| 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 | 47.4 | Very low | 233 Ų | 233 | 128.4 Ų | 128.4 | 100% | 1.148 | 72% | 0.716 | S | S | * | * | 0 | 57.6 | 0 | -62.3 | -55.1 | -176.7 | 0 | 0 | 110.3 | |||||
| 2 | T | 48.3 | Very low | 47.5 | Very low | 113 Ų | 113 | 128.4 Ų | 128.4 | 69% | 0.693 | 71% | 0.713 | S | S | * | * | trans | -118.4 | 3.2 | -172.7 | 38.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 3 | F | 47 | Very low | 47.5 | Very low | 187 Ų | 187 | 129.5 Ų | 129.5 | 82% | 0.82 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -95.2 | -18.4 | -179.4 | -92.4 | -87.8 | 0 | 0 | 0 | 114.5 | G5 | F3-G5 VanDerWaalsContact C-N 3.34Š|
| 4 | F | 46.6 | Very low | 47.6 | Very low | 199 Ų | 199 | 127.6 Ų | 127.6 | 87% | 0.873 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -79.9 | -15 | 179.2 | -118.3 | -91.2 | 0 | 0 | 0 | 113.8 | ||
| 5 | G | 44.7 | Very low | 47.4 | Very low | 53 Ų | 53 | 121.7 Ų | 121.7 | 55% | 0.546 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -83.8 | -29.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | F3 V9 | F3-G5 VanDerWaalsContact C-N 3.34Å; G5-V9 PolarHBondContact O-N 2.91Å |
| 6 | L | 48.6 | Very low | 47.6 | Very low | 125 Ų | 125 | 124.3 Ų | 124.3 | 65% | 0.654 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -76.5 | -29 | -179.8 | -108.5 | 115.3 | 0 | 0 | 0 | 112.9 | V9 N10 | L6-V9 PolarHBondContact O-N 3.08Å; L6-N10 WeakPolarHBondContact O-CB 3.4Å; L6-N10 PolarHBondContact O-N 3.46Å |
| 7 | A | 50.3 | Low | 47.6 | Very low | 69 Ų | 69 | 127.9 Ų | 127.9 | 57% | 0.57 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -68 | -36.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | D11 | A7-D11 PolarHBondContact O-N 3Å |
| 8 | A | 48.9 | Very low | 47.8 | Very low | 62 Ų | 62 | 124.2 Ų | 124.2 | 51% | 0.512 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -74.4 | -27 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 9 | V | 49.6 | Very low | 48.1 | Very low | 104 Ų | 104 | 124.2 Ų | 124.2 | 63% | 0.63 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -82.3 | -23.3 | 176.8 | 102.2 | 0 | 0 | 0 | 0 | 112.7 | G5 L6 | G5-V9 PolarHBondContact O-N 2.91Å; L6-V9 PolarHBondContact O-N 3.08Å |
| 10 | N | 47.5 | Very low | 48.5 | Very low | 119 Ų | 119 | 121 Ų | 121 | 64% | 0.636 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -85 | -22.8 | 176.6 | -158.6 | 65.9 | 0 | 0 | 0 | 113.2 | L6 L12 | L6-N10 WeakPolarHBondContact O-CB 3.4Å; L6-N10 PolarHBondContact O-N 3.46Å; N10-L12 VanDerWaalsContact C-N 3.31Å |
| 11 | D | 44.9 | Very low | 49.2 | Very low | 148 Ų | 148 | 117.2 Ų | 117.2 | 79% | 0.791 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -13.3 | 174.8 | -146.7 | 58.4 | 0 | 0 | 0 | 112.7 | A7 | A7-D11 PolarHBondContact O-N 3Š|
| 12 | L | 48.8 | Very low | 50.3 | Low | 129 Ų | 129 | 111.7 Ų | 111.7 | 68% | 0.675 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.4 | 31.6 | 178.3 | -106.9 | 153.7 | 0 | 0 | 0 | 112.1 | N10 P14 | N10-L12 VanDerWaalsContact C-N 3.31Å; L12-P14 WeakPolarHBondContact O-CD 3.42Å; L12-P14 VanDerWaalsContact O-CG 3.32Å; L12-P14 WeakPolarHBondContact O-CG 3.37Å; L12-P14 VanDerWaalsContact O-N 3.12Å |
| 13 | Q | 46.9 | Very low | 51.1 | Low | 143 Ų | 143 | 108.7 Ų | 108.7 | 67% | 0.668 | 61% | 0.607 | S | S | * | * | trans | -66.9 | 100 | 154.2 | -83.7 | -158.5 | -94.8 | 0 | 0 | 107.7 | G15 | Q13-G15 PolarHBondContact O-N 3.25Å; Q13-G15 VanDerWaalsContact O-N 3.12Å | ||
| 14 | P | 48.9 | Very low | 51.8 | Low | 103 Ų | 103 | 107 Ų | 107 | 67% | 0.669 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | 6.7 | -178.7 | 4.2 | 19.5 | 0 | 0 | 0 | 110.4 | L12 A18 | L12-P14 WeakPolarHBondContact O-CD 3.42Å; L12-P14 VanDerWaalsContact O-CG 3.32Å; L12-P14 WeakPolarHBondContact O-CG 3.37Å; L12-P14 VanDerWaalsContact O-N 3.12Å; P14-A18 VanDerWaalsContact O-CB 3.28Å; P14-A18 WeakPolarHBondContact O-CB 3.47Å |
| 15 | G | 45.7 | Very low | 52.3 | Low | 38 Ų | 38 | 106.2 Ų | 106.2 | 39% | 0.392 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -78.2 | -40 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q13 E19 | Q13-G15 PolarHBondContact O-N 3.25Å; Q13-G15 VanDerWaalsContact O-N 3.12Å; G15-E19 WeakPolarHBondContact O-CB 3.36Å; G15-E19 PolarHBondContact O-N 3.25Å |
| 16 | E | 49.3 | Very low | 52.9 | Low | 164 Ų | 164 | 108.3 Ų | 108.3 | 77% | 0.766 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -83.7 | -38.3 | -169.2 | -137.5 | -164.7 | 130.2 | 0 | 0 | 113.3 | S20 | E16-S20 WeakPolarHBondContact O-CB 3.34Å; E16-S20 PolarHBondContact O-N 2.95Å |
| 17 | K | 47.9 | Very low | 53.4 | Low | 185 Ų | 185 | 107.1 Ų | 107.1 | 80% | 0.804 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -73 | -34.7 | 176.9 | -98.8 | -171 | -179 | 174.1 | 0 | 113 | A21 | K17-A21 VanDerWaalsContact O-CB 3.27Å; K17-A21 WeakPolarHBondContact O-CB 3.49Å; K17-A21 PolarHBondContact O-N 2.92Å |
| 18 | A | 51.6 | Low | 53.9 | Low | 62 Ų | 62 | 108.5 Ų | 108.5 | 51% | 0.512 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -70.3 | -42.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | P14 L22 | P14-A18 VanDerWaalsContact O-CB 3.28Å; P14-A18 WeakPolarHBondContact O-CB 3.47Å; A18-L22 WeakPolarHBondContact O-CB 3.17Å; A18-L22 PolarHBondContact O-N 3.43Å |
| 19 | E | 54.3 | Low | 54.6 | Low | 124 Ų | 124 | 109.9 Ų | 109.9 | 58% | 0.579 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.8 | -41 | 171 | -101.3 | -166.3 | 89.8 | 0 | 0 | 112.4 | G15 L22 N23 | G15-E19 WeakPolarHBondContact O-CB 3.36Å; G15-E19 PolarHBondContact O-N 3.25Å; E19-L22 PolarHBondContact O-N 3.35Å; E19-N23 WeakPolarHBondContact O-CB 3.4Å; E19-N23 PolarHBondContact O-N 3.23Å; E19-N23 PolarHBondContact O-ND2 3.48Å; E19-N23 VanDerWaalsContact O-ND2 3.11Å |
| 20 | S | 55.8 | Low | 54.8 | Low | 60 Ų | 60 | 111 Ų | 111 | 42% | 0.42 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.7 | -42.1 | 177.8 | 178.5 | 0 | 0 | 0 | 0 | 112.1 | E16 R24 | E16-S20 WeakPolarHBondContact O-CB 3.34Å; E16-S20 PolarHBondContact O-N 2.95Å; S20-R24 WeakPolarHBondContact O-CB 3.35Å; S20-R24 PolarHBondContact O-N 3.3Å |
| 21 | A | 61.7 | Low | 55.1 | Low | 41 Ų | 41 | 108.8 Ų | 108.8 | 34% | 0.339 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -69.9 | -40.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K17 R24 W25 | K17-A21 VanDerWaalsContact O-CB 3.27Å; K17-A21 WeakPolarHBondContact O-CB 3.49Å; K17-A21 PolarHBondContact O-N 2.92Å; A21-R24 PolarHBondContact O-N 3.39Å; A21-W25 VanDerWaalsContact O-CB 3.31Å; A21-W25 WeakPolarHBondContact O-CB 3.4Å; A21-W25 PolarHBondContact O-N 3.4Å |
| 22 | L | 68.2 | Low | 55.6 | Low | 117 Ų | 117 | 106.2 Ų | 106.2 | 61% | 0.613 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -67.8 | -42.7 | 176.2 | -167.5 | 107.2 | 0 | 0 | 0 | 111.2 | A18 E19 W25 K26 | A18-L22 WeakPolarHBondContact O-CB 3.17Å; A18-L22 PolarHBondContact O-N 3.43Å; E19-L22 PolarHBondContact O-N 3.35Å; L22-W25 PolarHBondContact O-N 2.83Å; L22-K26 WeakPolarHBondContact O-CB 3.38Å; L22-K26 PolarHBondContact O-N 3.47Å |
| 23 | N | 64.8 | Low | 55.5 | Low | 51 Ų | 51 | 105.8 Ų | 105.8 | 27% | 0.273 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67 | -39.3 | 175.1 | -73.9 | -34.6 | 0 | 0 | 0 | 110.8 | E19 K26 D27 | E19-N23 WeakPolarHBondContact O-CB 3.4Å; E19-N23 PolarHBondContact O-N 3.23Å; E19-N23 PolarHBondContact O-ND2 3.48Å; E19-N23 VanDerWaalsContact O-ND2 3.11Å; N23-K26 CarbonylContact O-C 3.37Å; N23-K26 WeakPolarHBondContact O-CB 3.48Å; N23-K26 PolarHBondContact O-N 3.07Å; N23-K26 PolarHBondContact OD1-NZ 3.29Å; N23-K26 VanDerWaalsContact OD1-NZ 3.1Å; N23-D27 VanDerWaalsContact O-CB 3.32Å; N23-D27 WeakPolarHBondContact O-CB 3.43Å; N23-D27 PolarHBondContact O-N 3.03Å |
| 24 | R | 63.2 | Low | 55.5 | Low | 152 Ų | 152 | 101.5 Ų | 101.5 | 57% | 0.574 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.8 | -37 | 174 | -169.5 | 163.5 | 67.4 | -146.4 | 3.5 | 112.8 | S20 A21 D27 L28 | S20-R24 WeakPolarHBondContact O-CB 3.35Å; S20-R24 PolarHBondContact O-N 3.3Å; A21-R24 PolarHBondContact O-N 3.39Å; R24-D27 PolarHBondContact O-N 3.36Å; R24-L28 WeakPolarHBondContact O-CB 3.41Å; R24-L28 WeakPolarHBondContact O-CG 3.48Å; R24-L28 PolarHBondContact O-N 3.49Å |
| 25 | W | 57 | Low | 55.3 | Low | 182 Ų | 182 | 104.6 Ų | 104.6 | 69% | 0.689 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -68.8 | -38 | 171.3 | -95.4 | 62.2 | 0 | 0 | 0 | 111.9 | A21 L22 D27 L28 L29 | A21-W25 VanDerWaalsContact O-CB 3.31Å; A21-W25 WeakPolarHBondContact O-CB 3.4Å; A21-W25 PolarHBondContact O-N 3.4Å; L22-W25 PolarHBondContact O-N 2.83Å; W25-D27 VanDerWaalsContact C-N 3.34Å; W25-L28 PolarHBondContact O-N 3.32Å; W25-L29 WeakPolarHBondContact O-CB 3.46Å; W25-L29 VanDerWaalsContact O-CG 3.26Å; W25-L29 WeakPolarHBondContact O-CG 3.37Å; W25-L29 PolarHBondContact O-N 2.91Å |
| 26 | K | 56.1 | Low | 55.5 | Low | 97 Ų | 97 | 105.5 Ų | 105.5 | 42% | 0.422 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.3 | -40 | 173.9 | -164.7 | 179.4 | 69.6 | -176.2 | 0 | 110.2 | L22 N23 L29 F30 | L22-K26 WeakPolarHBondContact O-CB 3.38Å; L22-K26 PolarHBondContact O-N 3.47Å; N23-K26 CarbonylContact O-C 3.37Å; N23-K26 WeakPolarHBondContact O-CB 3.48Å; N23-K26 PolarHBondContact O-N 3.07Å; N23-K26 PolarHBondContact OD1-NZ 3.29Å; N23-K26 VanDerWaalsContact OD1-NZ 3.1Å; K26-L29 CarbonylContact O-C 3.53Å; K26-L29 PolarHBondContact O-N 3.5Å; K26-F30 HydrophobicContact CD-CE2 4.42Å; K26-F30 HydrophobicContact CG-CD2 3.95Å; K26-F30 HydrophobicContact CG-CE2 3.88Å; K26-F30 WeakPolarHBondContact O-CB 3.29Å; K26-F30 WeakPolarHBondContact O-CD2 3.33Å; K26-F30 PolarHBondContact O-N 3.18Å |
| 27 | D | 60.6 | Low | 55.5 | Low | 100 Ų | 100 | 100.3 Ų | 100.3 | 54% | 0.535 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70.7 | -34.4 | 175.5 | -67.9 | -22.9 | 0 | 0 | 0 | 112.1 | N23 R24 W25 F30 S31 | N23-D27 VanDerWaalsContact O-CB 3.32Å; N23-D27 WeakPolarHBondContact O-CB 3.43Å; N23-D27 PolarHBondContact O-N 3.03Å; R24-D27 PolarHBondContact O-N 3.36Å; W25-D27 VanDerWaalsContact C-N 3.34Å; D27-F30 CarbonylContact O-C 3.57Å; D27-F30 PolarHBondContact O-N 2.94Å; D27-S31 WeakPolarHBondContact O-CB 3.38Å; D27-S31 PolarHBondContact O-N 2.96Å |
| 28 | L | 61 | Low | 55.4 | Low | 98 Ų | 98 | 93 Ų | 93 | 51% | 0.513 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -71.1 | -36.9 | 171.4 | -74.3 | 171.7 | 0 | 0 | 0 | 111.7 | R24 W25 S31 V32 | R24-L28 WeakPolarHBondContact O-CB 3.41Å; R24-L28 WeakPolarHBondContact O-CG 3.48Å; R24-L28 PolarHBondContact O-N 3.49Å; W25-L28 PolarHBondContact O-N 3.32Å; L28-S31 PolarHBondContact O-N 3.01Å; L28-V32 WeakPolarHBondContact O-CB 3.27Å; L28-V32 VanDerWaalsContact O-CG2 3.27Å; L28-V32 WeakPolarHBondContact O-CG2 3.12Å; L28-V32 PolarHBondContact O-N 2.97Å |
| 29 | L | 62.2 | Low | 55.5 | Low | 90 Ų | 90 | 94.1 Ų | 94.1 | 47% | 0.471 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66 | -42.4 | 169.9 | -75.3 | 170.8 | 0 | 0 | 0 | 110.7 | W25 K26 S31 F33 | W25-L29 WeakPolarHBondContact O-CB 3.46Å; W25-L29 VanDerWaalsContact O-CG 3.26Å; W25-L29 WeakPolarHBondContact O-CG 3.37Å; W25-L29 PolarHBondContact O-N 2.91Å; K26-L29 CarbonylContact O-C 3.53Å; K26-L29 PolarHBondContact O-N 3.5Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-S31 PolarHBondContact O-N 3.22Å; L29-F33 HydrophobicContact CB-CD2 4.45Å; L29-F33 HydrophobicContact CD2-CD2 3.76Å; L29-F33 HydrophobicContact CD2-CE2 3.53Å; L29-F33 WeakPolarHBondContact O-CA 3.5Å; L29-F33 WeakPolarHBondContact O-CB 3.33Å; L29-F33 WeakPolarHBondContact O-CD2 3.2Å; L29-F33 PolarHBondContact O-N 3.08Å |
| 30 | F | 53.8 | Low | 55 | Low | 128 Ų | 128 | 95.4 Ų | 95.4 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | I | π-helix | trans | -66 | -33.3 | 172.8 | -88.9 | -73.4 | 0 | 0 | 0 | 111.8 | K26 D27 A34 | K26-F30 HydrophobicContact CD-CE2 4.42Å; K26-F30 HydrophobicContact CG-CD2 3.95Å; K26-F30 HydrophobicContact CG-CE2 3.88Å; K26-F30 WeakPolarHBondContact O-CB 3.29Å; K26-F30 WeakPolarHBondContact O-CD2 3.33Å; K26-F30 PolarHBondContact O-N 3.18Å; D27-F30 CarbonylContact O-C 3.57Å; D27-F30 PolarHBondContact O-N 2.94Å; F30-A34 HydrophobicContact CD1-CB 4.1Å; F30-A34 WeakPolarHBondContact O-CA 3.46Å; F30-A34 WeakPolarHBondContact O-CB 3.48Å; F30-A34 PolarHBondContact O-N 3.4Å |
| 31 | S | 54.5 | Low | 54.5 | Low | 72 Ų | 72 | 96.2 Ų | 96.2 | 50% | 0.503 | 50% | 0.5 | S | S | . | . | I | π-helix | trans | -77.1 | -42.9 | 178.2 | -172.9 | 0 | 0 | 0 | 0 | 112.2 | D27 L28 L29 F35 | D27-S31 WeakPolarHBondContact O-CB 3.38Å; D27-S31 PolarHBondContact O-N 2.96Å; L28-S31 PolarHBondContact O-N 3.01Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-S31 PolarHBondContact O-N 3.22Å; S31-F35 VanDerWaalsContact O-CB 3.26Å; S31-F35 WeakPolarHBondContact O-CB 3.33Å |
| 32 | V | 55.3 | Low | 53.9 | Low | 94 Ų | 94 | 98.6 Ų | 98.6 | 57% | 0.57 | 51% | 0.506 | S | S | * | . | I | π-helix | trans | -76.9 | -32.5 | 179.6 | 170.3 | 0 | 0 | 0 | 0 | 112.2 | L28 P36 | L28-V32 WeakPolarHBondContact O-CB 3.27Å; L28-V32 VanDerWaalsContact O-CG2 3.27Å; L28-V32 WeakPolarHBondContact O-CG2 3.12Å; L28-V32 PolarHBondContact O-N 2.97Å; V32-P36 WeakPolarHBondContact O-CD 3.05Å; V32-P36 VanDerWaalsContact O-CG 3.26Å; V32-P36 WeakPolarHBondContact O-CG 3.29Å |
| 33 | F | 45.8 | Very low | 53.3 | Low | 121 Ų | 121 | 96.8 Ų | 96.8 | 53% | 0.531 | 50% | 0.5 | S | S | . | . | I | π-helix | trans | -96.4 | -49.6 | 175.7 | -68.2 | -86.8 | 0 | 0 | 0 | 112.1 | L29 F35 P36 V37 | L29-F33 HydrophobicContact CB-CD2 4.45Å; L29-F33 HydrophobicContact CD2-CD2 3.76Å; L29-F33 HydrophobicContact CD2-CE2 3.53Å; L29-F33 WeakPolarHBondContact O-CA 3.5Å; L29-F33 WeakPolarHBondContact O-CB 3.33Å; L29-F33 WeakPolarHBondContact O-CD2 3.2Å; L29-F33 PolarHBondContact O-N 3.08Å; F33-F35 PolarHBondContact O-N 2.88Å; F33-P36 WeakPolarHBondContact O-CD 3.17Å; F33-V37 HydrophobicContact CB-CG2 4.26Å; F33-V37 HydrophobicContact CD1-CG2 4.36Å; F33-V37 WeakPolarHBondContact O-CA 3.47Å; F33-V37 WeakPolarHBondContact O-CB 3.46Å; F33-V37 WeakPolarHBondContact O-CG2 3.46Å; F33-V37 PolarHBondContact O-N 3.15Å |
| 34 | A | 48.7 | Very low | 52.7 | Low | 53 Ų | 53 | 99.4 Ų | 99.4 | 44% | 0.438 | 51% | 0.513 | S | S | . | . | I | π-helix | trans | -71.5 | -27 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | F30 G38 | F30-A34 HydrophobicContact CD1-CB 4.1Å; F30-A34 WeakPolarHBondContact O-CA 3.46Å; F30-A34 WeakPolarHBondContact O-CB 3.48Å; F30-A34 PolarHBondContact O-N 3.4Å; A34-G38 PolarHBondContact O-N 3.18Å; A34-G38 VanDerWaalsContact O-N 3.12Å |
| 35 | F | 44.9 | Very low | 52 | Low | 167 Ų | 167 | 95.5 Ų | 95.5 | 73% | 0.732 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -77.3 | -40.9 | 179.8 | -133.5 | -94.1 | 0 | 0 | 0 | 113.2 | S31 F33 T39 | S31-F35 VanDerWaalsContact O-CB 3.26Å; S31-F35 WeakPolarHBondContact O-CB 3.33Å; F33-F35 PolarHBondContact O-N 2.88Å; F35-T39 PolarHBondContact O-OG1 2.95Å |
| 36 | P | 49.4 | Very low | 52 | Low | 58 Ų | 58 | 90.6 Ų | 90.6 | 38% | 0.377 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -83.9 | -33.7 | 172.1 | -15.5 | 32.9 | 0 | 0 | 0 | 113.7 | V32 F33 G38 T39 H40 | V32-P36 WeakPolarHBondContact O-CD 3.05Å; V32-P36 VanDerWaalsContact O-CG 3.26Å; V32-P36 WeakPolarHBondContact O-CG 3.29Å; F33-P36 WeakPolarHBondContact O-CD 3.17Å; P36-G38 VanDerWaalsContact C-N 3.34Å; P36-T39 PolarHBondContact O-N 3.32Å; P36-H40 VanDerWaalsContact O-CB 3.31Å; P36-H40 WeakPolarHBondContact O-CB 3.33Å; P36-H40 PolarHBondContact O-N 3.09Å |
| 37 | V | 48.3 | Very low | 51.9 | Low | 55 Ų | 55 | 90.7 Ų | 90.7 | 33% | 0.333 | 50% | 0.502 | S | S | . | . | I | π-helix | trans | -70.3 | -33.8 | 179.4 | 177 | 0 | 0 | 0 | 0 | 110.2 | F33 T39 T41 L42 | F33-V37 HydrophobicContact CB-CG2 4.26Å; F33-V37 HydrophobicContact CD1-CG2 4.36Å; F33-V37 WeakPolarHBondContact O-CA 3.47Å; F33-V37 WeakPolarHBondContact O-CB 3.46Å; F33-V37 WeakPolarHBondContact O-CG2 3.46Å; F33-V37 PolarHBondContact O-N 3.15Å; V37-T39 VanDerWaalsContact C-N 3.32Å; V37-T39 PolarHBondContact O-N 2.89Å; V37-T41 WeakPolarHBondContact CA-OG1 3.4Å; V37-T41 VanDerWaalsContact CG1-CB 3.49Å; V37-T41 HydrophobicContact CG1-CG2 3.87Å; V37-T41 CarbonylContact O-C 3.57Å; V37-T41 VanDerWaalsContact O-CA 3.25Å; V37-T41 WeakPolarHBondContact O-CA 3.44Å; V37-T41 WeakPolarHBondContact O-CB 3.29Å; V37-T41 PolarHBondContact O-N 3.34Å; V37-L42 PolarHBondContact O-N 3.24Å |
| 38 | G | 46.5 | Very low | 51.5 | Low | 32 Ų | 32 | 90.3 Ų | 90.3 | 33% | 0.33 | 50% | 0.5 | S | S | . | . | I | π-helix | trans | -68.8 | -24 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | A34 P36 L42 | A34-G38 PolarHBondContact O-N 3.18Å; A34-G38 VanDerWaalsContact O-N 3.12Å; P36-G38 VanDerWaalsContact C-N 3.34Å; G38-L42 WeakPolarHBondContact O-CB 3.28Å; G38-L42 WeakPolarHBondContact O-CD1 3.32Å |
| 39 | T | 53.4 | Low | 51.2 | Low | 85 Ų | 85 | 87 Ų | 87 | 52% | 0.521 | 49% | 0.489 | S | S | . | . | I | π-helix | trans | -112.1 | -28.2 | -176.1 | 52.5 | 0 | 0 | 0 | 0 | 113.1 | F35 P36 V37 V43 | F35-T39 PolarHBondContact O-OG1 2.95Å; P36-T39 PolarHBondContact O-N 3.32Å; V37-T39 VanDerWaalsContact C-N 3.32Å; V37-T39 PolarHBondContact O-N 2.89Å; T39-V43 WeakPolarHBondContact O-CG2 3.3Å |
| 40 | H | 44.2 | Very low | 50.6 | Low | 150 Ų | 150 | 88.1 Ų | 88.1 | 69% | 0.694 | 49% | 0.492 | S | S | * | . | I | π-helix | trans | -107 | -28.9 | 177.8 | -66.6 | -72.3 | 0 | 0 | 0 | 114 | P36 | P36-H40 VanDerWaalsContact O-CB 3.31Å; P36-H40 WeakPolarHBondContact O-CB 3.33Å; P36-H40 PolarHBondContact O-N 3.09Å |
| 41 | T | 45.6 | Very low | 50.5 | Low | 77 Ų | 77 | 85.3 Ų | 85.3 | 47% | 0.472 | 49% | 0.485 | S | S | . | . | I | π-helix | trans | -97.6 | -24.4 | -179.2 | -48.7 | 0 | 0 | 0 | 0 | 112.7 | V37 P45 | V37-T41 WeakPolarHBondContact CA-OG1 3.4Å; V37-T41 VanDerWaalsContact CG1-CB 3.49Å; V37-T41 HydrophobicContact CG1-CG2 3.87Å; V37-T41 CarbonylContact O-C 3.57Å; V37-T41 VanDerWaalsContact O-CA 3.25Å; V37-T41 WeakPolarHBondContact O-CA 3.44Å; V37-T41 WeakPolarHBondContact O-CB 3.29Å; V37-T41 PolarHBondContact O-N 3.34Å; T41-P45 WeakPolarHBondContact O-CD 3.32Å |
| 42 | L | 48.3 | Very low | 50.4 | Low | 92 Ų | 92 | 86.6 Ų | 86.6 | 48% | 0.482 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -77.6 | -20.3 | 171 | -70 | -179.1 | 0 | 0 | 0 | 113.3 | V37 G38 L44 P45 V46 | V37-L42 PolarHBondContact O-N 3.24Å; G38-L42 WeakPolarHBondContact O-CB 3.28Å; G38-L42 WeakPolarHBondContact O-CD1 3.32Å; L42-L44 PolarHBondContact O-N 3.39Å; L42-P45 HydrophobicContact CD2-CG 4.25Å; L42-P45 VanDerWaalsContact O-CD 3.26Å; L42-P45 WeakPolarHBondContact O-CD 3.45Å; L42-P45 WeakPolarHBondContact O-CG 3.38Å; L42-V46 WeakPolarHBondContact O-CB 3.37Å; L42-V46 WeakPolarHBondContact O-CG2 3.28Å; L42-V46 PolarHBondContact O-N 2.94Å |
| 43 | V | 55.8 | Low | 49.9 | Very low | 78 Ų | 78 | 88.1 Ų | 88.1 | 47% | 0.473 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.8 | -38.1 | 172.2 | 165.7 | 0 | 0 | 0 | 0 | 110.8 | T39 L47 | T39-V43 WeakPolarHBondContact O-CG2 3.3Å; V43-L47 HydrophobicContact CG1-CD1 3.87Å; V43-L47 VanDerWaalsContact O-CB 3.25Å; V43-L47 WeakPolarHBondContact O-CB 3.37Å; V43-L47 WeakPolarHBondContact O-CD1 3.37Å; V43-L47 PolarHBondContact O-N 3.07Å |
| 44 | L | 51.1 | Low | 49.5 | Very low | 106 Ų | 106 | 86.4 Ų | 86.4 | 56% | 0.555 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -67.6 | -52.1 | -178.8 | -135.5 | 106.6 | 0 | 0 | 0 | 113.8 | L42 L47 L48 | L42-L44 PolarHBondContact O-N 3.39Å; L44-L47 PolarHBondContact O-N 3.12Å; L44-L48 WeakPolarHBondContact O-CB 3.38Å; L44-L48 PolarHBondContact O-N 3.42Å |
| 45 | P | 49.9 | Very low | 49.1 | Very low | 70 Ų | 70 | 85.7 Ų | 85.7 | 46% | 0.455 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -72.9 | -25.2 | 175.8 | 28.6 | -34 | 0 | 0 | 0 | 113.1 | T41 L42 G49 | T41-P45 WeakPolarHBondContact O-CD 3.32Å; L42-P45 HydrophobicContact CD2-CG 4.25Å; L42-P45 VanDerWaalsContact O-CD 3.26Å; L42-P45 WeakPolarHBondContact O-CD 3.45Å; L42-P45 WeakPolarHBondContact O-CG 3.38Å; P45-G49 WeakPolarHBondContact O-CA 3.48Å; P45-G49 PolarHBondContact O-N 2.96Å |
| 46 | V | 55.7 | Low | 49.2 | Very low | 80 Ų | 80 | 82.1 Ų | 82.1 | 49% | 0.485 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -71.9 | -42.8 | 170.2 | 173.6 | 0 | 0 | 0 | 0 | 110.3 | L42 G49 E50 | L42-V46 WeakPolarHBondContact O-CB 3.37Å; L42-V46 WeakPolarHBondContact O-CG2 3.28Å; L42-V46 PolarHBondContact O-N 2.94Å; V46-G49 CarbonylContact O-C 3.58Å; V46-G49 PolarHBondContact O-N 3.32Å; V46-E50 WeakPolarHBondContact O-CB 3.13Å; V46-E50 WeakPolarHBondContact O-CG 3.32Å; V46-E50 PolarHBondContact O-N 3.38Å |
| 47 | L | 55.1 | Low | 48.9 | Very low | 99 Ų | 99 | 84 Ų | 84 | 52% | 0.518 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.1 | -42.5 | 169.7 | -111.2 | 84.9 | 0 | 0 | 0 | 111.7 | V43 L44 G49 E50 V51 | V43-L47 HydrophobicContact CG1-CD1 3.87Å; V43-L47 VanDerWaalsContact O-CB 3.25Å; V43-L47 WeakPolarHBondContact O-CB 3.37Å; V43-L47 WeakPolarHBondContact O-CD1 3.37Å; V43-L47 PolarHBondContact O-N 3.07Å; L44-L47 PolarHBondContact O-N 3.12Å; L47-G49 VanDerWaalsContact C-N 3.29Å; L47-E50 PolarHBondContact O-N 3.05Å; L47-V51 WeakPolarHBondContact O-CB 3.31Å; L47-V51 VanDerWaalsContact O-CG2 3.23Å; L47-V51 WeakPolarHBondContact O-CG2 3.13Å; L47-V51 PolarHBondContact O-N 3.22Å |
| 48 | L | 52.9 | Low | 48.6 | Very low | 92 Ų | 92 | 86.1 Ų | 86.1 | 48% | 0.482 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64 | -40.2 | 176.8 | -126.5 | 70.7 | 0 | 0 | 0 | 110.4 | L44 V51 L52 | L44-L48 WeakPolarHBondContact O-CB 3.38Å; L44-L48 PolarHBondContact O-N 3.42Å; L48-V51 PolarHBondContact O-N 3.17Å; L48-L52 VanDerWaalsContact O-CB 3.25Å; L48-L52 WeakPolarHBondContact O-CB 3.38Å; L48-L52 WeakPolarHBondContact O-CD1 3.37Å; L48-L52 WeakPolarHBondContact O-CG 3.47Å; L48-L52 PolarHBondContact O-N 3Å |
| 49 | G | 54.2 | Low | 48.3 | Very low | 27 Ų | 27 | 88.2 Ų | 88.2 | 28% | 0.278 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.7 | -43.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | P45 V46 L47 L52 V53 | P45-G49 WeakPolarHBondContact O-CA 3.48Å; P45-G49 PolarHBondContact O-N 2.96Å; V46-G49 CarbonylContact O-C 3.58Å; V46-G49 PolarHBondContact O-N 3.32Å; L47-G49 VanDerWaalsContact C-N 3.29Å; G49-L52 PolarHBondContact O-N 3.4Å; G49-V53 WeakPolarHBondContact O-CB 3.26Å; G49-V53 WeakPolarHBondContact O-CG2 3.27Å; G49-V53 PolarHBondContact O-N 3.15Å |
| 50 | E | 49.1 | Very low | 48.1 | Very low | 114 Ų | 114 | 91 Ų | 91 | 53% | 0.533 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 174.3 | -76.3 | 180 | 172 | 0 | 0 | 111.9 | V46 L47 L52 V53 Q54 | V46-E50 WeakPolarHBondContact O-CB 3.13Å; V46-E50 WeakPolarHBondContact O-CG 3.32Å; V46-E50 PolarHBondContact O-N 3.38Å; L47-E50 PolarHBondContact O-N 3.05Å; E50-L52 VanDerWaalsContact C-N 3.32Å; E50-L52 PolarHBondContact O-N 3.49Å; E50-V53 PolarHBondContact O-N 3.41Å; E50-Q54 WeakPolarHBondContact O-CA 3.21Å; E50-Q54 VanDerWaalsContact O-CB 3.23Å; E50-Q54 WeakPolarHBondContact O-CB 2.77Å; E50-Q54 PolarHBondContact O-N 3.44Å |
| 51 | V | 51.9 | Low | 48.6 | Very low | 69 Ų | 69 | 88.6 Ų | 88.6 | 42% | 0.418 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66 | -33.2 | 173.4 | 166 | 0 | 0 | 0 | 0 | 112 | L47 L48 W128 | L47-V51 WeakPolarHBondContact O-CB 3.31Å; L47-V51 VanDerWaalsContact O-CG2 3.23Å; L47-V51 WeakPolarHBondContact O-CG2 3.13Å; L47-V51 PolarHBondContact O-N 3.22Å; L48-V51 PolarHBondContact O-N 3.17Å; V51-W128 WeakPolarHBondContact O-CZ3 3.31Å |
| 52 | L | 52.3 | Low | 48.8 | Very low | 100 Ų | 100 | 94.8 Ų | 94.8 | 52% | 0.524 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -80.8 | -32.5 | 177 | -78.5 | 161.5 | 0 | 0 | 0 | 113.1 | L48 G49 E50 W128 | L48-L52 VanDerWaalsContact O-CB 3.25Å; L48-L52 WeakPolarHBondContact O-CB 3.38Å; L48-L52 WeakPolarHBondContact O-CD1 3.37Å; L48-L52 WeakPolarHBondContact O-CG 3.47Å; L48-L52 PolarHBondContact O-N 3Å; G49-L52 PolarHBondContact O-N 3.4Å; E50-L52 VanDerWaalsContact C-N 3.32Å; E50-L52 PolarHBondContact O-N 3.49Å; L52-W128 VanDerWaalsContact O-CH2 3.26Å; L52-W128 WeakPolarHBondContact O-CH2 3.26Å |
| 53 | V | 43.9 | Very low | 49.2 | Very low | 126 Ų | 126 | 96 Ų | 96 | 76% | 0.764 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -90.5 | -30.8 | -176.3 | 171.1 | 0 | 0 | 0 | 0 | 111.7 | G49 E50 | G49-V53 WeakPolarHBondContact O-CB 3.26Å; G49-V53 WeakPolarHBondContact O-CG2 3.27Å; G49-V53 PolarHBondContact O-N 3.15Å; E50-V53 PolarHBondContact O-N 3.41Å |
| 54 | Q | 38.5 | Very low | 49.5 | Very low | 84 Ų | 84 | 93.2 Ų | 93.2 | 39% | 0.393 | 49% | 0.487 | S | S | . | . | S | Bend | trans | -114.9 | 110.3 | 177.9 | -163.1 | 174.7 | -21 | 0 | 0 | 108.1 | E50 H56 | E50-Q54 WeakPolarHBondContact O-CA 3.21Å; E50-Q54 VanDerWaalsContact O-CB 3.23Å; E50-Q54 WeakPolarHBondContact O-CB 2.77Å; E50-Q54 PolarHBondContact O-N 3.44Å; Q54-H56 PolarHBondContact O-N 3.16Å |
| 55 | P | 40.9 | Very low | 50.1 | Low | 39 Ų | 39 | 90.2 Ų | 90.2 | 25% | 0.253 | 47% | 0.471 | S | S | . | . | trans | -58.5 | 121.8 | 169.6 | 23.6 | -29.5 | 0 | 0 | 0 | 106.5 | W128 Y133 W137 | P55-W128 HydrophobicContact CB-CH2 3.83Å; P55-W128 HydrophobicContact CB-CZ2 3.66Å; P55-W128 HydrophobicContact CB-CZ3 4.35Å; P55-W128 HydrophobicContact CG-CH2 4.39Å; P55-W128 HydrophobicContact CG-CZ2 4.03Å; P55-Y133 HydrophobicContact CB-CE1 3.45Å; P55-Y133 VanDerWaalsContact CB-CE1 3.45Å; P55-Y133 WeakPolarHBondContact CB-OH 3.27Å; P55-Y133 HydrophobicContact CG-CE1 3.94Å; P55-W137 VanDerWaalsContact C-CH2 3.48Å; P55-W137 HydrophobicContact CB-CH2 4.03Å; P55-W137 HydrophobicContact CB-CZ2 4.04Å; P55-W137 HydrophobicContact CG-CH2 4.31Å; P55-W137 HydrophobicContact CG-CZ2 4.22Å; P55-W137 WeakPolarHBondContact O-CH2 3.47Å; P55-W137 VanDerWaalsContact O-CZ3 3.3Å; P55-W137 WeakPolarHBondContact O-CZ3 3.44Å | ||
| 56 | H | 47 | Very low | 50.9 | Low | 91 Ų | 91 | 89.2 Ų | 89.2 | 42% | 0.421 | 47% | 0.469 | S | S | . | . | trans | -103 | 119.9 | 170.7 | -128.6 | 50.6 | 0 | 0 | 0 | 106.4 | Q54 Y58 | Q54-H56 PolarHBondContact O-N 3.16Å; H56-Y58 PolarHBondContact O-N 2.83Å | ||
| 57 | T | 42.6 | Very low | 51.7 | Low | 98 Ų | 98 | 88.1 Ų | 88.1 | 60% | 0.601 | 47% | 0.468 | S | S | * | . | trans | -68.9 | 97.5 | 166 | -60.3 | 0 | 0 | 0 | 0 | 104.9 | P59 W137 | T57-P59 WeakPolarHBondContact O-CD 3Å; T57-P59 VanDerWaalsContact O-N 3.1Å; T57-W137 WeakPolarHBondContact OG1-CH2 3.26Å; T57-W137 VanDerWaalsContact OG1-CZ2 3.28Å; T57-W137 WeakPolarHBondContact OG1-CZ2 2.83Å; T57-W137 WeakPolarHBondContact OG1-CZ3 3.1Å | ||
| 58 | Y | 41.6 | Very low | 52.4 | Low | 100 Ų | 100 | 88 Ų | 88 | 39% | 0.392 | 47% | 0.467 | S | S | . | . | trans | -60.2 | 114.5 | -175.8 | -155.4 | -81.4 | 0 | 0 | 0 | 108.4 | H56 Q60 A64 Y117 | H56-Y58 PolarHBondContact O-N 2.83Å; Y58-Q60 PolarHBondContact O-N 3.13Å; Y58-A64 HydrophobicContact CE1-CB 3.42Å; Y58-A64 VanDerWaalsContact CE1-CB 3.42Å; Y58-A64 VanDerWaalsContact OH-CB 3.28Å; Y58-A64 WeakPolarHBondContact OH-CB 3.47Å; Y58-Y117 HydrophobicContact CD1-CE2 4.27Å; Y58-Y117 AromaticContact CD1-CZ 3.96Å; Y58-Y117 WeakPolarHBondContact CD1-OH 3.22Å; Y58-Y117 HydrophobicContact CD2-CE2 4.21Å; Y58-Y117 HydrophobicContact CE1-CE1 4.44Å; Y58-Y117 AromaticContact CE1-CE2 3.47Å; Y58-Y117 HydrophobicContact CE1-CE2 3.47Å; Y58-Y117 VanDerWaalsContact CE1-CE2 3.47Å; Y58-Y117 AromaticContact CE1-CZ 3.3Å; Y58-Y117 WeakPolarHBondContact CE1-OH 3.4Å; Y58-Y117 HydrophobicContact CE2-CD2 4.33Å; Y58-Y117 AromaticContact CE2-CE2 3.38Å; Y58-Y117 HydrophobicContact CE2-CE2 3.38Å; Y58-Y117 AromaticContact CZ-CD2 3.9Å; Y58-Y117 AromaticContact CZ-CE2 2.93Å; Y58-Y117 AromaticContact CZ-CZ 3.36Å; Y58-Y117 VanDerWaalsContact CZ-OH 3.28Å; Y58-Y117 WeakPolarHBondContact OH-CD2 3.47Å; Y58-Y117 WeakPolarHBondContact OH-CE2 3.09Å | ||
| 59 | P | 41.3 | Very low | 53.2 | Low | 76 Ų | 76 | 86 Ų | 86 | 49% | 0.494 | 46% | 0.461 | S | S | . | . | trans | -62.3 | 136.6 | 178.4 | 26.8 | -31.6 | 0 | 0 | 0 | 107.5 | T57 M61 | T57-P59 WeakPolarHBondContact O-CD 3Å; T57-P59 VanDerWaalsContact O-N 3.1Å; P59-M61 PolarHBondContact O-N 3.06Å | ||
| 60 | Q | 48 | Very low | 54.2 | Low | 143 Ų | 143 | 89.4 Ų | 89.4 | 67% | 0.668 | 48% | 0.476 | S | S | * | . | trans | -26.5 | 123 | -172.1 | -71.1 | 174.1 | -9.3 | 0 | 0 | 113.5 | Y58 R62 H63 | Y58-Q60 PolarHBondContact O-N 3.13Å; Q60-R62 PolarHBondContact O-N 3.38Å; Q60-H63 PolarHBondContact O-N 3.22Å; Q60-H63 PolarHBondContact OE1-CE1 3.34Å; Q60-H63 VanDerWaalsContact OE1-CE1 3.26Å | ||
| 61 | M | 54.6 | Low | 55.4 | Low | 100 Ų | 100 | 88.8 Ų | 88.8 | 49% | 0.493 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -30.2 | -36.5 | -178 | 176.8 | 175.9 | 176.4 | 0 | 0 | 116 | P59 L65 Y117 | P59-M61 PolarHBondContact O-N 3.06Å; M61-L65 HydrophobicContact CE-CD1 4.24Å; M61-L65 HydrophobicContact CG-CD1 3.94Å; M61-L65 WeakPolarHBondContact O-CB 3.34Å; M61-L65 WeakPolarHBondContact O-CD1 3.01Å; M61-L65 VanDerWaalsContact O-CG 3.3Å; M61-L65 WeakPolarHBondContact O-CG 3.25Å; M61-L65 PolarHBondContact O-N 2.91Å; M61-Y117 HydrophobicContact CG-CE1 4.07Å |
| 62 | R | 51 | Low | 56.3 | Low | 207 Ų | 207 | 86.6 Ų | 86.6 | 78% | 0.781 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -71.6 | -36 | -178.8 | -48.2 | -172 | 88.6 | -176 | 6 | 113.3 | Q60 A66 | Q60-R62 PolarHBondContact O-N 3.38Å; R62-A66 WeakPolarHBondContact O-CB 3.3Å; R62-A66 PolarHBondContact O-N 3.07Å |
| 63 | H | 55.2 | Low | 57.4 | Low | 116 Ų | 116 | 85.3 Ų | 85.3 | 54% | 0.537 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -78.1 | -40.4 | -175.6 | -62.7 | 98.6 | 0 | 0 | 0 | 112.4 | Q60 A66 A67 | Q60-H63 PolarHBondContact O-N 3.22Å; Q60-H63 PolarHBondContact OE1-CE1 3.34Å; Q60-H63 VanDerWaalsContact OE1-CE1 3.26Å; H63-A66 PolarHBondContact O-N 3.45Å; H63-A67 VanDerWaalsContact O-CB 3.29Å; H63-A67 WeakPolarHBondContact O-CB 3.13Å; H63-A67 PolarHBondContact O-N 3.22Å |
| 64 | A | 63.9 | Low | 59.1 | Low | 21 Ų | 21 | 82.1 Ų | 82.1 | 17% | 0.174 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -67.8 | -43.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y58 A67 L68 | Y58-A64 HydrophobicContact CE1-CB 3.42Å; Y58-A64 VanDerWaalsContact CE1-CB 3.42Å; Y58-A64 VanDerWaalsContact OH-CB 3.28Å; Y58-A64 WeakPolarHBondContact OH-CB 3.47Å; A64-A67 PolarHBondContact O-N 3.33Å; A64-L68 VanDerWaalsContact O-CB 3.32Å; A64-L68 WeakPolarHBondContact O-CB 3.17Å; A64-L68 PolarHBondContact O-N 2.96Å |
| 65 | L | 61.9 | Low | 60.8 | Low | 42 Ų | 42 | 83.2 Ų | 83.2 | 22% | 0.22 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 173.6 | -72.6 | 172 | 0 | 0 | 0 | 111.9 | M61 S69 Y117 | M61-L65 HydrophobicContact CE-CD1 4.24Å; M61-L65 HydrophobicContact CG-CD1 3.94Å; M61-L65 WeakPolarHBondContact O-CB 3.34Å; M61-L65 WeakPolarHBondContact O-CD1 3.01Å; M61-L65 VanDerWaalsContact O-CG 3.3Å; M61-L65 WeakPolarHBondContact O-CG 3.25Å; M61-L65 PolarHBondContact O-N 2.91Å; L65-S69 WeakPolarHBondContact O-CB 3.39Å; L65-S69 PolarHBondContact O-N 2.9Å; L65-Y117 HydrophobicContact CD1-CD1 4.29Å; L65-Y117 HydrophobicContact CD1-CE1 4.41Å; L65-Y117 HydrophobicContact CD2-CD1 4.03Å; L65-Y117 HydrophobicContact CD2-CG 4.34Å; L65-Y117 HydrophobicContact CG-CD1 4.26Å; L65-Y117 HydrophobicContact CG-CE1 4.46Å |
| 66 | A | 67.5 | Low | 62.2 | Low | 50 Ų | 50 | 83.1 Ų | 83.1 | 41% | 0.413 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.2 | -45.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | R62 H63 L68 S69 V70 | R62-A66 WeakPolarHBondContact O-CB 3.3Å; R62-A66 PolarHBondContact O-N 3.07Å; H63-A66 PolarHBondContact O-N 3.45Å; A66-L68 PolarHBondContact O-N 3.39Å; A66-S69 PolarHBondContact O-N 3.06Å; A66-V70 WeakPolarHBondContact O-CB 3.43Å; A66-V70 WeakPolarHBondContact O-CG2 3.26Å; A66-V70 PolarHBondContact O-N 2.91Å |
| 67 | A | 71.7 | Confident | 63.7 | Low | 56 Ų | 56 | 82.2 Ų | 82.2 | 46% | 0.463 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.8 | -44.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | H63 A64 S69 V70 V71 | H63-A67 VanDerWaalsContact O-CB 3.29Å; H63-A67 WeakPolarHBondContact O-CB 3.13Å; H63-A67 PolarHBondContact O-N 3.22Å; A64-A67 PolarHBondContact O-N 3.33Å; A67-S69 VanDerWaalsContact C-N 3.34Å; A67-S69 PolarHBondContact O-N 3.44Å; A67-V70 PolarHBondContact O-N 3.03Å; A67-V71 WeakPolarHBondContact O-CG2 2.87Å; A67-V71 PolarHBondContact O-N 3.39Å |
| 68 | L | 69.8 | Low | 65.5 | Low | 97 Ų | 97 | 83.3 Ų | 83.3 | 51% | 0.508 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.6 | -40 | 177.5 | -169.1 | 67.5 | 0 | 0 | 0 | 111.8 | A64 A66 G72 V113 | A64-L68 VanDerWaalsContact O-CB 3.32Å; A64-L68 WeakPolarHBondContact O-CB 3.17Å; A64-L68 PolarHBondContact O-N 2.96Å; A66-L68 PolarHBondContact O-N 3.39Å; L68-G72 PolarHBondContact O-N 3.48Å; L68-V113 HydrophobicContact CD2-CG1 3.32Å; L68-V113 HydrophobicContact CG-CG1 4.46Å |
| 69 | S | 70.4 | Confident | 67 | Low | 50 Ų | 50 | 79.1 Ų | 79.1 | 35% | 0.35 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 174.6 | -178.9 | 0 | 0 | 0 | 0 | 111.8 | L65 A66 A67 G72 V73 | L65-S69 WeakPolarHBondContact O-CB 3.39Å; L65-S69 PolarHBondContact O-N 2.9Å; A66-S69 PolarHBondContact O-N 3.06Å; A67-S69 VanDerWaalsContact C-N 3.34Å; A67-S69 PolarHBondContact O-N 3.44Å; S69-G72 PolarHBondContact O-N 2.96Å; S69-V73 WeakPolarHBondContact O-CB 3.18Å; S69-V73 VanDerWaalsContact O-CG2 3.29Å; S69-V73 WeakPolarHBondContact O-CG2 2.88Å; S69-V73 PolarHBondContact O-N 2.87Å |
| 70 | V | 76.1 | Confident | 68.6 | Low | 99 Ų | 99 | 78.4 Ų | 78.4 | 60% | 0.6 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -63.5 | -47.6 | 178.5 | 168.2 | 0 | 0 | 0 | 0 | 111.3 | A66 A67 G72 V73 A74 | A66-V70 WeakPolarHBondContact O-CB 3.43Å; A66-V70 WeakPolarHBondContact O-CG2 3.26Å; A66-V70 PolarHBondContact O-N 2.91Å; A67-V70 PolarHBondContact O-N 3.03Å; V70-G72 VanDerWaalsContact C-N 3.32Å; V70-G72 PolarHBondContact O-N 3.33Å; V70-V73 PolarHBondContact O-N 3.18Å; V70-A74 WeakPolarHBondContact O-CB 3.18Å; V70-A74 PolarHBondContact O-N 3.32Å |
| 71 | V | 73.8 | Confident | 70.3 | Confident | 101 Ų | 101 | 78.8 Ų | 78.8 | 61% | 0.612 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -64 | -41 | 176.8 | 175 | 0 | 0 | 0 | 0 | 110.6 | A67 A74 Y75 | A67-V71 WeakPolarHBondContact O-CG2 2.87Å; A67-V71 PolarHBondContact O-N 3.39Å; V71-A74 PolarHBondContact O-N 3.26Å; V71-Y75 PolarHBondContact O-N 3.3Å |
| 72 | G | 71.1 | Confident | 71.5 | Confident | 22 Ų | 22 | 75.2 Ų | 75.2 | 23% | 0.227 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -57.4 | -54.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L68 S69 V70 A74 Y75 L76 | L68-G72 PolarHBondContact O-N 3.48Å; S69-G72 PolarHBondContact O-N 2.96Å; V70-G72 VanDerWaalsContact C-N 3.32Å; V70-G72 PolarHBondContact O-N 3.33Å; G72-A74 VanDerWaalsContact C-N 3.33Å; G72-A74 PolarHBondContact O-N 2.84Å; G72-Y75 WeakPolarHBondContact O-CB 3.28Å; G72-Y75 PolarHBondContact O-N 2.93Å; G72-Y75 VanDerWaalsContact O-N 3.15Å; G72-L76 WeakPolarHBondContact O-CG 3.33Å; G72-L76 PolarHBondContact O-N 3.31Å |
| 73 | V | 73.6 | Confident | 72.7 | Confident | 74 Ų | 74 | 69.6 Ų | 69.6 | 45% | 0.448 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.1 | -42.9 | 179.3 | 171.1 | 0 | 0 | 0 | 0 | 111.4 | S69 V70 Y75 L76 S77 | S69-V73 WeakPolarHBondContact O-CB 3.18Å; S69-V73 VanDerWaalsContact O-CG2 3.29Å; S69-V73 WeakPolarHBondContact O-CG2 2.88Å; S69-V73 PolarHBondContact O-N 2.87Å; V70-V73 PolarHBondContact O-N 3.18Å; V73-Y75 VanDerWaalsContact C-N 3.31Å; V73-Y75 PolarHBondContact O-N 2.85Å; V73-L76 PolarHBondContact O-N 2.87Å; V73-L76 VanDerWaalsContact O-N 3.17Å; V73-S77 PolarHBondContact O-N 3.49Å; V73-S77 PolarHBondContact O-OG 2.99Å; V73-S77 VanDerWaalsContact O-OG 3.08Å |
| 74 | A | 79.6 | Confident | 73.7 | Confident | 59 Ų | 59 | 70.3 Ų | 70.3 | 49% | 0.488 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.2 | -42.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | V70 V71 G72 S77 W78 | V70-A74 WeakPolarHBondContact O-CB 3.18Å; V70-A74 PolarHBondContact O-N 3.32Å; V71-A74 PolarHBondContact O-N 3.26Å; G72-A74 VanDerWaalsContact C-N 3.33Å; G72-A74 PolarHBondContact O-N 2.84Å; A74-S77 PolarHBondContact O-N 3.43Å; A74-W78 PolarHBondContact O-N 3.46Å |
| 75 | Y | 74.2 | Confident | 74.3 | Confident | 106 Ų | 106 | 73.2 Ų | 73.2 | 42% | 0.416 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.6 | -38.8 | 175.9 | -176.7 | -111.5 | 0 | 0 | 0 | 112.4 | V71 G72 V73 W78 I79 | V71-Y75 PolarHBondContact O-N 3.3Å; G72-Y75 WeakPolarHBondContact O-CB 3.28Å; G72-Y75 PolarHBondContact O-N 2.93Å; G72-Y75 VanDerWaalsContact O-N 3.15Å; V73-Y75 VanDerWaalsContact C-N 3.31Å; V73-Y75 PolarHBondContact O-N 2.85Å; Y75-W78 HydrophobicContact CD2-CE3 4.05Å; Y75-W78 AromaticContact CE2-CE3 3.82Å; Y75-W78 HydrophobicContact CE2-CE3 3.82Å; Y75-W78 AromaticContact CE2-CZ3 3.84Å; Y75-W78 HydrophobicContact CE2-CZ3 3.84Å; Y75-W78 WeakPolarHBondContact O-CB 3.5Å; Y75-W78 PolarHBondContact O-N 3.25Å; Y75-I79 HydrophobicContact CD1-CD1 3.85Å; Y75-I79 HydrophobicContact CE1-CD1 3.35Å; Y75-I79 HydrophobicContact CE1-CG1 4.26Å; Y75-I79 HydrophobicContact CE2-CD1 4.46Å; Y75-I79 WeakPolarHBondContact O-CG1 3.23Å; Y75-I79 PolarHBondContact O-N 3.4Å |
| 76 | L | 72.3 | Confident | 75.3 | Confident | 38 Ų | 38 | 76 Ų | 76 | 20% | 0.199 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -65.9 | -44.1 | 175.6 | -60.2 | -171.9 | 0 | 0 | 0 | 112.2 | G72 V73 W78 I79 V80 F106 | G72-L76 WeakPolarHBondContact O-CG 3.33Å; G72-L76 PolarHBondContact O-N 3.31Å; V73-L76 PolarHBondContact O-N 2.87Å; V73-L76 VanDerWaalsContact O-N 3.17Å; L76-W78 PolarHBondContact O-N 3.24Å; L76-I79 PolarHBondContact O-N 2.94Å; L76-V80 WeakPolarHBondContact O-CG2 2.83Å; L76-V80 PolarHBondContact O-N 3.47Å; L76-F106 HydrophobicContact CD1-CB 4.36Å; L76-F106 HydrophobicContact CD1-CD1 3.32Å; L76-F106 HydrophobicContact CD1-CD2 4Å; L76-F106 HydrophobicContact CD1-CE1 3.52Å; L76-F106 HydrophobicContact CD1-CE2 4.09Å; L76-F106 HydrophobicContact CD1-CG 3.62Å; L76-F106 HydrophobicContact CD1-CZ 3.88Å; L76-F106 HydrophobicContact CD2-CD1 3.66Å; L76-F106 HydrophobicContact CD2-CE1 2.99Å; L76-F106 HydrophobicContact CD2-CE2 4.42Å; L76-F106 HydrophobicContact CD2-CZ 3.43Å; L76-F106 VanDerWaalsContact CD2-CZ 3.43Å; L76-F106 HydrophobicContact CG-CD1 4.09Å; L76-F106 HydrophobicContact CG-CE1 3.8Å; L76-F106 HydrophobicContact CG-CZ 4.09Å |
| 77 | S | 78 | Confident | 75.7 | Confident | 72 Ų | 72 | 76 Ų | 76 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -57.9 | -39.8 | 174.5 | -60.9 | 0 | 0 | 0 | 0 | 111.2 | V73 A74 V80 W81 | V73-S77 PolarHBondContact O-N 3.49Å; V73-S77 PolarHBondContact O-OG 2.99Å; V73-S77 VanDerWaalsContact O-OG 3.08Å; A74-S77 PolarHBondContact O-N 3.43Å; S77-V80 PolarHBondContact O-N 2.93Å; S77-W81 WeakPolarHBondContact O-CB 3.33Å; S77-W81 PolarHBondContact O-N 3.39Å |
| 78 | W | 80.9 | Confident | 75.7 | Confident | 120 Ų | 120 | 77.9 Ų | 77.9 | 46% | 0.455 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.1 | -45.8 | 175.1 | 178.8 | 74.6 | 0 | 0 | 0 | 112.8 | A74 Y75 L76 V80 W81 V82 | A74-W78 PolarHBondContact O-N 3.46Å; Y75-W78 HydrophobicContact CD2-CE3 4.05Å; Y75-W78 AromaticContact CE2-CE3 3.82Å; Y75-W78 HydrophobicContact CE2-CE3 3.82Å; Y75-W78 AromaticContact CE2-CZ3 3.84Å; Y75-W78 HydrophobicContact CE2-CZ3 3.84Å; Y75-W78 WeakPolarHBondContact O-CB 3.5Å; Y75-W78 PolarHBondContact O-N 3.25Å; L76-W78 PolarHBondContact O-N 3.24Å; W78-V80 VanDerWaalsContact C-N 3.33Å; W78-V80 PolarHBondContact O-N 3.38Å; W78-W81 AromaticContact CD1-CE3 3.92Å; W78-W81 WeakPolarHBondContact O-CB 3.46Å; W78-W81 PolarHBondContact O-N 3.04Å; W78-V82 HydrophobicContact CD2-CG2 4.26Å; W78-V82 HydrophobicContact CZ2-CG2 4.01Å; W78-V82 WeakPolarHBondContact O-CG2 3.14Å; W78-V82 PolarHBondContact O-N 3.39Å |
| 79 | I | 71.2 | Confident | 75.9 | Confident | 12 Ų | 12 | 75.7 Ų | 75.7 | 6% | 0.062 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -59.3 | -44.2 | 176.2 | -70.9 | 174.6 | 0 | 0 | 0 | 111.3 | Y75 L76 W81 V82 Y83 W89 | Y75-I79 HydrophobicContact CD1-CD1 3.85Å; Y75-I79 HydrophobicContact CE1-CD1 3.35Å; Y75-I79 HydrophobicContact CE1-CG1 4.26Å; Y75-I79 HydrophobicContact CE2-CD1 4.46Å; Y75-I79 WeakPolarHBondContact O-CG1 3.23Å; Y75-I79 PolarHBondContact O-N 3.4Å; L76-I79 PolarHBondContact O-N 2.94Å; I79-W81 VanDerWaalsContact C-N 3.32Å; I79-W81 PolarHBondContact O-N 3.35Å; I79-V82 PolarHBondContact O-N 3.3Å; I79-Y83 PolarHBondContact O-N 3.49Å; I79-W89 HydrophobicContact CG2-CZ3 4.43Å |
| 80 | V | 76.2 | Confident | 76.1 | Confident | 61 Ų | 61 | 76.1 Ų | 76.1 | 37% | 0.37 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.9 | -40.7 | 177.8 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | L76 S77 W78 Y83 L84 | L76-V80 WeakPolarHBondContact O-CG2 2.83Å; L76-V80 PolarHBondContact O-N 3.47Å; S77-V80 PolarHBondContact O-N 2.93Å; W78-V80 VanDerWaalsContact C-N 3.33Å; W78-V80 PolarHBondContact O-N 3.38Å; V80-Y83 WeakPolarHBondContact O-CB 3.25Å; V80-Y83 PolarHBondContact O-N 3.47Å; V80-L84 HydrophobicContact CG1-CD1 4.2Å; V80-L84 HydrophobicContact CG1-CG 4.46Å; V80-L84 WeakPolarHBondContact O-CG 3.26Å; V80-L84 PolarHBondContact O-N 2.88Å |
| 81 | W | 83.1 | Confident | 76 | Confident | 151 Ų | 151 | 77 Ų | 77 | 57% | 0.572 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -63 | -41.4 | 175.5 | 176.8 | 70.5 | 0 | 0 | 0 | 112.7 | S77 W78 I79 Y83 L84 T85 | S77-W81 WeakPolarHBondContact O-CB 3.33Å; S77-W81 PolarHBondContact O-N 3.39Å; W78-W81 AromaticContact CD1-CE3 3.92Å; W78-W81 WeakPolarHBondContact O-CB 3.46Å; W78-W81 PolarHBondContact O-N 3.04Å; I79-W81 VanDerWaalsContact C-N 3.32Å; I79-W81 PolarHBondContact O-N 3.35Å; W81-Y83 VanDerWaalsContact C-N 3.32Å; W81-Y83 PolarHBondContact O-N 3.36Å; W81-L84 PolarHBondContact O-N 3.41Å; W81-T85 HydrophobicContact CD2-CG2 4.36Å; W81-T85 HydrophobicContact CZ2-CG2 4.17Å; W81-T85 WeakPolarHBondContact O-CG2 3.46Å; W81-T85 PolarHBondContact O-N 2.8Å; W81-T85 PolarHBondContact O-OG1 3.43Å |
| 82 | V | 79.5 | Confident | 75.7 | Confident | 26 Ų | 26 | 77 Ų | 77 | 16% | 0.158 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -62 | -40.5 | 174.2 | 174.7 | 0 | 0 | 0 | 0 | 111.1 | W78 I79 T85 V86 V90 | W78-V82 HydrophobicContact CD2-CG2 4.26Å; W78-V82 HydrophobicContact CZ2-CG2 4.01Å; W78-V82 WeakPolarHBondContact O-CG2 3.14Å; W78-V82 PolarHBondContact O-N 3.39Å; I79-V82 PolarHBondContact O-N 3.3Å; V82-T85 WeakPolarHBondContact CA-OG1 2.91Å; V82-T85 PolarHBondContact O-N 2.74Å; V82-T85 PolarHBondContact O-OG1 3.25Å; V82-T85 VanDerWaalsContact O-OG1 3.08Å; V82-V86 HydrophobicContact CG1-CG2 4.33Å; V82-V86 WeakPolarHBondContact O-CB 2.91Å; V82-V86 PolarHBondContact O-N 2.92Å; V82-V90 HydrophobicContact CB-CG2 4.02Å; V82-V90 HydrophobicContact CG1-CG2 3.61Å |
| 83 | Y | 76.6 | Confident | 75.4 | Confident | 88 Ų | 88 | 82.3 Ų | 82.3 | 35% | 0.345 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | 174.9 | 176.3 | -106 | 0 | 0 | 0 | 112.4 | I79 V80 W81 T85 G87 W89 | I79-Y83 PolarHBondContact O-N 3.49Å; V80-Y83 WeakPolarHBondContact O-CB 3.25Å; V80-Y83 PolarHBondContact O-N 3.47Å; W81-Y83 VanDerWaalsContact C-N 3.32Å; W81-Y83 PolarHBondContact O-N 3.36Å; Y83-T85 VanDerWaalsContact C-N 3.3Å; Y83-T85 PolarHBondContact O-N 3.01Å; Y83-G87 WeakPolarHBondContact O-CA 3.25Å; Y83-G87 PolarHBondContact O-N 2.73Å; Y83-W89 HydrophobicContact CD1-CH2 4.35Å; Y83-W89 HydrophobicContact CD1-CZ2 4.16Å; Y83-W89 AromaticContact CD2-CD1 3.87Å; Y83-W89 AromaticContact CD2-CD2 3.72Å; Y83-W89 HydrophobicContact CD2-CD2 3.72Å; Y83-W89 AromaticContact CD2-CE2 3.58Å; Y83-W89 HydrophobicContact CD2-CE3 4.3Å; Y83-W89 AromaticContact CD2-CG 3.92Å; Y83-W89 HydrophobicContact CD2-CG 3.92Å; Y83-W89 HydrophobicContact CD2-CZ2 4.05Å; Y83-W89 AromaticContact CD2-NE1 3.67Å; Y83-W89 HydrophobicContact CE1-CZ2 4.13Å; Y83-W89 AromaticContact CE2-CD1 3.67Å; Y83-W89 HydrophobicContact CE2-CD2 4.12Å; Y83-W89 AromaticContact CE2-CE2 3.56Å; Y83-W89 HydrophobicContact CE2-CG 4.19Å; Y83-W89 HydrophobicContact CE2-CZ2 4.04Å; Y83-W89 AromaticContact CE2-NE1 3.26Å; Y83-W89 VanDerWaalsContact CE2-NE1 3.26Å; Y83-W89 HydrophobicContact CG-CD2 4.23Å; Y83-W89 HydrophobicContact CG-CE3 4.4Å; Y83-W89 HydrophobicContact CG-CH2 4.27Å; Y83-W89 HydrophobicContact CG-CZ2 4.11Å; Y83-W89 HydrophobicContact CG-CZ3 4.42Å; Y83-W89 AromaticContact CZ-NE1 3.85Å |
| 84 | L | 77.1 | Confident | 75.2 | Confident | 132 Ų | 132 | 79.8 Ų | 79.8 | 69% | 0.691 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -67.7 | -29.7 | 178.4 | -68.6 | 174.5 | 0 | 0 | 0 | 113.1 | V80 W81 | V80-L84 HydrophobicContact CG1-CD1 4.2Å; V80-L84 HydrophobicContact CG1-CG 4.46Å; V80-L84 WeakPolarHBondContact O-CG 3.26Å; V80-L84 PolarHBondContact O-N 2.88Å; W81-L84 PolarHBondContact O-N 3.41Å |
| 85 | T | 76.2 | Confident | 74.7 | Confident | 82 Ų | 82 | 79 Ų | 79 | 50% | 0.503 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -87.8 | -38.4 | -178.1 | 49.9 | 0 | 0 | 0 | 0 | 113.2 | W81 V82 Y83 | W81-T85 HydrophobicContact CD2-CG2 4.36Å; W81-T85 HydrophobicContact CZ2-CG2 4.17Å; W81-T85 WeakPolarHBondContact O-CG2 3.46Å; W81-T85 PolarHBondContact O-N 2.8Å; W81-T85 PolarHBondContact O-OG1 3.43Å; V82-T85 WeakPolarHBondContact CA-OG1 2.91Å; V82-T85 PolarHBondContact O-N 2.74Å; V82-T85 PolarHBondContact O-OG1 3.25Å; V82-T85 VanDerWaalsContact O-OG1 3.08Å; Y83-T85 VanDerWaalsContact C-N 3.3Å; Y83-T85 PolarHBondContact O-N 3.01Å |
| 86 | V | 82.4 | Confident | 74.8 | Confident | 99 Ų | 99 | 82.2 Ų | 82.2 | 60% | 0.6 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -103.3 | -20.6 | -174.5 | -175.9 | 0 | 0 | 0 | 0 | 112.3 | V82 V88 | V82-V86 HydrophobicContact CG1-CG2 4.33Å; V82-V86 WeakPolarHBondContact O-CB 2.91Å; V82-V86 PolarHBondContact O-N 2.92Å; V86-V88 HydrophobicContact CG1-CB 4.17Å; V86-V88 HydrophobicContact CG1-CG2 4.34Å; V86-V88 PolarHBondContact O-N 3.27Å |
| 87 | G | 75.6 | Confident | 74.7 | Confident | 51 Ų | 51 | 85.8 Ų | 85.8 | 53% | 0.526 | 46% | 0.456 | S | S | . | . | S | Bend | trans | 72.2 | 2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y83 | Y83-G87 WeakPolarHBondContact O-CA 3.25Å; Y83-G87 PolarHBondContact O-N 2.73Å |
| 88 | V | 71.9 | Confident | 74.8 | Confident | 96 Ų | 96 | 86.2 Ų | 86.2 | 58% | 0.582 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -118.3 | 134.5 | -179.9 | -178.7 | 0 | 0 | 0 | 0 | 109 | V86 | V86-V88 HydrophobicContact CG1-CB 4.17Å; V86-V88 HydrophobicContact CG1-CG2 4.34Å; V86-V88 PolarHBondContact O-N 3.27Å |
| 89 | W | 73.8 | Confident | 74.6 | Confident | 51 Ų | 51 | 84.7 Ų | 84.7 | 19% | 0.193 | 47% | 0.472 | C | S | . | . | trans | -68.9 | 134.3 | 174.8 | -71.2 | 97.3 | 0 | 0 | 0 | 110.7 | I79 Y83 Y91 L94 L102 | I79-W89 HydrophobicContact CG2-CZ3 4.43Å; Y83-W89 HydrophobicContact CD1-CH2 4.35Å; Y83-W89 HydrophobicContact CD1-CZ2 4.16Å; Y83-W89 AromaticContact CD2-CD1 3.87Å; Y83-W89 AromaticContact CD2-CD2 3.72Å; Y83-W89 HydrophobicContact CD2-CD2 3.72Å; Y83-W89 AromaticContact CD2-CE2 3.58Å; Y83-W89 HydrophobicContact CD2-CE3 4.3Å; Y83-W89 AromaticContact CD2-CG 3.92Å; Y83-W89 HydrophobicContact CD2-CG 3.92Å; Y83-W89 HydrophobicContact CD2-CZ2 4.05Å; Y83-W89 AromaticContact CD2-NE1 3.67Å; Y83-W89 HydrophobicContact CE1-CZ2 4.13Å; Y83-W89 AromaticContact CE2-CD1 3.67Å; Y83-W89 HydrophobicContact CE2-CD2 4.12Å; Y83-W89 AromaticContact CE2-CE2 3.56Å; Y83-W89 HydrophobicContact CE2-CG 4.19Å; Y83-W89 HydrophobicContact CE2-CZ2 4.04Å; Y83-W89 AromaticContact CE2-NE1 3.26Å; Y83-W89 VanDerWaalsContact CE2-NE1 3.26Å; Y83-W89 HydrophobicContact CG-CD2 4.23Å; Y83-W89 HydrophobicContact CG-CE3 4.4Å; Y83-W89 HydrophobicContact CG-CH2 4.27Å; Y83-W89 HydrophobicContact CG-CZ2 4.11Å; Y83-W89 HydrophobicContact CG-CZ3 4.42Å; Y83-W89 AromaticContact CZ-NE1 3.85Å; W89-Y91 VanDerWaalsContact CB-O 3.27Å; W89-Y91 WeakPolarHBondContact CB-O 3.41Å; W89-Y91 PolarHBondContact O-N 3.42Å; W89-Y91 VanDerWaalsContact O-N 3.16Å; W89-L94 HydrophobicContact CB-CB 4.39Å; W89-L94 HydrophobicContact CD2-CB 3.86Å; W89-L94 HydrophobicContact CE3-CB 3.67Å; W89-L94 HydrophobicContact CE3-CD1 4.15Å; W89-L94 HydrophobicContact CE3-CG 4.48Å; W89-L94 HydrophobicContact CG-CB 4.2Å; W89-L94 HydrophobicContact CZ3-CB 4.27Å; W89-L102 HydrophobicContact CH2-CD1 4.09Å; W89-L102 HydrophobicContact CH2-CD2 3.55Å; W89-L102 HydrophobicContact CH2-CG 4.5Å; W89-L102 HydrophobicContact CZ2-CD1 4.46Å; W89-L102 HydrophobicContact CZ3-CD1 4.43Å; W89-L102 HydrophobicContact CZ3-CD2 3.84Å | ||
| 90 | V | 74.6 | Confident | 74.9 | Confident | 59 Ų | 59 | 87.7 Ų | 87.7 | 36% | 0.358 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -53.5 | -34.6 | 171.1 | 179.4 | 0 | 0 | 0 | 0 | 111 | V82 | V82-V90 HydrophobicContact CB-CG2 4.02Å; V82-V90 HydrophobicContact CG1-CG2 3.61Å |
| 91 | Y | 73.7 | Confident | 75.1 | Confident | 116 Ų | 116 | 85.9 Ų | 85.9 | 46% | 0.455 | 49% | 0.493 | S | S | . | . | S | Bend | trans | -118.4 | 117.5 | 170.8 | -59.9 | -83.5 | 0 | 0 | 0 | 110.3 | W89 L93 L94 | W89-Y91 VanDerWaalsContact CB-O 3.27Å; W89-Y91 WeakPolarHBondContact CB-O 3.41Å; W89-Y91 PolarHBondContact O-N 3.42Å; W89-Y91 VanDerWaalsContact O-N 3.16Å; Y91-L93 PolarHBondContact O-N 2.92Å; Y91-L94 HydrophobicContact CD2-CD1 3.86Å; Y91-L94 HydrophobicContact CG-CD1 4.29Å; Y91-L94 WeakPolarHBondContact O-CB 3.15Å; Y91-L94 PolarHBondContact O-N 3.24Å |
| 92 | P | 68.1 | Low | 74.8 | Confident | 103 Ų | 103 | 79.6 Ų | 79.6 | 67% | 0.669 | 47% | 0.47 | S | S | * | . | G | 310 helix | trans | -54.1 | -30.1 | 178.9 | -26.9 | 33.4 | 0 | 0 | 0 | 114 | L94 G95 | P92-L94 VanDerWaalsContact C-N 3.3Å; P92-L94 PolarHBondContact O-N 2.96Å; P92-G95 PolarHBondContact O-N 3.38Å; P92-G95 VanDerWaalsContact O-N 3.13Å |
| 93 | L | 64.8 | Low | 74.8 | Confident | 132 Ų | 132 | 84.6 Ų | 84.6 | 69% | 0.691 | 50% | 0.495 | S | S | * | . | G | 310 helix | trans | -61.9 | -31.9 | 175.1 | -74.7 | 122.6 | 0 | 0 | 0 | 113.5 | Y91 G95 H96 F97 | Y91-L93 PolarHBondContact O-N 2.92Å; L93-G95 VanDerWaalsContact C-N 3.25Å; L93-G95 PolarHBondContact O-N 3.11Å; L93-H96 PolarHBondContact O-N 3.4Å; L93-F97 WeakPolarHBondContact O-CD2 3.39Å |
| 94 | L | 68.6 | Low | 75.1 | Confident | 22 Ų | 22 | 82.2 Ų | 82.2 | 12% | 0.115 | 50% | 0.498 | C | S | . | . | G | 310 helix | trans | -68.4 | -27.7 | 176.3 | -72.9 | 159.3 | 0 | 0 | 0 | 111.5 | W89 Y91 P92 H96 F97 L102 | W89-L94 HydrophobicContact CB-CB 4.39Å; W89-L94 HydrophobicContact CD2-CB 3.86Å; W89-L94 HydrophobicContact CE3-CB 3.67Å; W89-L94 HydrophobicContact CE3-CD1 4.15Å; W89-L94 HydrophobicContact CE3-CG 4.48Å; W89-L94 HydrophobicContact CG-CB 4.2Å; W89-L94 HydrophobicContact CZ3-CB 4.27Å; Y91-L94 HydrophobicContact CD2-CD1 3.86Å; Y91-L94 HydrophobicContact CG-CD1 4.29Å; Y91-L94 WeakPolarHBondContact O-CB 3.15Å; Y91-L94 PolarHBondContact O-N 3.24Å; P92-L94 VanDerWaalsContact C-N 3.3Å; P92-L94 PolarHBondContact O-N 2.96Å; L94-H96 PolarHBondContact O-N 3.42Å; L94-F97 PolarHBondContact O-N 3.42Å; L94-L102 HydrophobicContact CB-CD1 4.24Å; L94-L102 HydrophobicContact CD2-CD1 3.77Å; L94-L102 HydrophobicContact CD2-CG 4.09Å |
| 95 | G | 70.4 | Confident | 75.1 | Confident | 42 Ų | 42 | 80.3 Ų | 80.3 | 43% | 0.433 | 48% | 0.484 | S | S | . | . | G | 310 helix | trans | -70.6 | -15.3 | 177 | 0 | 0 | 0 | 0 | 0 | 114.7 | P92 L93 | P92-G95 PolarHBondContact O-N 3.38Å; P92-G95 VanDerWaalsContact O-N 3.13Å; L93-G95 VanDerWaalsContact C-N 3.25Å; L93-G95 PolarHBondContact O-N 3.11Å |
| 96 | H | 76.5 | Confident | 75 | Confident | 173 Ų | 173 | 78.8 Ų | 78.8 | 80% | 0.801 | 47% | 0.47 | S | S | * | . | G | 310 helix | trans | -83.5 | -12.1 | 173.6 | -80.8 | -77.4 | 0 | 0 | 0 | 113.5 | L93 L94 | L93-H96 PolarHBondContact O-N 3.4Å; L94-H96 PolarHBondContact O-N 3.42Å |
| 97 | F | 70.1 | Confident | 74.9 | Confident | 114 Ų | 114 | 81.3 Ų | 81.3 | 50% | 0.5 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -96.3 | 141.9 | -179.2 | -74.9 | -80.4 | 0 | 0 | 0 | 111.8 | L93 L94 L102 | L93-F97 WeakPolarHBondContact O-CD2 3.39Å; L94-F97 PolarHBondContact O-N 3.42Å; F97-L102 HydrophobicContact CB-CD1 4.07Å |
| 98 | S | 78.8 | Confident | 75.2 | Confident | 80 Ų | 80 | 85.1 Ų | 85.1 | 56% | 0.559 | 48% | 0.476 | S | S | * | . | trans | -69.2 | 164.9 | 167.4 | 69.7 | 0 | 0 | 0 | 0 | 110.7 | A100 G101 L102 | S98-A100 PolarHBondContact O-N 2.86Å; S98-A100 VanDerWaalsContact O-N 3.15Å; S98-G101 WeakPolarHBondContact O-CA 3.38Å; S98-G101 PolarHBondContact O-N 3.39Å; S98-G101 PolarHBondContact OG-N 3.2Å; S98-L102 PolarHBondContact O-N 3.24Å | ||
| 99 | A | 77.8 | Confident | 75.4 | Confident | 89 Ų | 89 | 84 Ų | 84 | 74% | 0.736 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -54 | -36.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L103 | A99-L103 PolarHBondContact O-N 3.03Å |
| 100 | A | 77.9 | Confident | 75.4 | Confident | 75 Ų | 75 | 85 Ų | 85 | 62% | 0.62 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -69.1 | -37.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S98 L103 G104 | S98-A100 PolarHBondContact O-N 2.86Å; S98-A100 VanDerWaalsContact O-N 3.15Å; A100-L103 PolarHBondContact O-N 3.22Å; A100-G104 PolarHBondContact O-N 3.32Å |
| 101 | G | 78.7 | Confident | 75.7 | Confident | 23 Ų | 23 | 85 Ų | 85 | 24% | 0.237 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -65.3 | -38.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | S98 G104 F105 | S98-G101 WeakPolarHBondContact O-CA 3.38Å; S98-G101 PolarHBondContact O-N 3.39Å; S98-G101 PolarHBondContact OG-N 3.2Å; G101-G104 PolarHBondContact O-N 3.03Å; G101-F105 WeakPolarHBondContact O-CB 3.37Å; G101-F105 PolarHBondContact O-N 3.37Å |
| 102 | L | 76.8 | Confident | 75.9 | Confident | 18 Ų | 18 | 82 Ų | 82 | 9% | 0.094 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62.2 | -46.6 | 173.5 | -125.7 | 89.4 | 0 | 0 | 0 | 111.5 | W89 L94 F97 S98 G104 F105 F106 | W89-L102 HydrophobicContact CH2-CD1 4.09Å; W89-L102 HydrophobicContact CH2-CD2 3.55Å; W89-L102 HydrophobicContact CH2-CG 4.5Å; W89-L102 HydrophobicContact CZ2-CD1 4.46Å; W89-L102 HydrophobicContact CZ3-CD1 4.43Å; W89-L102 HydrophobicContact CZ3-CD2 3.84Å; L94-L102 HydrophobicContact CB-CD1 4.24Å; L94-L102 HydrophobicContact CD2-CD1 3.77Å; L94-L102 HydrophobicContact CD2-CG 4.09Å; F97-L102 HydrophobicContact CB-CD1 4.07Å; S98-L102 PolarHBondContact O-N 3.24Å; L102-G104 VanDerWaalsContact C-N 3.32Å; L102-G104 PolarHBondContact O-N 3.29Å; L102-F105 WeakPolarHBondContact O-CB 3.21Å; L102-F105 PolarHBondContact O-N 2.91Å; L102-F106 HydrophobicContact CD2-CE2 3.95Å; L102-F106 HydrophobicContact CD2-CZ 4.4Å; L102-F106 HydrophobicContact CG-CE2 4.21Å; L102-F106 WeakPolarHBondContact O-CD2 3.41Å; L102-F106 PolarHBondContact O-N 2.96Å; L102-F106 VanDerWaalsContact O-N 3.07Å |
| 103 | L | 81.1 | Confident | 76.1 | Confident | 131 Ų | 131 | 79.1 Ų | 79.1 | 69% | 0.686 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.9 | -41.8 | 178 | -164.9 | 71.8 | 0 | 0 | 0 | 111.4 | A99 A100 F106 F107 | A99-L103 PolarHBondContact O-N 3.03Å; A100-L103 PolarHBondContact O-N 3.22Å; L103-F106 PolarHBondContact O-N 2.92Å; L103-F107 PolarHBondContact O-N 3.4Å |
| 104 | G | 82.9 | Confident | 76.6 | Confident | 39 Ų | 39 | 75.6 Ų | 75.6 | 40% | 0.402 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.4 | -41.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A100 G101 L102 F106 F107 F108 | A100-G104 PolarHBondContact O-N 3.32Å; G101-G104 PolarHBondContact O-N 3.03Å; L102-G104 VanDerWaalsContact C-N 3.32Å; L102-G104 PolarHBondContact O-N 3.29Å; G104-F106 VanDerWaalsContact C-N 3.35Å; G104-F106 PolarHBondContact O-N 3.23Å; G104-F107 PolarHBondContact O-N 3.41Å; G104-F108 WeakPolarHBondContact O-CB 3.21Å; G104-F108 PolarHBondContact O-N 3.41Å |
| 105 | F | 75.5 | Confident | 76.9 | Confident | 92 Ų | 92 | 79.8 Ų | 79.8 | 40% | 0.404 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 176.7 | -177.1 | -98.5 | 0 | 0 | 0 | 112.1 | G101 L102 F108 N109 | G101-F105 WeakPolarHBondContact O-CB 3.37Å; G101-F105 PolarHBondContact O-N 3.37Å; L102-F105 WeakPolarHBondContact O-CB 3.21Å; L102-F105 PolarHBondContact O-N 2.91Å; F105-F108 PolarHBondContact O-N 3.35Å; F105-N109 WeakPolarHBondContact O-CB 3.39Å; F105-N109 PolarHBondContact O-N 3.12Å |
| 106 | F | 74.6 | Confident | 77 | Confident | 50 Ų | 50 | 82.3 Ų | 82.3 | 22% | 0.219 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -67.9 | -42.1 | 175.7 | -68.1 | -48.6 | 0 | 0 | 0 | 113.2 | L76 L102 L103 G104 F108 N109 M110 | L76-F106 HydrophobicContact CD1-CB 4.36Å; L76-F106 HydrophobicContact CD1-CD1 3.32Å; L76-F106 HydrophobicContact CD1-CD2 4Å; L76-F106 HydrophobicContact CD1-CE1 3.52Å; L76-F106 HydrophobicContact CD1-CE2 4.09Å; L76-F106 HydrophobicContact CD1-CG 3.62Å; L76-F106 HydrophobicContact CD1-CZ 3.88Å; L76-F106 HydrophobicContact CD2-CD1 3.66Å; L76-F106 HydrophobicContact CD2-CE1 2.99Å; L76-F106 HydrophobicContact CD2-CE2 4.42Å; L76-F106 HydrophobicContact CD2-CZ 3.43Å; L76-F106 VanDerWaalsContact CD2-CZ 3.43Å; L76-F106 HydrophobicContact CG-CD1 4.09Å; L76-F106 HydrophobicContact CG-CE1 3.8Å; L76-F106 HydrophobicContact CG-CZ 4.09Å; L102-F106 HydrophobicContact CD2-CE2 3.95Å; L102-F106 HydrophobicContact CD2-CZ 4.4Å; L102-F106 HydrophobicContact CG-CE2 4.21Å; L102-F106 WeakPolarHBondContact O-CD2 3.41Å; L102-F106 PolarHBondContact O-N 2.96Å; L102-F106 VanDerWaalsContact O-N 3.07Å; L103-F106 PolarHBondContact O-N 2.92Å; G104-F106 VanDerWaalsContact C-N 3.35Å; G104-F106 PolarHBondContact O-N 3.23Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 3.24Å; F106-N109 PolarHBondContact O-N 3.35Å; F106-M110 WeakPolarHBondContact O-CG 3.42Å; F106-M110 PolarHBondContact O-N 3.36Å |
| 107 | F | 81.5 | Confident | 76.5 | Confident | 152 Ų | 152 | 75.7 Ų | 75.7 | 67% | 0.667 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -60.7 | -46 | 175.3 | -175.9 | -98.5 | 0 | 0 | 0 | 110.9 | L103 G104 N109 M110 V111 | L103-F107 PolarHBondContact O-N 3.4Å; G104-F107 PolarHBondContact O-N 3.41Å; F107-N109 VanDerWaalsContact C-N 3.32Å; F107-N109 PolarHBondContact O-N 2.73Å; F107-M110 PolarHBondContact O-N 3.45Å; F107-V111 HydrophobicContact CD1-CG2 4.2Å; F107-V111 HydrophobicContact CE1-CG2 3.87Å; F107-V111 HydrophobicContact CZ-CG2 4.18Å; F107-V111 VanDerWaalsContact O-CG2 3.32Å; F107-V111 WeakPolarHBondContact O-CG2 3.25Å; F107-V111 PolarHBondContact O-N 3.39Å |
| 108 | F | 81.9 | Confident | 76.6 | Confident | 130 Ų | 130 | 73.7 Ų | 73.7 | 57% | 0.57 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -58.3 | -43.4 | 174.9 | 179 | -101.4 | 0 | 0 | 0 | 112.1 | G104 F105 F106 M110 V111 V112 | G104-F108 WeakPolarHBondContact O-CB 3.21Å; G104-F108 PolarHBondContact O-N 3.41Å; F105-F108 PolarHBondContact O-N 3.35Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 3.24Å; F108-M110 PolarHBondContact O-N 2.88Å; F108-V111 PolarHBondContact O-N 2.99Å; F108-V112 HydrophobicContact CD1-CG2 4.22Å; F108-V112 HydrophobicContact CE1-CG2 3.78Å; F108-V112 HydrophobicContact CE2-CG2 4.12Å; F108-V112 HydrophobicContact CZ-CG2 3.73Å; F108-V112 WeakPolarHBondContact O-CG2 3.44Å; F108-V112 PolarHBondContact O-N 2.81Å |
| 109 | N | 75.4 | Confident | 76.3 | Confident | 73 Ų | 73 | 74.9 Ų | 74.9 | 39% | 0.39 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.2 | -44.1 | 177.5 | -129.1 | -83.4 | 0 | 0 | 0 | 112.1 | F105 F106 F107 V111 V112 V113 | F105-N109 WeakPolarHBondContact O-CB 3.39Å; F105-N109 PolarHBondContact O-N 3.12Å; F106-N109 PolarHBondContact O-N 3.35Å; F107-N109 VanDerWaalsContact C-N 3.32Å; F107-N109 PolarHBondContact O-N 2.73Å; N109-V111 VanDerWaalsContact C-N 3.32Å; N109-V111 PolarHBondContact O-N 2.75Å; N109-V112 PolarHBondContact O-N 3.47Å; N109-V113 WeakPolarHBondContact O-CB 3.11Å; N109-V113 VanDerWaalsContact O-CG2 3.28Å; N109-V113 WeakPolarHBondContact O-CG2 3.17Å; N109-V113 PolarHBondContact O-N 2.81Å |
| 110 | M | 73.4 | Confident | 75.7 | Confident | 73 Ų | 73 | 72.2 Ų | 72.2 | 36% | 0.36 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.7 | -38.4 | 176.8 | -73.5 | -67.4 | 169 | 0 | 0 | 112.3 | F106 F107 F108 T114 | F106-M110 WeakPolarHBondContact O-CG 3.42Å; F106-M110 PolarHBondContact O-N 3.36Å; F107-M110 PolarHBondContact O-N 3.45Å; F108-M110 PolarHBondContact O-N 2.88Å; M110-T114 WeakPolarHBondContact O-CB 3.23Å; M110-T114 PolarHBondContact O-N 3.32Å; M110-T114 PolarHBondContact O-OG1 2.96Å |
| 111 | V | 81.4 | Confident | 75.2 | Confident | 59 Ų | 59 | 71.8 Ų | 71.8 | 36% | 0.358 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.7 | -47.8 | 174.9 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | F107 F108 N109 T114 L115 | F107-V111 HydrophobicContact CD1-CG2 4.2Å; F107-V111 HydrophobicContact CE1-CG2 3.87Å; F107-V111 HydrophobicContact CZ-CG2 4.18Å; F107-V111 VanDerWaalsContact O-CG2 3.32Å; F107-V111 WeakPolarHBondContact O-CG2 3.25Å; F107-V111 PolarHBondContact O-N 3.39Å; F108-V111 PolarHBondContact O-N 2.99Å; N109-V111 VanDerWaalsContact C-N 3.32Å; N109-V111 PolarHBondContact O-N 2.75Å; V111-T114 PolarHBondContact O-N 2.92Å; V111-L115 HydrophobicContact CG1-CD1 4.1Å; V111-L115 HydrophobicContact CG1-CG 4.47Å; V111-L115 WeakPolarHBondContact O-CG 3.39Å; V111-L115 PolarHBondContact O-N 2.81Å |
| 112 | V | 78.4 | Confident | 74.7 | Confident | 51 Ų | 51 | 79 Ų | 79 | 31% | 0.309 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 179.4 | 170.5 | 0 | 0 | 0 | 0 | 111.7 | F108 N109 T114 L115 L116 | F108-V112 HydrophobicContact CD1-CG2 4.22Å; F108-V112 HydrophobicContact CE1-CG2 3.78Å; F108-V112 HydrophobicContact CE2-CG2 4.12Å; F108-V112 HydrophobicContact CZ-CG2 3.73Å; F108-V112 WeakPolarHBondContact O-CG2 3.44Å; F108-V112 PolarHBondContact O-N 2.81Å; N109-V112 PolarHBondContact O-N 3.47Å; V112-T114 VanDerWaalsContact C-N 3.31Å; V112-T114 PolarHBondContact O-N 2.91Å; V112-L115 PolarHBondContact O-N 3.46Å; V112-L116 HydrophobicContact CG1-CD1 3.74Å; V112-L116 PolarHBondContact O-N 2.84Å |
| 113 | V | 72.4 | Confident | 74.3 | Confident | 44 Ų | 44 | 83 Ų | 83 | 27% | 0.267 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -58.8 | -43.8 | 175.7 | 166.8 | 0 | 0 | 0 | 0 | 111.2 | L68 N109 Y117 | L68-V113 HydrophobicContact CD2-CG1 3.32Å; L68-V113 HydrophobicContact CG-CG1 4.46Å; N109-V113 WeakPolarHBondContact O-CB 3.11Å; N109-V113 VanDerWaalsContact O-CG2 3.28Å; N109-V113 WeakPolarHBondContact O-CG2 3.17Å; N109-V113 PolarHBondContact O-N 2.81Å; V113-Y117 VanDerWaalsContact O-CB 3.25Å; V113-Y117 WeakPolarHBondContact O-CB 3.32Å; V113-Y117 PolarHBondContact O-N 2.79Å |
| 114 | T | 73.5 | Confident | 73.4 | Confident | 57 Ų | 57 | 79 Ų | 79 | 35% | 0.35 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 177.3 | -57 | 0 | 0 | 0 | 0 | 111.2 | M110 V111 V112 Y117 L118 | M110-T114 WeakPolarHBondContact O-CB 3.23Å; M110-T114 PolarHBondContact O-N 3.32Å; M110-T114 PolarHBondContact O-OG1 2.96Å; V111-T114 PolarHBondContact O-N 2.92Å; V112-T114 VanDerWaalsContact C-N 3.31Å; V112-T114 PolarHBondContact O-N 2.91Å; T114-Y117 PolarHBondContact O-N 2.81Å; T114-L118 HydrophobicContact CG2-CD1 3.64Å; T114-L118 WeakPolarHBondContact O-CD1 3.41Å; T114-L118 PolarHBondContact O-N 2.92Å |
| 115 | L | 76.8 | Confident | 72.5 | Confident | 110 Ų | 110 | 80.5 Ų | 80.5 | 58% | 0.576 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -65.3 | -46.4 | 178.5 | -72.4 | 175 | 0 | 0 | 0 | 113.1 | V111 V112 Y117 L118 L119 | V111-L115 HydrophobicContact CG1-CD1 4.1Å; V111-L115 HydrophobicContact CG1-CG 4.47Å; V111-L115 WeakPolarHBondContact O-CG 3.39Å; V111-L115 PolarHBondContact O-N 2.81Å; V112-L115 PolarHBondContact O-N 3.46Å; L115-Y117 PolarHBondContact O-N 3.34Å; L115-L118 PolarHBondContact O-N 3.4Å; L115-L119 WeakPolarHBondContact O-CB 3.26Å; L115-L119 PolarHBondContact O-N 3.37Å |
| 116 | L | 70.8 | Confident | 71.8 | Confident | 95 Ų | 95 | 83.6 Ų | 83.6 | 50% | 0.497 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -57.6 | -39.7 | 174.8 | -84 | 155.3 | 0 | 0 | 0 | 111.1 | V112 L119 G120 | V112-L116 HydrophobicContact CG1-CD1 3.74Å; V112-L116 PolarHBondContact O-N 2.84Å; L116-L119 PolarHBondContact O-N 2.99Å; L116-G120 PolarHBondContact O-N 2.88Å |
| 117 | Y | 66.6 | Low | 71.2 | Confident | 35 Ų | 35 | 86.6 Ų | 86.6 | 14% | 0.137 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -68.7 | -44.8 | 178.2 | 179.7 | -104.5 | 0 | 0 | 0 | 112.9 | Y58 M61 L65 V113 T114 L115 L119 G120 D121 | Y58-Y117 HydrophobicContact CD1-CE2 4.27Å; Y58-Y117 AromaticContact CD1-CZ 3.96Å; Y58-Y117 WeakPolarHBondContact CD1-OH 3.22Å; Y58-Y117 HydrophobicContact CD2-CE2 4.21Å; Y58-Y117 HydrophobicContact CE1-CE1 4.44Å; Y58-Y117 AromaticContact CE1-CE2 3.47Å; Y58-Y117 HydrophobicContact CE1-CE2 3.47Å; Y58-Y117 VanDerWaalsContact CE1-CE2 3.47Å; Y58-Y117 AromaticContact CE1-CZ 3.3Å; Y58-Y117 WeakPolarHBondContact CE1-OH 3.4Å; Y58-Y117 HydrophobicContact CE2-CD2 4.33Å; Y58-Y117 AromaticContact CE2-CE2 3.38Å; Y58-Y117 HydrophobicContact CE2-CE2 3.38Å; Y58-Y117 AromaticContact CZ-CD2 3.9Å; Y58-Y117 AromaticContact CZ-CE2 2.93Å; Y58-Y117 AromaticContact CZ-CZ 3.36Å; Y58-Y117 VanDerWaalsContact CZ-OH 3.28Å; Y58-Y117 WeakPolarHBondContact OH-CD2 3.47Å; Y58-Y117 WeakPolarHBondContact OH-CE2 3.09Å; M61-Y117 HydrophobicContact CG-CE1 4.07Å; L65-Y117 HydrophobicContact CD1-CD1 4.29Å; L65-Y117 HydrophobicContact CD1-CE1 4.41Å; L65-Y117 HydrophobicContact CD2-CD1 4.03Å; L65-Y117 HydrophobicContact CD2-CG 4.34Å; L65-Y117 HydrophobicContact CG-CD1 4.26Å; L65-Y117 HydrophobicContact CG-CE1 4.46Å; V113-Y117 VanDerWaalsContact O-CB 3.25Å; V113-Y117 WeakPolarHBondContact O-CB 3.32Å; V113-Y117 PolarHBondContact O-N 2.79Å; T114-Y117 PolarHBondContact O-N 2.81Å; L115-Y117 PolarHBondContact O-N 3.34Å; Y117-L119 VanDerWaalsContact C-N 3.28Å; Y117-L119 PolarHBondContact O-N 2.79Å; Y117-G120 PolarHBondContact O-N 2.87Å; Y117-D121 PolarHBondContact O-N 3.38Å |
| 118 | L | 71.6 | Confident | 70.1 | Confident | 72 Ų | 72 | 83.1 Ų | 83.1 | 38% | 0.377 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -60.7 | -38.6 | 172.6 | -91 | 84.7 | 0 | 0 | 0 | 111.8 | T114 L115 D121 R122 | T114-L118 HydrophobicContact CG2-CD1 3.64Å; T114-L118 WeakPolarHBondContact O-CD1 3.41Å; T114-L118 PolarHBondContact O-N 2.92Å; L115-L118 PolarHBondContact O-N 3.4Å; L118-D121 PolarHBondContact O-N 2.97Å; L118-R122 WeakPolarHBondContact O-CG 3.37Å; L118-R122 PolarHBondContact O-N 3.42Å |
| 119 | L | 72.9 | Confident | 68.6 | Low | 105 Ų | 105 | 80.5 Ų | 80.5 | 55% | 0.55 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 176.7 | -173.6 | 60.7 | 0 | 0 | 0 | 111 | L115 L116 Y117 R122 L123 | L115-L119 WeakPolarHBondContact O-CB 3.26Å; L115-L119 PolarHBondContact O-N 3.37Å; L116-L119 PolarHBondContact O-N 2.99Å; Y117-L119 VanDerWaalsContact C-N 3.28Å; Y117-L119 PolarHBondContact O-N 2.79Å; L119-R122 PolarHBondContact O-N 2.82Å; L119-L123 HydrophobicContact CG-CD1 4.23Å; L119-L123 VanDerWaalsContact O-CG 3.25Å; L119-L123 WeakPolarHBondContact O-CG 3.2Å; L119-L123 PolarHBondContact O-N 3.4Å |
| 120 | G | 66.3 | Low | 67.6 | Low | 33 Ų | 33 | 85 Ų | 85 | 34% | 0.34 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.3 | -43.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L116 Y117 L123 N124 | L116-G120 PolarHBondContact O-N 2.88Å; Y117-G120 PolarHBondContact O-N 2.87Å; G120-L123 PolarHBondContact O-N 3.37Å; G120-N124 VanDerWaalsContact O-CB 3.26Å; G120-N124 WeakPolarHBondContact O-CB 3.34Å; G120-N124 PolarHBondContact O-N 2.95Å |
| 121 | D | 67.9 | Low | 66.4 | Low | 65 Ų | 65 | 88.1 Ų | 88.1 | 35% | 0.348 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.3 | -41.9 | 177 | -175.4 | 56.9 | 0 | 0 | 0 | 112 | Y117 L118 N124 S125 | Y117-D121 PolarHBondContact O-N 3.38Å; L118-D121 PolarHBondContact O-N 2.97Å; D121-N124 PolarHBondContact O-N 2.9Å; D121-S125 WeakPolarHBondContact O-CB 3.43Å; D121-S125 PolarHBondContact O-N 3.42Å |
| 122 | R | 68 | Low | 64.8 | Low | 175 Ų | 175 | 90.7 Ų | 90.7 | 66% | 0.66 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.2 | -43.2 | 176.4 | -67.9 | -71.6 | 157.1 | 164.3 | -1.9 | 111.8 | L118 L119 Q126 | L118-R122 WeakPolarHBondContact O-CG 3.37Å; L118-R122 PolarHBondContact O-N 3.42Å; L119-R122 PolarHBondContact O-N 2.82Å; R122-Q126 WeakPolarHBondContact O-CB 3.33Å; R122-Q126 WeakPolarHBondContact O-CG 3.25Å; R122-Q126 PolarHBondContact O-N 3.27Å; R122-Q126 VanDerWaalsContact O-N 3.11Å |
| 123 | L | 66.5 | Low | 63.4 | Low | 103 Ų | 103 | 92.9 Ų | 92.9 | 54% | 0.539 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.5 | -42.9 | 176.1 | -69.3 | 170.1 | 0 | 0 | 0 | 111.6 | L119 G120 Q126 I127 | L119-L123 HydrophobicContact CG-CD1 4.23Å; L119-L123 VanDerWaalsContact O-CG 3.25Å; L119-L123 WeakPolarHBondContact O-CG 3.2Å; L119-L123 PolarHBondContact O-N 3.4Å; G120-L123 PolarHBondContact O-N 3.37Å; L123-Q126 PolarHBondContact O-N 2.73Å; L123-I127 PolarHBondContact O-N 3.47Å |
| 124 | N | 63.7 | Low | 62.2 | Low | 46 Ų | 46 | 99.2 Ų | 99.2 | 25% | 0.246 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 178.6 | -175.2 | 67.4 | 0 | 0 | 0 | 112.3 | G120 D121 Q126 I127 W128 | G120-N124 VanDerWaalsContact O-CB 3.26Å; G120-N124 WeakPolarHBondContact O-CB 3.34Å; G120-N124 PolarHBondContact O-N 2.95Å; D121-N124 PolarHBondContact O-N 2.9Å; N124-Q126 VanDerWaalsContact C-N 3.29Å; N124-Q126 PolarHBondContact O-N 3.48Å; N124-I127 PolarHBondContact O-N 2.77Å; N124-W128 WeakPolarHBondContact O-CB 3.12Å; N124-W128 PolarHBondContact O-N 3.36Å; N124-W128 VanDerWaalsContact O-N 3.15Å |
| 125 | S | 63.9 | Low | 60.8 | Low | 70 Ų | 70 | 106.7 Ų | 106.7 | 49% | 0.49 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.8 | -28.1 | 175.6 | 174.5 | 0 | 0 | 0 | 0 | 113.2 | D121 | D121-S125 WeakPolarHBondContact O-CB 3.43Å; D121-S125 PolarHBondContact O-N 3.42Å |
| 126 | Q | 60.6 | Low | 59.1 | Low | 157 Ų | 157 | 106.1 Ų | 106.1 | 73% | 0.734 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -81.8 | -30 | 178.7 | -69.4 | -73.1 | -87.7 | 0 | 0 | 112.5 | R122 L123 N124 | R122-Q126 WeakPolarHBondContact O-CB 3.33Å; R122-Q126 WeakPolarHBondContact O-CG 3.25Å; R122-Q126 PolarHBondContact O-N 3.27Å; R122-Q126 VanDerWaalsContact O-N 3.11Å; L123-Q126 PolarHBondContact O-N 2.73Å; N124-Q126 VanDerWaalsContact C-N 3.29Å; N124-Q126 PolarHBondContact O-N 3.48Å |
| 127 | I | 61.6 | Low | 57.9 | Low | 113 Ų | 113 | 105.2 Ų | 105.2 | 58% | 0.579 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -85.1 | -27.2 | -179.2 | -143.4 | 77.8 | 0 | 0 | 0 | 112.8 | L123 N124 | L123-I127 PolarHBondContact O-N 3.47Å; N124-I127 PolarHBondContact O-N 2.77Å |
| 128 | W | 57.8 | Low | 56.7 | Low | 80 Ų | 80 | 114.5 Ų | 114.5 | 30% | 0.303 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -123.3 | 17.3 | -166.2 | -112.5 | -47.8 | 0 | 0 | 0 | 116.1 | V51 L52 P55 N124 E130 Y133 | V51-W128 WeakPolarHBondContact O-CZ3 3.31Å; L52-W128 VanDerWaalsContact O-CH2 3.26Å; L52-W128 WeakPolarHBondContact O-CH2 3.26Å; P55-W128 HydrophobicContact CB-CH2 3.83Å; P55-W128 HydrophobicContact CB-CZ2 3.66Å; P55-W128 HydrophobicContact CB-CZ3 4.35Å; P55-W128 HydrophobicContact CG-CH2 4.39Å; P55-W128 HydrophobicContact CG-CZ2 4.03Å; N124-W128 WeakPolarHBondContact O-CB 3.12Å; N124-W128 PolarHBondContact O-N 3.36Å; N124-W128 VanDerWaalsContact O-N 3.15Å; W128-E130 PolarHBondContact O-N 3.47Å; W128-Y133 AromaticContact CD1-CE2 3.98Å; W128-Y133 AromaticContact CD1-CZ 3.66Å; W128-Y133 HydrophobicContact CG-CE2 4.35Å; W128-Y133 AromaticContact CG-CZ 3.98Å; W128-Y133 AromaticContact NE1-CZ 3.81Å; W128-Y133 PolarHBondContact NE1-OH 3.26Å |
| 129 | S | 51.3 | Low | 55.6 | Low | 74 Ų | 74 | 118.2 Ų | 118.2 | 52% | 0.517 | 59% | 0.587 | S | S | . | * | trans | -69.7 | 122.6 | 168.4 | 57.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 130 | E | 53.6 | Low | 54.5 | Low | 169 Ų | 169 | 115.4 Ų | 115.4 | 79% | 0.79 | 58% | 0.579 | S | S | * | * | S | Bend | trans | 83.3 | 97.8 | 174 | -43.4 | -57.9 | 140.4 | 0 | 0 | 116.2 | W128 | W128-E130 PolarHBondContact O-N 3.47Š|
| 131 | T | 48.2 | Very low | 53.5 | Low | 137 Ų | 137 | 117.7 Ų | 117.7 | 84% | 0.84 | 59% | 0.59 | S | S | * | * | S | Bend | 153.8 | -23.3 | 118.4 | -52.4 | 0 | 0 | 0 | 0 | 116.9 | |||
| 132 | C | 47.8 | Very low | 52.7 | Low | 114 Ų | 114 | 120.4 Ų | 120.4 | 77% | 0.77 | 60% | 0.604 | S | S | * | * | trans | -145 | 82.9 | -166.3 | -153.6 | 0 | 0 | 0 | 0 | 117 | ||||
| 133 | Y | 49.3 | Very low | 51.6 | Low | 96 Ų | 96 | 115.7 Ų | 115.7 | 38% | 0.376 | 60% | 0.596 | S | S | . | * | trans | -136.6 | 25.5 | -178.4 | -73.7 | -56.5 | 0 | 0 | 0 | 117.2 | P55 W128 W137 | P55-Y133 HydrophobicContact CB-CE1 3.45Å; P55-Y133 VanDerWaalsContact CB-CE1 3.45Å; P55-Y133 WeakPolarHBondContact CB-OH 3.27Å; P55-Y133 HydrophobicContact CG-CE1 3.94Å; W128-Y133 AromaticContact CD1-CE2 3.98Å; W128-Y133 AromaticContact CD1-CZ 3.66Å; W128-Y133 HydrophobicContact CG-CE2 4.35Å; W128-Y133 AromaticContact CG-CZ 3.98Å; W128-Y133 AromaticContact NE1-CZ 3.81Å; W128-Y133 PolarHBondContact NE1-OH 3.26Å; Y133-W137 AromaticContact CD1-CE2 3.88Å; Y133-W137 AromaticContact CD1-CZ2 3.58Å; Y133-W137 HydrophobicContact CD1-CZ2 3.58Å; Y133-W137 AromaticContact CD1-NE1 3.54Å; Y133-W137 AromaticContact CE1-CZ2 3.71Å; Y133-W137 HydrophobicContact CE1-CZ2 3.71Å; Y133-W137 PolarHBondContact O-NE1 2.84Å | ||
| 134 | F | 48.4 | Very low | 51.1 | Low | 178 Ų | 178 | 114.5 Ų | 114.5 | 78% | 0.781 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -103.3 | -25.2 | -176.4 | -157.8 | -106.8 | 0 | 0 | 0 | 116.9 | ||
| 135 | Y | 42.4 | Very low | 50.8 | Low | 213 Ų | 213 | 116.3 Ų | 116.3 | 84% | 0.835 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -114.9 | -16.2 | -168.5 | -90.9 | -82.4 | 0 | 0 | 0 | 118.6 | ||
| 136 | S | 42.9 | Very low | 50.4 | Low | 98 Ų | 98 | 119.1 Ų | 119.1 | 69% | 0.685 | 61% | 0.61 | S | S | * | * | S | Bend | trans | -86.4 | -20 | -173.6 | -163.4 | 0 | 0 | 0 | 0 | 114.9 | R138 | S136-R138 PolarHBondContact O-N 3.47Š|
| 137 | W | 45.1 | Very low | 50.1 | Low | 77 Ų | 77 | 117.4 Ų | 117.4 | 29% | 0.292 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -76.9 | -21.6 | -163.1 | -63.8 | 102.1 | 0 | 0 | 0 | 116.9 | P55 T57 Y133 | P55-W137 VanDerWaalsContact C-CH2 3.48Å; P55-W137 HydrophobicContact CB-CH2 4.03Å; P55-W137 HydrophobicContact CB-CZ2 4.04Å; P55-W137 HydrophobicContact CG-CH2 4.31Å; P55-W137 HydrophobicContact CG-CZ2 4.22Å; P55-W137 WeakPolarHBondContact O-CH2 3.47Å; P55-W137 VanDerWaalsContact O-CZ3 3.3Å; P55-W137 WeakPolarHBondContact O-CZ3 3.44Å; T57-W137 WeakPolarHBondContact OG1-CH2 3.26Å; T57-W137 VanDerWaalsContact OG1-CZ2 3.28Å; T57-W137 WeakPolarHBondContact OG1-CZ2 2.83Å; T57-W137 WeakPolarHBondContact OG1-CZ3 3.1Å; Y133-W137 AromaticContact CD1-CE2 3.88Å; Y133-W137 AromaticContact CD1-CZ2 3.58Å; Y133-W137 HydrophobicContact CD1-CZ2 3.58Å; Y133-W137 AromaticContact CD1-NE1 3.54Å; Y133-W137 AromaticContact CE1-CZ2 3.71Å; Y133-W137 HydrophobicContact CE1-CZ2 3.71Å; Y133-W137 PolarHBondContact O-NE1 2.84Å |
| 138 | R | 41.6 | Very low | 49.9 | Very low | 229 Ų | 229 | 120 Ų | 120 | 86% | 0.864 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -75.4 | -25.2 | -178.5 | -100 | -177 | 153.2 | -146.4 | -5.2 | 113.6 | S136 | S136-R138 PolarHBondContact O-N 3.47Å |
| 139 | L | 47.9 | Very low | 49.9 | Very low | 150 Ų | 150 | 120.5 Ų | 120.5 | 79% | 0.785 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -90.8 | -34.3 | -176 | -138.3 | 73 | 0 | 0 | 0 | 112.5 | ||
| 140 | A | 49.1 | Very low | 50.1 | Low | 47 Ų | 47 | 120 Ų | 120 | 39% | 0.388 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -73.5 | -34.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L142 C143 Q144 | A140-L142 VanDerWaalsContact C-N 3.34Å; A140-L142 PolarHBondContact O-N 3.06Å; A140-C143 PolarHBondContact O-N 3.3Å; A140-Q144 PolarHBondContact O-N 2.85Å |
| 141 | S | 46 | Very low | 50.1 | Low | 80 Ų | 80 | 115.9 Ų | 115.9 | 56% | 0.559 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -67.4 | -33.2 | -177.6 | -163.7 | 0 | 0 | 0 | 0 | 112.9 | V145 | S141-V145 WeakPolarHBondContact O-CG2 3.14Å; S141-V145 PolarHBondContact O-N 2.75Å |
| 142 | L | 51.9 | Low | 50.5 | Low | 123 Ų | 123 | 114.9 Ų | 114.9 | 64% | 0.644 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -70 | -34.8 | 175.2 | -73.6 | 168 | 0 | 0 | 0 | 112.4 | A140 L146 | A140-L142 VanDerWaalsContact C-N 3.34Å; A140-L142 PolarHBondContact O-N 3.06Å; L142-L146 WeakPolarHBondContact O-CD1 3.14Å; L142-L146 WeakPolarHBondContact O-CG 3.13Å; L142-L146 PolarHBondContact O-N 2.8Å |
| 143 | C | 45.2 | Very low | 50.9 | Low | 75 Ų | 75 | 115 Ų | 115 | 51% | 0.507 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -72.6 | -37.2 | -179.3 | -153 | 0 | 0 | 0 | 0 | 112.1 | A140 L146 L147 | A140-C143 PolarHBondContact O-N 3.3Å; C143-L146 PolarHBondContact O-N 2.75Å; C143-L147 PolarHBondContact O-N 3.39Å; C143-L147 VanDerWaalsContact O-N 3.11Å |
| 144 | Q | 55.5 | Low | 51.1 | Low | 79 Ų | 79 | 117.5 Ų | 117.5 | 37% | 0.369 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -74.8 | -34.3 | -176.9 | -157.1 | 160.1 | -54.8 | 0 | 0 | 113 | A140 L147 Y148 | A140-Q144 PolarHBondContact O-N 2.85Å; Q144-L147 PolarHBondContact O-N 2.81Å; Q144-Y148 HydrophobicContact CG-CD2 4.41Å; Q144-Y148 HydrophobicContact CG-CE2 4.47Å; Q144-Y148 WeakPolarHBondContact O-CD2 3.18Å; Q144-Y148 PolarHBondContact O-N 3.43Å |
| 145 | V | 55.9 | Low | 51 | Low | 84 Ų | 84 | 115.8 Ų | 115.8 | 51% | 0.509 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.4 | -37.6 | 172.3 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | S141 I149 | S141-V145 WeakPolarHBondContact O-CG2 3.14Å; S141-V145 PolarHBondContact O-N 2.75Å; V145-I149 HydrophobicContact CG1-CD1 4.11Å; V145-I149 WeakPolarHBondContact O-CG1 3.41Å; V145-I149 PolarHBondContact O-N 2.74Å |
| 146 | L | 56 | Low | 51.4 | Low | 129 Ų | 129 | 109.3 Ų | 109.3 | 68% | 0.675 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -65.9 | -35.9 | 175.6 | -77.6 | 165.7 | 0 | 0 | 0 | 112.7 | L142 C143 | L142-L146 WeakPolarHBondContact O-CD1 3.14Å; L142-L146 WeakPolarHBondContact O-CG 3.13Å; L142-L146 PolarHBondContact O-N 2.8Å; C143-L146 PolarHBondContact O-N 2.75Å |
| 147 | L | 55.7 | Low | 51.6 | Low | 120 Ų | 120 | 112 Ų | 112 | 63% | 0.628 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -74 | -29.1 | 179.3 | -102.4 | 148.7 | 0 | 0 | 0 | 114.1 | C143 Q144 P151 | C143-L147 PolarHBondContact O-N 3.39Å; C143-L147 VanDerWaalsContact O-N 3.11Å; Q144-L147 PolarHBondContact O-N 2.81Å; L147-P151 VanDerWaalsContact O-CD 3.29Å; L147-P151 WeakPolarHBondContact O-CD 3.28Å |
| 148 | Y | 55.6 | Low | 51.8 | Low | 169 Ų | 169 | 112.8 Ų | 112.8 | 66% | 0.663 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -82.8 | -24.5 | 178.8 | -95.8 | -92.7 | 0 | 0 | 0 | 114.2 | Q144 | Q144-Y148 HydrophobicContact CG-CD2 4.41Å; Q144-Y148 HydrophobicContact CG-CE2 4.47Å; Q144-Y148 WeakPolarHBondContact O-CD2 3.18Å; Q144-Y148 PolarHBondContact O-N 3.43Å |
| 149 | I | 58.3 | Low | 51.9 | Low | 90 Ų | 90 | 106.4 Ų | 106.4 | 46% | 0.462 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -81.3 | -29 | -179.6 | -67.5 | -179.3 | 0 | 0 | 0 | 111.9 | V145 L152 L153 | V145-I149 HydrophobicContact CG1-CD1 4.11Å; V145-I149 WeakPolarHBondContact O-CG1 3.41Å; V145-I149 PolarHBondContact O-N 2.74Å; I149-L152 PolarHBondContact O-N 2.74Å; I149-L153 HydrophobicContact CG2-CD1 3.66Å; I149-L153 HydrophobicContact CG2-CG 4.15Å; I149-L153 PolarHBondContact O-N 3.44Å |
| 150 | A | 55.4 | Low | 51.7 | Low | 64 Ų | 64 | 109.2 Ų | 109.2 | 53% | 0.529 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.1 | -42.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | F154 | A150-F154 PolarHBondContact O-N 2.9Å |
| 151 | P | 54.8 | Low | 51.5 | Low | 81 Ų | 81 | 110 Ų | 110 | 53% | 0.526 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -73.3 | -32.4 | 178 | -15.8 | 30.9 | 0 | 0 | 0 | 113.2 | L147 F154 F155 | L147-P151 VanDerWaalsContact O-CD 3.29Å; L147-P151 WeakPolarHBondContact O-CD 3.28Å; P151-F154 PolarHBondContact O-N 2.91Å; P151-F155 WeakPolarHBondContact O-CB 3.47Å; P151-F155 PolarHBondContact O-N 3.15Å |
| 152 | L | 55.9 | Low | 51.3 | Low | 117 Ų | 117 | 115 Ų | 115 | 61% | 0.613 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -70.6 | -35.2 | 178.8 | -89.3 | 160.6 | 0 | 0 | 0 | 112.5 | I149 S156 | I149-L152 PolarHBondContact O-N 2.74Å; L152-S156 WeakPolarHBondContact O-CB 2.91Å; L152-S156 PolarHBondContact O-N 3.42Å; L152-S156 VanDerWaalsContact O-N 3.12Å; L152-S156 PolarHBondContact O-OG 3.23Å |
| 153 | L | 55.8 | Low | 51 | Low | 116 Ų | 116 | 119 Ų | 119 | 61% | 0.607 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -70.3 | -37.6 | 170.5 | -81.8 | 170.3 | 0 | 0 | 0 | 111.9 | I149 F157 | I149-L153 HydrophobicContact CG2-CD1 3.66Å; I149-L153 HydrophobicContact CG2-CG 4.15Å; I149-L153 PolarHBondContact O-N 3.44Å; L153-F157 WeakPolarHBondContact O-CB 3.32Å; L153-F157 PolarHBondContact O-N 3.11Å; L153-F157 VanDerWaalsContact O-N 3.07Å |
| 154 | F | 53.1 | Low | 51.1 | Low | 149 Ų | 149 | 119.6 Ų | 119.6 | 65% | 0.654 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.2 | -43.2 | 176.3 | -170.5 | -100 | 0 | 0 | 0 | 112.4 | A150 P151 F157 Q158 | A150-F154 PolarHBondContact O-N 2.9Å; P151-F154 PolarHBondContact O-N 2.91Å; F154-F157 PolarHBondContact O-N 2.99Å; F154-Q158 PolarHBondContact O-N 3.11Å; F154-Q158 VanDerWaalsContact O-N 3.09Å |
| 155 | F | 46.6 | Very low | 50.4 | Low | 141 Ų | 141 | 125.8 Ų | 125.8 | 62% | 0.618 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -68.2 | -39.9 | 178.2 | -162.3 | -96 | 0 | 0 | 0 | 112.3 | P151 F157 Q158 E159 | P151-F155 WeakPolarHBondContact O-CB 3.47Å; P151-F155 PolarHBondContact O-N 3.15Å; F155-F157 VanDerWaalsContact C-N 3.28Å; F155-F157 PolarHBondContact O-N 3.1Å; F155-Q158 PolarHBondContact O-N 2.87Å; F155-E159 PolarHBondContact O-N 3.47Å |
| 156 | S | 50.6 | Low | 50.2 | Low | 77 Ų | 77 | 127.9 Ų | 127.9 | 54% | 0.538 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -66.5 | -28.8 | 174.8 | -62.9 | 0 | 0 | 0 | 0 | 113.2 | L152 | L152-S156 WeakPolarHBondContact O-CB 2.91Å; L152-S156 PolarHBondContact O-N 3.42Å; L152-S156 VanDerWaalsContact O-N 3.12Å; L152-S156 PolarHBondContact O-OG 3.23Å |
| 157 | F | 47.4 | Very low | 49.9 | Very low | 154 Ų | 154 | 127.8 Ų | 127.8 | 68% | 0.675 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -75.6 | -37.6 | 175.5 | -169.1 | -100.1 | 0 | 0 | 0 | 112.3 | L153 F154 F155 R160 | L153-F157 WeakPolarHBondContact O-CB 3.32Å; L153-F157 PolarHBondContact O-N 3.11Å; L153-F157 VanDerWaalsContact O-N 3.07Å; F154-F157 PolarHBondContact O-N 2.99Å; F155-F157 VanDerWaalsContact C-N 3.28Å; F155-F157 PolarHBondContact O-N 3.1Å; F157-R160 PolarHBondContact O-N 3.19Å |
| 158 | Q | 49 | Very low | 49.5 | Very low | 95 Ų | 95 | 128.2 Ų | 128.2 | 44% | 0.444 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -66.3 | -37.3 | 177.3 | -121.3 | -89.3 | -61 | 0 | 0 | 112.9 | F154 F155 R160 T161 R162 | F154-Q158 PolarHBondContact O-N 3.11Å; F154-Q158 VanDerWaalsContact O-N 3.09Å; F155-Q158 PolarHBondContact O-N 2.87Å; Q158-R160 VanDerWaalsContact C-N 3.28Å; Q158-R160 PolarHBondContact O-N 3.12Å; Q158-T161 PolarHBondContact O-OG1 3.28Å; Q158-R162 PolarHBondContact O-N 3.18Å |
| 159 | E | 44.6 | Very low | 49.2 | Very low | 95 Ų | 95 | 125.8 Ų | 125.8 | 44% | 0.444 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -69.3 | -25.9 | 179.2 | -158.1 | 79.6 | -148.2 | 0 | 0 | 112.5 | F155 | F155-E159 PolarHBondContact O-N 3.47Å |
| 160 | R | 42.8 | Very low | 48.6 | Very low | 209 Ų | 209 | 128.1 Ų | 128.1 | 79% | 0.789 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -84 | -28.2 | -178.1 | -174 | 162.6 | -76.3 | -147 | -2.9 | 113.4 | F157 Q158 | F157-R160 PolarHBondContact O-N 3.19Å; Q158-R160 VanDerWaalsContact C-N 3.28Å; Q158-R160 PolarHBondContact O-N 3.12Å |
| 161 | T | 45.8 | Very low | 48.2 | Very low | 62 Ų | 62 | 132.3 Ų | 132.3 | 38% | 0.38 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -81.8 | -27 | 176.2 | 48 | 0 | 0 | 0 | 0 | 113 | Q158 R163 S164 | Q158-T161 PolarHBondContact O-OG1 3.28Å; T161-R163 PolarHBondContact O-N 3.4Å; T161-S164 PolarHBondContact O-N 3.49Å; T161-S164 PolarHBondContact O-OG 3.33Å; T161-S164 VanDerWaalsContact O-OG 3.07Å |
| 162 | R | 42.2 | Very low | 47.7 | Very low | 187 Ų | 187 | 136 Ų | 136 | 71% | 0.706 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | -1.6 | 176 | -149.4 | -160.7 | -89.1 | 165.3 | -6.1 | 114.2 | Q158 | Q158-R162 PolarHBondContact O-N 3.18Š|
| 163 | R | 44.3 | Very low | 47 | Very low | 206 Ų | 206 | 137.5 Ų | 137.5 | 78% | 0.777 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.1 | 5.2 | 178.1 | -143.3 | -172 | -75.8 | -170.6 | -4.2 | 112.7 | T161 | T161-R163 PolarHBondContact O-N 3.4Š|
| 164 | S | 47.6 | Very low | 46.3 | Very low | 88 Ų | 88 | 139.3 Ų | 139.3 | 62% | 0.615 | 65% | 0.646 | S | S | * | * | trans | -118.7 | 3.4 | -179.2 | 51.7 | 0 | 0 | 0 | 0 | 114.7 | T161 | T161-S164 PolarHBondContact O-N 3.49Å; T161-S164 PolarHBondContact O-OG 3.33Å; T161-S164 VanDerWaalsContact O-OG 3.07Å | ||
| 165 | D | 41.8 | Very low | 45.7 | Very low | 208 Ų | 208 | 138.4 Ų | 138.4 | 100% | 1.112 | 65% | 0.645 | S | S | * | * | trans | -119.7 | 0 | 165.3 | -67.6 | -33.1 | 0 | 0 | 0 | 108.7 |
Retrieved 165 of 165 residues in 73.1 ms
(Link to these results)