| 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 | 44.9 | Very low | 52.3 | Low | 252 Ų | 252 | 116.8 Ų | 116.8 | 100% | 1.241 | 69% | 0.693 | S | S | * | * | 0 | 95.4 | 0 | -80.3 | 157 | 132.7 | 0 | 0 | 107.7 | |||||
| 2 | G | 50.5 | Low | 52.5 | Low | 83 Ų | 83 | 112.6 Ų | 112.6 | 86% | 0.856 | 67% | 0.674 | S | S | * | * | trans | -138.7 | 42.8 | -171.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 3 | G | 49.4 | Very low | 52.6 | Low | 55 Ų | 55 | 110.9 Ų | 110.9 | 57% | 0.567 | 66% | 0.659 | S | S | * | * | trans | -119.7 | 2.9 | -172.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 4 | H | 48.9 | Very low | 52.9 | Low | 179 Ų | 179 | 110.3 Ų | 110.3 | 83% | 0.829 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | -8.5 | -173.1 | -123 | -20.5 | 0 | 0 | 0 | 115.2 | ||
| 5 | G | 53.8 | Low | 53.1 | Low | 59 Ų | 59 | 115 Ų | 115 | 61% | 0.608 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -14.9 | 179 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 6 | V | 54.2 | Low | 53.6 | Low | 94 Ų | 94 | 112.4 Ų | 112.4 | 57% | 0.57 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -44.8 | -176.1 | 179.1 | 0 | 0 | 0 | 0 | 111.2 | A8 N9 E10 | V6-A8 PolarHBondContact O-N 3.28Å; V6-N9 PolarHBondContact O-N 3.09Å; V6-E10 PolarHBondContact O-N 3.31Å; V6-E10 VanDerWaalsContact O-N 3.12Å |
| 7 | M | 54.6 | Low | 54.3 | Low | 135 Ų | 135 | 110.9 Ų | 110.9 | 67% | 0.665 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -68.1 | -31.4 | -178.5 | -63.4 | -145.4 | -147.3 | 0 | 0 | 114.3 | N9 E10 E11 | M7-N9 VanDerWaalsContact C-N 3.31Å; M7-E10 PolarHBondContact O-N 3.15Å; M7-E11 PolarHBondContact O-N 3.13Å |
| 8 | A | 53.6 | Low | 55 | Low | 64 Ų | 64 | 111.7 Ų | 111.7 | 53% | 0.529 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -72.9 | -26 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V6 S12 | V6-A8 PolarHBondContact O-N 3.28Å; A8-S12 PolarHBondContact O-OG 3.43Å |
| 9 | N | 54.8 | Low | 55.8 | Low | 93 Ų | 93 | 112.5 Ų | 112.5 | 50% | 0.497 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -77.6 | -37.7 | 174.3 | -156.8 | -9.3 | 0 | 0 | 0 | 110.2 | V6 M7 S12 L13 | V6-N9 PolarHBondContact O-N 3.09Å; M7-N9 VanDerWaalsContact C-N 3.31Å; N9-S12 WeakPolarHBondContact CA-OG 3.49Å; N9-S12 PolarHBondContact O-N 3.35Å; N9-S12 PolarHBondContact O-OG 2.86Å; N9-S12 VanDerWaalsContact O-OG 3.1Å; N9-L13 VanDerWaalsContact O-CB 3.27Å; N9-L13 WeakPolarHBondContact O-CB 3.34Å; N9-L13 WeakPolarHBondContact O-CD1 3.41Å; N9-L13 WeakPolarHBondContact O-CG 3.42Å; N9-L13 PolarHBondContact O-N 3.39Å |
| 10 | E | 55.4 | Low | 56.7 | Low | 117 Ų | 117 | 109.7 Ų | 109.7 | 55% | 0.547 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64.5 | -44.6 | 176.9 | -74.7 | 175.3 | 126.3 | 0 | 0 | 113.5 | V6 M7 S12 L13 D14 | V6-E10 PolarHBondContact O-N 3.31Å; V6-E10 VanDerWaalsContact O-N 3.12Å; M7-E10 PolarHBondContact O-N 3.15Å; E10-S12 PolarHBondContact O-N 3.4Å; E10-L13 PolarHBondContact O-N 3.29Å; E10-D14 PolarHBondContact O-N 3.2Å |
| 11 | E | 55.2 | Low | 57.7 | Low | 154 Ų | 154 | 113 Ų | 113 | 72% | 0.72 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -67.6 | -32.8 | 177.8 | -80.8 | -176.6 | 150.5 | 0 | 0 | 113.5 | M7 Y15 | M7-E11 PolarHBondContact O-N 3.13Å; E11-Y15 PolarHBondContact O-N 2.92Å |
| 12 | S | 55 | Low | 59.2 | Low | 66 Ų | 66 | 105.9 Ų | 105.9 | 46% | 0.462 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -78.1 | -30.6 | 176.1 | 51.2 | 0 | 0 | 0 | 0 | 112.5 | A8 N9 E10 Y15 S16 | A8-S12 PolarHBondContact O-OG 3.43Å; N9-S12 WeakPolarHBondContact CA-OG 3.49Å; N9-S12 PolarHBondContact O-N 3.35Å; N9-S12 PolarHBondContact O-OG 2.86Å; N9-S12 VanDerWaalsContact O-OG 3.1Å; E10-S12 PolarHBondContact O-N 3.4Å; S12-Y15 PolarHBondContact O-N 3.35Å; S12-S16 WeakPolarHBondContact O-CB 3.45Å; S12-S16 PolarHBondContact O-N 3.34Å |
| 13 | L | 54 | Low | 60.4 | Low | 91 Ų | 91 | 108.4 Ų | 108.4 | 48% | 0.476 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.1 | -41 | 170.6 | -74.4 | 169.6 | 0 | 0 | 0 | 111.8 | N9 E10 Y15 S16 V17 | N9-L13 VanDerWaalsContact O-CB 3.27Å; N9-L13 WeakPolarHBondContact O-CB 3.34Å; N9-L13 WeakPolarHBondContact O-CD1 3.41Å; N9-L13 WeakPolarHBondContact O-CG 3.42Å; N9-L13 PolarHBondContact O-N 3.39Å; E10-L13 PolarHBondContact O-N 3.29Å; L13-Y15 VanDerWaalsContact C-N 3.3Å; L13-Y15 PolarHBondContact O-N 2.71Å; L13-S16 PolarHBondContact O-N 3.03Å; L13-V17 WeakPolarHBondContact O-CB 3.47Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.42Å; L13-V17 PolarHBondContact O-N 2.79Å |
| 14 | D | 55.9 | Low | 61.9 | Low | 102 Ų | 102 | 107.7 Ų | 107.7 | 55% | 0.545 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.5 | -40.3 | 174.5 | -101.7 | -9.5 | 0 | 0 | 0 | 111.3 | E10 V17 H18 | E10-D14 PolarHBondContact O-N 3.2Å; D14-V17 PolarHBondContact O-N 3.5Å; D14-H18 WeakPolarHBondContact O-CB 3.06Å; D14-H18 PolarHBondContact O-CD2 3.16Å; D14-H18 PolarHBondContact O-N 3.34Å |
| 15 | Y | 56.6 | Low | 63.6 | Low | 181 Ų | 181 | 101 Ų | 101 | 71% | 0.71 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.2 | -41.6 | 175.1 | -128.8 | -91.6 | 0 | 0 | 0 | 112.6 | E11 S12 L13 H18 E19 | E11-Y15 PolarHBondContact O-N 2.92Å; S12-Y15 PolarHBondContact O-N 3.35Å; L13-Y15 VanDerWaalsContact C-N 3.3Å; L13-Y15 PolarHBondContact O-N 2.71Å; Y15-H18 PolarHBondContact O-N 2.81Å; Y15-E19 WeakPolarHBondContact O-CB 3.31Å; Y15-E19 PolarHBondContact O-N 2.82Å |
| 16 | S | 61.3 | Low | 65.1 | Low | 73 Ų | 73 | 102.4 Ų | 102.4 | 51% | 0.51 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.1 | -37.8 | 176.7 | -177.3 | 0 | 0 | 0 | 0 | 112.7 | S12 L13 E19 A20 | S12-S16 WeakPolarHBondContact O-CB 3.45Å; S12-S16 PolarHBondContact O-N 3.34Å; L13-S16 PolarHBondContact O-N 3.03Å; S16-E19 PolarHBondContact O-N 3.07Å; S16-A20 PolarHBondContact O-N 3.46Å |
| 17 | V | 65.1 | Low | 66.8 | Low | 88 Ų | 88 | 102 Ų | 102 | 53% | 0.533 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69 | -41.2 | 176 | 169.1 | 0 | 0 | 0 | 0 | 110.8 | L13 D14 E19 A20 W21 | L13-V17 WeakPolarHBondContact O-CB 3.47Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.42Å; L13-V17 PolarHBondContact O-N 2.79Å; D14-V17 PolarHBondContact O-N 3.5Å; V17-E19 VanDerWaalsContact C-N 3.28Å; V17-E19 PolarHBondContact O-N 2.8Å; V17-A20 PolarHBondContact O-N 3.49Å; V17-W21 VanDerWaalsContact O-CB 3.27Å; V17-W21 WeakPolarHBondContact O-CB 3.19Å; V17-W21 PolarHBondContact O-N 2.84Å |
| 18 | H | 66.7 | Low | 68.4 | Low | 124 Ų | 124 | 102.9 Ų | 102.9 | 57% | 0.574 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -63 | -35.6 | 174.8 | -82.7 | -59.3 | 0 | 0 | 0 | 112.5 | D14 Y15 W21 N22 | D14-H18 WeakPolarHBondContact O-CB 3.06Å; D14-H18 PolarHBondContact O-CD2 3.16Å; D14-H18 PolarHBondContact O-N 3.34Å; Y15-H18 PolarHBondContact O-N 2.81Å; H18-W21 PolarHBondContact O-N 3.48Å; H18-N22 VanDerWaalsContact O-CB 3.27Å; H18-N22 WeakPolarHBondContact O-CB 3.32Å; H18-N22 PolarHBondContact O-N 2.96Å |
| 19 | E | 69.6 | Low | 70.2 | Confident | 128 Ų | 128 | 104.1 Ų | 104.1 | 60% | 0.598 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -70.7 | -43 | 176.3 | -165 | 147.2 | -153.4 | 0 | 0 | 111.9 | Y15 S16 V17 W21 N22 E23 | Y15-E19 WeakPolarHBondContact O-CB 3.31Å; Y15-E19 PolarHBondContact O-N 2.82Å; S16-E19 PolarHBondContact O-N 3.07Å; V17-E19 VanDerWaalsContact C-N 3.28Å; V17-E19 PolarHBondContact O-N 2.8Å; E19-W21 VanDerWaalsContact C-N 3.29Å; E19-W21 PolarHBondContact O-N 3.18Å; E19-N22 PolarHBondContact O-N 3.42Å; E19-E23 WeakPolarHBondContact O-CB 3.45Å; E19-E23 PolarHBondContact O-N 2.98Å |
| 20 | A | 73.9 | Confident | 72 | Confident | 56 Ų | 56 | 104.5 Ų | 104.5 | 46% | 0.463 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.9 | -34.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S16 V17 A24 | S16-A20 PolarHBondContact O-N 3.46Å; V17-A20 PolarHBondContact O-N 3.49Å; A20-A24 VanDerWaalsContact O-CB 3.28Å; A20-A24 WeakPolarHBondContact O-CB 3.28Å; A20-A24 PolarHBondContact O-N 3.29Å |
| 21 | W | 78.9 | Confident | 73.8 | Confident | 179 Ų | 179 | 103.2 Ų | 103.2 | 68% | 0.678 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -71.1 | -38.9 | 175.5 | -161.3 | 82.7 | 0 | 0 | 0 | 111.6 | V17 H18 E19 T25 | V17-W21 VanDerWaalsContact O-CB 3.27Å; V17-W21 WeakPolarHBondContact O-CB 3.19Å; V17-W21 PolarHBondContact O-N 2.84Å; H18-W21 PolarHBondContact O-N 3.48Å; E19-W21 VanDerWaalsContact C-N 3.29Å; E19-W21 PolarHBondContact O-N 3.18Å; W21-T25 WeakPolarHBondContact O-CB 3.33Å; W21-T25 PolarHBondContact O-N 3.37Å; W21-T25 PolarHBondContact O-OG1 3.47Å |
| 22 | N | 76.8 | Confident | 75.6 | Confident | 102 Ų | 102 | 100.4 Ų | 100.4 | 55% | 0.545 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.5 | -42.4 | 174.1 | -179.7 | 55.2 | 0 | 0 | 0 | 111.5 | H18 E19 T25 N26 | H18-N22 VanDerWaalsContact O-CB 3.27Å; H18-N22 WeakPolarHBondContact O-CB 3.32Å; H18-N22 PolarHBondContact O-N 2.96Å; E19-N22 PolarHBondContact O-N 3.42Å; N22-T25 PolarHBondContact O-N 2.83Å; N22-N26 VanDerWaalsContact O-CB 3.3Å; N22-N26 WeakPolarHBondContact O-CB 3.32Å; N22-N26 PolarHBondContact O-N 3.42Å |
| 23 | E | 74.6 | Confident | 77.5 | Confident | 137 Ų | 137 | 103 Ų | 103 | 64% | 0.64 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.3 | -48.4 | 175.8 | -170.6 | 175.6 | -176.4 | 0 | 0 | 111.2 | E19 T25 N26 V27 | E19-E23 WeakPolarHBondContact O-CB 3.45Å; E19-E23 PolarHBondContact O-N 2.98Å; E23-T25 VanDerWaalsContact C-N 3.34Å; E23-T25 PolarHBondContact O-N 2.89Å; E23-N26 PolarHBondContact O-N 3.46Å; E23-V27 WeakPolarHBondContact O-CG2 3.15Å; E23-V27 PolarHBondContact O-N 2.92Å; E23-V27 VanDerWaalsContact O-N 3.08Å |
| 24 | A | 81.3 | Confident | 79.4 | Confident | 40 Ų | 40 | 103 Ų | 103 | 33% | 0.331 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.3 | -44.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | A20 N26 V27 Y28 | A20-A24 VanDerWaalsContact O-CB 3.28Å; A20-A24 WeakPolarHBondContact O-CB 3.28Å; A20-A24 PolarHBondContact O-N 3.29Å; A24-N26 PolarHBondContact O-N 3Å; A24-V27 WeakPolarHBondContact O-CB 3.43Å; A24-V27 PolarHBondContact O-N 2.88Å; A24-Y28 HydrophobicContact CB-CE2 4.19Å; A24-Y28 WeakPolarHBondContact O-CD2 3.24Å; A24-Y28 PolarHBondContact O-N 3.23Å |
| 25 | T | 84.2 | Confident | 81.2 | Confident | 38 Ų | 38 | 101.4 Ų | 101.4 | 23% | 0.233 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 178.6 | -60.8 | 0 | 0 | 0 | 0 | 111.4 | W21 N22 E23 V27 Y28 L29 | W21-T25 WeakPolarHBondContact O-CB 3.33Å; W21-T25 PolarHBondContact O-N 3.37Å; W21-T25 PolarHBondContact O-OG1 3.47Å; N22-T25 PolarHBondContact O-N 2.83Å; E23-T25 VanDerWaalsContact C-N 3.34Å; E23-T25 PolarHBondContact O-N 2.89Å; T25-V27 VanDerWaalsContact C-N 3.31Å; T25-V27 PolarHBondContact O-N 3.46Å; T25-Y28 CarbonylContact O-C 3.59Å; T25-Y28 PolarHBondContact O-N 2.75Å; T25-Y28 VanDerWaalsContact O-N 3.11Å; T25-L29 HydrophobicContact CG2-CD1 4.05Å; T25-L29 HydrophobicContact CG2-CG 4.21Å; T25-L29 VanDerWaalsContact O-CG 3.27Å; T25-L29 WeakPolarHBondContact O-CG 3.11Å; T25-L29 PolarHBondContact O-N 2.83Å |
| 26 | N | 86.6 | Confident | 83 | Confident | 89 Ų | 89 | 99.2 Ų | 99.2 | 48% | 0.476 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.1 | -40.1 | 178.9 | -161.9 | 9.6 | 0 | 0 | 0 | 111.2 | N22 E23 A24 L29 L30 | N22-N26 VanDerWaalsContact O-CB 3.3Å; N22-N26 WeakPolarHBondContact O-CB 3.32Å; N22-N26 PolarHBondContact O-N 3.42Å; E23-N26 PolarHBondContact O-N 3.46Å; A24-N26 PolarHBondContact O-N 3Å; N26-L29 PolarHBondContact O-N 2.82Å; N26-L30 WeakPolarHBondContact O-CG 3.29Å; N26-L30 PolarHBondContact O-N 2.77Å |
| 27 | V | 88 | Confident | 84.4 | Confident | 84 Ų | 84 | 97.8 Ų | 97.8 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.2 | -46.2 | 171.7 | 175.4 | 0 | 0 | 0 | 0 | 111 | E23 A24 T25 L29 L30 V31 | E23-V27 WeakPolarHBondContact O-CG2 3.15Å; E23-V27 PolarHBondContact O-N 2.92Å; E23-V27 VanDerWaalsContact O-N 3.08Å; A24-V27 WeakPolarHBondContact O-CB 3.43Å; A24-V27 PolarHBondContact O-N 2.88Å; T25-V27 VanDerWaalsContact C-N 3.31Å; T25-V27 PolarHBondContact O-N 3.46Å; V27-L29 PolarHBondContact O-N 2.86Å; V27-L30 PolarHBondContact O-N 3.27Å; V27-V31 WeakPolarHBondContact O-CG2 3.17Å; V27-V31 PolarHBondContact O-N 2.86Å |
| 28 | Y | 89.9 | Confident | 85.5 | Confident | 154 Ų | 154 | 98.9 Ų | 98.9 | 60% | 0.604 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.3 | -41.1 | 176.5 | -69.7 | -61.3 | 0 | 0 | 0 | 112.5 | A24 T25 L30 V31 I32 | A24-Y28 HydrophobicContact CB-CE2 4.19Å; A24-Y28 WeakPolarHBondContact O-CD2 3.24Å; A24-Y28 PolarHBondContact O-N 3.23Å; T25-Y28 CarbonylContact O-C 3.59Å; T25-Y28 PolarHBondContact O-N 2.75Å; T25-Y28 VanDerWaalsContact O-N 3.11Å; Y28-L30 VanDerWaalsContact C-N 3.33Å; Y28-L30 PolarHBondContact O-N 3.26Å; Y28-V31 PolarHBondContact O-N 2.89Å; Y28-I32 WeakPolarHBondContact O-CB 3.38Å; Y28-I32 WeakPolarHBondContact O-CD1 3.44Å; Y28-I32 WeakPolarHBondContact O-CG1 3.39Å; Y28-I32 PolarHBondContact O-N 2.67Å |
| 29 | L | 91.3 | Very high | 86.4 | Confident | 91 Ų | 91 | 97.5 Ų | 97.5 | 48% | 0.476 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.7 | -40.1 | 177.6 | -70.1 | 174.3 | 0 | 0 | 0 | 111.6 | T25 N26 V27 I32 L33 | T25-L29 HydrophobicContact CG2-CD1 4.05Å; T25-L29 HydrophobicContact CG2-CG 4.21Å; T25-L29 VanDerWaalsContact O-CG 3.27Å; T25-L29 WeakPolarHBondContact O-CG 3.11Å; T25-L29 PolarHBondContact O-N 2.83Å; N26-L29 PolarHBondContact O-N 2.82Å; V27-L29 PolarHBondContact O-N 2.86Å; L29-I32 PolarHBondContact O-N 3.02Å; L29-L33 WeakPolarHBondContact O-CB 3.48Å; L29-L33 WeakPolarHBondContact O-CG 3.27Å; L29-L33 PolarHBondContact O-N 2.77Å |
| 30 | L | 91.2 | Very high | 87.1 | Confident | 101 Ų | 101 | 98 Ų | 98 | 53% | 0.529 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.7 | -44.6 | 173.7 | -70.5 | 176.7 | 0 | 0 | 0 | 111.9 | N26 V27 Y28 I32 L33 V34 | N26-L30 WeakPolarHBondContact O-CG 3.29Å; N26-L30 PolarHBondContact O-N 2.77Å; V27-L30 PolarHBondContact O-N 3.27Å; Y28-L30 VanDerWaalsContact C-N 3.33Å; Y28-L30 PolarHBondContact O-N 3.26Å; L30-I32 VanDerWaalsContact C-N 3.31Å; L30-I32 PolarHBondContact O-N 2.88Å; L30-L33 PolarHBondContact O-N 2.79Å; L30-V34 WeakPolarHBondContact O-CB 3.4Å; L30-V34 VanDerWaalsContact O-CG2 3.27Å; L30-V34 WeakPolarHBondContact O-CG2 3.39Å; L30-V34 PolarHBondContact O-N 3.41Å |
| 31 | V | 93.3 | Very high | 87.5 | Confident | 90 Ų | 90 | 102.7 Ų | 102.7 | 55% | 0.545 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.2 | -41.6 | 176.3 | 172.8 | 0 | 0 | 0 | 0 | 111 | V27 Y28 V34 S35 | V27-V31 WeakPolarHBondContact O-CG2 3.17Å; V27-V31 PolarHBondContact O-N 2.86Å; Y28-V31 PolarHBondContact O-N 2.89Å; V31-V34 PolarHBondContact O-N 2.66Å; V31-S35 WeakPolarHBondContact O-CB 3.46Å; V31-S35 PolarHBondContact O-N 2.85Å |
| 32 | I | 93.3 | Very high | 87.4 | Confident | 94 Ų | 94 | 96 Ų | 96 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.1 | -44.8 | 176.7 | -69.3 | 162.4 | 0 | 0 | 0 | 110.7 | Y28 L29 L30 S35 F36 | Y28-I32 WeakPolarHBondContact O-CB 3.38Å; Y28-I32 WeakPolarHBondContact O-CD1 3.44Å; Y28-I32 WeakPolarHBondContact O-CG1 3.39Å; Y28-I32 PolarHBondContact O-N 2.67Å; L29-I32 PolarHBondContact O-N 3.02Å; L30-I32 VanDerWaalsContact C-N 3.31Å; L30-I32 PolarHBondContact O-N 2.88Å; I32-S35 PolarHBondContact O-N 3.49Å; I32-F36 HydrophobicContact CG2-CD2 4.25Å; I32-F36 WeakPolarHBondContact O-CB 3.44Å; I32-F36 PolarHBondContact O-N 3.02Å |
| 33 | L | 94.6 | Very high | 87.3 | Confident | 121 Ų | 121 | 99 Ų | 99 | 63% | 0.634 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.9 | -45 | 176.9 | -83.3 | 168.1 | 0 | 0 | 0 | 112.2 | L29 L30 S35 F36 G37 | L29-L33 WeakPolarHBondContact O-CB 3.48Å; L29-L33 WeakPolarHBondContact O-CG 3.27Å; L29-L33 PolarHBondContact O-N 2.77Å; L30-L33 PolarHBondContact O-N 2.79Å; L33-S35 VanDerWaalsContact C-N 3.34Å; L33-F36 PolarHBondContact O-N 2.93Å; L33-G37 PolarHBondContact O-N 2.94Å |
| 34 | V | 94.5 | Very high | 87.2 | Confident | 91 Ų | 91 | 101.2 Ų | 101.2 | 55% | 0.552 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.1 | -43 | 176.5 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | L30 V31 G37 L38 | L30-V34 WeakPolarHBondContact O-CB 3.4Å; L30-V34 VanDerWaalsContact O-CG2 3.27Å; L30-V34 WeakPolarHBondContact O-CG2 3.39Å; L30-V34 PolarHBondContact O-N 3.41Å; V31-V34 PolarHBondContact O-N 2.66Å; V34-G37 PolarHBondContact O-N 3.49Å; V34-L38 HydrophobicContact CG1-CD1 3.8Å; V34-L38 WeakPolarHBondContact O-CB 3.31Å; V34-L38 WeakPolarHBondContact O-CG 3.09Å; V34-L38 PolarHBondContact O-N 3.39Å |
| 35 | S | 93.3 | Very high | 86.5 | Confident | 68 Ų | 68 | 101.3 Ų | 101.3 | 48% | 0.476 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 174.7 | -177.2 | 0 | 0 | 0 | 0 | 111.6 | V31 I32 L33 G37 L38 L39 | V31-S35 WeakPolarHBondContact O-CB 3.46Å; V31-S35 PolarHBondContact O-N 2.85Å; I32-S35 PolarHBondContact O-N 3.49Å; L33-S35 VanDerWaalsContact C-N 3.34Å; S35-G37 PolarHBondContact O-N 3.19Å; S35-L38 PolarHBondContact O-N 2.59Å; S35-L39 WeakPolarHBondContact O-CB 3.39Å; S35-L39 PolarHBondContact O-N 3.16Å |
| 36 | F | 94.2 | Very high | 85.6 | Confident | 136 Ų | 136 | 104.1 Ų | 104.1 | 60% | 0.596 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.1 | -40.3 | 175.8 | -110.6 | -83.4 | 0 | 0 | 0 | 112.2 | I32 L33 L39 M40 | I32-F36 HydrophobicContact CG2-CD2 4.25Å; I32-F36 WeakPolarHBondContact O-CB 3.44Å; I32-F36 PolarHBondContact O-N 3.02Å; L33-F36 PolarHBondContact O-N 2.93Å; F36-L39 PolarHBondContact O-N 3.02Å; F36-M40 WeakPolarHBondContact O-CB 3.31Å; F36-M40 PolarHBondContact O-N 2.86Å |
| 37 | G | 91.7 | Very high | 84.4 | Confident | 42 Ų | 42 | 111.1 Ų | 111.1 | 43% | 0.433 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L33 V34 S35 M40 Y41 | L33-G37 PolarHBondContact O-N 2.94Å; V34-G37 PolarHBondContact O-N 3.49Å; S35-G37 PolarHBondContact O-N 3.19Å; G37-M40 PolarHBondContact O-N 2.79Å; G37-Y41 WeakPolarHBondContact O-CB 3.34Å; G37-Y41 PolarHBondContact O-N 3.44Å |
| 38 | L | 88.4 | Confident | 83.2 | Confident | 112 Ų | 112 | 114 Ų | 114 | 59% | 0.586 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.8 | -43.4 | 173.8 | -78.5 | 160.1 | 0 | 0 | 0 | 111.4 | V34 S35 Y41 A42 | V34-L38 HydrophobicContact CG1-CD1 3.8Å; V34-L38 WeakPolarHBondContact O-CB 3.31Å; V34-L38 WeakPolarHBondContact O-CG 3.09Å; V34-L38 PolarHBondContact O-N 3.39Å; S35-L38 PolarHBondContact O-N 2.59Å; L38-Y41 PolarHBondContact O-N 3.06Å; L38-A42 VanDerWaalsContact O-CB 3.25Å; L38-A42 WeakPolarHBondContact O-CB 3.47Å; L38-A42 PolarHBondContact O-N 3.04Å |
| 39 | L | 84.4 | Confident | 81.9 | Confident | 94 Ų | 94 | 110.4 Ų | 110.4 | 49% | 0.492 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.9 | -40.5 | 178.2 | -173.8 | 139.9 | 0 | 0 | 0 | 111.6 | S35 F36 R43 | S35-L39 WeakPolarHBondContact O-CB 3.39Å; S35-L39 PolarHBondContact O-N 3.16Å; F36-L39 PolarHBondContact O-N 3.02Å; L39-R43 VanDerWaalsContact O-CB 3.28Å; L39-R43 WeakPolarHBondContact O-CB 3.15Å; L39-R43 PolarHBondContact O-N 3.46Å |
| 40 | M | 85.2 | Confident | 80.4 | Confident | 138 Ų | 138 | 112.4 Ų | 112.4 | 68% | 0.68 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.3 | -40.6 | 173.8 | -113.8 | -145.7 | 160.2 | 0 | 0 | 111.5 | F36 G37 R43 K44 | F36-M40 WeakPolarHBondContact O-CB 3.31Å; F36-M40 PolarHBondContact O-N 2.86Å; G37-M40 PolarHBondContact O-N 2.79Å; M40-R43 CarbonylContact O-C 3.41Å; M40-R43 WeakPolarHBondContact O-CA 3.2Å; M40-R43 WeakPolarHBondContact O-CB 3.39Å; M40-R43 PolarHBondContact O-N 3.06Å; M40-K44 WeakPolarHBondContact O-CB 3.49Å; M40-K44 PolarHBondContact O-N 2.92Å |
| 41 | Y | 81.8 | Confident | 79.1 | Confident | 155 Ų | 155 | 117.2 Ų | 117.2 | 61% | 0.608 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.8 | -45.8 | 176.5 | -177.2 | -95.6 | 0 | 0 | 0 | 111 | G37 L38 K44 N45 | G37-Y41 WeakPolarHBondContact O-CB 3.34Å; G37-Y41 PolarHBondContact O-N 3.44Å; L38-Y41 PolarHBondContact O-N 3.06Å; Y41-K44 PolarHBondContact O-N 3.22Å; Y41-K44 VanDerWaalsContact O-N 3.12Å; Y41-N45 VanDerWaalsContact CE1-ND2 3.35Å; Y41-N45 WeakPolarHBondContact CE1-ND2 3.47Å; Y41-N45 VanDerWaalsContact CE2-ND2 3.33Å; Y41-N45 WeakPolarHBondContact CE2-ND2 3.13Å; Y41-N45 WeakPolarHBondContact O-CB 3.21Å; Y41-N45 PolarHBondContact O-N 3.16Å; Y41-N45 PolarHBondContact O-ND2 3.08Å |
| 42 | A | 76.3 | Confident | 77.8 | Confident | 40 Ų | 40 | 119.3 Ų | 119.3 | 33% | 0.331 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62.5 | -40 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L38 K44 N45 K46 | L38-A42 VanDerWaalsContact O-CB 3.25Å; L38-A42 WeakPolarHBondContact O-CB 3.47Å; L38-A42 PolarHBondContact O-N 3.04Å; A42-K44 VanDerWaalsContact C-N 3.33Å; A42-K44 PolarHBondContact O-N 3.26Å; A42-N45 CarbonylContact O-C 3.34Å; A42-N45 PolarHBondContact O-N 2.82Å; A42-K46 VanDerWaalsContact O-CA 3.27Å; A42-K46 WeakPolarHBondContact O-CA 3.47Å; A42-K46 PolarHBondContact O-N 2.78Å |
| 43 | R | 74.3 | Confident | 76.1 | Confident | 163 Ų | 163 | 123.6 Ų | 123.6 | 62% | 0.615 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.2 | -30.3 | 171.3 | -106.2 | -169.2 | 118.2 | 115.2 | -8.1 | 112.3 | L39 M40 K46 | L39-R43 VanDerWaalsContact O-CB 3.28Å; L39-R43 WeakPolarHBondContact O-CB 3.15Å; L39-R43 PolarHBondContact O-N 3.46Å; M40-R43 CarbonylContact O-C 3.41Å; M40-R43 WeakPolarHBondContact O-CA 3.2Å; M40-R43 WeakPolarHBondContact O-CB 3.39Å; M40-R43 PolarHBondContact O-N 3.06Å; R43-K46 VanDerWaalsContact C-CE 3.5Å; R43-K46 HydrophobicContact CB-CD 4.47Å; R43-K46 HydrophobicContact CG-CD 4.26Å; R43-K46 VanDerWaalsContact O-CD 3.26Å; R43-K46 WeakPolarHBondContact O-CD 2.96Å; R43-K46 WeakPolarHBondContact O-CE 3.22Å; R43-K46 WeakPolarHBondContact O-CG 3.12Å |
| 44 | K | 72.7 | Confident | 74.3 | Confident | 185 Ų | 185 | 120.4 Ų | 120.4 | 80% | 0.804 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -80.7 | -32.3 | 178.8 | -159.1 | 169.2 | 178.5 | 177.2 | 0 | 110.1 | M40 Y41 A42 | M40-K44 WeakPolarHBondContact O-CB 3.49Å; M40-K44 PolarHBondContact O-N 2.92Å; Y41-K44 PolarHBondContact O-N 3.22Å; Y41-K44 VanDerWaalsContact O-N 3.12Å; A42-K44 VanDerWaalsContact C-N 3.33Å; A42-K44 PolarHBondContact O-N 3.26Å |
| 45 | N | 67.4 | Low | 72.2 | Confident | 42 Ų | 42 | 122.5 Ų | 122.5 | 23% | 0.225 | 58% | 0.584 | C | S | . | * | S | Bend | trans | -102.6 | 20.1 | -178.9 | -65.2 | -34.5 | 0 | 0 | 0 | 114 | Y41 A42 R47 K48 I49 | Y41-N45 VanDerWaalsContact CE1-ND2 3.35Å; Y41-N45 WeakPolarHBondContact CE1-ND2 3.47Å; Y41-N45 VanDerWaalsContact CE2-ND2 3.33Å; Y41-N45 WeakPolarHBondContact CE2-ND2 3.13Å; Y41-N45 WeakPolarHBondContact O-CB 3.21Å; Y41-N45 PolarHBondContact O-N 3.16Å; Y41-N45 PolarHBondContact O-ND2 3.08Å; A42-N45 CarbonylContact O-C 3.34Å; A42-N45 PolarHBondContact O-N 2.82Å; N45-R47 PolarHBondContact O-N 3.47Å; N45-R47 VanDerWaalsContact O-N 3.08Å; N45-K48 WeakPolarHBondContact O-CA 3.17Å; N45-K48 PolarHBondContact O-N 2.81Å; N45-I49 PolarHBondContact O-N 2.86Å |
| 46 | K | 65.1 | Low | 70.2 | Confident | 97 Ų | 97 | 124.7 Ų | 124.7 | 42% | 0.422 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -52.7 | -39.2 | -174.5 | -13.7 | -166.7 | -173.8 | -178.8 | 0 | 112.4 | A42 R43 K48 M50 | A42-K46 VanDerWaalsContact O-CA 3.27Å; A42-K46 WeakPolarHBondContact O-CA 3.47Å; A42-K46 PolarHBondContact O-N 2.78Å; R43-K46 VanDerWaalsContact C-CE 3.5Å; R43-K46 HydrophobicContact CB-CD 4.47Å; R43-K46 HydrophobicContact CG-CD 4.26Å; R43-K46 VanDerWaalsContact O-CD 3.26Å; R43-K46 WeakPolarHBondContact O-CD 2.96Å; R43-K46 WeakPolarHBondContact O-CE 3.22Å; R43-K46 WeakPolarHBondContact O-CG 3.12Å; K46-K48 VanDerWaalsContact C-N 3.26Å; K46-K48 PolarHBondContact O-N 3.36Å; K46-M50 WeakPolarHBondContact O-CB 3.48Å; K46-M50 PolarHBondContact O-N 3.37Å |
| 47 | R | 61.2 | Low | 68.1 | Low | 235 Ų | 235 | 123.4 Ų | 123.4 | 89% | 0.887 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.7 | -27.6 | 178.5 | -64.4 | -173.4 | -169.5 | 172.1 | 3.2 | 113.2 | N45 | N45-R47 PolarHBondContact O-N 3.47Å; N45-R47 VanDerWaalsContact O-N 3.08Å |
| 48 | K | 63.2 | Low | 65.8 | Low | 146 Ų | 146 | 126.7 Ų | 126.7 | 64% | 0.635 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -87.8 | -42.2 | 177.9 | -70.3 | -172.7 | 177.5 | -177.3 | 0 | 112.1 | N45 K46 R51 I52 | N45-K48 WeakPolarHBondContact O-CA 3.17Å; N45-K48 PolarHBondContact O-N 2.81Å; K46-K48 VanDerWaalsContact C-N 3.26Å; K46-K48 PolarHBondContact O-N 3.36Å; K48-R51 VanDerWaalsContact O-CB 3.28Å; K48-R51 WeakPolarHBondContact O-CB 3.44Å; K48-R51 PolarHBondContact O-N 3.47Å; K48-I52 WeakPolarHBondContact O-CD1 3.09Å; K48-I52 WeakPolarHBondContact O-CG1 3.28Å; K48-I52 PolarHBondContact O-N 2.8Å |
| 49 | I | 63.1 | Low | 63.7 | Low | 78 Ų | 78 | 126.6 Ų | 126.6 | 40% | 0.4 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -69.1 | -42.1 | 178 | -103.5 | 73.3 | 0 | 0 | 0 | 111.5 | N45 R51 I52 F53 | N45-I49 PolarHBondContact O-N 2.86Å; I49-R51 PolarHBondContact O-N 3.36Å; I49-R51 VanDerWaalsContact O-N 3.16Å; I49-I52 PolarHBondContact O-N 3.22Å; I49-F53 PolarHBondContact O-N 2.89Å |
| 50 | M | 60.1 | Low | 61.9 | Low | 133 Ų | 133 | 124.8 Ų | 124.8 | 66% | 0.655 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -60.9 | -25.2 | 174.2 | -170.7 | -178.2 | -78.5 | 0 | 0 | 111.2 | K46 A54 | K46-M50 WeakPolarHBondContact O-CB 3.48Å; K46-M50 PolarHBondContact O-N 3.37Å; M50-A54 WeakPolarHBondContact O-CB 3.35Å; M50-A54 PolarHBondContact O-N 2.71Å |
| 51 | R | 62.7 | Low | 59.8 | Low | 202 Ų | 202 | 122.6 Ų | 122.6 | 76% | 0.762 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -76.4 | -20.5 | 176.6 | -156 | -178.5 | -164.7 | 146.9 | 4 | 114 | K48 I49 | K48-R51 VanDerWaalsContact O-CB 3.28Å; K48-R51 WeakPolarHBondContact O-CB 3.44Å; K48-R51 PolarHBondContact O-N 3.47Å; I49-R51 PolarHBondContact O-N 3.36Å; I49-R51 VanDerWaalsContact O-N 3.16Å |
| 52 | I | 67 | Low | 57.8 | Low | 134 Ų | 134 | 119.7 Ų | 119.7 | 69% | 0.687 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -101.9 | -32.9 | -175.8 | -59.2 | 159.4 | 0 | 0 | 0 | 110.9 | K48 I49 | K48-I52 WeakPolarHBondContact O-CD1 3.09Å; K48-I52 WeakPolarHBondContact O-CG1 3.28Å; K48-I52 PolarHBondContact O-N 2.8Å; I49-I52 PolarHBondContact O-N 3.22Å |
| 53 | F | 57.6 | Low | 56.3 | Low | 183 Ų | 183 | 124.4 Ų | 124.4 | 80% | 0.803 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -96.7 | -23.3 | 177.9 | -93.4 | -82 | 0 | 0 | 0 | 114.6 | I49 L55 | I49-F53 PolarHBondContact O-N 2.89Å; F53-L55 PolarHBondContact O-N 3.12Å |
| 54 | A | 55.4 | Low | 54.8 | Low | 54 Ų | 54 | 122.4 Ų | 122.4 | 45% | 0.446 | 66% | 0.658 | S | S | . | * | S | Bend | trans | -70.3 | 130.1 | 158.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | M50 | M50-A54 WeakPolarHBondContact O-CB 3.35Å; M50-A54 PolarHBondContact O-N 2.71Å |
| 55 | L | 50.1 | Low | 53.8 | Low | 136 Ų | 136 | 118.8 Ų | 118.8 | 71% | 0.712 | 65% | 0.653 | S | S | * | * | trans | -27.8 | 151 | 165.2 | -83.6 | 63.2 | 0 | 0 | 0 | 112.2 | F53 | F53-L55 PolarHBondContact O-N 3.12Š| ||
| 56 | P | 51.2 | Low | 53.3 | Low | 114 Ų | 114 | 120.5 Ų | 120.5 | 74% | 0.74 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -38.8 | 123.5 | 172.2 | 19.5 | -33.6 | 0 | 0 | 0 | 106.9 | T58 | P56-T58 PolarHBondContact O-N 2.85Š|
| 57 | P | 51.2 | Low | 52.7 | Low | 109 Ų | 109 | 121.2 Ų | 121.2 | 71% | 0.708 | 67% | 0.665 | S | S | * | * | trans | -42.7 | 111.7 | -164.3 | 17.4 | -31.9 | 0 | 0 | 0 | 106.1 | A59 | P57-A59 VanDerWaalsContact C-N 3.31Å; P57-A59 PolarHBondContact O-N 3.38Å | ||
| 58 | T | 43.4 | Very low | 52.2 | Low | 111 Ų | 111 | 118.4 Ų | 118.4 | 68% | 0.681 | 66% | 0.656 | S | S | * | * | trans | -43.5 | 114 | 165.2 | 31.5 | 0 | 0 | 0 | 0 | 103.5 | P56 G60 A61 | P56-T58 PolarHBondContact O-N 2.85Å; T58-G60 WeakPolarHBondContact O-CA 3.33Å; T58-G60 PolarHBondContact O-N 3.36Å; T58-A61 PolarHBondContact O-N 2.82Å | ||
| 59 | A | 44.9 | Very low | 51.9 | Low | 109 Ų | 109 | 114.7 Ų | 114.7 | 90% | 0.901 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | 88.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | P57 | P57-A59 VanDerWaalsContact C-N 3.31Å; P57-A59 PolarHBondContact O-N 3.38Å |
| 60 | G | 45.3 | Very low | 51.7 | Low | 56 Ų | 56 | 113.5 Ų | 113.5 | 58% | 0.577 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 172.6 | -14.9 | -157.7 | 0 | 0 | 0 | 0 | 0 | 115 | T58 T62 | T58-G60 WeakPolarHBondContact O-CA 3.33Å; T58-G60 PolarHBondContact O-N 3.36Å; G60-T62 VanDerWaalsContact C-N 3.33Å |
| 61 | A | 41.3 | Very low | 51.6 | Low | 93 Ų | 93 | 111 Ų | 111 | 77% | 0.769 | 63% | 0.63 | S | S | * | * | trans | -104.6 | 43.7 | 149.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | T58 T63 | T58-A61 PolarHBondContact O-N 2.82Å; A61-T63 PolarHBondContact O-N 3.39Å | ||
| 62 | T | 40.6 | Very low | 51.3 | Low | 94 Ų | 94 | 107.1 Ų | 107.1 | 58% | 0.577 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -51.5 | 119.7 | 135 | 49.4 | 0 | 0 | 0 | 0 | 103.8 | G60 E64 | G60-T62 VanDerWaalsContact C-N 3.33Å; T62-E64 PolarHBondContact O-N 3.46Å |
| 63 | T | 44.3 | Very low | 50.8 | Low | 139 Ų | 139 | 106.8 Ų | 106.8 | 85% | 0.853 | 61% | 0.614 | S | S | * | * | trans | -44.7 | 97.8 | 145.8 | -1 | 0 | 0 | 0 | 0 | 103.4 | A61 P65 | A61-T63 PolarHBondContact O-N 3.39Å; T63-P65 WeakPolarHBondContact O-CD 3.35Å | ||
| 64 | E | 42.7 | Very low | 50.8 | Low | 121 Ų | 121 | 102 Ų | 102 | 57% | 0.565 | 60% | 0.6 | S | S | * | * | trans | -45.7 | 117.1 | 179.2 | -171.1 | 178.4 | 173.1 | 0 | 0 | 103.1 | T62 N66 F67 | T62-E64 PolarHBondContact O-N 3.46Å; E64-N66 PolarHBondContact O-N 2.77Å; E64-F67 HydrophobicContact CG-CB 3.98Å; E64-F67 HydrophobicContact CG-CD2 3.67Å; E64-F67 HydrophobicContact CG-CG 4.26Å; E64-F67 WeakPolarHBondContact OE1-CB 3.46Å; E64-F67 VanDerWaalsContact OE1-CD2 3.31Å; E64-F67 WeakPolarHBondContact OE1-CD2 2.8Å; E64-F67 VanDerWaalsContact OE1-CG 3.31Å; E64-F67 WeakPolarHBondContact OE1-CG 3.26Å | ||
| 65 | P | 51.5 | Low | 50.9 | Low | 108 Ų | 108 | 107.9 Ų | 107.9 | 70% | 0.701 | 61% | 0.611 | S | S | * | * | trans | -65.7 | 86 | -176.7 | 23.8 | -30.5 | 0 | 0 | 0 | 105.9 | T63 F67 | T63-P65 WeakPolarHBondContact O-CD 3.35Å; P65-F67 VanDerWaalsContact C-N 3.34Å; P65-F67 PolarHBondContact O-N 2.82Å | ||
| 66 | N | 56.5 | Low | 51.3 | Low | 78 Ų | 78 | 106.2 Ų | 106.2 | 42% | 0.417 | 60% | 0.602 | S | S | . | * | trans | 19.6 | 71.1 | 179.8 | -156.8 | -23.2 | 0 | 0 | 0 | 112.4 | E64 Y68 D69 S70 | E64-N66 PolarHBondContact O-N 2.77Å; N66-Y68 PolarHBondContact O-N 2.82Å; N66-Y68 VanDerWaalsContact O-N 3.16Å; N66-D69 HydrophobicContact CB-CB 3.72Å; N66-D69 VanDerWaalsContact CG-OD2 3.3Å; N66-D69 PolarHBondContact ND2-OD1 3.3Å; N66-D69 PolarHBondContact ND2-OD2 3.3Å; N66-D69 CarbonylContact O-C 3.58Å; N66-D69 WeakPolarHBondContact O-CA 3.2Å; N66-D69 WeakPolarHBondContact O-CB 3.4Å; N66-D69 PolarHBondContact O-N 2.87Å; N66-D69 WeakPolarHBondContact OD1-CB 3.28Å; N66-D69 PolarHBondContact OD1-N 2.76Å; N66-S70 PolarHBondContact O-N 3.46Å | ||
| 67 | F | 53.3 | Low | 51.6 | Low | 112 Ų | 112 | 109.1 Ų | 109.1 | 49% | 0.491 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -57.5 | -27.2 | 177.2 | -121.8 | -89.7 | 0 | 0 | 0 | 110.8 | E64 P65 S70 L71 | E64-F67 HydrophobicContact CG-CB 3.98Å; E64-F67 HydrophobicContact CG-CD2 3.67Å; E64-F67 HydrophobicContact CG-CG 4.26Å; E64-F67 WeakPolarHBondContact OE1-CB 3.46Å; E64-F67 VanDerWaalsContact OE1-CD2 3.31Å; E64-F67 WeakPolarHBondContact OE1-CD2 2.8Å; E64-F67 VanDerWaalsContact OE1-CG 3.31Å; E64-F67 WeakPolarHBondContact OE1-CG 3.26Å; P65-F67 VanDerWaalsContact C-N 3.34Å; P65-F67 PolarHBondContact O-N 2.82Å; F67-S70 WeakPolarHBondContact CA-OG 2.68Å; F67-S70 PolarHBondContact O-OG 3.41Å; F67-L71 HydrophobicContact CD1-CD1 4.33Å; F67-L71 WeakPolarHBondContact O-CB 3.27Å; F67-L71 WeakPolarHBondContact O-CD1 3.44Å; F67-L71 WeakPolarHBondContact O-CG 3.25Å; F67-L71 PolarHBondContact O-N 3.4Å |
| 68 | Y | 50.6 | Low | 52.1 | Low | 177 Ų | 177 | 109.8 Ų | 109.8 | 69% | 0.694 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.6 | -42.8 | 170.7 | -93.7 | -90.8 | 0 | 0 | 0 | 112.8 | N66 L71 Q72 | N66-Y68 PolarHBondContact O-N 2.82Å; N66-Y68 VanDerWaalsContact O-N 3.16Å; Y68-L71 PolarHBondContact O-N 2.85Å; Y68-Q72 WeakPolarHBondContact O-CB 3.4Å; Y68-Q72 WeakPolarHBondContact O-CG 3.21Å; Y68-Q72 PolarHBondContact O-N 3.48Å |
| 69 | D | 57.2 | Low | 52.7 | Low | 68 Ų | 68 | 110.2 Ų | 110.2 | 36% | 0.364 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -66 | -36.9 | 171.8 | -84.7 | -1.1 | 0 | 0 | 0 | 111.9 | N66 K73 | N66-D69 HydrophobicContact CB-CB 3.72Å; N66-D69 VanDerWaalsContact CG-OD2 3.3Å; N66-D69 PolarHBondContact ND2-OD1 3.3Å; N66-D69 PolarHBondContact ND2-OD2 3.3Å; N66-D69 CarbonylContact O-C 3.58Å; N66-D69 WeakPolarHBondContact O-CA 3.2Å; N66-D69 WeakPolarHBondContact O-CB 3.4Å; N66-D69 PolarHBondContact O-N 2.87Å; N66-D69 WeakPolarHBondContact OD1-CB 3.28Å; N66-D69 PolarHBondContact OD1-N 2.76Å; D69-K73 WeakPolarHBondContact O-CB 3.34Å; D69-K73 WeakPolarHBondContact O-CG 3.38Å; D69-K73 PolarHBondContact O-N 2.87Å |
| 70 | S | 58.8 | Low | 53.4 | Low | 52 Ų | 52 | 110.3 Ų | 110.3 | 36% | 0.364 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -69.3 | -43.6 | 177.5 | 73.8 | 0 | 0 | 0 | 0 | 110.4 | N66 F67 K73 V74 | N66-S70 PolarHBondContact O-N 3.46Å; F67-S70 WeakPolarHBondContact CA-OG 2.68Å; F67-S70 PolarHBondContact O-OG 3.41Å; S70-K73 PolarHBondContact O-N 3Å; S70-V74 WeakPolarHBondContact O-CB 3.47Å; S70-V74 WeakPolarHBondContact O-CG2 3.34Å; S70-V74 PolarHBondContact O-N 3.27Å |
| 71 | L | 57 | Low | 54 | Low | 80 Ų | 80 | 113.4 Ų | 113.4 | 42% | 0.419 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.8 | -40.6 | 173.8 | -74.7 | 170.3 | 0 | 0 | 0 | 112.7 | F67 Y68 V74 R75 | F67-L71 HydrophobicContact CD1-CD1 4.33Å; F67-L71 WeakPolarHBondContact O-CB 3.27Å; F67-L71 WeakPolarHBondContact O-CD1 3.44Å; F67-L71 WeakPolarHBondContact O-CG 3.25Å; F67-L71 PolarHBondContact O-N 3.4Å; Y68-L71 PolarHBondContact O-N 2.85Å; L71-V74 PolarHBondContact O-N 3.34Å; L71-R75 WeakPolarHBondContact O-CG 3.27Å; L71-R75 PolarHBondContact O-N 3.43Å |
| 72 | Q | 57.4 | Low | 54.8 | Low | 122 Ų | 122 | 116 Ų | 116 | 57% | 0.57 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.2 | -40.8 | 174.8 | -77.6 | -178.3 | -27.4 | 0 | 0 | 111.2 | Y68 V74 R75 L76 | Y68-Q72 WeakPolarHBondContact O-CB 3.4Å; Y68-Q72 WeakPolarHBondContact O-CG 3.21Å; Y68-Q72 PolarHBondContact O-N 3.48Å; Q72-V74 VanDerWaalsContact C-N 3.34Å; Q72-R75 PolarHBondContact O-N 2.91Å; Q72-L76 WeakPolarHBondContact O-CB 3.38Å; Q72-L76 PolarHBondContact O-N 2.82Å |
| 73 | K | 55.7 | Low | 55.6 | Low | 127 Ų | 127 | 120.3 Ų | 120.3 | 55% | 0.552 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.8 | -36.3 | 172.7 | -81.1 | 174.2 | 178.8 | 168.5 | 0 | 112.2 | D69 S70 R77 | D69-K73 WeakPolarHBondContact O-CB 3.34Å; D69-K73 WeakPolarHBondContact O-CG 3.38Å; D69-K73 PolarHBondContact O-N 2.87Å; S70-K73 PolarHBondContact O-N 3Å; K73-R77 WeakPolarHBondContact O-CB 3.46Å; K73-R77 VanDerWaalsContact O-CG 3.29Å; K73-R77 WeakPolarHBondContact O-CG 3.45Å; K73-R77 PolarHBondContact O-N 3.3Å |
| 74 | V | 57.7 | Low | 56.3 | Low | 83 Ų | 83 | 116.8 Ų | 116.8 | 50% | 0.503 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -69.4 | -45.5 | 177.3 | 169 | 0 | 0 | 0 | 0 | 110.7 | S70 L71 Q72 Q78 | S70-V74 WeakPolarHBondContact O-CB 3.47Å; S70-V74 WeakPolarHBondContact O-CG2 3.34Å; S70-V74 PolarHBondContact O-N 3.27Å; L71-V74 PolarHBondContact O-N 3.34Å; Q72-V74 VanDerWaalsContact C-N 3.34Å; V74-Q78 WeakPolarHBondContact O-CB 3.5Å; V74-Q78 PolarHBondContact O-N 3.48Å |
| 75 | R | 58.6 | Low | 57 | Low | 177 Ų | 177 | 115.6 Ų | 115.6 | 67% | 0.668 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.7 | -41.2 | 176.7 | -70.3 | -179.6 | -177.7 | 176.9 | 1.3 | 112.4 | L71 Q72 Q78 Q79 | L71-R75 WeakPolarHBondContact O-CG 3.27Å; L71-R75 PolarHBondContact O-N 3.43Å; Q72-R75 PolarHBondContact O-N 2.91Å; R75-Q78 PolarHBondContact O-N 2.99Å; R75-Q79 WeakPolarHBondContact O-CB 3.21Å; R75-Q79 PolarHBondContact O-N 3.11Å |
| 76 | L | 58.7 | Low | 57.3 | Low | 100 Ų | 100 | 113.1 Ų | 113.1 | 52% | 0.524 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.1 | -40 | 177.8 | -175 | 65.2 | 0 | 0 | 0 | 111.7 | Q72 Q79 L80 | Q72-L76 WeakPolarHBondContact O-CB 3.38Å; Q72-L76 PolarHBondContact O-N 2.82Å; L76-Q79 PolarHBondContact O-N 3.08Å; L76-L80 HydrophobicContact CD1-CD1 4.15Å; L76-L80 HydrophobicContact CG-CD1 4.05Å; L76-L80 WeakPolarHBondContact O-CB 2.9Å; L76-L80 PolarHBondContact O-N 3.3Å |
| 77 | R | 57.9 | Low | 57.3 | Low | 175 Ų | 175 | 118.9 Ų | 118.9 | 66% | 0.66 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66 | -42.3 | 173 | -81.6 | -170.1 | 175.1 | 156.4 | -1.8 | 112 | K73 Q79 L80 E81 | K73-R77 WeakPolarHBondContact O-CB 3.46Å; K73-R77 VanDerWaalsContact O-CG 3.29Å; K73-R77 WeakPolarHBondContact O-CG 3.45Å; K73-R77 PolarHBondContact O-N 3.3Å; R77-Q79 VanDerWaalsContact C-N 3.33Å; R77-Q79 PolarHBondContact O-N 3.42Å; R77-L80 PolarHBondContact O-N 2.84Å; R77-E81 WeakPolarHBondContact O-CB 3.18Å; R77-E81 WeakPolarHBondContact O-CG 3.43Å; R77-E81 PolarHBondContact O-N 2.98Å |
| 78 | Q | 60 | Low | 57.4 | Low | 124 Ų | 124 | 120 Ų | 120 | 58% | 0.579 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.2 | -40.5 | 174.3 | -100.7 | 177.2 | -31.9 | 0 | 0 | 112.2 | V74 R75 E81 M82 | V74-Q78 WeakPolarHBondContact O-CB 3.5Å; V74-Q78 PolarHBondContact O-N 3.48Å; R75-Q78 PolarHBondContact O-N 2.99Å; Q78-E81 PolarHBondContact O-N 3.46Å; Q78-M82 WeakPolarHBondContact O-CB 3.44Å; Q78-M82 PolarHBondContact O-N 3.25Å |
| 79 | Q | 57.6 | Low | 57.7 | Low | 120 Ų | 120 | 117.9 Ų | 117.9 | 56% | 0.561 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.4 | -44.1 | 174 | -81.2 | -179.6 | -22.9 | 0 | 0 | 111.6 | R75 L76 R77 M82 Y83 | R75-Q79 WeakPolarHBondContact O-CB 3.21Å; R75-Q79 PolarHBondContact O-N 3.11Å; L76-Q79 PolarHBondContact O-N 3.08Å; R77-Q79 VanDerWaalsContact C-N 3.33Å; R77-Q79 PolarHBondContact O-N 3.42Å; Q79-M82 PolarHBondContact O-N 2.81Å; Q79-Y83 WeakPolarHBondContact O-CB 3.3Å; Q79-Y83 VanDerWaalsContact O-CD2 3.27Å; Q79-Y83 WeakPolarHBondContact O-CD2 3.5Å; Q79-Y83 PolarHBondContact O-N 2.82Å |
| 80 | L | 58.4 | Low | 57.6 | Low | 110 Ų | 110 | 119 Ų | 119 | 58% | 0.576 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -66.5 | -35.5 | 176.3 | -103 | 127.3 | 0 | 0 | 0 | 113.2 | L76 R77 S84 | L76-L80 HydrophobicContact CD1-CD1 4.15Å; L76-L80 HydrophobicContact CG-CD1 4.05Å; L76-L80 WeakPolarHBondContact O-CB 2.9Å; L76-L80 PolarHBondContact O-N 3.3Å; R77-L80 PolarHBondContact O-N 2.84Å; L80-S84 VanDerWaalsContact O-CB 3.24Å; L80-S84 WeakPolarHBondContact O-CB 3.27Å; L80-S84 PolarHBondContact O-N 3.45Å; L80-S84 PolarHBondContact O-OG 3.36Å |
| 81 | E | 58 | Low | 57.4 | Low | 122 Ų | 122 | 122.9 Ų | 122.9 | 57% | 0.57 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.7 | -41.3 | 172.3 | -76.6 | 178.8 | -174.1 | 0 | 0 | 110.6 | R77 Q78 S84 L85 | R77-E81 WeakPolarHBondContact O-CB 3.18Å; R77-E81 WeakPolarHBondContact O-CG 3.43Å; R77-E81 PolarHBondContact O-N 2.98Å; Q78-E81 PolarHBondContact O-N 3.46Å; E81-S84 WeakPolarHBondContact CA-OG 3.42Å; E81-S84 PolarHBondContact O-N 3.3Å; E81-S84 PolarHBondContact O-OG 2.99Å; E81-L85 WeakPolarHBondContact O-CB 3.28Å; E81-L85 PolarHBondContact O-N 2.66Å |
| 82 | M | 59 | Low | 57.2 | Low | 148 Ų | 148 | 125.3 Ų | 125.3 | 73% | 0.729 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.2 | -43.4 | 173.2 | -115.4 | -125.2 | 177 | 0 | 0 | 112.3 | Q78 Q79 A86 | Q78-M82 WeakPolarHBondContact O-CB 3.44Å; Q78-M82 PolarHBondContact O-N 3.25Å; Q79-M82 PolarHBondContact O-N 2.81Å; M82-A86 WeakPolarHBondContact O-CB 3.38Å; M82-A86 PolarHBondContact O-N 2.83Å |
| 83 | Y | 57.1 | Low | 56.9 | Low | 184 Ų | 184 | 125.3 Ų | 125.3 | 72% | 0.722 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -67.4 | -38.6 | 177.8 | -91.1 | -80.1 | 0 | 0 | 0 | 112.2 | Q79 R87 | Q79-Y83 WeakPolarHBondContact O-CB 3.3Å; Q79-Y83 VanDerWaalsContact O-CD2 3.27Å; Q79-Y83 WeakPolarHBondContact O-CD2 3.5Å; Q79-Y83 PolarHBondContact O-N 2.82Å; Y83-R87 WeakPolarHBondContact O-CB 3.44Å; Y83-R87 PolarHBondContact O-N 3.42Å |
| 84 | S | 59.3 | Low | 56.6 | Low | 64 Ų | 64 | 125.2 Ų | 125.2 | 45% | 0.448 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -74.4 | -36.1 | 176.8 | 62.2 | 0 | 0 | 0 | 0 | 112.6 | L80 E81 R87 K88 | L80-S84 VanDerWaalsContact O-CB 3.24Å; L80-S84 WeakPolarHBondContact O-CB 3.27Å; L80-S84 PolarHBondContact O-N 3.45Å; L80-S84 PolarHBondContact O-OG 3.36Å; E81-S84 WeakPolarHBondContact CA-OG 3.42Å; E81-S84 PolarHBondContact O-N 3.3Å; E81-S84 PolarHBondContact O-OG 2.99Å; S84-R87 PolarHBondContact O-N 3.41Å; S84-K88 WeakPolarHBondContact O-CG 3.47Å; S84-K88 PolarHBondContact O-N 2.95Å |
| 85 | L | 56.7 | Low | 56.1 | Low | 96 Ų | 96 | 127 Ų | 127 | 50% | 0.503 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.7 | -43.8 | 173 | -169.1 | 64.7 | 0 | 0 | 0 | 110.6 | E81 R87 K88 F89 | E81-L85 WeakPolarHBondContact O-CB 3.28Å; E81-L85 PolarHBondContact O-N 2.66Å; L85-R87 VanDerWaalsContact C-N 3.32Å; L85-R87 PolarHBondContact O-N 2.86Å; L85-K88 PolarHBondContact O-N 2.86Å; L85-F89 HydrophobicContact CD1-CD2 4.15Å; L85-F89 HydrophobicContact CD1-CE2 3.86Å; L85-F89 HydrophobicContact CD2-CE2 4.26Å; L85-F89 HydrophobicContact CG-CD2 3.87Å; L85-F89 HydrophobicContact CG-CE2 3.79Å; L85-F89 VanDerWaalsContact O-CD2 3.31Å; L85-F89 WeakPolarHBondContact O-CD2 3.27Å; L85-F89 PolarHBondContact O-N 3.25Å |
| 86 | A | 57.8 | Low | 55.5 | Low | 57 Ų | 57 | 120.5 Ų | 120.5 | 47% | 0.471 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -59.1 | -43 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | M82 K88 F89 D90 | M82-A86 WeakPolarHBondContact O-CB 3.38Å; M82-A86 PolarHBondContact O-N 2.83Å; A86-K88 PolarHBondContact O-N 2.85Å; A86-F89 PolarHBondContact O-N 2.99Å; A86-D90 WeakPolarHBondContact O-CB 3.19Å; A86-D90 PolarHBondContact O-N 3.36Å |
| 87 | R | 56.2 | Low | 54.9 | Low | 198 Ų | 198 | 121 Ų | 121 | 75% | 0.747 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.9 | -34.7 | 176.6 | -145.3 | -174.2 | -152.5 | 164.8 | 6 | 112.9 | Y83 S84 L85 Q91 | Y83-R87 WeakPolarHBondContact O-CB 3.44Å; Y83-R87 PolarHBondContact O-N 3.42Å; S84-R87 PolarHBondContact O-N 3.41Å; L85-R87 VanDerWaalsContact C-N 3.32Å; L85-R87 PolarHBondContact O-N 2.86Å; R87-Q91 WeakPolarHBondContact O-CB 3.27Å; R87-Q91 PolarHBondContact O-N 3.25Å |
| 88 | K | 56.7 | Low | 54.3 | Low | 135 Ų | 135 | 115.6 Ų | 115.6 | 59% | 0.587 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69.9 | -37.6 | 173.1 | -77.9 | -174.3 | 176.9 | -169.4 | 0 | 112.2 | S84 L85 A86 Q91 H92 | S84-K88 WeakPolarHBondContact O-CG 3.47Å; S84-K88 PolarHBondContact O-N 2.95Å; L85-K88 PolarHBondContact O-N 2.86Å; A86-K88 PolarHBondContact O-N 2.85Å; K88-Q91 PolarHBondContact O-N 3.44Å; K88-H92 WeakPolarHBondContact O-CB 3.26Å; K88-H92 PolarHBondContact O-N 3.41Å |
| 89 | F | 55.7 | Low | 53.6 | Low | 134 Ų | 134 | 116.3 Ų | 116.3 | 59% | 0.588 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65.7 | -41.1 | 172.7 | -89.9 | -75.8 | 0 | 0 | 0 | 111.6 | L85 A86 Q91 H92 Q93 | L85-F89 HydrophobicContact CD1-CD2 4.15Å; L85-F89 HydrophobicContact CD1-CE2 3.86Å; L85-F89 HydrophobicContact CD2-CE2 4.26Å; L85-F89 HydrophobicContact CG-CD2 3.87Å; L85-F89 HydrophobicContact CG-CE2 3.79Å; L85-F89 VanDerWaalsContact O-CD2 3.31Å; L85-F89 WeakPolarHBondContact O-CD2 3.27Å; L85-F89 PolarHBondContact O-N 3.25Å; A86-F89 PolarHBondContact O-N 2.99Å; F89-Q91 VanDerWaalsContact C-N 3.35Å; F89-Q91 PolarHBondContact O-N 2.93Å; F89-H92 PolarHBondContact O-N 3.45Å; F89-Q93 VanDerWaalsContact O-CB 3.28Å; F89-Q93 WeakPolarHBondContact O-CB 3.39Å; F89-Q93 PolarHBondContact O-N 3.42Å |
| 90 | D | 55.8 | Low | 53.1 | Low | 90 Ų | 90 | 114 Ų | 114 | 48% | 0.481 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.1 | -41.9 | 174.9 | -152.4 | 53 | 0 | 0 | 0 | 111.2 | A86 Q93 H94 | A86-D90 WeakPolarHBondContact O-CB 3.19Å; A86-D90 PolarHBondContact O-N 3.36Å; D90-Q93 PolarHBondContact O-N 2.78Å; D90-H94 PolarHBondContact O-CD2 3.03Å; D90-H94 VanDerWaalsContact O-CD2 3.23Å; D90-H94 PolarHBondContact O-N 3.48Å |
| 91 | Q | 54.1 | Low | 52.5 | Low | 134 Ų | 134 | 113.2 Ų | 113.2 | 63% | 0.626 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -68 | -37.4 | 176.2 | -159.8 | 174.6 | 1.7 | 0 | 0 | 113 | R87 K88 F89 Q95 | R87-Q91 WeakPolarHBondContact O-CB 3.27Å; R87-Q91 PolarHBondContact O-N 3.25Å; K88-Q91 PolarHBondContact O-N 3.44Å; F89-Q91 VanDerWaalsContact C-N 3.35Å; F89-Q91 PolarHBondContact O-N 2.93Å; Q91-Q95 PolarHBondContact O-N 3.1Å |
| 92 | H | 52.5 | Low | 51.8 | Low | 132 Ų | 132 | 114.6 Ų | 114.6 | 61% | 0.611 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -71.6 | -31.9 | 172.2 | -82.2 | -163.9 | 0 | 0 | 0 | 112.6 | K88 F89 H94 Q95 G96 | K88-H92 WeakPolarHBondContact O-CB 3.26Å; K88-H92 PolarHBondContact O-N 3.41Å; F89-H92 PolarHBondContact O-N 3.45Å; H92-H94 VanDerWaalsContact C-N 3.33Å; H92-Q95 PolarHBondContact O-N 3.28Å; H92-G96 PolarHBondContact O-N 3.46Å |
| 93 | Q | 52.1 | Low | 51 | Low | 122 Ų | 122 | 114.5 Ų | 114.5 | 57% | 0.57 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69.1 | -34.6 | 176.2 | -160.9 | 179.3 | -32.3 | 0 | 0 | 111.1 | F89 D90 Q97 | F89-Q93 VanDerWaalsContact O-CB 3.28Å; F89-Q93 WeakPolarHBondContact O-CB 3.39Å; F89-Q93 PolarHBondContact O-N 3.42Å; D90-Q93 PolarHBondContact O-N 2.78Å; Q93-Q97 WeakPolarHBondContact O-CB 3.42Å; Q93-Q97 PolarHBondContact O-N 2.92Å; Q93-Q97 VanDerWaalsContact O-N 3.07Å |
| 94 | H | 48.3 | Very low | 50.3 | Low | 124 Ų | 124 | 110.5 Ų | 110.5 | 57% | 0.574 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -71.9 | -30.4 | 172.5 | -82.7 | -68.9 | 0 | 0 | 0 | 114 | D90 H92 S98 | D90-H94 PolarHBondContact O-CD2 3.03Å; D90-H94 VanDerWaalsContact O-CD2 3.23Å; D90-H94 PolarHBondContact O-N 3.48Å; H92-H94 VanDerWaalsContact C-N 3.33Å; H94-S98 PolarHBondContact O-N 3.43Å; H94-S98 PolarHBondContact O-OG 3.46Å |
| 95 | Q | 47.4 | Very low | 49.8 | Very low | 121 Ų | 121 | 115.7 Ų | 115.7 | 57% | 0.565 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -78.6 | -36 | 175.3 | -156.9 | 165.4 | 18.3 | 0 | 0 | 112.2 | Q91 H92 S98 E99 | Q91-Q95 PolarHBondContact O-N 3.1Å; H92-Q95 PolarHBondContact O-N 3.28Å; Q95-S98 WeakPolarHBondContact CA-OG 3.46Å; Q95-S98 PolarHBondContact O-OG 2.99Å; Q95-S98 VanDerWaalsContact O-OG 3.13Å; Q95-E99 PolarHBondContact O-N 3.36Å |
| 96 | G | 46.4 | Very low | 49 | Very low | 41 Ų | 41 | 122.6 Ų | 122.6 | 42% | 0.423 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -70.8 | -33.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | H92 S100 | H92-G96 PolarHBondContact O-N 3.46Å; G96-S100 WeakPolarHBondContact O-CB 3.49Å; G96-S100 PolarHBondContact O-N 3.02Å; G96-S100 VanDerWaalsContact O-N 3.09Å; G96-S100 PolarHBondContact O-OG 3.12Å |
| 97 | Q | 45.6 | Very low | 48.6 | Very low | 110 Ų | 110 | 125.9 Ų | 125.9 | 51% | 0.514 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -75.6 | -28.5 | 174.1 | -90.3 | -171.7 | -2.6 | 0 | 0 | 113.6 | Q93 S100 V101 | Q93-Q97 WeakPolarHBondContact O-CB 3.42Å; Q93-Q97 PolarHBondContact O-N 2.92Å; Q93-Q97 VanDerWaalsContact O-N 3.07Å; Q97-S100 WeakPolarHBondContact CA-OG 3.27Å; Q97-S100 PolarHBondContact O-OG 3.4Å; Q97-V101 WeakPolarHBondContact O-CB 3.39Å; Q97-V101 WeakPolarHBondContact O-CG2 3.07Å; Q97-V101 PolarHBondContact O-N 3.44Å; Q97-V101 VanDerWaalsContact O-N 3.15Å |
| 98 | S | 44.8 | Very low | 48.2 | Very low | 61 Ų | 61 | 122.1 Ų | 122.1 | 43% | 0.427 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -74.4 | -30.3 | 177.5 | 36.4 | 0 | 0 | 0 | 0 | 112.5 | H94 Q95 | H94-S98 PolarHBondContact O-N 3.43Å; H94-S98 PolarHBondContact O-OG 3.46Å; Q95-S98 WeakPolarHBondContact CA-OG 3.46Å; Q95-S98 PolarHBondContact O-OG 2.99Å; Q95-S98 VanDerWaalsContact O-OG 3.13Å |
| 99 | E | 45.6 | Very low | 47.7 | Very low | 140 Ų | 140 | 121.4 Ų | 121.4 | 65% | 0.654 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -79.3 | -35.6 | 171.1 | -69.1 | -172.7 | 155.1 | 0 | 0 | 112.7 | Q95 L103 | Q95-E99 PolarHBondContact O-N 3.36Å; E99-L103 PolarHBondContact O-N 3.21Å |
| 100 | S | 46.8 | Very low | 47.2 | Very low | 70 Ų | 70 | 120.6 Ų | 120.6 | 49% | 0.49 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -74.4 | -26 | -179.6 | 74.6 | 0 | 0 | 0 | 0 | 114.2 | G96 Q97 | G96-S100 WeakPolarHBondContact O-CB 3.49Å; G96-S100 PolarHBondContact O-N 3.02Å; G96-S100 VanDerWaalsContact O-N 3.09Å; G96-S100 PolarHBondContact O-OG 3.12Å; Q97-S100 WeakPolarHBondContact CA-OG 3.27Å; Q97-S100 PolarHBondContact O-OG 3.4Å |
| 101 | V | 47.3 | Very low | 46.7 | Very low | 94 Ų | 94 | 122.6 Ų | 122.6 | 57% | 0.57 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -81.5 | -27.8 | 177.9 | 174.9 | 0 | 0 | 0 | 0 | 111.8 | Q97 | Q97-V101 WeakPolarHBondContact O-CB 3.39Å; Q97-V101 WeakPolarHBondContact O-CG2 3.07Å; Q97-V101 PolarHBondContact O-N 3.44Å; Q97-V101 VanDerWaalsContact O-N 3.15Å |
| 102 | Q | 43.3 | Very low | 46.2 | Very low | 151 Ų | 151 | 121.8 Ų | 121.8 | 71% | 0.706 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -76 | -31 | 175.3 | -75.4 | -174.1 | 44.5 | 0 | 0 | 113 | S104 | Q102-S104 PolarHBondContact O-N 3.24Å |
| 103 | L | 41.6 | Very low | 45.7 | Very low | 146 Ų | 146 | 121.1 Ų | 121.1 | 76% | 0.764 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | -4 | 178.9 | -122.1 | 94.5 | 0 | 0 | 0 | 115 | E99 | E99-L103 PolarHBondContact O-N 3.21Š|
| 104 | S | 43.2 | Very low | 45.2 | Very low | 101 Ų | 101 | 121 Ų | 121 | 71% | 0.706 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.9 | 3.2 | -177.9 | -170.5 | 0 | 0 | 0 | 0 | 113.7 | Q102 | Q102-S104 PolarHBondContact O-N 3.24Š|
| 105 | M | 47.6 | Very low | 45 | Very low | 173 Ų | 173 | 120.8 Ų | 120.8 | 85% | 0.852 | 65% | 0.65 | S | S | * | * | trans | -112.1 | 14.5 | 179.6 | -76 | -155.9 | 174.2 | 0 | 0 | 114.6 | ||||
| 106 | E | 40.3 | Very low | 44.8 | Very low | 241 Ų | 241 | 120.7 Ų | 120.7 | 100% | 1.126 | 66% | 0.657 | S | S | * | * | trans | -103.6 | 0 | 169.7 | -70.3 | -176.6 | 103.8 | 0 | 0 | 112.2 |
Retrieved 106 of 106 residues in 19 ms
(Link to these results)