.36Å; Q40-I44 PolarHBondContact O-N 2.91Å |
| 41 | K | 78 | Confident | 71.8 | Confident | 133 Ų | 133 | 108.2 Ų | 108.2 | 58% | 0.578 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.9 | -34.7 | 177.3 | -162.7 | 172 | -170.9 | 176.7 | 0 | 112.4 | N37 R38 V39 R45 | N37-K41 WeakPolarHBondContact O-CB 3.33Å; N37-K41 PolarHBondContact O-N 3.44Å; R38-K41 PolarHBondContact O-N 2.89Å; V39-K41 PolarHBondContact O-N 3Å; K41-R45 PolarHBondContact O-N 3.37Å; K41-R45 VanDerWaalsContact O-N 3.15Å |
| 42 | I | 80.2 | Confident | 73.7 | Confident | 86 Ų | 86 | 107.9 Ų | 107.9 | 44% | 0.441 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69.3 | -43.9 | 172.8 | -67.5 | 162.7 | 0 | 0 | 0 | 110.7 | R38 V39 Q40 R45 K46 | R38-I42 HydrophobicContact CG-CD1 4.36Å; R38-I42 WeakPolarHBondContact O-CD1 3.34Å; R38-I42 VanDerWaalsContact O-CG1 3.24Å; R38-I42 WeakPolarHBondContact O-CG1 3.3Å; R38-I42 PolarHBondContact O-N 3.2Å; R38-I42 VanDerWaalsContact O-N 3.07Å; V39-I42 PolarHBondContact O-N 3.47Å; Q40-I42 VanDerWaalsContact C-N 3.29Å; Q40-I42 PolarHBondContact O-N 3.14Å; I42-R45 PolarHBondContact O-N 3.41Å; I42-K46 HydrophobicContact CG2-CD 4.32Å; I42-K46 WeakPolarHBondContact O-CB 3.23Å; I42-K46 WeakPolarHBondContact O-CG 3.43Å; I42-K46 PolarHBondContact O-N 2.92Å |
| 43 | I | 78.4 | Confident | 75.5 | Confident | 93 Ų | 93 | 109.7 Ų | 109.7 | 48% | 0.477 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.1 | -45.8 | 178.1 | -68.7 | 168 | 0 | 0 | 0 | 110.4 | V39 Q40 R45 K46 L47 | V39-I43 HydrophobicContact CG1-CD1 3.83Å; V39-I43 HydrophobicContact CG1-CG1 4.39Å; V39-I43 VanDerWaalsContact O-CG1 3.28Å; V39-I43 WeakPolarHBondContact O-CG1 3.45Å; V39-I43 PolarHBondContact O-N 3.19Å; Q40-I43 PolarHBondContact O-N 3.13Å; I43-R45 PolarHBondContact O-N 3.18Å; I43-K46 PolarHBondContact O-N 3.19Å; I43-L47 WeakPolarHBondContact O-CB 3.27Å; I43-L47 PolarHBondContact O-N 3.45Å |
| 44 | I | 79.8 | Confident | 77.1 | Confident | 111 Ų | 111 | 107.7 Ų | 107.7 | 57% | 0.569 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.4 | -47.6 | 178.5 | -69.8 | 163.7 | 0 | 0 | 0 | 110.7 | Q40 K46 L47 E48 | Q40-I44 WeakPolarHBondContact O-CB 3.38Å; Q40-I44 VanDerWaalsContact O-CG1 3.23Å; Q40-I44 WeakPolarHBondContact O-CG1 3.36Å; Q40-I44 PolarHBondContact O-N 2.91Å; I44-K46 VanDerWaalsContact C-N 3.33Å; I44-K46 PolarHBondContact O-N 3.49Å; I44-L47 PolarHBondContact O-N 3.41Å; I44-E48 WeakPolarHBondContact O-CB 3.28Å; I44-E48 PolarHBondContact O-N 3.46Å |
| 45 | R | 78.5 | Confident | 78.7 | Confident | 166 Ų | 166 | 108.1 Ų | 108.1 | 63% | 0.626 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -59 | -43.1 | 174.3 | -90.4 | -177.3 | 173.2 | 166.5 | -2.9 | 112.6 | K41 I42 I43 E48 I49 | K41-R45 PolarHBondContact O-N 3.37Å; K41-R45 VanDerWaalsContact O-N 3.15Å; I42-R45 PolarHBondContact O-N 3.41Å; I43-R45 PolarHBondContact O-N 3.18Å; R45-E48 PolarHBondContact O-N 2.81Å; R45-I49 WeakPolarHBondContact O-CD1 3.35Å; R45-I49 VanDerWaalsContact O-CG1 3.27Å; R45-I49 WeakPolarHBondContact O-CG1 3.39Å; R45-I49 PolarHBondContact O-N 3.18Å; R45-I49 VanDerWaalsContact O-N 3.13Å |
| 46 | K | 76.4 | Confident | 80.3 | Confident | 131 Ų | 131 | 110.6 Ų | 110.6 | 57% | 0.57 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.9 | -44.7 | 176.3 | -78.3 | -172.7 | 165.4 | -158.8 | 0 | 110.8 | I42 I43 I44 E48 I49 L50 | I42-K46 HydrophobicContact CG2-CD 4.32Å; I42-K46 WeakPolarHBondContact O-CB 3.23Å; I42-K46 WeakPolarHBondContact O-CG 3.43Å; I42-K46 PolarHBondContact O-N 2.92Å; I43-K46 PolarHBondContact O-N 3.19Å; I44-K46 VanDerWaalsContact C-N 3.33Å; I44-K46 PolarHBondContact O-N 3.49Å; K46-E48 VanDerWaalsContact C-N 3.3Å; K46-E48 PolarHBondContact O-N 2.78Å; K46-I49 PolarHBondContact O-N 2.86Å; K46-L50 HydrophobicContact CB-CD1 4.24Å; K46-L50 WeakPolarHBondContact O-CB 3.33Å; K46-L50 WeakPolarHBondContact O-CD1 3.42Å; K46-L50 PolarHBondContact O-N 3.42Å |
| 47 | L | 81.3 | Confident | 81.6 | Confident | 121 Ų | 121 | 109.4 Ų | 109.4 | 63% | 0.634 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63 | -37 | 179.9 | -145.2 | 74.3 | 0 | 0 | 0 | 111.9 | I43 I44 L50 G51 | I43-L47 WeakPolarHBondContact O-CB 3.27Å; I43-L47 PolarHBondContact O-N 3.45Å; I44-L47 PolarHBondContact O-N 3.41Å; L47-L50 PolarHBondContact O-N 3.49Å; L47-G51 PolarHBondContact O-N 3.45Å |
| 48 | E | 83.7 | Confident | 82.6 | Confident | 132 Ų | 132 | 107.8 Ų | 107.8 | 62% | 0.617 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.3 | -43.9 | 173.8 | -169.8 | -179.4 | 175.9 | 0 | 0 | 111.9 | I44 R45 K46 T52 | I44-E48 WeakPolarHBondContact O-CB 3.28Å; I44-E48 PolarHBondContact O-N 3.46Å; R45-E48 PolarHBondContact O-N 2.81Å; K46-E48 VanDerWaalsContact C-N 3.3Å; K46-E48 PolarHBondContact O-N 2.78Å; E48-T52 WeakPolarHBondContact O-CB 3.38Å; E48-T52 PolarHBondContact O-N 2.78Å; E48-T52 PolarHBondContact O-OG1 2.81Å |
| 49 | I | 85.9 | Confident | 83.5 | Confident | 109 Ų | 109 | 104 Ų | 104 | 56% | 0.559 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.3 | -42.6 | 175.7 | -64 | 161.2 | 0 | 0 | 0 | 110.9 | R45 K46 T52 T53 | R45-I49 WeakPolarHBondContact O-CD1 3.35Å; R45-I49 VanDerWaalsContact O-CG1 3.27Å; R45-I49 WeakPolarHBondContact O-CG1 3.39Å; R45-I49 PolarHBondContact O-N 3.18Å; R45-I49 VanDerWaalsContact O-N 3.13Å; K46-I49 PolarHBondContact O-N 2.86Å; I49-T52 PolarHBondContact O-N 3.47Å; I49-T53 WeakPolarHBondContact O-CB 3.44Å; I49-T53 PolarHBondContact O-N 2.72Å; I49-T53 PolarHBondContact O-OG1 2.99Å |
| 50 | L | 87.5 | Confident | 84.1 | Confident | 110 Ų | 110 | 104.1 Ų | 104.1 | 58% | 0.576 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.4 | -44.1 | 177.2 | -88.9 | 130.6 | 0 | 0 | 0 | 111.4 | K46 L47 T53 Q54 | K46-L50 HydrophobicContact CB-CD1 4.24Å; K46-L50 WeakPolarHBondContact O-CB 3.33Å; K46-L50 WeakPolarHBondContact O-CD1 3.42Å; K46-L50 PolarHBondContact O-N 3.42Å; L47-L50 PolarHBondContact O-N 3.49Å; L50-T53 PolarHBondContact O-N 3.43Å; L50-Q54 VanDerWaalsContact O-CB 3.29Å; L50-Q54 WeakPolarHBondContact O-CB 3.45Å; L50-Q54 PolarHBondContact O-N 2.94Å |
| 51 | G | 87.5 | Confident | 84.3 | Confident | 29 Ų | 29 | 102.6 Ų | 102.6 | 30% | 0.299 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.7 | -45.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L47 T53 Q54 I55 | L47-G51 PolarHBondContact O-N 3.45Å; G51-T53 VanDerWaalsContact C-N 3.34Å; G51-T53 PolarHBondContact O-N 2.82Å; G51-Q54 PolarHBondContact O-N 2.9Å; G51-I55 WeakPolarHBondContact O-CG1 3.34Å; G51-I55 PolarHBondContact O-N 3.41Å |
| 52 | T | 90.5 | Very high | 84.5 | Confident | 91 Ų | 91 | 103.4 Ų | 103.4 | 56% | 0.558 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.7 | -44.3 | 176.1 | -56.3 | 0 | 0 | 0 | 0 | 111.4 | E48 I49 Q54 I55 L56 | E48-T52 WeakPolarHBondContact O-CB 3.38Å; E48-T52 PolarHBondContact O-N 2.78Å; E48-T52 PolarHBondContact O-OG1 2.81Å; I49-T52 PolarHBondContact O-N 3.47Å; T52-Q54 PolarHBondContact O-N 2.98Å; T52-I55 PolarHBondContact O-N 3.26Å; T52-L56 WeakPolarHBondContact O-CB 3.16Å; T52-L56 PolarHBondContact O-N 3.03Å |
| 53 | T | 87.7 | Confident | 84.4 | Confident | 80 Ų | 80 | 101.8 Ų | 101.8 | 49% | 0.491 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 177.9 | -55.5 | 0 | 0 | 0 | 0 | 111.5 | I49 L50 G51 L56 F57 | I49-T53 WeakPolarHBondContact O-CB 3.44Å; I49-T53 PolarHBondContact O-N 2.72Å; I49-T53 PolarHBondContact O-OG1 2.99Å; L50-T53 PolarHBondContact O-N 3.43Å; G51-T53 VanDerWaalsContact C-N 3.34Å; G51-T53 PolarHBondContact O-N 2.82Å; T53-L56 PolarHBondContact O-N 2.85Å; T53-F57 VanDerWaalsContact O-CB 3.31Å; T53-F57 WeakPolarHBondContact O-CB 3.47Å; T53-F57 PolarHBondContact O-N 2.94Å |
| 54 | Q | 85.5 | Confident | 84.3 | Confident | 134 Ų | 134 | 104.1 Ų | 104.1 | 63% | 0.626 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.8 | -38.9 | 179.5 | -168.3 | 172.4 | 3.9 | 0 | 0 | 112.1 | L50 G51 T52 F57 G58 | L50-Q54 VanDerWaalsContact O-CB 3.29Å; L50-Q54 WeakPolarHBondContact O-CB 3.45Å; L50-Q54 PolarHBondContact O-N 2.94Å; G51-Q54 PolarHBondContact O-N 2.9Å; T52-Q54 PolarHBondContact O-N 2.98Å; Q54-F57 PolarHBondContact O-N 2.93Å; Q54-G58 PolarHBondContact O-N 3.4Å |
| 55 | I | 89.2 | Confident | 84.1 | Confident | 115 Ų | 115 | 100.7 Ų | 100.7 | 59% | 0.59 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.9 | -46.3 | 174.1 | -66 | 162.8 | 0 | 0 | 0 | 110.6 | G51 T52 F57 G58 I59 | G51-I55 WeakPolarHBondContact O-CG1 3.34Å; G51-I55 PolarHBondContact O-N 3.41Å; T52-I55 PolarHBondContact O-N 3.26Å; I55-F57 VanDerWaalsContact C-N 3.28Å; I55-F57 PolarHBondContact O-N 2.89Å; I55-G58 WeakPolarHBondContact O-CA 3.34Å; I55-G58 PolarHBondContact O-N 3.38Å; I55-G58 VanDerWaalsContact O-N 3.08Å; I55-I59 HydrophobicContact CG2-CD1 3.98Å; I55-I59 WeakPolarHBondContact O-CG1 3.29Å; I55-I59 PolarHBondContact O-N 3.5Å |
| 56 | L | 89.7 | Confident | 84 | Confident | 118 Ų | 118 | 95.4 Ų | 95.4 | 62% | 0.618 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.7 | -42.2 | 176.4 | -177.4 | 63.1 | 0 | 0 | 0 | 111.4 | T52 T53 G58 I59 M60 | T52-L56 WeakPolarHBondContact O-CB 3.16Å; T52-L56 PolarHBondContact O-N 3.03Å; T53-L56 PolarHBondContact O-N 2.85Å; L56-G58 VanDerWaalsContact C-N 3.34Å; L56-I59 PolarHBondContact O-N 3.36Å; L56-M60 WeakPolarHBondContact O-CB 3.31Å; L56-M60 PolarHBondContact O-N 3.08Å |
| 57 | F | 87.1 | Confident | 83.8 | Confident | 97 Ų | 97 | 94.1 Ų | 94.1 | 43% | 0.425 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.3 | -40.2 | 175.3 | -155.9 | -101.6 | 0 | 0 | 0 | 111.4 | T53 Q54 I55 M60 N61 | T53-F57 VanDerWaalsContact O-CB 3.31Å; T53-F57 WeakPolarHBondContact O-CB 3.47Å; T53-F57 PolarHBondContact O-N 2.94Å; Q54-F57 PolarHBondContact O-N 2.93Å; I55-F57 VanDerWaalsContact C-N 3.28Å; I55-F57 PolarHBondContact O-N 2.89Å; F57-M60 HydrophobicContact CD2-CE 3.49Å; F57-M60 VanDerWaalsContact CD2-CE 3.49Å; F57-M60 HydrophobicContact CE2-CE 3.49Å; F57-M60 VanDerWaalsContact CE2-CE 3.49Å; F57-M60 HydrophobicContact CG-CE 4.34Å; F57-M60 HydrophobicContact CZ-CE 4.34Å; F57-M60 PolarHBondContact O-N 3.4Å; F57-N61 WeakPolarHBondContact CD1-ND2 3.45Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.3Å; F57-N61 WeakPolarHBondContact O-CB 3.36Å; F57-N61 PolarHBondContact O-N 3.01Å; F57-N61 PolarHBondContact O-ND2 3.47Å |
| 58 | G | 88.2 | Confident | 83.1 | Confident | 40 Ų | 40 | 92.7 Ų | 92.7 | 41% | 0.412 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.3 | -48.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q54 I55 L56 N61 F62 | Q54-G58 PolarHBondContact O-N 3.4Å; I55-G58 WeakPolarHBondContact O-CA 3.34Å; I55-G58 PolarHBondContact O-N 3.38Å; I55-G58 VanDerWaalsContact O-N 3.08Å; L56-G58 VanDerWaalsContact C-N 3.34Å; G58-N61 PolarHBondContact O-N 2.76Å; G58-F62 VanDerWaalsContact O-CB 3.3Å; G58-F62 WeakPolarHBondContact O-CB 3.11Å; G58-F62 PolarHBondContact O-N 3.33Å |
| 59 | I | 88.5 | Confident | 82.3 | Confident | 101 Ų | 101 | 92 Ų | 92 | 52% | 0.518 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.5 | -40.5 | 179.1 | -64.3 | 166.9 | 0 | 0 | 0 | 111.1 | I55 L56 F62 S63 | I55-I59 HydrophobicContact CG2-CD1 3.98Å; I55-I59 WeakPolarHBondContact O-CG1 3.29Å; I55-I59 PolarHBondContact O-N 3.5Å; L56-I59 PolarHBondContact O-N 3.36Å; I59-F62 PolarHBondContact O-N 2.91Å; I59-S63 WeakPolarHBondContact O-CB 3.11Å; I59-S63 PolarHBondContact O-N 3.44Å; I59-S63 PolarHBondContact O-OG 3.39Å |
| 60 | M | 86.8 | Confident | 81.1 | Confident | 86 Ų | 86 | 94.1 Ų | 94.1 | 42% | 0.424 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.9 | -50 | 176 | -176 | 175.8 | 70.1 | 0 | 0 | 110.9 | L56 F57 F62 S63 F64 | L56-M60 WeakPolarHBondContact O-CB 3.31Å; L56-M60 PolarHBondContact O-N 3.08Å; F57-M60 HydrophobicContact CD2-CE 3.49Å; F57-M60 VanDerWaalsContact CD2-CE 3.49Å; F57-M60 HydrophobicContact CE2-CE 3.49Å; F57-M60 VanDerWaalsContact CE2-CE 3.49Å; F57-M60 HydrophobicContact CG-CE 4.34Å; F57-M60 HydrophobicContact CZ-CE 4.34Å; F57-M60 PolarHBondContact O-N 3.4Å; M60-F62 PolarHBondContact O-N 3.49Å; M60-S63 PolarHBondContact O-N 2.87Å; M60-F64 HydrophobicContact CG-CD2 4.05Å; M60-F64 HydrophobicContact CG-CE2 4.04Å; M60-F64 VanDerWaalsContact O-CD2 3.3Å; M60-F64 WeakPolarHBondContact O-CD2 3.3Å; M60-F64 PolarHBondContact O-N 2.94Å |
| 61 | N | 78.9 | Confident | 79.7 | Confident | 72 Ų | 72 | 93.3 Ų | 93.3 | 39% | 0.385 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.3 | -39 | 178.7 | -78.9 | -88.6 | 0 | 0 | 0 | 112.4 | F57 G58 F64 G65 | F57-N61 WeakPolarHBondContact CD1-ND2 3.45Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.3Å; F57-N61 WeakPolarHBondContact O-CB 3.36Å; F57-N61 PolarHBondContact O-N 3.01Å; F57-N61 PolarHBondContact O-ND2 3.47Å; G58-N61 PolarHBondContact O-N 2.76Å; N61-F64 PolarHBondContact O-N 3.43Å; N61-G65 PolarHBondContact O-N 2.9Å |
| 62 | F | 82.4 | Confident | 78.3 | Confident | 149 Ų | 149 | 95.6 Ų | 95.6 | 65% | 0.654 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.8 | -45.2 | 175.1 | -178.1 | -101.7 | 0 | 0 | 0 | 111.6 | G58 I59 M60 F64 G65 V66 | G58-F62 VanDerWaalsContact O-CB 3.3Å; G58-F62 WeakPolarHBondContact O-CB 3.11Å; G58-F62 PolarHBondContact O-N 3.33Å; I59-F62 PolarHBondContact O-N 2.91Å; M60-F62 PolarHBondContact O-N 3.49Å; F62-F64 PolarHBondContact O-N 2.75Å; F62-G65 PolarHBondContact O-N 2.9Å; F62-G65 VanDerWaalsContact O-N 3.12Å; F62-V66 HydrophobicContact CD1-CG2 4.28Å; F62-V66 HydrophobicContact CE1-CG2 3.91Å; F62-V66 HydrophobicContact CZ-CG2 4.03Å; F62-V66 WeakPolarHBondContact O-CG2 3.28Å; F62-V66 PolarHBondContact O-N 3.49Å |
| 63 | S | 79.9 | Confident | 76.4 | Confident | 52 Ų | 52 | 96.4 Ų | 96.4 | 36% | 0.364 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 177.7 | -56.9 | 0 | 0 | 0 | 0 | 111.6 | I59 M60 G65 V66 I67 | I59-S63 WeakPolarHBondContact O-CB 3.11Å; I59-S63 PolarHBondContact O-N 3.44Å; I59-S63 PolarHBondContact O-OG 3.39Å; M60-S63 PolarHBondContact O-N 2.87Å; S63-G65 VanDerWaalsContact C-N 3.32Å; S63-G65 PolarHBondContact O-N 3.42Å; S63-V66 PolarHBondContact O-N 2.98Å; S63-I67 VanDerWaalsContact O-CG1 3.28Å; S63-I67 WeakPolarHBondContact O-CG1 3.49Å; S63-I67 PolarHBondContact O-N 3.48Å |
| 64 | F | 75.8 | Confident | 74.8 | Confident | 143 Ų | 143 | 98.6 Ų | 98.6 | 63% | 0.627 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.6 | -40.6 | 172.7 | -90.5 | -74.2 | 0 | 0 | 0 | 112.2 | M60 N61 F62 I67 F68 | M60-F64 HydrophobicContact CG-CD2 4.05Å; M60-F64 HydrophobicContact CG-CE2 4.04Å; M60-F64 VanDerWaalsContact O-CD2 3.3Å; M60-F64 WeakPolarHBondContact O-CD2 3.3Å; M60-F64 PolarHBondContact O-N 2.94Å; N61-F64 PolarHBondContact O-N 3.43Å; F62-F64 PolarHBondContact O-N 2.75Å; F64-I67 PolarHBondContact O-N 2.87Å; F64-F68 WeakPolarHBondContact O-CB 3.26Å; F64-F68 PolarHBondContact O-N 3.46Å |
| 65 | G | 75.6 | Confident | 73.1 | Confident | 39 Ų | 39 | 97.1 Ų | 97.1 | 40% | 0.402 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -40.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | N61 F62 S63 F68 L69 | N61-G65 PolarHBondContact O-N 2.9Å; F62-G65 PolarHBondContact O-N 2.9Å; F62-G65 VanDerWaalsContact O-N 3.12Å; S63-G65 VanDerWaalsContact C-N 3.32Å; S63-G65 PolarHBondContact O-N 3.42Å; G65-F68 WeakPolarHBondContact O-CB 3.44Å; G65-F68 PolarHBondContact O-N 3.12Å; G65-L69 WeakPolarHBondContact O-CB 3.2Å; G65-L69 PolarHBondContact O-N 2.69Å |
| 66 | V | 76.4 | Confident | 71.4 | Confident | 54 Ų | 54 | 101.4 Ų | 101.4 | 33% | 0.327 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.4 | -48.6 | 176.2 | 177.1 | 0 | 0 | 0 | 0 | 110.8 | F62 S63 F68 L69 F70 | F62-V66 HydrophobicContact CD1-CG2 4.28Å; F62-V66 HydrophobicContact CE1-CG2 3.91Å; F62-V66 HydrophobicContact CZ-CG2 4.03Å; F62-V66 WeakPolarHBondContact O-CG2 3.28Å; F62-V66 PolarHBondContact O-N 3.49Å; S63-V66 PolarHBondContact O-N 2.98Å; V66-F68 PolarHBondContact O-N 3.06Å; V66-L69 WeakPolarHBondContact O-CB 3.29Å; V66-L69 PolarHBondContact O-N 3.14Å; V66-L69 VanDerWaalsContact O-N 3.14Å; V66-F70 HydrophobicContact CG1-CD2 3.76Å; V66-F70 HydrophobicContact CG1-CE2 3.69Å; V66-F70 VanDerWaalsContact O-CD2 3.26Å; V66-F70 WeakPolarHBondContact O-CD2 3.49Å; V66-F70 PolarHBondContact O-N 3.33Å |
| 67 | I | 72.3 | Confident | 69.7 | Low | 105 Ų | 105 | 100.2 Ų | 100.2 | 54% | 0.538 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.4 | -40 | 177 | -65 | 164 | 0 | 0 | 0 | 110.5 | S63 F64 F70 T71 | S63-I67 VanDerWaalsContact O-CG1 3.28Å; S63-I67 WeakPolarHBondContact O-CG1 3.49Å; S63-I67 PolarHBondContact O-N 3.48Å; F64-I67 PolarHBondContact O-N 2.87Å; I67-F70 PolarHBondContact O-N 3.31Å; I67-T71 WeakPolarHBondContact O-CB 3.37Å; I67-T71 PolarHBondContact O-N 2.94Å; I67-T71 PolarHBondContact O-OG1 2.94Å |
| 68 | F | 65.7 | Low | 68.3 | Low | 90 Ų | 90 | 106.9 Ų | 106.9 | 40% | 0.395 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.5 | -49.1 | 174.3 | -175.5 | -102.2 | 0 | 0 | 0 | 111.6 | F64 G65 V66 F70 T71 L72 F79 I84 | F64-F68 WeakPolarHBondContact O-CB 3.26Å; F64-F68 PolarHBondContact O-N 3.46Å; G65-F68 WeakPolarHBondContact O-CB 3.44Å; G65-F68 PolarHBondContact O-N 3.12Å; V66-F68 PolarHBondContact O-N 3.06Å; F68-F70 VanDerWaalsContact C-N 3.28Å; F68-F70 PolarHBondContact O-N 2.93Å; F68-T71 PolarHBondContact O-N 3.43Å; F68-T71 VanDerWaalsContact O-N 3.08Å; F68-L72 HydrophobicContact CD1-CD1 3.62Å; F68-L72 HydrophobicContact CD2-CD1 3.71Å; F68-L72 HydrophobicContact CE1-CD1 3.47Å; F68-L72 VanDerWaalsContact CE1-CD1 3.47Å; F68-L72 HydrophobicContact CE1-CD2 4.02Å; F68-L72 HydrophobicContact CE1-CG 4.41Å; F68-L72 HydrophobicContact CE2-CD1 3.56Å; F68-L72 HydrophobicContact CG-CD1 3.75Å; F68-L72 HydrophobicContact CZ-CD1 3.45Å; F68-L72 VanDerWaalsContact CZ-CD1 3.45Å; F68-L72 HydrophobicContact CZ-CD2 4.26Å; F68-L72 HydrophobicContact CZ-CG 4.49Å; F68-L72 WeakPolarHBondContact O-CD1 3.18Å; F68-L72 PolarHBondContact O-N 3.22Å; F68-F79 AromaticContact CE2-CE1 3.98Å; F68-F79 HydrophobicContact CE2-CE1 3.98Å; F68-F79 HydrophobicContact CZ-CE1 4.13Å; F68-I84 HydrophobicContact CZ-CD1 4.39Å |
| 69 | L | 67.1 | Low | 66.9 | Low | 119 Ų | 119 | 109.9 Ų | 109.9 | 62% | 0.623 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -56.3 | -42.6 | 178.2 | -171.3 | 71.1 | 0 | 0 | 0 | 112.2 | G65 V66 | G65-L69 WeakPolarHBondContact O-CB 3.2Å; G65-L69 PolarHBondContact O-N 2.69Å; V66-L69 WeakPolarHBondContact O-CB 3.29Å; V66-L69 PolarHBondContact O-N 3.14Å; V66-L69 VanDerWaalsContact O-N 3.14Å |
| 70 | F | 60 | Low | 65.4 | Low | 152 Ų | 152 | 108.7 Ų | 108.7 | 67% | 0.667 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -72.3 | -33.3 | 176.8 | -80.1 | -75.7 | 0 | 0 | 0 | 113.2 | V66 I67 F68 L72 V73 | V66-F70 HydrophobicContact CG1-CD2 3.76Å; V66-F70 HydrophobicContact CG1-CE2 3.69Å; V66-F70 VanDerWaalsContact O-CD2 3.26Å; V66-F70 WeakPolarHBondContact O-CD2 3.49Å; V66-F70 PolarHBondContact O-N 3.33Å; I67-F70 PolarHBondContact O-N 3.31Å; F68-F70 VanDerWaalsContact C-N 3.28Å; F68-F70 PolarHBondContact O-N 2.93Å; F70-L72 VanDerWaalsContact C-N 3.3Å; F70-L72 PolarHBondContact O-N 3.18Å; F70-V73 PolarHBondContact O-N 3.3Å |
| 71 | T | 59.8 | Low | 63.8 | Low | 93 Ų | 93 | 113.7 Ų | 113.7 | 57% | 0.571 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -72.7 | -23.9 | 177.1 | -52.6 | 0 | 0 | 0 | 0 | 112.1 | I67 F68 | I67-T71 WeakPolarHBondContact O-CB 3.37Å; I67-T71 PolarHBondContact O-N 2.94Å; I67-T71 PolarHBondContact O-OG1 2.94Å; F68-T71 PolarHBondContact O-N 3.43Å; F68-T71 VanDerWaalsContact O-N 3.08Å |
| 72 | L | 57.3 | Low | 62.7 | Low | 78 Ų | 78 | 116.2 Ų | 116.2 | 41% | 0.408 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -78.1 | -18.5 | 174.2 | -93.7 | 81.9 | 0 | 0 | 0 | 113.9 | F68 F70 N74 F79 | F68-L72 HydrophobicContact CD1-CD1 3.62Å; F68-L72 HydrophobicContact CD2-CD1 3.71Å; F68-L72 HydrophobicContact CE1-CD1 3.47Å; F68-L72 VanDerWaalsContact CE1-CD1 3.47Å; F68-L72 HydrophobicContact CE1-CD2 4.02Å; F68-L72 HydrophobicContact CE1-CG 4.41Å; F68-L72 HydrophobicContact CE2-CD1 3.56Å; F68-L72 HydrophobicContact CG-CD1 3.75Å; F68-L72 HydrophobicContact CZ-CD1 3.45Å; F68-L72 VanDerWaalsContact CZ-CD1 3.45Å; F68-L72 HydrophobicContact CZ-CD2 4.26Å; F68-L72 HydrophobicContact CZ-CG 4.49Å; F68-L72 WeakPolarHBondContact O-CD1 3.18Å; F68-L72 PolarHBondContact O-N 3.22Å; F70-L72 VanDerWaalsContact C-N 3.3Å; F70-L72 PolarHBondContact O-N 3.18Å; L72-N74 PolarHBondContact O-N 3.26Å; L72-F79 HydrophobicContact CD1-CE1 4.15Å; L72-F79 HydrophobicContact CD1-CE2 4.39Å; L72-F79 HydrophobicContact CD1-CZ 3.5Å; L72-F79 HydrophobicContact CD2-CZ 3.9Å; L72-F79 HydrophobicContact CG-CE2 4.08Å; L72-F79 HydrophobicContact CG-CZ 3.49Å; L72-F79 VanDerWaalsContact CG-CZ 3.49Å |
| 73 | V | 51.5 | Low | 61.2 | Low | 108 Ų | 108 | 116 Ų | 116 | 66% | 0.655 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -78.1 | 116.7 | 172.6 | 163 | 0 | 0 | 0 | 0 | 108.4 | F70 | F70-V73 PolarHBondContact O-N 3.3Š|
| 74 | N | 52.3 | Low | 60 | Low | 126 Ų | 126 | 119.1 Ų | 119.1 | 67% | 0.674 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -45.6 | 143.4 | -176.2 | -94.6 | -75.3 | 0 | 0 | 0 | 114 | L72 | L72-N74 PolarHBondContact O-N 3.26Š|
| 75 | P | 51.5 | Low | 59.1 | Low | 103 Ų | 103 | 114.7 Ų | 114.7 | 67% | 0.669 | 58% | 0.583 | S | S | * | * | S | Bend | cis | -130.8 | 34.1 | 45.3 | 42.1 | -28.1 | 0 | 0 | 0 | 116.8 | P77 | P75-P77 WeakPolarHBondContact O-CD 3.45Š|
| 76 | Y | 52 | Low | 58.2 | Low | 204 Ų | 204 | 113.8 Ų | 113.8 | 80% | 0.8 | 57% | 0.574 | S | S | * | * | trans | -122 | 85.5 | 175.3 | -89.7 | -85.8 | 0 | 0 | 0 | 113.7 | R78 | Y76-R78 PolarHBondContact O-N 3.24Š| ||
| 77 | P | 54.4 | Low | 57.2 | Low | 94 Ų | 94 | 120.3 Ų | 120.3 | 61% | 0.61 | 59% | 0.594 | S | S | * | * | trans | -89.8 | 83 | 178 | 35.4 | -30.2 | 0 | 0 | 0 | 110 | P75 | P75-P77 WeakPolarHBondContact O-CD 3.45Š| ||
| 78 | R | 58.3 | Low | 56.6 | Low | 236 Ų | 236 | 120.5 Ų | 120.5 | 89% | 0.891 | 60% | 0.602 | S | S | * | * | trans | -134.3 | 80.8 | 163.2 | -73.5 | -170.4 | -176 | 172 | 2 | 109.9 | Y76 | Y76-R78 PolarHBondContact O-N 3.24Š| ||
| 79 | F | 58.3 | Low | 56.2 | Low | 104 Ų | 104 | 122.5 Ų | 122.5 | 46% | 0.456 | 61% | 0.61 | S | S | . | * | trans | -78 | 129 | 177.3 | -94.9 | -90.7 | 0 | 0 | 0 | 112.2 | F68 L72 I84 | F68-F79 AromaticContact CE2-CE1 3.98Å; F68-F79 HydrophobicContact CE2-CE1 3.98Å; F68-F79 HydrophobicContact CZ-CE1 4.13Å; L72-F79 HydrophobicContact CD1-CE1 4.15Å; L72-F79 HydrophobicContact CD1-CE2 4.39Å; L72-F79 HydrophobicContact CD1-CZ 3.5Å; L72-F79 HydrophobicContact CD2-CZ 3.9Å; L72-F79 HydrophobicContact CG-CE2 4.08Å; L72-F79 HydrophobicContact CG-CZ 3.49Å; L72-F79 VanDerWaalsContact CG-CZ 3.49Å; F79-I84 HydrophobicContact CD1-CD1 4.27Å; F79-I84 HydrophobicContact CE1-CD1 3.89Å | ||
| 80 | P | 58 | Low | 55.7 | Low | 75 Ų | 75 | 124.1 Ų | 124.1 | 49% | 0.487 | 61% | 0.608 | S | S | . | * | trans | -85 | 119.3 | 158.7 | 2.5 | 16.6 | 0 | 0 | 0 | 109.1 | I82 F83 | P80-I82 PolarHBondContact O-N 3.37Å; P80-F83 HydrophobicContact CB-CD2 4.04Å; P80-F83 HydrophobicContact CB-CE2 4.3Å; P80-F83 HydrophobicContact CG-CD2 3.87Å; P80-F83 HydrophobicContact CG-CE2 4Å; P80-F83 PolarHBondContact O-N 2.78Å; P80-F83 VanDerWaalsContact O-N 3.17Å | ||
| 81 | F | 52 | Low | 55.8 | Low | 191 Ų | 191 | 118.5 Ų | 118.5 | 84% | 0.838 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.1 | -19.9 | 177.5 | -97.1 | -95.9 | 0 | 0 | 0 | 115.3 | F83 | F81-F83 PolarHBondContact O-N 3.37Š|
| 82 | I | 56.4 | Low | 55.8 | Low | 126 Ų | 126 | 117 Ų | 117 | 65% | 0.646 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -32.8 | 177.3 | -100.1 | 74.8 | 0 | 0 | 0 | 112.4 | P80 S85 | P80-I82 PolarHBondContact O-N 3.37Å; I82-S85 PolarHBondContact O-OG 3.3Å |
| 83 | F | 51.1 | Low | 56.2 | Low | 144 Ų | 144 | 116.9 Ų | 116.9 | 63% | 0.632 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -21.8 | -168.8 | -72.5 | -81.6 | 0 | 0 | 0 | 115 | P80 F81 S85 | P80-F83 HydrophobicContact CB-CD2 4.04Å; P80-F83 HydrophobicContact CB-CE2 4.3Å; P80-F83 HydrophobicContact CG-CD2 3.87Å; P80-F83 HydrophobicContact CG-CE2 4Å; P80-F83 PolarHBondContact O-N 2.78Å; P80-F83 VanDerWaalsContact O-N 3.17Å; F81-F83 PolarHBondContact O-N 3.37Å; F83-S85 VanDerWaalsContact C-N 3.27Å; F83-S85 PolarHBondContact O-N 3.26Å |
| 84 | I | 54.9 | Low | 56.8 | Low | 117 Ų | 117 | 117 Ų | 117 | 60% | 0.6 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -24.5 | 175 | -120.7 | 88.1 | 0 | 0 | 0 | 111.9 | F68 F79 G86 | F68-I84 HydrophobicContact CZ-CD1 4.39Å; F79-I84 HydrophobicContact CD1-CD1 4.27Å; F79-I84 HydrophobicContact CE1-CD1 3.89Å; I84-G86 PolarHBondContact O-N 3.13Å; I84-G86 VanDerWaalsContact O-N 3.15Å |
| 85 | S | 56.4 | Low | 57 | Low | 51 Ų | 51 | 117.1 Ų | 117.1 | 36% | 0.357 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.4 | -13.9 | -170.6 | 70 | 0 | 0 | 0 | 0 | 114 | I82 F83 Y87 W90 | I82-S85 PolarHBondContact O-OG 3.3Å; F83-S85 VanDerWaalsContact C-N 3.27Å; F83-S85 PolarHBondContact O-N 3.26Å; S85-Y87 PolarHBondContact O-N 3.49Å; S85-Y87 VanDerWaalsContact O-N 3.11Å; S85-Y87 PolarHBondContact OG-N 3.22Å; S85-W90 PolarHBondContact O-NE1 3.47Å |
| 86 | G | 55.7 | Low | 57.1 | Low | 20 Ų | 20 | 120.2 Ų | 120.2 | 21% | 0.206 | 59% | 0.589 | C | S | . | * | trans | 58.5 | 23.9 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | I84 P88 F89 W90 | I84-G86 PolarHBondContact O-N 3.13Å; I84-G86 VanDerWaalsContact O-N 3.15Å; G86-P88 VanDerWaalsContact C-N 3.29Å; G86-F89 CarbonylContact O-C 3.55Å; G86-F89 VanDerWaalsContact O-CA 3.29Å; G86-F89 WeakPolarHBondContact O-CA 3.02Å; G86-F89 WeakPolarHBondContact O-CB 3.46Å; G86-F89 PolarHBondContact O-N 3.08Å; G86-W90 PolarHBondContact O-N 3.35Å | ||
| 87 | Y | 56.1 | Low | 57.3 | Low | 191 Ų | 191 | 117.1 Ų | 117.1 | 75% | 0.749 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -53.1 | -38.6 | 179.9 | -143.2 | -102.6 | 0 | 0 | 0 | 113.8 | S85 F89 G91 | S85-Y87 PolarHBondContact O-N 3.49Å; S85-Y87 VanDerWaalsContact O-N 3.11Å; S85-Y87 PolarHBondContact OG-N 3.22Å; Y87-F89 PolarHBondContact O-N 3.3Å; Y87-G91 PolarHBondContact O-N 2.96Å |
| 88 | P | 59.4 | Low | 57.8 | Low | 108 Ų | 108 | 118.7 Ų | 118.7 | 70% | 0.701 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.8 | -25 | 171.6 | -18.3 | 31.9 | 0 | 0 | 0 | 113.6 | G86 | G86-P88 VanDerWaalsContact C-N 3.29Å |
| 89 | F | 57.9 | Low | 57.8 | Low | 132 Ų | 132 | 110.8 Ų | 110.8 | 58% | 0.579 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -83.1 | -45.3 | -178.4 | -177.1 | -100 | 0 | 0 | 0 | 111.9 | G86 Y87 G91 S92 | G86-F89 CarbonylContact O-C 3.55Å; G86-F89 VanDerWaalsContact O-CA 3.29Å; G86-F89 WeakPolarHBondContact O-CA 3.02Å; G86-F89 WeakPolarHBondContact O-CB 3.46Å; G86-F89 PolarHBondContact O-N 3.08Å; Y87-F89 PolarHBondContact O-N 3.3Å; F89-G91 VanDerWaalsContact C-N 3.34Å; F89-G91 PolarHBondContact O-N 3.39Å; F89-S92 PolarHBondContact O-N 2.8Å |
| 90 | W | 56.4 | Low | 57.2 | Low | 154 Ų | 154 | 116.5 Ų | 116.5 | 58% | 0.583 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -66.7 | -31.5 | 178 | -66.2 | 107.2 | 0 | 0 | 0 | 113.4 | S85 G86 S92 V93 L94 | S85-W90 PolarHBondContact O-NE1 3.47Å; G86-W90 PolarHBondContact O-N 3.35Å; W90-S92 PolarHBondContact O-N 3.28Å; W90-V93 PolarHBondContact O-N 3.17Å; W90-L94 PolarHBondContact O-N 3.34Å; W90-L94 VanDerWaalsContact O-N 3.13Å |
| 91 | G | 62.3 | Low | 57.2 | Low | 33 Ų | 33 | 118.6 Ų | 118.6 | 34% | 0.34 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -61.4 | -28.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y87 F89 N95 | Y87-G91 PolarHBondContact O-N 2.96Å; F89-G91 VanDerWaalsContact C-N 3.34Å; F89-G91 PolarHBondContact O-N 3.39Å; G91-N95 PolarHBondContact O-ND2 3.26Å |
| 92 | S | 59.9 | Low | 57.4 | Low | 63 Ų | 63 | 114.8 Ų | 114.8 | 44% | 0.441 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -82.1 | -28.5 | 177.4 | -60.9 | 0 | 0 | 0 | 0 | 112.9 | F89 W90 | F89-S92 PolarHBondContact O-N 2.8Å; W90-S92 PolarHBondContact O-N 3.28Å |
| 93 | V | 65.8 | Low | 57.5 | Low | 74 Ų | 74 | 114.2 Ų | 114.2 | 45% | 0.448 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -75.6 | -41 | 178.8 | 177.4 | 0 | 0 | 0 | 0 | 111.2 | W90 K96 L97 | W90-V93 PolarHBondContact O-N 3.17Å; V93-K96 PolarHBondContact O-N 3.11Å; V93-L97 PolarHBondContact O-N 2.9Å |
| 94 | L | 62.8 | Low | 57.9 | Low | 110 Ų | 110 | 112.4 Ų | 112.4 | 58% | 0.576 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64.6 | -41.5 | 179.1 | -82.2 | 156.2 | 0 | 0 | 0 | 112.8 | W90 K96 L97 V98 | W90-L94 PolarHBondContact O-N 3.34Å; W90-L94 VanDerWaalsContact O-N 3.13Å; L94-K96 PolarHBondContact O-N 3.15Å; L94-L97 PolarHBondContact O-N 2.93Å; L94-V98 PolarHBondContact O-N 3.42Å |
| 95 | N | 56.6 | Low | 58.1 | Low | 130 Ų | 130 | 112.1 Ų | 112.1 | 70% | 0.695 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.8 | -22.3 | 177.2 | -73.3 | -40.8 | 0 | 0 | 0 | 113.1 | G91 | G91-N95 PolarHBondContact O-ND2 3.26Å |
| 96 | K | 54.3 | Low | 58.2 | Low | 168 Ų | 168 | 116.2 Ų | 116.2 | 73% | 0.73 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -83.9 | -22.3 | 177.1 | -157.6 | 167.2 | -174.4 | -179.8 | 0 | 113 | V93 L94 | V93-K96 PolarHBondContact O-N 3.11Å; L94-K96 PolarHBondContact O-N 3.15Å |
| 97 | L | 55.6 | Low | 58.3 | Low | 139 Ų | 139 | 123.1 Ų | 123.1 | 73% | 0.728 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -87.5 | -31.1 | 178.4 | -159.5 | 93.9 | 0 | 0 | 0 | 112.7 | V93 L94 G99 | V93-L97 PolarHBondContact O-N 2.9Å; L94-L97 PolarHBondContact O-N 2.93Å; L97-G99 VanDerWaalsContact C-N 3.34Å |
| 98 | V | 66.2 | Low | 58.5 | Low | 126 Ų | 126 | 117.8 Ų | 117.8 | 76% | 0.764 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | -14 | -179.1 | 164 | 0 | 0 | 0 | 0 | 113.4 | L94 | L94-V98 PolarHBondContact O-N 3.42Š|
| 99 | G | 57.2 | Low | 58.4 | Low | 71 Ų | 71 | 118.7 Ų | 118.7 | 73% | 0.732 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 13.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | L97 | L97-G99 VanDerWaalsContact C-N 3.34Š|
| 100 | L | 46.4 | Very low | 58.5 | Low | 224 Ų | 224 | 117.5 Ų | 117.5 | 100% | 1.173 | 66% | 0.655 | S | S | * | * | trans | -111.5 | 0 | 175 | -160.3 | 100.7 | 0 | 0 | 0 | 110.8 |
Retrieved 100 of 100 residues in 64.5 ms
(Link to these results)