| 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 | 43.4 | Very low | 52.2 | Low | 230 Ų | 230 | 178.4 Ų | 178.4 | 100% | 1.133 | 84% | 0.843 | S | S | * | * | 0 | 107.2 | 0 | -88.4 | 162.2 | 132.6 | 0 | 0 | 108.8 | |||||
| 2 | F | 47.8 | Very low | 53 | Low | 174 Ų | 174 | 172.8 Ų | 172.8 | 76% | 0.763 | 83% | 0.832 | S | S | * | * | trans | 52.5 | 96.8 | 146.1 | -65.7 | -87.2 | 0 | 0 | 0 | 118.4 | V4 | F2-V4 PolarHBondContact O-N 2.94Š| ||
| 3 | S | 57.2 | Low | 53 | Low | 107 Ų | 107 | 172.3 Ų | 172.3 | 75% | 0.748 | 83% | 0.828 | S | S | * | * | 57 | 25.9 | 70.9 | 86.1 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 4 | V | 54.4 | Low | 52.9 | Low | 118 Ų | 118 | 171.6 Ų | 171.6 | 72% | 0.715 | 82% | 0.824 | S | S | * | * | trans | -105.4 | -3.1 | 178.8 | 127.8 | 0 | 0 | 0 | 0 | 114.3 | F2 | F2-V4 PolarHBondContact O-N 2.94Š| ||
| 5 | W | 54.2 | Low | 52.9 | Low | 233 Ų | 233 | 165.8 Ų | 165.8 | 88% | 0.883 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -110.7 | 7 | -176.9 | -78.8 | 89 | 0 | 0 | 0 | 114.8 | ||
| 6 | D | 52.8 | Low | 52.7 | Low | 163 Ų | 163 | 164.5 Ų | 164.5 | 87% | 0.872 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -106 | 16.3 | -175.6 | -135.6 | -82.3 | 0 | 0 | 0 | 113.2 | ||
| 7 | R | 55 | Low | 52.3 | Low | 237 Ų | 237 | 158.4 Ų | 158.4 | 89% | 0.894 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -121 | 3.4 | -178.2 | -155.2 | -175.2 | -105.1 | -155.1 | -4.1 | 113.9 | ||
| 8 | Q | 56.8 | Low | 51.9 | Low | 174 Ų | 174 | 155.4 Ų | 155.4 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -115.3 | 29.6 | -173.8 | -167.7 | 149.4 | -34 | 0 | 0 | 113.3 | ||
| 9 | E | 46.5 | Very low | 51.3 | Low | 179 Ų | 179 | 149.1 Ų | 149.1 | 84% | 0.836 | 79% | 0.791 | S | S | * | * | trans | -128.4 | 61.1 | 169.4 | -69.9 | -84.6 | 149.1 | 0 | 0 | 107 | P11 | E9-P11 WeakPolarHBondContact O-CD 3.34Š| ||
| 10 | R | 55.5 | Low | 51 | Low | 236 Ų | 236 | 150.8 Ų | 150.8 | 89% | 0.891 | 80% | 0.799 | S | S | * | * | trans | -60.9 | 116.8 | 170.4 | -97.3 | -157.3 | -73.2 | 174.1 | -4.6 | 107.9 | ||||
| 11 | P | 50.4 | Low | 50.8 | Low | 111 Ų | 111 | 152.1 Ų | 152.1 | 72% | 0.721 | 80% | 0.801 | S | S | * | * | trans | -73.3 | 160 | 169.7 | 31.8 | -31.7 | 0 | 0 | 0 | 110.4 | E9 | E9-P11 WeakPolarHBondContact O-CD 3.34Š| ||
| 12 | P | 62 | Low | 50.8 | Low | 111 Ų | 111 | 144.2 Ų | 144.2 | 72% | 0.721 | 78% | 0.778 | S | S | * | * | trans | -103.5 | 100.2 | -156.1 | 34.3 | -21.7 | 0 | 0 | 0 | 110.3 | ||||
| 13 | E | 53 | Low | 50.6 | Low | 167 Ų | 167 | 145.6 Ų | 145.6 | 78% | 0.78 | 78% | 0.784 | S | S | * | * | trans | -141.2 | 138.6 | 175.9 | -66.8 | -68.1 | 131.7 | 0 | 0 | 111 | ||||
| 14 | E | 51.7 | Low | 50 | Low | 163 Ų | 163 | 143.3 Ų | 143.3 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | trans | 86.1 | 51.4 | 164.3 | -66.2 | 165.7 | 124.3 | 0 | 0 | 118.4 | T16 | E14-T16 VanDerWaalsContact C-N 3.33Š| ||
| 15 | G | 53.4 | Low | 49.8 | Very low | 84 Ų | 84 | 141.3 Ų | 141.3 | 87% | 0.866 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -87.6 | 9.8 | 151.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 16 | T | 49.4 | Very low | 49.4 | Very low | 145 Ų | 145 | 134.4 Ų | 134.4 | 89% | 0.89 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -121.8 | 10.9 | -173.8 | -53.8 | 0 | 0 | 0 | 0 | 113.4 | E14 | E14-T16 VanDerWaalsContact C-N 3.33Š|
| 17 | A | 45.8 | Very low | 49.2 | Very low | 61 Ų | 61 | 135.1 Ų | 135.1 | 50% | 0.504 | 74% | 0.741 | S | S | . | * | trans | -140.1 | 57.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G19 | A17-G19 WeakPolarHBondContact O-CA 3.47Å; A17-G19 PolarHBondContact O-N 3.41Å | ||
| 18 | A | 44.2 | Very low | 49.2 | Very low | 104 Ų | 104 | 128.4 Ų | 128.4 | 86% | 0.86 | 73% | 0.726 | S | S | * | * | trans | -67.2 | 71.2 | 133.3 | 0 | 0 | 0 | 0 | 0 | 105.9 | L20 | A18-L20 PolarHBondContact O-N 2.88Š| ||
| 19 | G | 40.4 | Very low | 49 | Very low | 36 Ų | 36 | 127.1 Ų | 127.1 | 37% | 0.371 | 72% | 0.718 | S | S | . | * | 48.2 | 76.1 | 75.1 | 0 | 0 | 0 | 0 | 0 | 105.2 | A17 Q21 | A17-G19 WeakPolarHBondContact O-CA 3.47Å; A17-G19 PolarHBondContact O-N 3.41Å; G19-Q21 PolarHBondContact O-N 2.87Å | |||
| 20 | L | 47 | Very low | 49.3 | Very low | 183 Ų | 183 | 121 Ų | 121 | 96% | 0.958 | 69% | 0.691 | S | S | * | * | 28.2 | 24.1 | 65.7 | -79.6 | 172.3 | 0 | 0 | 0 | 112.9 | A18 G22 | A18-L20 PolarHBondContact O-N 2.88Å; L20-G22 PolarHBondContact O-N 3.37Å | |||
| 21 | Q | 45 | Very low | 49.2 | Very low | 178 Ų | 178 | 114.1 Ų | 114.1 | 83% | 0.832 | 68% | 0.679 | S | S | * | * | trans | -70.4 | 94 | 171.6 | -75.7 | -163.3 | 37.7 | 0 | 0 | 105.4 | G19 | G19-Q21 PolarHBondContact O-N 2.87Š| ||
| 22 | G | 43.6 | Very low | 49.3 | Very low | 64 Ų | 64 | 112 Ų | 112 | 66% | 0.66 | 67% | 0.667 | S | S | * | * | trans | 65.7 | 73.8 | 132.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L20 G24 | L20-G22 PolarHBondContact O-N 3.37Å; G22-G24 PolarHBondContact O-N 3.4Å | ||
| 23 | F | 44.8 | Very low | 48.9 | Very low | 204 Ų | 204 | 111.7 Ų | 111.7 | 90% | 0.895 | 66% | 0.659 | S | S | * | * | trans | -60.5 | 54.2 | 131.8 | -131.5 | -93.5 | 0 | 0 | 0 | 108.6 | V25 | F23-V25 HydrophobicContact CD1-CG2 3.63Å; F23-V25 HydrophobicContact CE1-CG2 4.07Å; F23-V25 PolarHBondContact O-N 2.98Å | ||
| 24 | G | 44.8 | Very low | 48.8 | Very low | 58 Ų | 58 | 111.4 Ų | 111.4 | 60% | 0.598 | 66% | 0.655 | S | S | * | * | trans | -69.6 | 85.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 103.2 | G22 D26 | G22-G24 PolarHBondContact O-N 3.4Å; G24-D26 PolarHBondContact O-N 3.43Å | ||
| 25 | V | 48.8 | Very low | 49.2 | Very low | 77 Ų | 77 | 103.8 Ų | 103.8 | 47% | 0.467 | 62% | 0.62 | S | S | . | * | trans | -57.6 | 90.3 | 164.6 | 178.3 | 0 | 0 | 0 | 0 | 104.2 | F23 K27 L30 | F23-V25 HydrophobicContact CD1-CG2 3.63Å; F23-V25 HydrophobicContact CE1-CG2 4.07Å; F23-V25 PolarHBondContact O-N 2.98Å; V25-K27 PolarHBondContact O-N 2.83Å; V25-L30 HydrophobicContact CG1-CD1 3.65Å; V25-L30 HydrophobicContact CG1-CD2 3.59Å; V25-L30 HydrophobicContact CG1-CG 3.52Å | ||
| 26 | D | 47.6 | Very low | 49.5 | Very low | 88 Ų | 88 | 104.2 Ų | 104.2 | 47% | 0.471 | 60% | 0.602 | S | S | . | * | trans | -64.3 | 130.3 | -170.8 | -163.8 | -77.2 | 0 | 0 | 0 | 106.9 | G24 T28 F29 L30 | G24-D26 PolarHBondContact O-N 3.43Å; D26-T28 PolarHBondContact O-N 3.48Å; D26-T28 WeakPolarHBondContact OD1-CB 3.23Å; D26-T28 WeakPolarHBondContact OD1-CG2 3.34Å; D26-T28 PolarHBondContact OD1-N 2.78Å; D26-T28 VanDerWaalsContact OD1-N 3.09Å; D26-T28 PolarHBondContact OD1-OG1 3.32Å; D26-F29 HydrophobicContact CB-CB 4.4Å; D26-F29 WeakPolarHBondContact O-CA 3.41Å; D26-F29 WeakPolarHBondContact O-CB 3.39Å; D26-F29 PolarHBondContact O-N 2.92Å; D26-L30 PolarHBondContact O-N 3.5Å | ||
| 27 | K | 47.2 | Very low | 50 | Low | 178 Ų | 178 | 99.3 Ų | 99.3 | 77% | 0.774 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -57.4 | -22.3 | -177.2 | -69.3 | -177.6 | 173.5 | 71.4 | 0 | 111.5 | V25 S31 | V25-K27 PolarHBondContact O-N 2.83Å; K27-S31 WeakPolarHBondContact O-CB 3.21Å; K27-S31 PolarHBondContact O-N 3.15Å; K27-S31 VanDerWaalsContact O-N 3.16Å |
| 28 | T | 56.1 | Low | 50.8 | Low | 95 Ų | 95 | 100.9 Ų | 100.9 | 58% | 0.583 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -78.7 | -23.4 | 175.1 | 67.4 | 0 | 0 | 0 | 0 | 113.6 | D26 S32 | D26-T28 PolarHBondContact O-N 3.48Å; D26-T28 WeakPolarHBondContact OD1-CB 3.23Å; D26-T28 WeakPolarHBondContact OD1-CG2 3.34Å; D26-T28 PolarHBondContact OD1-N 2.78Å; D26-T28 VanDerWaalsContact OD1-N 3.09Å; D26-T28 PolarHBondContact OD1-OG1 3.32Å; T28-S32 PolarHBondContact O-N 2.89Å; T28-S32 VanDerWaalsContact O-N 3.1Å; T28-S32 PolarHBondContact O-OG 3.43Å; T28-S32 VanDerWaalsContact O-OG 3.05Å |
| 29 | F | 51.7 | Low | 51.7 | Low | 147 Ų | 147 | 100.6 Ų | 100.6 | 65% | 0.645 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -80.4 | -34.5 | 174.1 | -128.7 | -93.4 | 0 | 0 | 0 | 111.6 | D26 G35 | D26-F29 HydrophobicContact CB-CB 4.4Å; D26-F29 WeakPolarHBondContact O-CA 3.41Å; D26-F29 WeakPolarHBondContact O-CB 3.39Å; D26-F29 PolarHBondContact O-N 2.92Å; F29-G35 VanDerWaalsContact O-CA 3.27Å; F29-G35 WeakPolarHBondContact O-CA 3.46Å; F29-G35 PolarHBondContact O-N 3.21Å |
| 30 | L | 52.8 | Low | 52.9 | Low | 51 Ų | 51 | 100.7 Ų | 100.7 | 27% | 0.267 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.7 | -35.6 | 169.1 | -69.3 | -178.7 | 0 | 0 | 0 | 112.4 | V25 D26 G35 I36 | V25-L30 HydrophobicContact CG1-CD1 3.65Å; V25-L30 HydrophobicContact CG1-CD2 3.59Å; V25-L30 HydrophobicContact CG1-CG 3.52Å; D26-L30 PolarHBondContact O-N 3.5Å; L30-G35 CarbonylContact O-C 3.58Å; L30-G35 WeakPolarHBondContact O-CA 3.42Å; L30-I36 PolarHBondContact O-N 3.42Å; L30-I36 VanDerWaalsContact O-N 3.1Å |
| 31 | S | 54.1 | Low | 53.7 | Low | 92 Ų | 92 | 97.4 Ų | 97.4 | 64% | 0.643 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -83.5 | -19.8 | -179.5 | -152.7 | 0 | 0 | 0 | 0 | 113.9 | K27 | K27-S31 WeakPolarHBondContact O-CB 3.21Å; K27-S31 PolarHBondContact O-N 3.15Å; K27-S31 VanDerWaalsContact O-N 3.16Å |
| 32 | S | 51.7 | Low | 54.7 | Low | 65 Ų | 65 | 94.2 Ų | 94.2 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | S | Bend | trans | -65.8 | 148.5 | 169.2 | -74.3 | 0 | 0 | 0 | 0 | 109.6 | T28 K34 G35 I36 | T28-S32 PolarHBondContact O-N 2.89Å; T28-S32 VanDerWaalsContact O-N 3.1Å; T28-S32 PolarHBondContact O-OG 3.43Å; T28-S32 VanDerWaalsContact O-OG 3.05Å; S32-K34 CarbonylContact O-C 3.59Å; S32-K34 PolarHBondContact O-N 3.47Å; S32-G35 WeakPolarHBondContact O-CA 3.43Å; S32-G35 PolarHBondContact O-N 2.85Å; S32-I36 PolarHBondContact O-N 2.83Å |
| 33 | L | 53 | Low | 56 | Low | 106 Ų | 106 | 95.9 Ų | 95.9 | 56% | 0.555 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -41 | -31.6 | -179.3 | -161.6 | 75.7 | 0 | 0 | 0 | 115.4 | L37 | L33-L37 PolarHBondContact O-N 2.94Å |
| 34 | K | 52.2 | Low | 56.9 | Low | 160 Ų | 160 | 91.1 Ų | 91.1 | 70% | 0.696 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -72.5 | -29.5 | 175 | -80.7 | 167.4 | 170.7 | 164.1 | 0 | 114.7 | S32 L37 L38 | S32-K34 CarbonylContact O-C 3.59Å; S32-K34 PolarHBondContact O-N 3.47Å; K34-L37 WeakPolarHBondContact O-CB 3.32Å; K34-L38 VanDerWaalsContact O-CB 3.31Å; K34-L38 WeakPolarHBondContact O-CB 3.28Å; K34-L38 PolarHBondContact O-N 3.4Å |
| 35 | G | 59.8 | Low | 58 | Low | 3 Ų | 3 | 93.2 Ų | 93.2 | 3% | 0.031 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -80.3 | -34.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | F29 L30 S32 L37 L38 E39 | F29-G35 VanDerWaalsContact O-CA 3.27Å; F29-G35 WeakPolarHBondContact O-CA 3.46Å; F29-G35 PolarHBondContact O-N 3.21Å; L30-G35 CarbonylContact O-C 3.58Å; L30-G35 WeakPolarHBondContact O-CA 3.42Å; S32-G35 WeakPolarHBondContact O-CA 3.43Å; S32-G35 PolarHBondContact O-N 2.85Å; G35-L37 VanDerWaalsContact C-N 3.3Å; G35-L38 PolarHBondContact O-N 3.39Å; G35-E39 WeakPolarHBondContact O-CB 3.4Å; G35-E39 PolarHBondContact O-N 3.23Å |
| 36 | I | 59.4 | Low | 59.3 | Low | 94 Ų | 94 | 98.5 Ų | 98.5 | 48% | 0.482 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.5 | -41.3 | 167.5 | -64.3 | 168.3 | 0 | 0 | 0 | 109.7 | L30 S32 L38 E39 T40 | L30-I36 PolarHBondContact O-N 3.42Å; L30-I36 VanDerWaalsContact O-N 3.1Å; S32-I36 PolarHBondContact O-N 2.83Å; I36-L38 VanDerWaalsContact C-N 3.33Å; I36-L38 PolarHBondContact O-N 2.95Å; I36-E39 PolarHBondContact O-N 3.05Å; I36-T40 PolarHBondContact O-N 3.1Å; I36-T40 PolarHBondContact O-OG1 3.28Å |
| 37 | L | 60.6 | Low | 60.4 | Low | 41 Ų | 41 | 95.6 Ų | 95.6 | 22% | 0.215 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -57.1 | -46.3 | 171.7 | -154.3 | 84.7 | 0 | 0 | 0 | 112 | L33 K34 G35 T40 E41 Y91 L95 | L33-L37 PolarHBondContact O-N 2.94Å; K34-L37 WeakPolarHBondContact O-CB 3.32Å; G35-L37 VanDerWaalsContact C-N 3.3Å; L37-T40 VanDerWaalsContact C-OG1 3.31Å; L37-T40 WeakPolarHBondContact CA-OG1 3.37Å; L37-T40 PolarHBondContact O-N 3.39Å; L37-T40 PolarHBondContact O-OG1 2.86Å; L37-E41 PolarHBondContact O-N 2.79Å; L37-Y91 HydrophobicContact CD1-CD2 3.9Å; L37-Y91 HydrophobicContact CD1-CE2 3.1Å; L37-Y91 HydrophobicContact CG-CE2 3.7Å; L37-L95 HydrophobicContact CD1-CD1 3.18Å; L37-L95 HydrophobicContact CD1-CD2 3.34Å; L37-L95 HydrophobicContact CD1-CG 3.86Å |
| 38 | L | 62.8 | Low | 61.5 | Low | 94 Ų | 94 | 90.4 Ų | 90.4 | 49% | 0.492 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -73.6 | -37.2 | -175.8 | -155.8 | 156.2 | 0 | 0 | 0 | 111.2 | K34 G35 I36 E41 L42 | K34-L38 VanDerWaalsContact O-CB 3.31Å; K34-L38 WeakPolarHBondContact O-CB 3.28Å; K34-L38 PolarHBondContact O-N 3.4Å; G35-L38 PolarHBondContact O-N 3.39Å; I36-L38 VanDerWaalsContact C-N 3.33Å; I36-L38 PolarHBondContact O-N 2.95Å; L38-E41 PolarHBondContact O-N 2.93Å; L38-L42 VanDerWaalsContact O-CB 3.32Å; L38-L42 WeakPolarHBondContact O-CB 3.28Å; L38-L42 PolarHBondContact O-N 2.94Å |
| 39 | E | 63.6 | Low | 62.4 | Low | 99 Ų | 99 | 88.1 Ų | 88.1 | 46% | 0.463 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 169.3 | -84 | -173.5 | 74.8 | 0 | 0 | 110.7 | G35 I36 E41 L42 D43 | G35-E39 WeakPolarHBondContact O-CB 3.4Å; G35-E39 PolarHBondContact O-N 3.23Å; I36-E39 PolarHBondContact O-N 3.05Å; E39-E41 PolarHBondContact O-N 3.28Å; E39-L42 PolarHBondContact O-N 2.81Å; E39-D43 WeakPolarHBondContact O-CB 3.33Å; E39-D43 PolarHBondContact O-N 2.71Å |
| 40 | T | 63.8 | Low | 63.3 | Low | 38 Ų | 38 | 83.6 Ų | 83.6 | 23% | 0.233 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -64.3 | -37.2 | 174.3 | 49.6 | 0 | 0 | 0 | 0 | 113.3 | I36 L37 F44 | I36-T40 PolarHBondContact O-N 3.1Å; I36-T40 PolarHBondContact O-OG1 3.28Å; L37-T40 VanDerWaalsContact C-OG1 3.31Å; L37-T40 WeakPolarHBondContact CA-OG1 3.37Å; L37-T40 PolarHBondContact O-N 3.39Å; L37-T40 PolarHBondContact O-OG1 2.86Å; T40-F44 WeakPolarHBondContact O-CB 3.29Å; T40-F44 PolarHBondContact O-N 3.5Å |
| 41 | E | 64.9 | Low | 64.1 | Low | 113 Ų | 113 | 82.8 Ų | 82.8 | 53% | 0.528 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -66.9 | -40.3 | 173 | -90.5 | -150.9 | 100 | 0 | 0 | 111.8 | L37 L38 E39 F44 L45 | L37-E41 PolarHBondContact O-N 2.79Å; L38-E41 PolarHBondContact O-N 2.93Å; E39-E41 PolarHBondContact O-N 3.28Å; E41-F44 WeakPolarHBondContact O-CB 3.38Å; E41-F44 PolarHBondContact O-N 3.46Å; E41-L45 WeakPolarHBondContact O-CB 3.1Å; E41-L45 WeakPolarHBondContact O-CD1 3.39Å; E41-L45 PolarHBondContact O-N 2.95Å |
| 42 | L | 66.7 | Low | 65 | Low | 111 Ų | 111 | 83.4 Ų | 83.4 | 58% | 0.581 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -68.5 | -38.1 | 178.2 | -144.6 | 80.1 | 0 | 0 | 0 | 111.1 | L38 E39 F44 L45 R46 | L38-L42 VanDerWaalsContact O-CB 3.32Å; L38-L42 WeakPolarHBondContact O-CB 3.28Å; L38-L42 PolarHBondContact O-N 2.94Å; E39-L42 PolarHBondContact O-N 2.81Å; L42-F44 VanDerWaalsContact C-N 3.33Å; L42-L45 PolarHBondContact O-N 3.49Å; L42-R46 WeakPolarHBondContact O-CB 3.08Å; L42-R46 PolarHBondContact O-N 2.69Å |
| 43 | D | 69.4 | Low | 66.4 | Low | 99 Ų | 99 | 85.4 Ų | 85.4 | 53% | 0.529 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.2 | -38.2 | 170.6 | -97.4 | -51.4 | 0 | 0 | 0 | 111.3 | E39 R46 C47 | E39-D43 WeakPolarHBondContact O-CB 3.33Å; E39-D43 PolarHBondContact O-N 2.71Å; D43-R46 PolarHBondContact O-N 3.02Å; D43-C47 WeakPolarHBondContact O-CB 3.35Å; D43-C47 PolarHBondContact O-N 3.17Å |
| 44 | F | 63.8 | Low | 67.2 | Low | 105 Ų | 105 | 84.3 Ų | 84.3 | 46% | 0.461 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66 | -42.1 | 174.1 | -168.4 | -103.4 | 0 | 0 | 0 | 112.1 | T40 E41 L42 C47 L48 A84 | T40-F44 WeakPolarHBondContact O-CB 3.29Å; T40-F44 PolarHBondContact O-N 3.5Å; E41-F44 WeakPolarHBondContact O-CB 3.38Å; E41-F44 PolarHBondContact O-N 3.46Å; L42-F44 VanDerWaalsContact C-N 3.33Å; F44-C47 PolarHBondContact O-N 2.82Å; F44-L48 HydrophobicContact CD1-CD1 3.55Å; F44-L48 HydrophobicContact CD1-CG 4.23Å; F44-L48 HydrophobicContact CE1-CD1 3.35Å; F44-L48 HydrophobicContact CE1-CG 4.04Å; F44-L48 HydrophobicContact CZ-CD1 4.18Å; F44-L48 HydrophobicContact CZ-CG 4.45Å; F44-L48 VanDerWaalsContact O-CB 3.28Å; F44-L48 WeakPolarHBondContact O-CB 3.3Å; F44-L48 WeakPolarHBondContact O-CG 3.48Å; F44-L48 PolarHBondContact O-N 2.55Å; F44-A84 HydrophobicContact CD2-CB 4.43Å; F44-A84 HydrophobicContact CE2-CB 3.93Å |
| 45 | L | 68.1 | Low | 67.9 | Low | 102 Ų | 102 | 79.3 Ų | 79.3 | 53% | 0.534 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -67.5 | -38 | 174.1 | -88.6 | 143.8 | 0 | 0 | 0 | 112.4 | E41 L42 S49 | E41-L45 WeakPolarHBondContact O-CB 3.1Å; E41-L45 WeakPolarHBondContact O-CD1 3.39Å; E41-L45 PolarHBondContact O-N 2.95Å; L42-L45 PolarHBondContact O-N 3.49Å; L45-S49 VanDerWaalsContact O-CB 3.3Å; L45-S49 WeakPolarHBondContact O-CB 3.17Å; L45-S49 PolarHBondContact O-N 3.36Å; L45-S49 PolarHBondContact O-OG 2.8Å |
| 46 | R | 77.2 | Confident | 68.7 | Low | 188 Ų | 188 | 83.7 Ų | 83.7 | 71% | 0.709 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -65 | -42.7 | 172.6 | -171.4 | 87.6 | 170.2 | 144.2 | 0.4 | 110.2 | L42 D43 S49 A50 | L42-R46 WeakPolarHBondContact O-CB 3.08Å; L42-R46 PolarHBondContact O-N 2.69Å; D43-R46 PolarHBondContact O-N 3.02Å; R46-S49 WeakPolarHBondContact CA-OG 3.42Å; R46-S49 PolarHBondContact O-N 3.16Å; R46-S49 PolarHBondContact O-OG 3.1Å; R46-A50 WeakPolarHBondContact O-CB 3.34Å; R46-A50 PolarHBondContact O-N 3.2Å |
| 47 | C | 70.4 | Confident | 69.4 | Low | 27 Ų | 27 | 83.3 Ų | 83.3 | 18% | 0.182 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -66.2 | -46.1 | 176.3 | -158.2 | 0 | 0 | 0 | 0 | 111.1 | D43 F44 S49 A50 I51 V80 | D43-C47 WeakPolarHBondContact O-CB 3.35Å; D43-C47 PolarHBondContact O-N 3.17Å; F44-C47 PolarHBondContact O-N 2.82Å; C47-S49 PolarHBondContact O-N 3Å; C47-A50 CarbonylContact O-C 3.02Å; C47-A50 WeakPolarHBondContact O-CB 3.38Å; C47-A50 PolarHBondContact O-N 3.09Å; C47-I51 WeakPolarHBondContact O-CG1 3.39Å; C47-I51 PolarHBondContact O-N 3.33Å; C47-V80 VanDerWaalsContact SG-CG1 3.51Å |
| 48 | L | 70.3 | Confident | 69.7 | Low | 68 Ų | 68 | 81.8 Ų | 81.8 | 36% | 0.356 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.1 | -43.4 | 173.9 | -84.5 | 171.4 | 0 | 0 | 0 | 112.6 | F44 A50 I51 I52 | F44-L48 HydrophobicContact CD1-CD1 3.55Å; F44-L48 HydrophobicContact CD1-CG 4.23Å; F44-L48 HydrophobicContact CE1-CD1 3.35Å; F44-L48 HydrophobicContact CE1-CG 4.04Å; F44-L48 HydrophobicContact CZ-CD1 4.18Å; F44-L48 HydrophobicContact CZ-CG 4.45Å; F44-L48 VanDerWaalsContact O-CB 3.28Å; F44-L48 WeakPolarHBondContact O-CB 3.3Å; F44-L48 WeakPolarHBondContact O-CG 3.48Å; F44-L48 PolarHBondContact O-N 2.55Å; L48-A50 VanDerWaalsContact C-N 3.31Å; L48-A50 PolarHBondContact O-N 3.47Å; L48-I51 HydrophobicContact CD2-CD1 3.91Å; L48-I51 WeakPolarHBondContact O-CB 3.45Å; L48-I51 PolarHBondContact O-N 3.04Å; L48-I52 WeakPolarHBondContact O-CG1 3.44Å; L48-I52 PolarHBondContact O-N 3.33Å |
| 49 | S | 73.4 | Confident | 69.7 | Low | 48 Ų | 48 | 84.3 Ų | 84.3 | 34% | 0.336 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.2 | -39 | 176 | 66.8 | 0 | 0 | 0 | 0 | 111.1 | L45 R46 C47 I52 I53 | L45-S49 VanDerWaalsContact O-CB 3.3Å; L45-S49 WeakPolarHBondContact O-CB 3.17Å; L45-S49 PolarHBondContact O-N 3.36Å; L45-S49 PolarHBondContact O-OG 2.8Å; R46-S49 WeakPolarHBondContact CA-OG 3.42Å; R46-S49 PolarHBondContact O-N 3.16Å; R46-S49 PolarHBondContact O-OG 3.1Å; C47-S49 PolarHBondContact O-N 3Å; S49-I52 PolarHBondContact O-N 2.99Å; S49-I53 WeakPolarHBondContact O-CB 3.46Å; S49-I53 WeakPolarHBondContact O-CD1 3.14Å; S49-I53 WeakPolarHBondContact O-CG1 3.45Å; S49-I53 PolarHBondContact O-N 3.36Å |
| 50 | A | 70.8 | Confident | 69.8 | Low | 52 Ų | 52 | 82.4 Ų | 82.4 | 43% | 0.43 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.4 | -39.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112 | R46 C47 L48 F54 | R46-A50 WeakPolarHBondContact O-CB 3.34Å; R46-A50 PolarHBondContact O-N 3.2Å; C47-A50 CarbonylContact O-C 3.02Å; C47-A50 WeakPolarHBondContact O-CB 3.38Å; C47-A50 PolarHBondContact O-N 3.09Å; L48-A50 VanDerWaalsContact C-N 3.31Å; L48-A50 PolarHBondContact O-N 3.47Å; A50-F54 WeakPolarHBondContact O-CB 3.14Å; A50-F54 PolarHBondContact O-N 2.92Å |
| 51 | I | 71.1 | Confident | 69.7 | Low | 33 Ų | 33 | 82.5 Ų | 82.5 | 17% | 0.169 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -57 | -58.1 | 170.5 | -63.6 | 163.2 | 0 | 0 | 0 | 109.3 | C47 L48 I53 F54 L55 V80 | C47-I51 WeakPolarHBondContact O-CG1 3.39Å; C47-I51 PolarHBondContact O-N 3.33Å; L48-I51 HydrophobicContact CD2-CD1 3.91Å; L48-I51 WeakPolarHBondContact O-CB 3.45Å; L48-I51 PolarHBondContact O-N 3.04Å; I51-I53 VanDerWaalsContact C-N 3.28Å; I51-I53 PolarHBondContact O-N 3.49Å; I51-F54 CarbonylContact O-C 3.51Å; I51-F54 WeakPolarHBondContact O-CA 3.29Å; I51-F54 WeakPolarHBondContact O-CB 3.12Å; I51-F54 PolarHBondContact O-N 3.38Å; I51-L55 HydrophobicContact CG2-CD1 3.89Å; I51-L55 HydrophobicContact CG2-CD2 4.26Å; I51-L55 HydrophobicContact CG2-CG 3.87Å; I51-L55 VanDerWaalsContact O-CG 3.28Å; I51-L55 WeakPolarHBondContact O-CG 3.43Å; I51-L55 PolarHBondContact O-N 2.94Å; I51-V80 HydrophobicContact CD1-CB 4.03Å; I51-V80 HydrophobicContact CD1-CG1 3.14Å; I51-V80 HydrophobicContact CD1-CG2 4.39Å; I51-V80 HydrophobicContact CG1-CB 3.84Å; I51-V80 HydrophobicContact CG1-CG1 3.41Å; I51-V80 VanDerWaalsContact CG1-CG1 3.41Å; I51-V80 HydrophobicContact CG1-CG2 3.68Å |
| 52 | I | 71.9 | Confident | 69.4 | Low | 105 Ų | 105 | 80.1 Ų | 80.1 | 54% | 0.538 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.1 | -43.3 | -174.2 | -67.1 | 176.8 | 0 | 0 | 0 | 110.7 | L48 S49 L55 V56 | L48-I52 WeakPolarHBondContact O-CG1 3.44Å; L48-I52 PolarHBondContact O-N 3.33Å; S49-I52 PolarHBondContact O-N 2.99Å; I52-L55 PolarHBondContact O-N 2.9Å; I52-V56 VanDerWaalsContact O-CG2 3.26Å; I52-V56 WeakPolarHBondContact O-CG2 3.27Å; I52-V56 PolarHBondContact O-N 2.71Å |
| 53 | I | 80.4 | Confident | 69.1 | Low | 108 Ų | 108 | 80 Ų | 80 | 55% | 0.554 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -62.6 | -44.7 | 175.6 | -66.4 | 165 | 0 | 0 | 0 | 110.7 | S49 I51 L55 V56 V57 | S49-I53 WeakPolarHBondContact O-CB 3.46Å; S49-I53 WeakPolarHBondContact O-CD1 3.14Å; S49-I53 WeakPolarHBondContact O-CG1 3.45Å; S49-I53 PolarHBondContact O-N 3.36Å; I51-I53 VanDerWaalsContact C-N 3.28Å; I51-I53 PolarHBondContact O-N 3.49Å; I53-L55 VanDerWaalsContact C-N 3.34Å; I53-L55 PolarHBondContact O-N 3.02Å; I53-V56 PolarHBondContact O-N 2.86Å; I53-V57 HydrophobicContact CG2-CG2 4.36Å; I53-V57 WeakPolarHBondContact O-CB 3.32Å; I53-V57 WeakPolarHBondContact O-CG2 3.31Å; I53-V57 PolarHBondContact O-N 3.22Å |
| 54 | F | 70.2 | Confident | 68.6 | Low | 82 Ų | 82 | 78.3 Ų | 78.3 | 36% | 0.36 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.4 | -36.4 | 178.2 | -169.4 | -97 | 0 | 0 | 0 | 112.2 | A50 I51 S58 A72 | A50-F54 WeakPolarHBondContact O-CB 3.14Å; A50-F54 PolarHBondContact O-N 2.92Å; I51-F54 CarbonylContact O-C 3.51Å; I51-F54 WeakPolarHBondContact O-CA 3.29Å; I51-F54 WeakPolarHBondContact O-CB 3.12Å; I51-F54 PolarHBondContact O-N 3.38Å; F54-S58 WeakPolarHBondContact O-CA 3.27Å; F54-S58 WeakPolarHBondContact O-CB 3.43Å; F54-S58 PolarHBondContact O-N 2.91Å; F54-S58 PolarHBondContact O-OG 3.42Å; F54-A72 WeakPolarHBondContact CE1-O 3.43Å; F54-A72 HydrophobicContact CZ-CB 4Å; F54-A72 VanDerWaalsContact CZ-O 3.28Å; F54-A72 WeakPolarHBondContact CZ-O 3.41Å |
| 55 | L | 67.8 | Low | 68.4 | Low | 55 Ų | 55 | 84.4 Ų | 84.4 | 29% | 0.288 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.9 | -43.4 | 172.7 | -60 | -176.5 | 0 | 0 | 0 | 111 | I51 I52 I53 S58 F59 F73 I77 | I51-L55 HydrophobicContact CG2-CD1 3.89Å; I51-L55 HydrophobicContact CG2-CD2 4.26Å; I51-L55 HydrophobicContact CG2-CG 3.87Å; I51-L55 VanDerWaalsContact O-CG 3.28Å; I51-L55 WeakPolarHBondContact O-CG 3.43Å; I51-L55 PolarHBondContact O-N 2.94Å; I52-L55 PolarHBondContact O-N 2.9Å; I53-L55 VanDerWaalsContact C-N 3.34Å; I53-L55 PolarHBondContact O-N 3.02Å; L55-S58 PolarHBondContact O-N 2.77Å; L55-F59 WeakPolarHBondContact O-CB 3.35Å; L55-F59 PolarHBondContact O-N 2.8Å; L55-F73 HydrophobicContact CB-CE2 4.34Å; L55-F73 HydrophobicContact CD2-CD2 3.68Å; L55-F73 HydrophobicContact CD2-CE1 4.48Å; L55-F73 HydrophobicContact CD2-CE2 3.04Å; L55-F73 HydrophobicContact CD2-CZ 3.5Å; L55-F73 HydrophobicContact CG-CE2 4.17Å; L55-I77 HydrophobicContact CD2-CD1 4.05Å |
| 56 | V | 75.6 | Confident | 68.4 | Low | 95 Ų | 95 | 85.5 Ų | 85.5 | 58% | 0.576 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63.8 | -46.5 | 177.8 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | I52 I53 F59 A60 | I52-V56 VanDerWaalsContact O-CG2 3.26Å; I52-V56 WeakPolarHBondContact O-CG2 3.27Å; I52-V56 PolarHBondContact O-N 2.71Å; I53-V56 PolarHBondContact O-N 2.86Å; V56-F59 PolarHBondContact O-N 3.23Å; V56-A60 WeakPolarHBondContact O-CB 3.28Å; V56-A60 PolarHBondContact O-N 3.45Å |
| 57 | V | 74.9 | Confident | 67.8 | Low | 87 Ų | 87 | 79.2 Ų | 79.2 | 53% | 0.527 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65.4 | -42.5 | 176.4 | 169.1 | 0 | 0 | 0 | 0 | 111 | I53 F59 A60 A61 | I53-V57 HydrophobicContact CG2-CG2 4.36Å; I53-V57 WeakPolarHBondContact O-CB 3.32Å; I53-V57 WeakPolarHBondContact O-CG2 3.31Å; I53-V57 PolarHBondContact O-N 3.22Å; V57-F59 VanDerWaalsContact C-N 3.34Å; V57-F59 PolarHBondContact O-N 2.79Å; V57-A60 PolarHBondContact O-N 2.87Å; V57-A61 WeakPolarHBondContact O-CB 3.49Å; V57-A61 PolarHBondContact O-N 3.36Å |
| 58 | S | 66.6 | Low | 67.6 | Low | 8 Ų | 8 | 81.4 Ų | 81.4 | 6% | 0.056 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -64.8 | -38.5 | 176.2 | -64.4 | 0 | 0 | 0 | 0 | 111.4 | F54 L55 A61 V62 | F54-S58 WeakPolarHBondContact O-CA 3.27Å; F54-S58 WeakPolarHBondContact O-CB 3.43Å; F54-S58 PolarHBondContact O-N 2.91Å; F54-S58 PolarHBondContact O-OG 3.42Å; L55-S58 PolarHBondContact O-N 2.77Å; S58-A61 CarbonylContact O-C 3.51Å; S58-A61 PolarHBondContact O-N 2.77Å; S58-V62 WeakPolarHBondContact O-CB 3.27Å; S58-V62 PolarHBondContact O-N 3.05Å |
| 59 | F | 63.4 | Low | 67.4 | Low | 147 Ų | 147 | 78.8 Ų | 78.8 | 65% | 0.645 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -66.1 | -45.1 | 175.3 | -176.7 | -98.1 | 0 | 0 | 0 | 110.9 | L55 V56 V57 A61 V62 T63 | L55-F59 WeakPolarHBondContact O-CB 3.35Å; L55-F59 PolarHBondContact O-N 2.8Å; V56-F59 PolarHBondContact O-N 3.23Å; V57-F59 VanDerWaalsContact C-N 3.34Å; V57-F59 PolarHBondContact O-N 2.79Å; F59-A61 VanDerWaalsContact C-N 3.26Å; F59-A61 PolarHBondContact O-N 3.22Å; F59-V62 PolarHBondContact O-N 3.35Å; F59-T63 PolarHBondContact O-N 2.88Å |
| 60 | A | 64.1 | Low | 67.2 | Low | 60 Ų | 60 | 81.5 Ų | 81.5 | 50% | 0.496 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -57.1 | -41.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | V56 V57 T63 | V56-A60 WeakPolarHBondContact O-CB 3.28Å; V56-A60 PolarHBondContact O-N 3.45Å; V57-A60 PolarHBondContact O-N 2.87Å; A60-T63 PolarHBondContact O-OG1 3.32Å |
| 61 | A | 61.5 | Low | 67.3 | Low | 40 Ų | 40 | 82 Ų | 82 | 33% | 0.331 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -73.6 | -32.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | V57 S58 F59 T63 S64 A69 | V57-A61 WeakPolarHBondContact O-CB 3.49Å; V57-A61 PolarHBondContact O-N 3.36Å; S58-A61 CarbonylContact O-C 3.51Å; S58-A61 PolarHBondContact O-N 2.77Å; F59-A61 VanDerWaalsContact C-N 3.26Å; F59-A61 PolarHBondContact O-N 3.22Å; A61-T63 PolarHBondContact O-N 3.4Å; A61-S64 WeakPolarHBondContact O-CA 3.31Å; A61-S64 WeakPolarHBondContact O-CB 3.37Å; A61-S64 PolarHBondContact O-N 3.32Å; A61-S64 PolarHBondContact O-OG 2.85Å; A61-A69 HydrophobicContact CB-CB 4.27Å |
| 62 | V | 58.8 | Low | 67.3 | Low | 63 Ų | 63 | 82.3 Ų | 82.3 | 38% | 0.382 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -67.1 | -25.4 | -179.9 | 105.9 | 0 | 0 | 0 | 0 | 111.2 | S58 F59 S64 R65 A69 I70 | S58-V62 WeakPolarHBondContact O-CB 3.27Å; S58-V62 PolarHBondContact O-N 3.05Å; F59-V62 PolarHBondContact O-N 3.35Å; V62-S64 PolarHBondContact O-N 2.72Å; V62-R65 PolarHBondContact O-N 3.41Å; V62-A69 HydrophobicContact CB-CB 4.48Å; V62-A69 HydrophobicContact CG2-CB 4.13Å; V62-I70 HydrophobicContact CG2-CG1 4.11Å |
| 63 | T | 61.5 | Low | 67 | Low | 109 Ų | 109 | 81.2 Ų | 81.2 | 67% | 0.669 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -16.1 | 169.5 | 71 | 0 | 0 | 0 | 0 | 113 | F59 A60 A61 | F59-T63 PolarHBondContact O-N 2.88Å; A60-T63 PolarHBondContact O-OG1 3.32Å; A61-T63 PolarHBondContact O-N 3.4Å |
| 64 | S | 59.6 | Low | 66.8 | Low | 62 Ų | 62 | 79.7 Ų | 79.7 | 43% | 0.434 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.8 | -4.8 | 172.1 | 95.1 | 0 | 0 | 0 | 0 | 114.4 | A61 V62 | A61-S64 WeakPolarHBondContact O-CA 3.31Å; A61-S64 WeakPolarHBondContact O-CB 3.37Å; A61-S64 PolarHBondContact O-N 3.32Å; A61-S64 PolarHBondContact O-OG 2.85Å; V62-S64 PolarHBondContact O-N 2.72Å |
| 65 | R | 59.8 | Low | 66.8 | Low | 234 Ų | 234 | 81.9 Ų | 81.9 | 88% | 0.883 | 47% | 0.473 | S | S | * | . | trans | 55.1 | 53.9 | 172.8 | -158.9 | -178.4 | -179.1 | -169.2 | -0.2 | 114.3 | V62 | V62-R65 PolarHBondContact O-N 3.41Š| ||
| 66 | E | 67.9 | Low | 67 | Low | 124 Ų | 124 | 80 Ų | 80 | 58% | 0.579 | 47% | 0.466 | S | S | * | . | trans | -120.2 | 129.7 | 173.2 | -72 | 155.4 | -165.9 | 0 | 0 | 109.7 | A68 A69 | E66-A68 PolarHBondContact O-N 3.09Å; E66-A69 WeakPolarHBondContact O-CB 3.13Å; E66-A69 PolarHBondContact O-N 3.45Å | ||
| 67 | G | 63.6 | Low | 66.9 | Low | 57 Ų | 57 | 78.7 Ų | 78.7 | 59% | 0.588 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -56.5 | -19.1 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | A69 I70 A71 | G67-A69 VanDerWaalsContact C-N 3.34Å; G67-A69 PolarHBondContact O-N 3.01Å; G67-I70 PolarHBondContact O-N 3.14Å; G67-A71 PolarHBondContact O-N 3.4Å; G67-A71 VanDerWaalsContact O-N 3.14Å |
| 68 | A | 65.6 | Low | 67.1 | Low | 72 Ų | 72 | 78.8 Ų | 78.8 | 60% | 0.595 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -62.2 | -35.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | E66 A71 A72 | E66-A68 PolarHBondContact O-N 3.09Å; A68-A71 PolarHBondContact O-N 3.49Å; A68-A72 VanDerWaalsContact O-CB 3.27Å; A68-A72 WeakPolarHBondContact O-CB 3.35Å; A68-A72 PolarHBondContact O-N 2.77Å |
| 69 | A | 67.8 | Low | 67.4 | Low | 13 Ų | 13 | 82.9 Ų | 82.9 | 11% | 0.107 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -67.3 | -39 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A61 V62 E66 G67 F73 | A61-A69 HydrophobicContact CB-CB 4.27Å; V62-A69 HydrophobicContact CB-CB 4.48Å; V62-A69 HydrophobicContact CG2-CB 4.13Å; E66-A69 WeakPolarHBondContact O-CB 3.13Å; E66-A69 PolarHBondContact O-N 3.45Å; G67-A69 VanDerWaalsContact C-N 3.34Å; G67-A69 PolarHBondContact O-N 3.01Å; A69-F73 VanDerWaalsContact O-CB 3.31Å; A69-F73 WeakPolarHBondContact O-CB 3.38Å; A69-F73 PolarHBondContact O-N 3.22Å |
| 70 | I | 68.8 | Low | 67.8 | Low | 105 Ų | 105 | 77.3 Ų | 77.3 | 54% | 0.538 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -68.4 | -42.2 | 177 | -58.3 | 171.7 | 0 | 0 | 0 | 110.2 | V62 G67 F73 V74 | V62-I70 HydrophobicContact CG2-CG1 4.11Å; G67-I70 PolarHBondContact O-N 3.14Å; I70-F73 WeakPolarHBondContact O-CB 3.21Å; I70-F73 PolarHBondContact O-N 2.85Å; I70-V74 WeakPolarHBondContact O-CG2 3.3Å; I70-V74 PolarHBondContact O-N 3.5Å; I70-V74 VanDerWaalsContact O-N 3.09Å |
| 71 | A | 72.4 | Confident | 68.2 | Low | 62 Ų | 62 | 77.7 Ų | 77.7 | 51% | 0.512 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -65.4 | -43.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | G67 A68 F73 V74 F75 | G67-A71 PolarHBondContact O-N 3.4Å; G67-A71 VanDerWaalsContact O-N 3.14Å; A68-A71 PolarHBondContact O-N 3.49Å; A71-F73 VanDerWaalsContact C-N 3.35Å; A71-F73 PolarHBondContact O-N 3.2Å; A71-V74 PolarHBondContact O-N 3.38Å; A71-F75 VanDerWaalsContact O-CB 3.3Å; A71-F75 WeakPolarHBondContact O-CB 3.35Å; A71-F75 PolarHBondContact O-N 2.85Å |
| 72 | A | 70.1 | Confident | 69 | Low | 41 Ų | 41 | 80.2 Ų | 80.2 | 34% | 0.339 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111 | F54 A68 F75 G76 | F54-A72 WeakPolarHBondContact CE1-O 3.43Å; F54-A72 HydrophobicContact CZ-CB 4Å; F54-A72 VanDerWaalsContact CZ-O 3.28Å; F54-A72 WeakPolarHBondContact CZ-O 3.41Å; A68-A72 VanDerWaalsContact O-CB 3.27Å; A68-A72 WeakPolarHBondContact O-CB 3.35Å; A68-A72 PolarHBondContact O-N 2.77Å; A72-F75 PolarHBondContact O-N 3.49Å; A72-G76 PolarHBondContact O-N 2.77Å |
| 73 | F | 67.6 | Low | 69.5 | Low | 82 Ų | 82 | 83.6 Ų | 83.6 | 36% | 0.36 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -55.1 | -52.7 | 175.6 | -174.7 | -90.2 | 0 | 0 | 0 | 112.7 | L55 A69 I70 A71 G76 I77 | L55-F73 HydrophobicContact CB-CE2 4.34Å; L55-F73 HydrophobicContact CD2-CD2 3.68Å; L55-F73 HydrophobicContact CD2-CE1 4.48Å; L55-F73 HydrophobicContact CD2-CE2 3.04Å; L55-F73 HydrophobicContact CD2-CZ 3.5Å; L55-F73 HydrophobicContact CG-CE2 4.17Å; A69-F73 VanDerWaalsContact O-CB 3.31Å; A69-F73 WeakPolarHBondContact O-CB 3.38Å; A69-F73 PolarHBondContact O-N 3.22Å; I70-F73 WeakPolarHBondContact O-CB 3.21Å; I70-F73 PolarHBondContact O-N 2.85Å; A71-F73 VanDerWaalsContact C-N 3.35Å; A71-F73 PolarHBondContact O-N 3.2Å; F73-G76 PolarHBondContact O-N 3.15Å; F73-I77 HydrophobicContact CD1-CG1 4.39Å; F73-I77 HydrophobicContact CE1-CG1 4.18Å; F73-I77 WeakPolarHBondContact O-CG1 3.47Å; F73-I77 PolarHBondContact O-N 3.38Å |
| 74 | V | 74.3 | Confident | 69.9 | Low | 75 Ų | 75 | 79.4 Ų | 79.4 | 46% | 0.455 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65.1 | -42.3 | -179 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | I70 A71 G76 I77 I78 | I70-V74 WeakPolarHBondContact O-CG2 3.3Å; I70-V74 PolarHBondContact O-N 3.5Å; I70-V74 VanDerWaalsContact O-N 3.09Å; A71-V74 PolarHBondContact O-N 3.38Å; V74-G76 VanDerWaalsContact C-N 3.35Å; V74-G76 PolarHBondContact O-N 2.81Å; V74-I77 PolarHBondContact O-N 2.9Å; V74-I78 HydrophobicContact CG1-CD1 3.83Å; V74-I78 HydrophobicContact CG1-CG1 4.45Å; V74-I78 VanDerWaalsContact O-CG1 3.29Å; V74-I78 WeakPolarHBondContact O-CG1 3.38Å; V74-I78 PolarHBondContact O-N 2.94Å |
| 75 | F | 71.9 | Confident | 70.5 | Confident | 129 Ų | 129 | 83.7 Ų | 83.7 | 57% | 0.566 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -64.9 | -39.8 | 178.3 | -168.8 | -108.9 | 0 | 0 | 0 | 112 | A71 A72 I78 L79 | A71-F75 VanDerWaalsContact O-CB 3.3Å; A71-F75 WeakPolarHBondContact O-CB 3.35Å; A71-F75 PolarHBondContact O-N 2.85Å; A72-F75 PolarHBondContact O-N 3.49Å; F75-I78 PolarHBondContact O-N 2.92Å; F75-L79 HydrophobicContact CD1-CD1 3.73Å; F75-L79 HydrophobicContact CD1-CG 4.18Å; F75-L79 HydrophobicContact CE1-CD1 3.28Å; F75-L79 HydrophobicContact CE1-CD2 4.45Å; F75-L79 HydrophobicContact CE1-CG 3.89Å; F75-L79 HydrophobicContact CE2-CG 4.44Å; F75-L79 HydrophobicContact CZ-CD1 3.8Å; F75-L79 HydrophobicContact CZ-CD2 4.14Å; F75-L79 HydrophobicContact CZ-CG 4.02Å; F75-L79 WeakPolarHBondContact O-CB 3.28Å; F75-L79 WeakPolarHBondContact O-CG 3.48Å; F75-L79 PolarHBondContact O-N 2.95Å |
| 76 | G | 71 | Confident | 71.3 | Confident | 14 Ų | 14 | 77 Ų | 77 | 14% | 0.144 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | A72 F73 V74 I78 V80 | A72-G76 PolarHBondContact O-N 2.77Å; F73-G76 PolarHBondContact O-N 3.15Å; V74-G76 VanDerWaalsContact C-N 3.35Å; V74-G76 PolarHBondContact O-N 2.81Å; G76-I78 PolarHBondContact O-N 3.48Å; G76-V80 WeakPolarHBondContact O-CB 3.47Å; G76-V80 VanDerWaalsContact O-CG2 3.27Å; G76-V80 WeakPolarHBondContact O-CG2 3.06Å; G76-V80 PolarHBondContact O-N 2.77Å |
| 77 | I | 72.8 | Confident | 71.3 | Confident | 68 Ų | 68 | 72.8 Ų | 72.8 | 35% | 0.349 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 175.6 | -68 | -77.3 | 0 | 0 | 0 | 111.4 | L55 F73 V74 S81 | L55-I77 HydrophobicContact CD2-CD1 4.05Å; F73-I77 HydrophobicContact CD1-CG1 4.39Å; F73-I77 HydrophobicContact CE1-CG1 4.18Å; F73-I77 WeakPolarHBondContact O-CG1 3.47Å; F73-I77 PolarHBondContact O-N 3.38Å; V74-I77 PolarHBondContact O-N 2.9Å; I77-S81 VanDerWaalsContact O-CB 3.29Å; I77-S81 WeakPolarHBondContact O-CB 3.4Å; I77-S81 PolarHBondContact O-N 3.42Å; I77-S81 PolarHBondContact O-OG 2.84Å |
| 78 | I | 79.1 | Confident | 71.5 | Confident | 90 Ų | 90 | 75.5 Ų | 75.5 | 46% | 0.462 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -65.9 | -50 | -179.7 | -68.9 | 171 | 0 | 0 | 0 | 110.8 | V74 F75 G76 V80 S81 V82 | V74-I78 HydrophobicContact CG1-CD1 3.83Å; V74-I78 HydrophobicContact CG1-CG1 4.45Å; V74-I78 VanDerWaalsContact O-CG1 3.29Å; V74-I78 WeakPolarHBondContact O-CG1 3.38Å; V74-I78 PolarHBondContact O-N 2.94Å; F75-I78 PolarHBondContact O-N 2.92Å; G76-I78 PolarHBondContact O-N 3.48Å; I78-V80 VanDerWaalsContact C-N 3.3Å; I78-V80 PolarHBondContact O-N 2.77Å; I78-S81 PolarHBondContact O-N 2.67Å; I78-V82 HydrophobicContact CG2-CG2 4.5Å; I78-V82 WeakPolarHBondContact O-CG2 3.46Å; I78-V82 PolarHBondContact O-N 2.76Å |
| 79 | L | 74.1 | Confident | 71.9 | Confident | 93 Ų | 93 | 77 Ų | 77 | 49% | 0.487 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 179.8 | -75.6 | -175.2 | 0 | 0 | 0 | 111.5 | F75 V82 F83 | F75-L79 HydrophobicContact CD1-CD1 3.73Å; F75-L79 HydrophobicContact CD1-CG 4.18Å; F75-L79 HydrophobicContact CE1-CD1 3.28Å; F75-L79 HydrophobicContact CE1-CD2 4.45Å; F75-L79 HydrophobicContact CE1-CG 3.89Å; F75-L79 HydrophobicContact CE2-CG 4.44Å; F75-L79 HydrophobicContact CZ-CD1 3.8Å; F75-L79 HydrophobicContact CZ-CD2 4.14Å; F75-L79 HydrophobicContact CZ-CG 4.02Å; F75-L79 WeakPolarHBondContact O-CB 3.28Å; F75-L79 WeakPolarHBondContact O-CG 3.48Å; F75-L79 PolarHBondContact O-N 2.95Å; L79-V82 PolarHBondContact O-N 3.48Å; L79-F83 WeakPolarHBondContact O-CB 3.14Å; L79-F83 PolarHBondContact O-N 3Å |
| 80 | V | 70.8 | Confident | 72 | Confident | 30 Ų | 30 | 80.4 Ų | 80.4 | 18% | 0.182 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -68.6 | -40.1 | 178.2 | 176.9 | 0 | 0 | 0 | 0 | 111.6 | C47 I51 G76 I78 V82 F83 A84 | C47-V80 VanDerWaalsContact SG-CG1 3.51Å; I51-V80 HydrophobicContact CD1-CB 4.03Å; I51-V80 HydrophobicContact CD1-CG1 3.14Å; I51-V80 HydrophobicContact CD1-CG2 4.39Å; I51-V80 HydrophobicContact CG1-CB 3.84Å; I51-V80 HydrophobicContact CG1-CG1 3.41Å; I51-V80 VanDerWaalsContact CG1-CG1 3.41Å; I51-V80 HydrophobicContact CG1-CG2 3.68Å; G76-V80 WeakPolarHBondContact O-CB 3.47Å; G76-V80 VanDerWaalsContact O-CG2 3.27Å; G76-V80 WeakPolarHBondContact O-CG2 3.06Å; G76-V80 PolarHBondContact O-N 2.77Å; I78-V80 VanDerWaalsContact C-N 3.3Å; I78-V80 PolarHBondContact O-N 2.77Å; V80-V82 VanDerWaalsContact C-N 3.3Å; V80-V82 PolarHBondContact O-N 3.34Å; V80-F83 PolarHBondContact O-N 2.86Å; V80-A84 WeakPolarHBondContact O-CB 3.49Å; V80-A84 PolarHBondContact O-N 2.91Å |
| 81 | S | 72.9 | Confident | 71.6 | Confident | 68 Ų | 68 | 79.3 Ų | 79.3 | 48% | 0.476 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61 | -40.9 | 176.5 | -59.9 | 0 | 0 | 0 | 0 | 111.6 | I77 I78 Y85 | I77-S81 VanDerWaalsContact O-CB 3.29Å; I77-S81 WeakPolarHBondContact O-CB 3.4Å; I77-S81 PolarHBondContact O-N 3.42Å; I77-S81 PolarHBondContact O-OG 2.84Å; I78-S81 PolarHBondContact O-N 2.67Å; S81-Y85 WeakPolarHBondContact O-CB 3.46Å; S81-Y85 PolarHBondContact O-N 3.48Å |
| 82 | V | 77.8 | Confident | 71.2 | Confident | 93 Ų | 93 | 82.4 Ų | 82.4 | 56% | 0.564 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -66 | -45.5 | 176 | 172.3 | 0 | 0 | 0 | 0 | 111 | I78 L79 V80 Y85 D86 | I78-V82 HydrophobicContact CG2-CG2 4.5Å; I78-V82 WeakPolarHBondContact O-CG2 3.46Å; I78-V82 PolarHBondContact O-N 2.76Å; L79-V82 PolarHBondContact O-N 3.48Å; V80-V82 VanDerWaalsContact C-N 3.3Å; V80-V82 PolarHBondContact O-N 3.34Å; V82-Y85 PolarHBondContact O-N 3.3Å; V82-D86 WeakPolarHBondContact O-CB 3.43Å; V82-D86 PolarHBondContact O-N 3.02Å |
| 83 | F | 69.4 | Low | 70.8 | Confident | 134 Ų | 134 | 84.6 Ų | 84.6 | 59% | 0.588 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -66.4 | -42.5 | -179.3 | -151.4 | -91.3 | 0 | 0 | 0 | 112 | L79 V80 D86 A87 | L79-F83 WeakPolarHBondContact O-CB 3.14Å; L79-F83 PolarHBondContact O-N 3Å; V80-F83 PolarHBondContact O-N 2.86Å; F83-D86 PolarHBondContact O-N 3.2Å; F83-A87 WeakPolarHBondContact O-CB 3.45Å; F83-A87 PolarHBondContact O-N 3.27Å |
| 84 | A | 70.7 | Confident | 70.3 | Confident | 22 Ų | 22 | 86.6 Ų | 86.6 | 18% | 0.182 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -64 | -40.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F44 V80 F88 | F44-A84 HydrophobicContact CD2-CB 4.43Å; F44-A84 HydrophobicContact CE2-CB 3.93Å; V80-A84 WeakPolarHBondContact O-CB 3.49Å; V80-A84 PolarHBondContact O-N 2.91Å; A84-F88 WeakPolarHBondContact O-CB 3.22Å; A84-F88 PolarHBondContact O-N 2.7Å |
| 85 | Y | 72.3 | Confident | 69.4 | Low | 152 Ų | 152 | 85.7 Ų | 85.7 | 60% | 0.596 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -68.9 | -38.2 | 177.9 | -174.2 | -98.1 | 0 | 0 | 0 | 112 | S81 V82 F88 K89 | S81-Y85 WeakPolarHBondContact O-CB 3.46Å; S81-Y85 PolarHBondContact O-N 3.48Å; V82-Y85 PolarHBondContact O-N 3.3Å; Y85-F88 PolarHBondContact O-N 2.92Å; Y85-K89 HydrophobicContact CD1-CG 4.12Å; Y85-K89 HydrophobicContact CE1-CD 4.41Å; Y85-K89 HydrophobicContact CE1-CG 3.7Å; Y85-K89 WeakPolarHBondContact O-CB 3.28Å; Y85-K89 WeakPolarHBondContact O-CG 3.43Å; Y85-K89 PolarHBondContact O-N 3.01Å |
| 86 | D | 76.3 | Confident | 68.4 | Low | 94 Ų | 94 | 85.6 Ų | 85.6 | 50% | 0.503 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.8 | -48.6 | 175.6 | -166.7 | 53.6 | 0 | 0 | 0 | 111 | V82 F83 F88 K89 I90 | V82-D86 WeakPolarHBondContact O-CB 3.43Å; V82-D86 PolarHBondContact O-N 3.02Å; F83-D86 PolarHBondContact O-N 3.2Å; D86-F88 PolarHBondContact O-N 2.86Å; D86-K89 WeakPolarHBondContact O-CB 3.32Å; D86-K89 PolarHBondContact O-N 3.26Å; D86-K89 VanDerWaalsContact O-N 3.15Å; D86-I90 VanDerWaalsContact O-CD1 3.23Å; D86-I90 WeakPolarHBondContact O-CD1 3.35Å; D86-I90 PolarHBondContact O-N 2.68Å |
| 87 | A | 67.1 | Low | 67.5 | Low | 35 Ų | 35 | 88.7 Ų | 88.7 | 29% | 0.289 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.4 | -42.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | F83 K89 I90 Y91 | F83-A87 WeakPolarHBondContact O-CB 3.45Å; F83-A87 PolarHBondContact O-N 3.27Å; A87-K89 VanDerWaalsContact C-N 3.34Å; A87-K89 PolarHBondContact O-N 3.31Å; A87-I90 PolarHBondContact O-N 3.35Å; A87-Y91 WeakPolarHBondContact O-CB 3.19Å; A87-Y91 PolarHBondContact O-N 3.36Å |
| 88 | F | 68.5 | Low | 66.4 | Low | 113 Ų | 113 | 94.7 Ų | 94.7 | 50% | 0.496 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.3 | -35.2 | 175.8 | -178.3 | -100.3 | 0 | 0 | 0 | 112.3 | A84 Y85 D86 R92 | A84-F88 WeakPolarHBondContact O-CB 3.22Å; A84-F88 PolarHBondContact O-N 2.7Å; Y85-F88 PolarHBondContact O-N 2.92Å; D86-F88 PolarHBondContact O-N 2.86Å; F88-R92 HydrophobicContact CD1-CG 4.27Å; F88-R92 HydrophobicContact CE1-CG 3.78Å; F88-R92 HydrophobicContact CE2-CG 4.23Å; F88-R92 HydrophobicContact CZ-CG 3.76Å; F88-R92 VanDerWaalsContact O-CB 3.32Å; F88-R92 WeakPolarHBondContact O-CB 3.26Å; F88-R92 PolarHBondContact O-N 3.21Å |
| 89 | K | 73.4 | Confident | 65 | Low | 105 Ų | 105 | 96.5 Ų | 96.5 | 46% | 0.457 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66 | -48.8 | 174.6 | -94.5 | -92.3 | -80.2 | 161.1 | 0 | 110.8 | Y85 D86 A87 Y91 R92 T93 | Y85-K89 HydrophobicContact CD1-CG 4.12Å; Y85-K89 HydrophobicContact CE1-CD 4.41Å; Y85-K89 HydrophobicContact CE1-CG 3.7Å; Y85-K89 WeakPolarHBondContact O-CB 3.28Å; Y85-K89 WeakPolarHBondContact O-CG 3.43Å; Y85-K89 PolarHBondContact O-N 3.01Å; D86-K89 WeakPolarHBondContact O-CB 3.32Å; D86-K89 PolarHBondContact O-N 3.26Å; D86-K89 VanDerWaalsContact O-N 3.15Å; A87-K89 VanDerWaalsContact C-N 3.34Å; A87-K89 PolarHBondContact O-N 3.31Å; K89-Y91 VanDerWaalsContact C-N 3.33Å; K89-Y91 PolarHBondContact O-N 3.29Å; K89-R92 PolarHBondContact O-N 3.36Å; K89-T93 WeakPolarHBondContact O-CG2 3.43Å; K89-T93 PolarHBondContact O-N 2.84Å; K89-T93 PolarHBondContact O-OG1 2.88Å |
| 90 | I | 70.8 | Confident | 63.8 | Low | 84 Ų | 84 | 98.6 Ų | 98.6 | 43% | 0.431 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.3 | -48.3 | 174.3 | -91.2 | 78.5 | 0 | 0 | 0 | 110.1 | D86 A87 R92 T93 E94 | D86-I90 VanDerWaalsContact O-CD1 3.23Å; D86-I90 WeakPolarHBondContact O-CD1 3.35Å; D86-I90 PolarHBondContact O-N 2.68Å; A87-I90 PolarHBondContact O-N 3.35Å; I90-R92 PolarHBondContact O-N 2.91Å; I90-T93 WeakPolarHBondContact CA-OG1 3.41Å; I90-T93 PolarHBondContact O-N 3.5Å; I90-T93 PolarHBondContact O-OG1 2.89Å; I90-E94 WeakPolarHBondContact O-CB 3.46Å; I90-E94 PolarHBondContact O-N 3.48Å |
| 91 | Y | 60.8 | Low | 62.8 | Low | 82 Ų | 82 | 106 Ų | 106 | 32% | 0.322 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -57.5 | -50.3 | 177.5 | -179.7 | -84 | 0 | 0 | 0 | 111.1 | L37 A87 K89 T93 E94 L95 | L37-Y91 HydrophobicContact CD1-CD2 3.9Å; L37-Y91 HydrophobicContact CD1-CE2 3.1Å; L37-Y91 HydrophobicContact CG-CE2 3.7Å; A87-Y91 WeakPolarHBondContact O-CB 3.19Å; A87-Y91 PolarHBondContact O-N 3.36Å; K89-Y91 VanDerWaalsContact C-N 3.33Å; K89-Y91 PolarHBondContact O-N 3.29Å; Y91-T93 VanDerWaalsContact C-N 3.33Å; Y91-T93 PolarHBondContact O-N 3.26Å; Y91-E94 PolarHBondContact O-N 3.05Å; Y91-L95 HydrophobicContact CD1-CD1 3.85Å; Y91-L95 HydrophobicContact CD2-CD1 3.35Å; Y91-L95 HydrophobicContact CE1-CD1 3.9Å; Y91-L95 HydrophobicContact CE2-CD1 3.46Å; Y91-L95 VanDerWaalsContact CE2-CD1 3.46Å; Y91-L95 HydrophobicContact CG-CD1 3.56Å; Y91-L95 VanDerWaalsContact O-CB 3.28Å; Y91-L95 WeakPolarHBondContact O-CB 3.33Å; Y91-L95 VanDerWaalsContact O-CD1 3.28Å; Y91-L95 WeakPolarHBondContact O-CD1 3.42Å; Y91-L95 PolarHBondContact O-N 2.76Å |
| 92 | R | 63.1 | Low | 61.4 | Low | 127 Ų | 127 | 106.6 Ų | 106.6 | 48% | 0.479 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.6 | -37 | 177.5 | -86.7 | -85.8 | -91.9 | -168.9 | -8.3 | 112.9 | F88 K89 I90 M96 | F88-R92 HydrophobicContact CD1-CG 4.27Å; F88-R92 HydrophobicContact CE1-CG 3.78Å; F88-R92 HydrophobicContact CE2-CG 4.23Å; F88-R92 HydrophobicContact CZ-CG 3.76Å; F88-R92 VanDerWaalsContact O-CB 3.32Å; F88-R92 WeakPolarHBondContact O-CB 3.26Å; F88-R92 PolarHBondContact O-N 3.21Å; K89-R92 PolarHBondContact O-N 3.36Å; I90-R92 PolarHBondContact O-N 2.91Å; R92-M96 PolarHBondContact NH1-SD 3.23Å; R92-M96 WeakPolarHBondContact O-CB 3.33Å; R92-M96 PolarHBondContact O-N 2.85Å |
| 93 | T | 61.4 | Low | 59.9 | Low | 86 Ų | 86 | 109.6 Ų | 109.6 | 53% | 0.528 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -74.1 | -34.3 | -179.7 | 44.2 | 0 | 0 | 0 | 0 | 113.3 | K89 I90 Y91 | K89-T93 WeakPolarHBondContact O-CG2 3.43Å; K89-T93 PolarHBondContact O-N 2.84Å; K89-T93 PolarHBondContact O-OG1 2.88Å; I90-T93 WeakPolarHBondContact CA-OG1 3.41Å; I90-T93 PolarHBondContact O-N 3.5Å; I90-T93 PolarHBondContact O-OG1 2.89Å; Y91-T93 VanDerWaalsContact C-N 3.33Å; Y91-T93 PolarHBondContact O-N 3.26Å |
| 94 | E | 57.7 | Low | 58.9 | Low | 125 Ų | 125 | 112.2 Ų | 112.2 | 58% | 0.584 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -84.6 | -30.6 | -179.9 | -74.3 | -74.1 | 162.6 | 0 | 0 | 112.7 | I90 Y91 P97 | I90-E94 WeakPolarHBondContact O-CB 3.46Å; I90-E94 PolarHBondContact O-N 3.48Å; Y91-E94 PolarHBondContact O-N 3.05Å; E94-P97 WeakPolarHBondContact O-CD 3.2Å |
| 95 | L | 55.3 | Low | 57.3 | Low | 56 Ų | 56 | 124.1 Ų | 124.1 | 29% | 0.293 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -93.5 | -5.8 | -176.9 | -75.8 | 130.8 | 0 | 0 | 0 | 115.5 | L37 Y91 | L37-L95 HydrophobicContact CD1-CD1 3.18Å; L37-L95 HydrophobicContact CD1-CD2 3.34Å; L37-L95 HydrophobicContact CD1-CG 3.86Å; Y91-L95 HydrophobicContact CD1-CD1 3.85Å; Y91-L95 HydrophobicContact CD2-CD1 3.35Å; Y91-L95 HydrophobicContact CE1-CD1 3.9Å; Y91-L95 HydrophobicContact CE2-CD1 3.46Å; Y91-L95 VanDerWaalsContact CE2-CD1 3.46Å; Y91-L95 HydrophobicContact CG-CD1 3.56Å; Y91-L95 VanDerWaalsContact O-CB 3.28Å; Y91-L95 WeakPolarHBondContact O-CB 3.33Å; Y91-L95 VanDerWaalsContact O-CD1 3.28Å; Y91-L95 WeakPolarHBondContact O-CD1 3.42Å; Y91-L95 PolarHBondContact O-N 2.76Å |
| 96 | M | 51.6 | Low | 56.6 | Low | 126 Ų | 126 | 122.8 Ų | 122.8 | 62% | 0.621 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -115.8 | 35.9 | 178.4 | -66.8 | -164.9 | 149 | 0 | 0 | 116.6 | R92 | R92-M96 PolarHBondContact NH1-SD 3.23Å; R92-M96 WeakPolarHBondContact O-CB 3.33Å; R92-M96 PolarHBondContact O-N 2.85Å |
| 97 | P | 51 | Low | 55.5 | Low | 80 Ų | 80 | 124.3 Ų | 124.3 | 52% | 0.519 | 64% | 0.635 | S | S | . | * | S | Bend | trans | -131.4 | 33.8 | 151.2 | 35.8 | -20.5 | 0 | 0 | 0 | 113.3 | E94 | E94-P97 WeakPolarHBondContact O-CD 3.2Š|
| 98 | R | 49.7 | Very low | 54.9 | Low | 194 Ų | 194 | 129.2 Ų | 129.2 | 73% | 0.732 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -129.9 | 31.5 | 174.9 | -58.9 | -65.8 | 161.5 | 94.7 | 6.6 | 114 | ||
| 99 | T | 49.6 | Very low | 54.1 | Low | 127 Ų | 127 | 130.2 Ų | 130.2 | 78% | 0.779 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -122.5 | 14.7 | 168.9 | -20.7 | 0 | 0 | 0 | 0 | 112.5 | ||
| 100 | T | 50.4 | Low | 52.9 | Low | 138 Ų | 138 | 131.8 Ų | 131.8 | 85% | 0.847 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -143.6 | 41 | 177 | -37.9 | 0 | 0 | 0 | 0 | 111.2 | ||
| 101 | E | 48.1 | Very low | 51.7 | Low | 184 Ų | 184 | 134.9 Ų | 134.9 | 86% | 0.86 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -150.3 | 57.5 | 169.5 | -155.5 | 174.9 | 98.5 | 0 | 0 | 109 | ||
| 102 | G | 45.1 | Very low | 51 | Low | 81 Ų | 81 | 138.7 Ų | 138.7 | 84% | 0.835 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -158 | 20.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 103 | D | 46.7 | Very low | 50.1 | Low | 156 Ų | 156 | 139.6 Ų | 139.6 | 83% | 0.834 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -128.9 | 127 | 167.5 | -136.3 | -9.3 | 0 | 0 | 0 | 104.8 | ||
| 104 | Q | 46.6 | Very low | 49.1 | Very low | 190 Ų | 190 | 144.1 Ų | 144.1 | 89% | 0.888 | 76% | 0.755 | S | S | * | * | trans | 90.7 | 78.4 | -169.5 | -44.8 | -143.1 | -47.9 | 0 | 0 | 116.4 | ||||
| 105 | Q | 37.9 | Very low | 48.4 | Very low | 272 Ų | 272 | 145.8 Ų | 145.8 | 100% | 1.271 | 77% | 0.771 | S | S | * | * | -158.9 | 0 | 112.5 | -139.8 | 173.2 | -98.5 | 0 | 0 | 112.4 |
Retrieved 105 of 105 residues in 62.7 ms
(Link to these results)