| 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 | 34.9 | Very low | 43.4 | Very low | 236 Ų | 236 | 155.6 Ų | 155.6 | 100% | 1.163 | 86% | 0.855 | S | S | * | * | 0 | 129.2 | 0 | -82.3 | -177.6 | 148 | 0 | 0 | 108.4 | |||||
| 2 | S | 44.4 | Very low | 42.7 | Very low | 117 Ų | 117 | 160.4 Ų | 160.4 | 82% | 0.818 | 85% | 0.851 | S | S | * | * | trans | 56.5 | 159.6 | 153.1 | -50.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 3 | P | 50.8 | Low | 42.6 | Very low | 117 Ų | 117 | 158.2 Ų | 158.2 | 76% | 0.76 | 85% | 0.847 | S | S | * | * | cis | -122.2 | 165.8 | -1.9 | 40.2 | -27 | 0 | 0 | 0 | 115.2 | ||||
| 4 | C | 43.4 | Very low | 42.5 | Very low | 128 Ų | 128 | 157.1 Ų | 157.1 | 87% | 0.865 | 84% | 0.839 | S | S | * | * | trans | -94.8 | 149 | 158.2 | -58.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 5 | P | 47.9 | Very low | 42.7 | Very low | 115 Ų | 115 | 158.9 Ų | 158.9 | 75% | 0.747 | 84% | 0.84 | S | S | * | * | -150.6 | -178.4 | 125.9 | 39.7 | -24.6 | 0 | 0 | 0 | 113.1 | |||||
| 6 | P | 45.8 | Very low | 42.6 | Very low | 113 Ų | 113 | 157.1 Ų | 157.1 | 73% | 0.734 | 83% | 0.83 | S | S | * | * | cis | -123.4 | 171.2 | -47.7 | 37.2 | -24.6 | 0 | 0 | 0 | 111.4 | ||||
| 7 | Q | 44.9 | Very low | 42.9 | Very low | 194 Ų | 194 | 151.5 Ų | 151.5 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | trans | -78.4 | 150.6 | 167.1 | -76.2 | -164.5 | -11.9 | 0 | 0 | 112.3 | ||||
| 8 | Q | 38 | Very low | 43.2 | Very low | 189 Ų | 189 | 150.3 Ų | 150.3 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -132 | 139.2 | 157.4 | -75.1 | -168.9 | -12.6 | 0 | 0 | 109.9 | ||||
| 9 | S | 46 | Very low | 43.6 | Very low | 116 Ų | 116 | 146.6 Ų | 146.6 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | trans | -77.2 | 149.4 | -177.5 | 50.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 10 | R | 36.1 | Very low | 44.1 | Very low | 221 Ų | 221 | 144.1 Ų | 144.1 | 83% | 0.834 | 78% | 0.776 | S | S | * | * | trans | -135.9 | 89.2 | 167.6 | -85.3 | -172.6 | 164.9 | 168.8 | -2.6 | 111.3 | R12 | R10-R12 PolarHBondContact O-N 2.84Š| ||
| 11 | N | 44.8 | Very low | 44.6 | Very low | 166 Ų | 166 | 143.3 Ų | 143.3 | 89% | 0.888 | 77% | 0.771 | S | S | * | * | trans | -56.8 | 128.3 | 145.3 | -83.3 | -46.1 | 0 | 0 | 0 | 107.6 | ||||
| 12 | R | 35.8 | Very low | 45.9 | Very low | 213 Ų | 213 | 133.8 Ų | 133.8 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | trans | -128.1 | 89.4 | 176.5 | -147.7 | 179.7 | -160.9 | -151.9 | 2.1 | 109.9 | R10 I14 | R10-R12 PolarHBondContact O-N 2.84Å; R12-I14 PolarHBondContact O-N 2.71Å | ||
| 13 | V | 40.9 | Very low | 47 | Very low | 131 Ų | 131 | 134.6 Ų | 134.6 | 79% | 0.794 | 72% | 0.724 | S | S | * | * | trans | -57.3 | 127.6 | 164 | 176.5 | 0 | 0 | 0 | 0 | 107.6 | Q15 | V13-Q15 PolarHBondContact O-N 2.77Š| ||
| 14 | I | 41.8 | Very low | 47.4 | Very low | 143 Ų | 143 | 134.1 Ų | 134.1 | 73% | 0.733 | 71% | 0.713 | S | S | * | * | trans | -82.1 | 105.1 | 177.3 | -56.3 | 176.9 | 0 | 0 | 0 | 107.7 | R12 L16 | R12-I14 PolarHBondContact O-N 2.71Å; I14-L16 HydrophobicContact CG2-CD1 4.04Å | ||
| 15 | Q | 45 | Very low | 48.8 | Very low | 185 Ų | 185 | 133.1 Ų | 133.1 | 86% | 0.864 | 70% | 0.696 | S | S | * | * | trans | -80.5 | 113 | 158.2 | -68 | -176.3 | -93.2 | 0 | 0 | 107.5 | V13 | V13-Q15 PolarHBondContact O-N 2.77Š| ||
| 16 | L | 40.4 | Very low | 49.8 | Very low | 130 Ų | 130 | 133.1 Ų | 133.1 | 68% | 0.681 | 69% | 0.689 | S | S | * | * | trans | -66.4 | 155 | 163.5 | -84 | 85.1 | 0 | 0 | 0 | 109.8 | I14 | I14-L16 HydrophobicContact CG2-CD1 4.04Š| ||
| 17 | S | 48 | Very low | 51.1 | Low | 61 Ų | 61 | 131 Ų | 131 | 43% | 0.427 | 67% | 0.674 | S | S | . | * | trans | -83.7 | 145.8 | -179.9 | 72.7 | 0 | 0 | 0 | 0 | 111 | S19 E20 | S17-S19 PolarHBondContact O-N 3.33Å; S17-S19 VanDerWaalsContact O-N 3.16Å; S17-E20 WeakPolarHBondContact CB-OE2 3.4Å; S17-E20 PolarHBondContact N-OE2 2.83Å; S17-E20 PolarHBondContact O-N 2.82Å; S17-E20 PolarHBondContact OG-OE2 3.34Å | ||
| 18 | T | 48.7 | Very low | 52.3 | Low | 130 Ų | 130 | 129 Ų | 129 | 80% | 0.798 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -67.8 | -13 | -177.1 | 41.1 | 0 | 0 | 0 | 0 | 114.1 | ||
| 19 | S | 51.1 | Low | 53.8 | Low | 81 Ų | 81 | 125.3 Ų | 125.3 | 57% | 0.566 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -69.2 | -44.9 | 173.6 | -65.4 | 0 | 0 | 0 | 0 | 112.5 | S17 L21 G22 E23 | S17-S19 PolarHBondContact O-N 3.33Å; S17-S19 VanDerWaalsContact O-N 3.16Å; S19-L21 PolarHBondContact O-N 3.5Å; S19-G22 PolarHBondContact O-N 2.97Å; S19-E23 PolarHBondContact O-N 2.97Å; S19-E23 VanDerWaalsContact O-N 3.15Å |
| 20 | E | 52.8 | Low | 55 | Low | 96 Ų | 96 | 126 Ų | 126 | 45% | 0.449 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -62 | -31.8 | -176.3 | -65.5 | 163.2 | 111 | 0 | 0 | 112 | S17 M24 | S17-E20 WeakPolarHBondContact CB-OE2 3.4Å; S17-E20 PolarHBondContact N-OE2 2.83Å; S17-E20 PolarHBondContact O-N 2.82Å; S17-E20 PolarHBondContact OG-OE2 3.34Å; E20-M24 WeakPolarHBondContact O-CB 3.3Å; E20-M24 PolarHBondContact O-N 2.9Å |
| 21 | L | 55.4 | Low | 56.6 | Low | 127 Ų | 127 | 119.7 Ų | 119.7 | 67% | 0.665 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -69.2 | -37.8 | 174.9 | -164.6 | 75.7 | 0 | 0 | 0 | 112.4 | S19 M24 E25 | S19-L21 PolarHBondContact O-N 3.5Å; L21-M24 PolarHBondContact O-N 3.44Å; L21-E25 PolarHBondContact O-N 3.07Å; L21-E25 VanDerWaalsContact O-N 3.09Å |
| 22 | G | 62.6 | Low | 57.3 | Low | 36 Ų | 36 | 118 Ų | 118 | 37% | 0.371 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72 | -38 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S19 M24 L26 | S19-G22 PolarHBondContact O-N 2.97Å; G22-M24 VanDerWaalsContact C-N 3.35Å; G22-L26 WeakPolarHBondContact O-CG 3.21Å; G22-L26 PolarHBondContact O-N 2.97Å; G22-L26 VanDerWaalsContact O-N 3.12Å |
| 23 | E | 65.8 | Low | 58.2 | Low | 135 Ų | 135 | 111 Ų | 111 | 63% | 0.631 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.6 | -39.4 | 173.1 | -68.2 | 178.2 | -167.9 | 0 | 0 | 111.2 | S19 L26 T27 | S19-E23 PolarHBondContact O-N 2.97Å; S19-E23 VanDerWaalsContact O-N 3.15Å; E23-L26 PolarHBondContact O-N 3.44Å; E23-T27 WeakPolarHBondContact O-CG2 3.38Å; E23-T27 PolarHBondContact O-N 2.85Å; E23-T27 VanDerWaalsContact O-N 3.07Å |
| 24 | M | 60.9 | Low | 58.8 | Low | 107 Ų | 107 | 110.2 Ų | 110.2 | 53% | 0.527 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.2 | -46.6 | 176.5 | -159.9 | 177.7 | -55.2 | 0 | 0 | 112.2 | E20 L21 G22 L26 T27 W28 | E20-M24 WeakPolarHBondContact O-CB 3.3Å; E20-M24 PolarHBondContact O-N 2.9Å; L21-M24 PolarHBondContact O-N 3.44Å; G22-M24 VanDerWaalsContact C-N 3.35Å; M24-L26 VanDerWaalsContact C-N 3.34Å; M24-L26 PolarHBondContact O-N 3.38Å; M24-T27 PolarHBondContact O-N 3.44Å; M24-T27 PolarHBondContact O-OG1 3.25Å; M24-W28 VanDerWaalsContact O-CD1 3.25Å; M24-W28 PolarHBondContact O-N 3.13Å; M24-W28 VanDerWaalsContact O-N 3.09Å |
| 25 | E | 71.7 | Confident | 59.4 | Low | 107 Ų | 107 | 108.3 Ų | 108.3 | 50% | 0.5 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -58.8 | -42.6 | 175.7 | -177.7 | 62.9 | -152.5 | 0 | 0 | 112 | L21 T27 W28 Q29 | L21-E25 PolarHBondContact O-N 3.07Å; L21-E25 VanDerWaalsContact O-N 3.09Å; E25-T27 PolarHBondContact O-N 3.2Å; E25-W28 PolarHBondContact O-N 3.28Å; E25-Q29 WeakPolarHBondContact O-CG 3.46Å; E25-Q29 PolarHBondContact O-N 2.91Å; E25-Q29 PolarHBondContact OE1-NE2 3.47Å |
| 26 | L | 69.1 | Low | 59.6 | Low | 115 Ų | 115 | 107.7 Ų | 107.7 | 60% | 0.602 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.6 | -44.4 | 175.9 | -77.9 | 165.1 | 0 | 0 | 0 | 112.2 | G22 E23 M24 W28 Q29 E30 | G22-L26 WeakPolarHBondContact O-CG 3.21Å; G22-L26 PolarHBondContact O-N 2.97Å; G22-L26 VanDerWaalsContact O-N 3.12Å; E23-L26 PolarHBondContact O-N 3.44Å; M24-L26 VanDerWaalsContact C-N 3.34Å; M24-L26 PolarHBondContact O-N 3.38Å; L26-W28 VanDerWaalsContact C-N 3.33Å; L26-W28 PolarHBondContact O-N 2.81Å; L26-Q29 PolarHBondContact O-N 3.38Å; L26-E30 PolarHBondContact O-N 3.26Å |
| 27 | T | 73.6 | Confident | 60.1 | Low | 69 Ų | 69 | 108.8 Ų | 108.8 | 42% | 0.423 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.6 | -34.3 | 177.4 | 59.6 | 0 | 0 | 0 | 0 | 113 | E23 M24 E25 E30 I31 | E23-T27 WeakPolarHBondContact O-CG2 3.38Å; E23-T27 PolarHBondContact O-N 2.85Å; E23-T27 VanDerWaalsContact O-N 3.07Å; M24-T27 PolarHBondContact O-N 3.44Å; M24-T27 PolarHBondContact O-OG1 3.25Å; E25-T27 PolarHBondContact O-N 3.2Å; T27-E30 PolarHBondContact O-N 2.97Å; T27-I31 WeakPolarHBondContact O-CD1 3.48Å; T27-I31 VanDerWaalsContact O-CG1 3.26Å; T27-I31 WeakPolarHBondContact O-CG1 3.5Å; T27-I31 PolarHBondContact O-N 3.13Å |
| 28 | W | 69.1 | Low | 60.1 | Low | 151 Ų | 151 | 114 Ų | 114 | 57% | 0.572 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.7 | -38.8 | 174.2 | -80.1 | 114.5 | 0 | 0 | 0 | 112.6 | M24 E25 L26 I31 M32 | M24-W28 VanDerWaalsContact O-CD1 3.25Å; M24-W28 PolarHBondContact O-N 3.13Å; M24-W28 VanDerWaalsContact O-N 3.09Å; E25-W28 PolarHBondContact O-N 3.28Å; L26-W28 VanDerWaalsContact C-N 3.33Å; L26-W28 PolarHBondContact O-N 2.81Å; W28-I31 HydrophobicContact CE3-CD1 4.23Å; W28-I31 HydrophobicContact CZ3-CD1 4.43Å; W28-I31 PolarHBondContact O-N 2.95Å; W28-M32 WeakPolarHBondContact O-CG 3.4Å; W28-M32 PolarHBondContact O-N 2.94Å |
| 29 | Q | 70.1 | Confident | 60.1 | Low | 111 Ų | 111 | 111.7 Ų | 111.7 | 52% | 0.519 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -66.5 | -38.2 | 174.3 | -70.5 | -179.6 | 10.3 | 0 | 0 | 112.1 | E25 L26 M32 S33 | E25-Q29 WeakPolarHBondContact O-CG 3.46Å; E25-Q29 PolarHBondContact O-N 2.91Å; E25-Q29 PolarHBondContact OE1-NE2 3.47Å; L26-Q29 PolarHBondContact O-N 3.38Å; Q29-M32 PolarHBondContact O-N 3.01Å; Q29-S33 PolarHBondContact O-N 2.89Å |
| 30 | E | 71.4 | Confident | 59.5 | Low | 130 Ų | 130 | 115.8 Ų | 115.8 | 61% | 0.607 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -61.4 | -47.3 | 172.8 | -172.3 | 171.5 | -160 | 0 | 0 | 111.2 | L26 T27 M32 S33 I34 | L26-E30 PolarHBondContact O-N 3.26Å; T27-E30 PolarHBondContact O-N 2.97Å; E30-M32 PolarHBondContact O-N 2.84Å; E30-S33 PolarHBondContact O-N 2.86Å; E30-S33 PolarHBondContact O-OG 3.38Å; E30-I34 HydrophobicContact CG-CD1 4.4Å; E30-I34 WeakPolarHBondContact O-CG1 3.3Å; E30-I34 PolarHBondContact O-N 2.95Å |
| 31 | I | 69.5 | Low | 58.9 | Low | 89 Ų | 89 | 118.7 Ų | 118.7 | 46% | 0.456 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -58.2 | -45.7 | 176.5 | -71.1 | 164.5 | 0 | 0 | 0 | 111.8 | T27 W28 S33 I34 | T27-I31 WeakPolarHBondContact O-CD1 3.48Å; T27-I31 VanDerWaalsContact O-CG1 3.26Å; T27-I31 WeakPolarHBondContact O-CG1 3.5Å; T27-I31 PolarHBondContact O-N 3.13Å; W28-I31 HydrophobicContact CE3-CD1 4.23Å; W28-I31 HydrophobicContact CZ3-CD1 4.43Å; W28-I31 PolarHBondContact O-N 2.95Å; I31-S33 VanDerWaalsContact C-N 3.33Å; I31-S33 PolarHBondContact O-N 3.49Å; I31-I34 PolarHBondContact O-N 2.84Å |
| 32 | M | 59.5 | Low | 57.9 | Low | 132 Ų | 132 | 116.9 Ų | 116.9 | 65% | 0.65 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.7 | -35.7 | 178.7 | -70.6 | -129.9 | 67.1 | 0 | 0 | 112.7 | W28 Q29 E30 I34 T35 | W28-M32 WeakPolarHBondContact O-CG 3.4Å; W28-M32 PolarHBondContact O-N 2.94Å; Q29-M32 PolarHBondContact O-N 3.01Å; E30-M32 PolarHBondContact O-N 2.84Å; M32-I34 VanDerWaalsContact C-N 3.27Å; M32-I34 PolarHBondContact O-N 2.74Å; M32-T35 PolarHBondContact O-N 2.97Å; M32-T35 PolarHBondContact O-OG1 3.14Å |
| 33 | S | 54.6 | Low | 57 | Low | 65 Ų | 65 | 121.1 Ų | 121.1 | 46% | 0.455 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -64.7 | -30 | 177.4 | 79.7 | 0 | 0 | 0 | 0 | 113.4 | Q29 E30 I31 T35 | Q29-S33 PolarHBondContact O-N 2.89Å; E30-S33 PolarHBondContact O-N 2.86Å; E30-S33 PolarHBondContact O-OG 3.38Å; I31-S33 VanDerWaalsContact C-N 3.33Å; I31-S33 PolarHBondContact O-N 3.49Å; S33-T35 VanDerWaalsContact C-N 3.34Å |
| 34 | I | 53.5 | Low | 55.5 | Low | 115 Ų | 115 | 120.5 Ų | 120.5 | 59% | 0.59 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -72 | -29.5 | -179.2 | -67 | 163.6 | 0 | 0 | 0 | 111.4 | E30 I31 M32 E36 | E30-I34 HydrophobicContact CG-CD1 4.4Å; E30-I34 WeakPolarHBondContact O-CG1 3.3Å; E30-I34 PolarHBondContact O-N 2.95Å; I31-I34 PolarHBondContact O-N 2.84Å; M32-I34 VanDerWaalsContact C-N 3.27Å; M32-I34 PolarHBondContact O-N 2.74Å; I34-E36 PolarHBondContact O-N 2.79Å |
| 35 | T | 54.1 | Low | 54.2 | Low | 103 Ų | 103 | 124.2 Ų | 124.2 | 63% | 0.632 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -72.5 | -17.5 | -179.5 | 27.8 | 0 | 0 | 0 | 0 | 115.5 | M32 S33 L37 | M32-T35 PolarHBondContact O-N 2.97Å; M32-T35 PolarHBondContact O-OG1 3.14Å; S33-T35 VanDerWaalsContact C-N 3.34Å; T35-L37 PolarHBondContact O-N 2.74Å |
| 36 | E | 49.1 | Very low | 53 | Low | 171 Ų | 171 | 124.1 Ų | 124.1 | 80% | 0.799 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -9.1 | -176.3 | -63.3 | -162.3 | 130.7 | 0 | 0 | 114.6 | I34 | I34-E36 PolarHBondContact O-N 2.79Š|
| 37 | L | 51.7 | Low | 51 | Low | 153 Ų | 153 | 124 Ų | 124 | 80% | 0.801 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.4 | 22.8 | -168.2 | -71.2 | 172.7 | 0 | 0 | 0 | 116.1 | T35 | T35-L37 PolarHBondContact O-N 2.74Š|
| 38 | Q | 48.3 | Very low | 48.9 | Very low | 171 Ų | 171 | 130.5 Ų | 130.5 | 80% | 0.799 | 72% | 0.717 | S | S | * | * | trans | -121.3 | 61.4 | 173.5 | -64.8 | -162.9 | 19.5 | 0 | 0 | 113.9 | L40 | Q38-L40 PolarHBondContact O-N 2.8Š| ||
| 39 | G | 48.5 | Very low | 47.1 | Very low | 81 Ų | 81 | 129.7 Ų | 129.7 | 84% | 0.835 | 72% | 0.72 | S | S | * | * | trans | -71.4 | 84.7 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 40 | L | 38.2 | Very low | 45.7 | Very low | 167 Ų | 167 | 130.5 Ų | 130.5 | 87% | 0.874 | 74% | 0.735 | S | S | * | * | trans | -94.5 | 97.8 | 166.9 | -72.7 | 178.6 | 0 | 0 | 0 | 110.6 | Q38 | Q38-L40 PolarHBondContact O-N 2.8Š| ||
| 41 | N | 41 | Very low | 43.7 | Very low | 157 Ų | 157 | 131.9 Ų | 131.9 | 84% | 0.84 | 74% | 0.741 | S | S | * | * | trans | -95.1 | 125.5 | 178.3 | -172.6 | -9.5 | 0 | 0 | 0 | 110.7 | ||||
| 42 | A | 34.6 | Very low | 42.2 | Very low | 89 Ų | 89 | 131.7 Ų | 131.7 | 74% | 0.736 | 75% | 0.753 | S | S | * | * | trans | -140 | 132.4 | 175 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 43 | P | 43.8 | Very low | 41.4 | Very low | 126 Ų | 126 | 131.5 Ų | 131.5 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -102.4 | 139.7 | -160.2 | 36.9 | -35.3 | 0 | 0 | 0 | 116.1 | ||||
| 44 | S | 33.8 | Very low | 40.4 | Very low | 121 Ų | 121 | 132.5 Ų | 132.5 | 85% | 0.846 | 77% | 0.774 | S | S | * | * | trans | -160.4 | 124.4 | 151.9 | 58 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 45 | E | 32.8 | Very low | 39.4 | Very low | 186 Ų | 186 | 133 Ų | 133 | 87% | 0.869 | 79% | 0.788 | S | S | * | * | trans | -86.1 | 179.8 | 177.8 | -84.7 | -161.9 | 154 | 0 | 0 | 113.2 | ||||
| 46 | P | 47.2 | Very low | 38.5 | Very low | 104 Ų | 104 | 138.1 Ų | 138.1 | 68% | 0.675 | 80% | 0.797 | S | S | * | * | cis | -138.8 | 170.8 | -44.1 | 38.2 | -23.2 | 0 | 0 | 0 | 113.3 | ||||
| 47 | S | 26.8 | Very low | 37.9 | Very low | 114 Ų | 114 | 137.8 Ų | 137.8 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -171.2 | 136 | 143.2 | -88.5 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 48 | F | 30 | Very low | 37 | Very low | 204 Ų | 204 | 133.9 Ų | 133.9 | 90% | 0.895 | 80% | 0.797 | S | S | * | * | trans | 65.6 | 98.3 | 158.1 | -87 | -86.9 | 0 | 0 | 0 | 122.1 | ||||
| 49 | E | 31.8 | Very low | 36.9 | Very low | 135 Ų | 135 | 131.5 Ų | 131.5 | 63% | 0.631 | 80% | 0.796 | S | S | * | * | trans | -63.8 | 147.8 | 157.8 | 158.7 | 177.8 | -154.6 | 0 | 0 | 112.8 | Q51 | E49-Q51 VanDerWaalsContact OE1-CG 3.29Å; E49-Q51 WeakPolarHBondContact OE1-CG 3.2Å; E49-Q51 PolarHBondContact OE1-NE2 3.11Å | ||
| 50 | P | 39.3 | Very low | 36.9 | Very low | 127 Ų | 127 | 133.6 Ų | 133.6 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | -127.8 | 138.5 | 106.1 | 1.6 | 20 | 0 | 0 | 0 | 116.5 | |||||
| 51 | Q | 30.2 | Very low | 37.5 | Very low | 159 Ų | 159 | 131 Ų | 131 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | trans | -43.8 | 163.2 | 156.9 | -90.4 | 164 | 34.9 | 0 | 0 | 115.3 | E49 | E49-Q51 VanDerWaalsContact OE1-CG 3.29Å; E49-Q51 WeakPolarHBondContact OE1-CG 3.2Å; E49-Q51 PolarHBondContact OE1-NE2 3.11Å | ||
| 52 | A | 38.1 | Very low | 37 | Very low | 85 Ų | 85 | 131.8 Ų | 131.8 | 70% | 0.702 | 79% | 0.786 | S | S | * | * | cis | -170.4 | -168.7 | 6 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 53 | P | 42.6 | Very low | 37.2 | Very low | 128 Ų | 128 | 133.5 Ų | 133.5 | 83% | 0.831 | 79% | 0.788 | S | S | * | * | cis | -124.2 | -178.6 | -7.5 | 40.2 | -23.6 | 0 | 0 | 0 | 114.5 | ||||
| 54 | A | 33.2 | Very low | 36.5 | Very low | 86 Ų | 86 | 133.4 Ų | 133.4 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | -97 | 165.3 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 55 | S | 33.6 | Very low | 36.6 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | -136.7 | 152.6 | 159.4 | -78.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 56 | Y | 34.5 | Very low | 36.7 | Very low | 210 Ų | 210 | 134.7 Ų | 134.7 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | -116.8 | 148.5 | -159.1 | -100.2 | -82.4 | 0 | 0 | 0 | 115.3 | ||||
| 57 | L | 35.4 | Very low | 36.9 | Very low | 164 Ų | 164 | 135.5 Ų | 135.5 | 86% | 0.859 | 79% | 0.785 | S | S | * | * | trans | 63.4 | 132.4 | 147 | -81.9 | 156 | 0 | 0 | 0 | 122.1 | ||||
| 58 | G | 33.5 | Very low | 37.2 | Very low | 71 Ų | 71 | 135.7 Ų | 135.7 | 73% | 0.732 | 79% | 0.786 | S | S | * | * | trans | 170.3 | 108.6 | 160 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 59 | P | 46.4 | Very low | 37.5 | Very low | 121 Ų | 121 | 130.5 Ų | 130.5 | 79% | 0.786 | 78% | 0.775 | S | S | * | * | trans | -95.6 | 164.4 | -179.7 | 36.5 | -34.3 | 0 | 0 | 0 | 114.8 | ||||
| 60 | P | 49.3 | Very low | 37.7 | Very low | 124 Ų | 124 | 131.2 Ų | 131.2 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | trans | -99.1 | 165.5 | -169.9 | 38.7 | -37.2 | 0 | 0 | 0 | 115.6 | ||||
| 61 | P | 50.8 | Low | 37.3 | Very low | 113 Ų | 113 | 133.2 Ų | 133.2 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -127.1 | 124.6 | 167.1 | 36.4 | -21.6 | 0 | 0 | 0 | 116.6 | ||||
| 62 | H | 29.6 | Very low | 38.5 | Very low | 173 Ų | 173 | 130.6 Ų | 130.6 | 80% | 0.801 | 78% | 0.776 | S | S | * | * | trans | 51 | 114.7 | 136.6 | -61.2 | -71.9 | 0 | 0 | 0 | 124.5 | ||||
| 63 | T | 38.2 | Very low | 38.2 | Very low | 126 Ų | 126 | 133.5 Ų | 133.5 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | trans | -11.7 | 141 | 136.2 | 52 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 64 | T | 30.2 | Very low | 37.9 | Very low | 124 Ų | 124 | 132 Ų | 132 | 76% | 0.761 | 78% | 0.778 | S | S | * | * | trans | -154.5 | 144.9 | 149.3 | 1.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 65 | Y | 34.3 | Very low | 37.8 | Very low | 226 Ų | 226 | 131.3 Ų | 131.3 | 89% | 0.886 | 78% | 0.78 | S | S | * | * | trans | 72.7 | 147 | 156.5 | -82.6 | -72.2 | 0 | 0 | 0 | 124.1 | ||||
| 66 | C | 36 | Very low | 38 | Very low | 108 Ų | 108 | 134.7 Ų | 134.7 | 73% | 0.73 | 78% | 0.779 | S | S | * | * | trans | -152 | 155.7 | 179.3 | 173.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 67 | P | 50.5 | Low | 38.6 | Very low | 120 Ų | 120 | 130.8 Ų | 130.8 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | trans | -137.2 | 147.1 | 157.8 | 34.1 | -17.5 | 0 | 0 | 0 | 117.8 | ||||
| 68 | C | 33.4 | Very low | 38.7 | Very low | 119 Ų | 119 | 130.8 Ų | 130.8 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | trans | -52.8 | 175.6 | 161.9 | -61.3 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 69 | S | 37.5 | Very low | 40 | Very low | 95 Ų | 95 | 132.4 Ų | 132.4 | 66% | 0.664 | 78% | 0.777 | S | S | * | * | cis | 177.2 | 157.6 | -19.9 | -87.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 70 | I | 35.7 | Very low | 40.2 | Very low | 149 Ų | 149 | 132.2 Ų | 132.2 | 76% | 0.764 | 78% | 0.775 | S | S | * | * | trans | 79 | 117 | 139.3 | -74.5 | 163.2 | 0 | 0 | 0 | 123.2 | ||||
| 71 | H | 30.9 | Very low | 40.5 | Very low | 169 Ų | 169 | 132.1 Ų | 132.1 | 78% | 0.782 | 78% | 0.775 | S | S | * | * | trans | 57.1 | 167.4 | 142.4 | -91.3 | -91.9 | 0 | 0 | 0 | 123.3 | ||||
| 72 | P | 54.3 | Low | 40.5 | Very low | 104 Ų | 104 | 131.8 Ų | 131.8 | 68% | 0.675 | 77% | 0.773 | S | S | * | * | cis | -129.9 | -153 | -10.6 | 44.6 | -26.6 | 0 | 0 | 0 | 112.3 | ||||
| 73 | D | 33.2 | Very low | 40.8 | Very low | 146 Ų | 146 | 133.8 Ų | 133.8 | 78% | 0.781 | 78% | 0.775 | S | S | * | * | cis | -160.2 | 172.8 | -10.9 | -135.9 | -42.2 | 0 | 0 | 0 | 114 | ||||
| 74 | A | 34.5 | Very low | 40.6 | Very low | 96 Ų | 96 | 135.9 Ų | 135.9 | 79% | 0.793 | 78% | 0.776 | S | S | * | * | trans | 43.6 | 134.5 | 146.1 | 0 | 0 | 0 | 0 | 0 | 126.1 | ||||
| 75 | G | 31.3 | Very low | 40.9 | Very low | 73 Ų | 73 | 137.3 Ų | 137.3 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | 152.4 | 117.5 | 147.4 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 76 | F | 38.5 | Very low | 41.3 | Very low | 198 Ų | 198 | 132.5 Ų | 132.5 | 87% | 0.868 | 77% | 0.774 | S | S | * | * | trans | -154.5 | 146 | 168.5 | -104.2 | -70.5 | 0 | 0 | 0 | 111.2 | ||||
| 77 | P | 47.6 | Very low | 40.8 | Very low | 127 Ų | 127 | 131.7 Ų | 131.7 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | -145.2 | -160.8 | 117.5 | 35 | -15.7 | 0 | 0 | 0 | 115 | |||||
| 78 | L | 36.6 | Very low | 40 | Very low | 164 Ų | 164 | 130.7 Ų | 130.7 | 86% | 0.859 | 77% | 0.771 | S | S | * | * | trans | -124.1 | 177.1 | -153.6 | -86.6 | 170.8 | 0 | 0 | 0 | 115.6 | ||||
| 79 | P | 61.5 | Low | 39.8 | Very low | 106 Ų | 106 | 131 Ų | 131 | 69% | 0.688 | 77% | 0.77 | S | S | * | * | trans | -100.5 | -173.7 | -157.1 | 42.5 | -39.7 | 0 | 0 | 0 | 115.7 | ||||
| 80 | P | 51 | Low | 39.5 | Very low | 116 Ų | 116 | 131.4 Ų | 131.4 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | -153.9 | -158.8 | 104.7 | 39.3 | -16.7 | 0 | 0 | 0 | 114.5 | |||||
| 81 | P | 55.4 | Low | 39.3 | Very low | 122 Ų | 122 | 132.5 Ų | 132.5 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | -129.7 | -135.3 | -73.8 | 48 | -30 | 0 | 0 | 0 | 114.1 | |||||
| 82 | P | 51.1 | Low | 39.5 | Very low | 107 Ų | 107 | 130.3 Ų | 130.3 | 70% | 0.695 | 77% | 0.772 | S | S | * | * | trans | -125.6 | -174.1 | -141.4 | 40.5 | -17.5 | 0 | 0 | 0 | 117 | ||||
| 83 | Y | 34.8 | Very low | 39 | Very low | 215 Ų | 215 | 131 Ų | 131 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | 162.1 | 157.4 | 155.9 | -88.6 | -57 | 0 | 0 | 0 | 108.7 | ||||
| 84 | E | 34 | Very low | 38.7 | Very low | 169 Ų | 169 | 131.3 Ų | 131.3 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | cis | -155.8 | 174.4 | -24.9 | -156.8 | 164.4 | -124.9 | 0 | 0 | 109 | ||||
| 85 | L | 36.7 | Very low | 38.7 | Very low | 155 Ų | 155 | 131.2 Ų | 131.2 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | trans | -100.2 | 158.2 | 173.4 | -87.3 | 168.7 | 0 | 0 | 0 | 112.2 | ||||
| 86 | P | 42.1 | Very low | 39.4 | Very low | 124 Ų | 124 | 133.6 Ų | 133.6 | 81% | 0.805 | 78% | 0.78 | S | S | * | * | -139.2 | 161.4 | 125.5 | 37.2 | -25.6 | 0 | 0 | 0 | 115.4 | |||||
| 87 | A | 27 | Very low | 39 | Very low | 92 Ų | 92 | 134.9 Ų | 134.9 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | trans | -103.5 | 179.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 88 | S | 33 | Very low | 38.3 | Very low | 99 Ų | 99 | 134.5 Ų | 134.5 | 69% | 0.692 | 78% | 0.78 | S | S | * | * | cis | -153.5 | 177 | 7 | -82.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 89 | T | 29.9 | Very low | 38 | Very low | 126 Ų | 126 | 137.4 Ų | 137.4 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | 167 | 154.6 | 81.7 | 40.1 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 90 | S | 31.1 | Very low | 36.5 | Very low | 102 Ų | 102 | 135.2 Ų | 135.2 | 71% | 0.713 | 78% | 0.779 | S | S | * | * | trans | 50.2 | 125.1 | 157.8 | 49.5 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 91 | H | 31.3 | Very low | 35.6 | Very low | 173 Ų | 173 | 137.3 Ų | 137.3 | 80% | 0.801 | 78% | 0.784 | S | S | * | * | 69.5 | 107.6 | 62.2 | -85.2 | -92.9 | 0 | 0 | 0 | 115.5 | |||||
| 92 | V | 33.8 | Very low | 34.6 | Very low | 122 Ų | 122 | 140.6 Ų | 140.6 | 74% | 0.739 | 79% | 0.79 | S | S | * | * | 86.7 | 144.8 | 80.3 | 158.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 93 | P | 44.8 | Very low | 33.7 | Very low | 118 Ų | 118 | 141.5 Ų | 141.5 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | cis | -133.6 | -163.7 | 18 | 38.9 | -16.8 | 0 | 0 | 0 | 117.4 | ||||
| 94 | D | 27.5 | Very low | 34 | Very low | 154 Ų | 154 | 138.8 Ų | 138.8 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | -107.4 | 172.3 | -169.4 | -48.9 | -91.1 | 0 | 0 | 0 | 118.6 | ||||
| 95 | A | 33 | Very low | 34 | Very low | 94 Ų | 94 | 136.4 Ų | 136.4 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | trans | 74 | 168.6 | 145.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 96 | P | 46.7 | Very low | 33.7 | Very low | 123 Ų | 123 | 135.4 Ų | 135.4 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | cis | -137.7 | -167.6 | 9 | 45.1 | -26 | 0 | 0 | 0 | 117.8 | ||||
| 97 | Y | 30.2 | Very low | 33.5 | Very low | 225 Ų | 225 | 135 Ų | 135 | 88% | 0.882 | 79% | 0.792 | S | S | * | * | trans | -65.7 | 167.2 | -176.7 | -73 | -101.1 | 0 | 0 | 0 | 117.5 | ||||
| 98 | S | 31.8 | Very low | 34 | Very low | 118 Ų | 118 | 139.5 Ų | 139.5 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -136.4 | 163.7 | 158 | -169.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 99 | Y | 31 | Very low | 34.3 | Very low | 225 Ų | 225 | 141 Ų | 141 | 88% | 0.882 | 80% | 0.802 | S | S | * | * | trans | -147.9 | 150.7 | -169.7 | -131 | -87.8 | 0 | 0 | 0 | 112 | ||||
| 100 | G | 30.4 | Very low | 34.8 | Very low | 61 Ų | 61 | 142.6 Ų | 142.6 | 63% | 0.629 | 81% | 0.805 | S | S | * | * | trans | 101.6 | 152.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 101 | N | 31.5 | Very low | 35.4 | Very low | 160 Ų | 160 | 142 Ų | 142 | 86% | 0.856 | 80% | 0.8 | S | S | * | * | cis | -141.5 | 158 | 2.6 | -79.2 | -33.8 | 0 | 0 | 0 | 110.8 | ||||
| 102 | M | 35.7 | Very low | 35.9 | Very low | 190 Ų | 190 | 140.6 Ų | 140.6 | 94% | 0.936 | 80% | 0.798 | S | S | * | * | trans | -79.6 | 138.9 | 163.3 | -95.4 | -167 | 167.7 | 0 | 0 | 111.3 | ||||
| 103 | T | 32.1 | Very low | 36.3 | Very low | 127 Ų | 127 | 139.3 Ų | 139.3 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | trans | -130.9 | 121.5 | 167.7 | 49.5 | 0 | 0 | 0 | 0 | 109.8 | P105 | T103-P105 WeakPolarHBondContact O-CD 3.06Š| ||
| 104 | I | 39.6 | Very low | 36 | Very low | 158 Ų | 158 | 135.8 Ų | 135.8 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 118.2 | 178.6 | -58.8 | 171.1 | 0 | 0 | 0 | 108.8 | ||
| 105 | P | 34.1 | Very low | 37 | Very low | 119 Ų | 119 | 135 Ų | 135 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 130 | 169.3 | 30.6 | -31.7 | 0 | 0 | 0 | 110.5 | T103 | T103-P105 WeakPolarHBondContact O-CD 3.06Š|
| 106 | V | 32.2 | Very low | 37.6 | Very low | 133 Ų | 133 | 137.6 Ų | 137.6 | 81% | 0.806 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 131.7 | 177.3 | 170.2 | 0 | 0 | 0 | 0 | 110.7 | ||
| 107 | S | 37.6 | Very low | 37.4 | Very low | 117 Ų | 117 | 136.8 Ų | 136.8 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 130.6 | 175.6 | 25.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 108 | K | 37.2 | Very low | 37.6 | Very low | 185 Ų | 185 | 133.6 Ų | 133.6 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | trans | -106.5 | 148.8 | 165.5 | -71.6 | 178.3 | 179.5 | 174.3 | 0 | 108.9 | L110 | K108-L110 PolarHBondContact O-N 2.96Š| ||
| 109 | P | 39.4 | Very low | 37.8 | Very low | 130 Ų | 130 | 133.2 Ų | 133.2 | 84% | 0.844 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 129.1 | 177.9 | 27.7 | -34 | 0 | 0 | 0 | 110.6 | ||
| 110 | L | 39.5 | Very low | 38.4 | Very low | 161 Ų | 161 | 129.7 Ų | 129.7 | 84% | 0.843 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 134 | 175.2 | -73.4 | 162.6 | 0 | 0 | 0 | 109.9 | K108 | K108-L110 PolarHBondContact O-N 2.96Š|
| 111 | S | 44.1 | Very low | 39.1 | Very low | 88 Ų | 88 | 134.8 Ų | 134.8 | 62% | 0.615 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -103 | 150.7 | 173.9 | -175.7 | 0 | 0 | 0 | 0 | 110.1 | S113 G114 | S111-S113 PolarHBondContact O-N 3Å; S111-G114 PolarHBondContact O-N 3.22Å |
| 112 | L | 41.8 | Very low | 39.3 | Very low | 144 Ų | 144 | 132 Ų | 132 | 75% | 0.754 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -53 | -29.9 | -173.1 | -90 | 161.9 | 0 | 0 | 0 | 114.6 | G114 L115 | L112-G114 PolarHBondContact O-N 3.46Å; L112-L115 PolarHBondContact O-N 3.27Å |
| 113 | S | 42 | Very low | 39.5 | Very low | 95 Ų | 95 | 128 Ų | 128 | 66% | 0.664 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -65.9 | -17.4 | 176.7 | -49.9 | 0 | 0 | 0 | 0 | 114.4 | S111 | S111-S113 PolarHBondContact O-N 3Š|
| 114 | G | 39.1 | Very low | 39.9 | Very low | 44 Ų | 44 | 128.7 Ų | 128.7 | 45% | 0.454 | 74% | 0.735 | S | S | . | * | G | 310 helix | trans | -74.3 | -28.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | S111 L112 L116 | S111-G114 PolarHBondContact O-N 3.22Å; L112-G114 PolarHBondContact O-N 3.46Å; G114-L116 VanDerWaalsContact C-N 3.33Å; G114-L116 PolarHBondContact O-N 3.08Å |
| 115 | L | 47.5 | Very low | 39.9 | Very low | 137 Ų | 137 | 124.8 Ų | 124.8 | 72% | 0.717 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -84.3 | -3.7 | -172.9 | -64.7 | 173.7 | 0 | 0 | 0 | 114.3 | L112 | L112-L115 PolarHBondContact O-N 3.27Š|
| 116 | L | 45.4 | Very low | 40.1 | Very low | 150 Ų | 150 | 127 Ų | 127 | 79% | 0.785 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -128 | 15.2 | -170.9 | -65.9 | 173.1 | 0 | 0 | 0 | 113.4 | G114 | G114-L116 VanDerWaalsContact C-N 3.33Å; G114-L116 PolarHBondContact O-N 3.08Å |
| 117 | S | 43.1 | Very low | 40.6 | Very low | 106 Ų | 106 | 128.8 Ų | 128.8 | 74% | 0.741 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -148.2 | 6.2 | -175.7 | -63.6 | 0 | 0 | 0 | 0 | 115.4 | ||
| 118 | E | 33.6 | Very low | 40.5 | Very low | 157 Ų | 157 | 130 Ų | 130 | 73% | 0.734 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -93.9 | 127.5 | 165.6 | -159.4 | 163.6 | -155.5 | 0 | 0 | 108.3 | L120 | E118-L120 PolarHBondContact O-N 2.95Š|
| 119 | P | 37.8 | Very low | 40.7 | Very low | 110 Ų | 110 | 129 Ų | 129 | 71% | 0.714 | 73% | 0.734 | S | S | * | * | trans | -65.5 | 125.7 | 177.1 | 27.5 | -33.2 | 0 | 0 | 0 | 108.7 | Q121 | P119-Q121 PolarHBondContact O-N 3Š| ||
| 120 | L | 42.4 | Very low | 40.4 | Very low | 151 Ų | 151 | 125.7 Ų | 125.7 | 79% | 0.791 | 72% | 0.723 | S | S | * | * | trans | -59.5 | 106.8 | -175.2 | -166.2 | 145.4 | 0 | 0 | 0 | 109.6 | E118 D122 P123 | E118-L120 PolarHBondContact O-N 2.95Å; L120-D122 PolarHBondContact O-N 2.82Å; L120-P123 HydrophobicContact CD2-CG 4.06Å | ||
| 121 | Q | 44.5 | Very low | 40.2 | Very low | 168 Ų | 168 | 125.6 Ų | 125.6 | 79% | 0.785 | 72% | 0.722 | S | S | * | * | trans | -64.2 | 133 | 177.5 | -71.1 | -173.8 | -1.3 | 0 | 0 | 109 | P119 | P119-Q121 PolarHBondContact O-N 3Š| ||
| 122 | D | 36.7 | Very low | 39.9 | Very low | 101 Ų | 101 | 127.5 Ų | 127.5 | 54% | 0.54 | 73% | 0.733 | S | S | . | * | trans | -50.4 | 121 | -169.7 | -172.7 | -18 | 0 | 0 | 0 | 111.7 | L120 L124 A125 | L120-D122 PolarHBondContact O-N 2.82Å; D122-L124 PolarHBondContact O-N 2.85Å; D122-L124 WeakPolarHBondContact OD1-CB 3.4Å; D122-L124 PolarHBondContact OD1-N 3.49Å; D122-A125 WeakPolarHBondContact O-CB 3.5Å; D122-A125 PolarHBondContact O-N 3.15Å | ||
| 123 | P | 40.1 | Very low | 39.6 | Very low | 106 Ų | 106 | 127.5 Ų | 127.5 | 69% | 0.688 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | -14.7 | 178.3 | -25.5 | 35.3 | 0 | 0 | 0 | 114.6 | L120 | L120-P123 HydrophobicContact CD2-CG 4.06Š|
| 124 | L | 39.8 | Very low | 39.4 | Very low | 142 Ų | 142 | 125.6 Ų | 125.6 | 74% | 0.743 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -4.4 | 178.3 | -57 | 179.8 | 0 | 0 | 0 | 113.9 | D122 L126 | D122-L124 PolarHBondContact O-N 2.85Å; D122-L124 WeakPolarHBondContact OD1-CB 3.4Å; D122-L124 PolarHBondContact OD1-N 3.49Å; L124-L126 PolarHBondContact O-N 3.39Å |
| 125 | A | 40.3 | Very low | 39.6 | Very low | 76 Ų | 76 | 129.5 Ų | 129.5 | 63% | 0.628 | 75% | 0.751 | S | S | * | * | trans | -75.2 | 2.9 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | D122 L127 | D122-A125 WeakPolarHBondContact O-CB 3.5Å; D122-A125 PolarHBondContact O-N 3.15Å; A125-L127 PolarHBondContact O-N 3.02Å | ||
| 126 | L | 37.6 | Very low | 39.1 | Very low | 167 Ų | 167 | 129 Ų | 129 | 87% | 0.874 | 76% | 0.756 | S | S | * | * | trans | -86.9 | 27.6 | -178 | -152.7 | 109.6 | 0 | 0 | 0 | 114.2 | L124 | L124-L126 PolarHBondContact O-N 3.39Š| ||
| 127 | L | 42.8 | Very low | 38.4 | Very low | 170 Ų | 170 | 131.3 Ų | 131.3 | 89% | 0.89 | 76% | 0.76 | S | S | * | * | trans | -131.9 | 44.3 | -179.6 | -72.7 | 177.9 | 0 | 0 | 0 | 113.1 | A125 | A125-L127 PolarHBondContact O-N 3.02Š| ||
| 128 | D | 36.6 | Very low | 38.2 | Very low | 141 Ų | 141 | 132.2 Ų | 132.2 | 75% | 0.754 | 76% | 0.763 | S | S | * | * | trans | -119.6 | 94.4 | 163.3 | -169.8 | 11.4 | 0 | 0 | 0 | 111 | ||||
| 129 | I | 40.7 | Very low | 38.1 | Very low | 165 Ų | 165 | 132.4 Ų | 132.4 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | trans | -106.6 | 96.3 | 164.3 | -59.4 | -178.4 | 0 | 0 | 0 | 106.1 | L131 | I129-L131 PolarHBondContact O-N 3.38Š| ||
| 130 | G | 32.3 | Very low | 37.9 | Very low | 60 Ų | 60 | 135 Ų | 135 | 62% | 0.619 | 77% | 0.767 | S | S | * | * | trans | -59.1 | 130.7 | -165.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 131 | L | 36.2 | Very low | 37.9 | Very low | 159 Ų | 159 | 135.2 Ų | 135.2 | 83% | 0.832 | 77% | 0.769 | S | S | * | * | trans | -97.8 | 134.9 | 159.7 | -72.3 | 170.3 | 0 | 0 | 0 | 109.1 | I129 V133 | I129-L131 PolarHBondContact O-N 3.38Å; L131-V133 PolarHBondContact O-N 3.13Å; L131-V133 VanDerWaalsContact O-N 3.17Å | ||
| 132 | P | 38.6 | Very low | 38.3 | Very low | 128 Ų | 128 | 132.8 Ų | 132.8 | 83% | 0.831 | 77% | 0.768 | S | S | * | * | trans | -74.1 | 108.6 | -177.6 | 28.9 | -33.8 | 0 | 0 | 0 | 111.7 | G134 | P132-G134 PolarHBondContact O-N 3.46Š| ||
| 133 | V | 34.5 | Very low | 38.6 | Very low | 144 Ų | 144 | 136.5 Ų | 136.5 | 87% | 0.873 | 78% | 0.782 | S | S | * | * | trans | -77.2 | 113.7 | 173.3 | 175.1 | 0 | 0 | 0 | 0 | 110.5 | L131 | L131-V133 PolarHBondContact O-N 3.13Å; L131-V133 VanDerWaalsContact O-N 3.17Å | ||
| 134 | G | 38.6 | Very low | 38.7 | Very low | 56 Ų | 56 | 137.6 Ų | 137.6 | 58% | 0.577 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 156.1 | 165.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | P132 | P132-G134 PolarHBondContact O-N 3.46Š|
| 135 | P | 43 | Very low | 39 | Very low | 125 Ų | 125 | 137.9 Ų | 137.9 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 147.5 | -176.8 | 31.1 | -35.5 | 0 | 0 | 0 | 112.8 | ||
| 136 | P | 36.1 | Very low | 39.2 | Very low | 126 Ų | 126 | 139.8 Ų | 139.8 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 149.2 | -176.9 | 31.9 | -35.7 | 0 | 0 | 0 | 113.5 | ||
| 137 | K | 30.6 | Very low | 39.7 | Very low | 199 Ų | 199 | 135.1 Ų | 135.1 | 87% | 0.865 | 80% | 0.795 | S | S | * | * | trans | -126.5 | 141.4 | 153.4 | -80.4 | -173.5 | 174.9 | -178.4 | 0 | 108.6 | ||||
| 138 | P | 39.8 | Very low | 39.6 | Very low | 125 Ų | 125 | 135 Ų | 135 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -89.9 | 133 | -177.9 | 33.7 | -31.8 | 0 | 0 | 0 | 111.7 | ||||
| 139 | Q | 31.3 | Very low | 39.9 | Very low | 161 Ų | 161 | 133.4 Ų | 133.4 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | trans | -159.6 | 120.2 | 151 | -156.9 | 151.9 | -19.2 | 0 | 0 | 113.7 | ||||
| 140 | E | 32.6 | Very low | 39.9 | Very low | 164 Ų | 164 | 132.9 Ų | 132.9 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | trans | 53.4 | 121.5 | 145.9 | -66.5 | 158.4 | 177.5 | 0 | 0 | 122.2 | ||||
| 141 | D | 42.4 | Very low | 40.2 | Very low | 156 Ų | 156 | 136.2 Ų | 136.2 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -61 | 161.7 | 155.4 | -62.5 | -76.9 | 0 | 0 | 0 | 111.8 | ||||
| 142 | P | 52.9 | Low | 40.2 | Very low | 118 Ų | 118 | 139 Ų | 139 | 77% | 0.766 | 80% | 0.798 | S | S | * | * | -138.9 | 138.5 | 98 | 35.9 | -23.7 | 0 | 0 | 0 | 115.7 | |||||
| 143 | E | 44.8 | Very low | 40.7 | Very low | 178 Ų | 178 | 138.3 Ų | 138.3 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | 7.7 | 124.4 | 150.4 | -56.1 | 176 | 116.8 | 0 | 0 | 119.1 | ||||
| 144 | S | 41.9 | Very low | 40.8 | Very low | 130 Ų | 130 | 138.9 Ų | 138.9 | 91% | 0.909 | 79% | 0.793 | S | S | * | * | -165.7 | 137.1 | 126.2 | -81.9 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 145 | D | 44.4 | Very low | 40.9 | Very low | 147 Ų | 147 | 140.7 Ų | 140.7 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | trans | -59.1 | 139.2 | 177.2 | 170.7 | 31.9 | 0 | 0 | 0 | 115.3 | G147 | D145-G147 PolarHBondContact OD1-N 3.23Š| ||
| 146 | S | 45.3 | Very low | 40.7 | Very low | 117 Ų | 117 | 143.7 Ų | 143.7 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -169.6 | 79.8 | 149.4 | -81.9 | 0 | 0 | 0 | 0 | 111.2 | L148 | S146-L148 PolarHBondContact O-N 2.82Š| ||
| 147 | G | 49.3 | Very low | 40.7 | Very low | 69 Ų | 69 | 143.2 Ų | 143.2 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | -77.5 | 106.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | D145 | D145-G147 PolarHBondContact OD1-N 3.23Š| ||
| 148 | L | 39.9 | Very low | 41.5 | Very low | 168 Ų | 168 | 141.1 Ų | 141.1 | 88% | 0.88 | 80% | 0.803 | S | S | * | * | trans | -136.7 | 79.8 | 166.8 | -74.3 | 178.9 | 0 | 0 | 0 | 111.9 | S146 L150 | S146-L148 PolarHBondContact O-N 2.82Å; L148-L150 PolarHBondContact O-N 3.44Å | ||
| 149 | S | 42.3 | Very low | 41.5 | Very low | 107 Ų | 107 | 144 Ų | 144 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | trans | -80.1 | 92.9 | 174.7 | -165.2 | 0 | 0 | 0 | 0 | 111.1 | N151 | S149-N151 PolarHBondContact O-N 3.49Å; S149-N151 VanDerWaalsContact O-N 3.1Å; S149-N151 PolarHBondContact OG-OD1 3.07Å | ||
| 150 | L | 41.2 | Very low | 42.2 | Very low | 154 Ų | 154 | 144 Ų | 144 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | trans | -78.8 | 86.4 | 169.1 | -96.2 | 168.6 | 0 | 0 | 0 | 110.2 | L148 Y152 | L148-L150 PolarHBondContact O-N 3.44Å; L150-Y152 PolarHBondContact O-N 2.89Å | ||
| 151 | N | 38.3 | Very low | 42.8 | Very low | 130 Ų | 130 | 145.8 Ų | 145.8 | 70% | 0.695 | 82% | 0.819 | S | S | * | * | trans | -67.2 | 116.2 | 170.8 | -64.7 | 7.3 | 0 | 0 | 0 | 109.3 | S149 | S149-N151 PolarHBondContact O-N 3.49Å; S149-N151 VanDerWaalsContact O-N 3.1Å; S149-N151 PolarHBondContact OG-OD1 3.07Å | ||
| 152 | Y | 36.7 | Very low | 42.4 | Very low | 218 Ų | 218 | 141.5 Ų | 141.5 | 86% | 0.855 | 81% | 0.811 | S | S | * | * | trans | -123.7 | 94.5 | 162.8 | -106 | -88.3 | 0 | 0 | 0 | 108.7 | L150 | L150-Y152 PolarHBondContact O-N 2.89Š| ||
| 153 | S | 48.4 | Very low | 41.6 | Very low | 113 Ų | 113 | 141.8 Ų | 141.8 | 79% | 0.79 | 81% | 0.811 | S | S | * | * | trans | -103 | 131.2 | 162.2 | -67.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 154 | D | 37.3 | Very low | 41.4 | Very low | 155 Ų | 155 | 141.9 Ų | 141.9 | 83% | 0.829 | 81% | 0.811 | S | S | * | * | trans | 7.1 | 138 | 147.9 | -147 | 2.1 | 0 | 0 | 0 | 119.4 | ||||
| 155 | A | 40.6 | Very low | 41.4 | Very low | 94 Ų | 94 | 141 Ų | 141 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | trans | -128.4 | 118.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 156 | E | 38 | Very low | 41.2 | Very low | 189 Ų | 189 | 137.6 Ų | 137.6 | 88% | 0.883 | 81% | 0.811 | S | S | * | * | trans | -62.7 | 148.7 | -162.2 | -64.2 | 171.2 | 115.1 | 0 | 0 | 114.5 | L158 | E156-L158 PolarHBondContact O-N 3.09Š| ||
| 157 | S | 36.7 | Very low | 41.4 | Very low | 116 Ų | 116 | 144 Ų | 144 | 81% | 0.811 | 82% | 0.818 | S | S | * | * | trans | -73 | 119.3 | 169.4 | -167.8 | 0 | 0 | 0 | 0 | 109.8 | E159 | S157-E159 PolarHBondContact O-N 2.92Š| ||
| 158 | L | 47.3 | Very low | 40.8 | Very low | 154 Ų | 154 | 151.2 Ų | 151.2 | 81% | 0.806 | 82% | 0.823 | S | S | * | * | trans | -75.8 | 108.9 | -178 | -160.5 | 168 | 0 | 0 | 0 | 110.1 | E156 | E156-L158 PolarHBondContact O-N 3.09Š| ||
| 159 | E | 39.3 | Very low | 40.8 | Very low | 185 Ų | 185 | 154.2 Ų | 154.2 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | trans | -68.3 | 129.4 | 175.3 | -63.7 | -169.5 | 139.1 | 0 | 0 | 111.8 | S157 | S157-E159 PolarHBondContact O-N 2.92Š| ||
| 160 | L | 47.3 | Very low | 40.4 | Very low | 163 Ų | 163 | 153.7 Ų | 153.7 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | trans | -135.7 | 95.4 | 164.8 | -167 | 73.9 | 0 | 0 | 0 | 110 | ||||
| 161 | E | 44.5 | Very low | 40.5 | Very low | 201 Ų | 201 | 153.4 Ų | 153.4 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | trans | -74.3 | 128.3 | 171.2 | -172.9 | 174.6 | -151.9 | 0 | 0 | 109.8 | ||||
| 162 | G | 33.1 | Very low | 40.6 | Very low | 65 Ų | 65 | 157.1 Ų | 157.1 | 67% | 0.67 | 82% | 0.82 | S | S | * | * | trans | 170.9 | 74.6 | -173 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 163 | T | 37.9 | Very low | 40.9 | Very low | 125 Ų | 125 | 153 Ų | 153 | 77% | 0.767 | 82% | 0.817 | S | S | * | * | trans | 2.2 | 139.5 | 157 | 47.3 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 164 | E | 39.1 | Very low | 40.8 | Very low | 179 Ų | 179 | 156 Ų | 156 | 84% | 0.836 | 82% | 0.819 | S | S | * | * | trans | 89.5 | 109.2 | 146.1 | -71.4 | 164.2 | -135.1 | 0 | 0 | 122.2 | ||||
| 165 | A | 43.6 | Very low | 41 | Very low | 112 Ų | 112 | 155 Ų | 155 | 93% | 0.926 | 81% | 0.811 | S | S | * | * | trans | 32.7 | 92.1 | 138.6 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 166 | G | 38.5 | Very low | 41.1 | Very low | 75 Ų | 75 | 160 Ų | 160 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | trans | -150.4 | 111.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | R168 | G166-R168 PolarHBondContact O-N 3.31Å; G166-R168 VanDerWaalsContact O-N 3.11Å | ||
| 167 | R | 50.3 | Low | 41.2 | Very low | 251 Ų | 251 | 156.2 Ų | 156.2 | 95% | 0.947 | 80% | 0.802 | S | S | * | * | trans | -69.7 | 103.3 | 176.4 | 179.6 | -143.2 | -85.6 | -133.4 | -2.4 | 111.4 | ||||
| 168 | R | 37.3 | Very low | 41.6 | Very low | 221 Ų | 221 | 156.5 Ų | 156.5 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | trans | -132.4 | 135.8 | 148.1 | -83.2 | -154.2 | 172.1 | -109.7 | 1.7 | 111.9 | G166 E171 | G166-R168 PolarHBondContact O-N 3.31Å; G166-R168 VanDerWaalsContact O-N 3.11Å; R168-E171 IonicContact NH1-OE1 3.87Å | ||
| 169 | R | 38.4 | Very low | 41.3 | Very low | 231 Ų | 231 | 157.3 Ų | 157.3 | 87% | 0.872 | 80% | 0.799 | S | S | * | * | trans | -97 | 137.1 | 173.8 | -159.9 | -179.7 | -165 | -175.9 | 2.8 | 106.8 | ||||
| 170 | S | 35.4 | Very low | 41.4 | Very low | 96 Ų | 96 | 158.4 Ų | 158.4 | 67% | 0.671 | 80% | 0.796 | S | S | * | * | trans | -74.6 | 127.1 | 177.5 | -173.3 | 0 | 0 | 0 | 0 | 110.4 | Y172 | S170-Y172 VanDerWaalsContact C-N 3.26Å; S170-Y172 PolarHBondContact O-N 3.35Å | ||
| 171 | E | 41.7 | Very low | 41.2 | Very low | 148 Ų | 148 | 156.6 Ų | 156.6 | 69% | 0.692 | 79% | 0.794 | S | S | * | * | G | 310 helix | trans | -81.1 | -0.8 | -171.4 | -70.1 | 162.4 | -173.5 | 0 | 0 | 113 | R168 V173 | R168-E171 IonicContact NH1-OE1 3.87Å; E171-V173 VanDerWaalsContact C-N 3.29Å; E171-V173 PolarHBondContact O-N 3.37Å |
| 172 | Y | 40.8 | Very low | 40.7 | Very low | 208 Ų | 208 | 157.9 Ų | 157.9 | 82% | 0.816 | 79% | 0.792 | S | S | * | * | G | 310 helix | trans | -79.1 | -0.3 | -175.2 | -150.1 | -98.9 | 0 | 0 | 0 | 115.5 | S170 | S170-Y172 VanDerWaalsContact C-N 3.26Å; S170-Y172 PolarHBondContact O-N 3.35Å |
| 173 | V | 43.8 | Very low | 41.2 | Very low | 131 Ų | 131 | 159.1 Ų | 159.1 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | G | 310 helix | trans | -89.2 | -17.4 | 179 | -178 | 0 | 0 | 0 | 0 | 111.9 | E171 M175 | E171-V173 VanDerWaalsContact C-N 3.29Å; E171-V173 PolarHBondContact O-N 3.37Å; V173-M175 PolarHBondContact O-N 2.87Å |
| 174 | E | 46.7 | Very low | 41.3 | Very low | 178 Ų | 178 | 160.2 Ų | 160.2 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.1 | 54.3 | -165.2 | -162.6 | 160.1 | -140.4 | 0 | 0 | 113.2 | ||
| 175 | M | 41.5 | Very low | 41.1 | Very low | 134 Ų | 134 | 159.1 Ų | 159.1 | 66% | 0.66 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.9 | -30.1 | 175 | -151.6 | -174.6 | -58.1 | 0 | 0 | 115.1 | V173 | V173-M175 PolarHBondContact O-N 2.87Š|
| 176 | Y | 41.1 | Very low | 40.9 | Very low | 199 Ų | 199 | 159.6 Ų | 159.6 | 78% | 0.78 | 78% | 0.781 | S | S | * | * | trans | -144.6 | 91.9 | 177.7 | -73.7 | -78.6 | 0 | 0 | 0 | 112.9 | V178 | Y176-V178 PolarHBondContact O-N 3.28Š| ||
| 177 | P | 39.9 | Very low | 40.7 | Very low | 108 Ų | 108 | 163.5 Ų | 163.5 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | trans | -67.8 | 126.4 | 166 | -16.4 | 31.4 | 0 | 0 | 0 | 110.7 | E179 | P177-E179 HydrophobicContact CB-CG 4.23Š| ||
| 178 | V | 45.2 | Very low | 39.9 | Very low | 122 Ų | 122 | 156.8 Ų | 156.8 | 74% | 0.739 | 78% | 0.776 | S | S | * | * | trans | -112 | 91.8 | 170.7 | -179.6 | 0 | 0 | 0 | 0 | 108.1 | Y176 Y180 | Y176-V178 PolarHBondContact O-N 3.28Å; V178-Y180 HydrophobicContact CG1-CD2 4.44Å; V178-Y180 HydrophobicContact CG1-CE2 4.41Å | ||
| 179 | E | 41.5 | Very low | 40 | Very low | 172 Ų | 172 | 153.7 Ų | 153.7 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -91.4 | 117.5 | -171.9 | -62.8 | -178.1 | 140.3 | 0 | 0 | 111.6 | P177 P181 | P177-E179 HydrophobicContact CB-CG 4.23Å; E179-P181 WeakPolarHBondContact O-CD 3.28Å | ||
| 180 | Y | 41.8 | Very low | 39.9 | Very low | 207 Ų | 207 | 147.6 Ų | 147.6 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | trans | -102.4 | 105.3 | 171.3 | -95.6 | -92.3 | 0 | 0 | 0 | 110 | V178 Y182 | V178-Y180 HydrophobicContact CG1-CD2 4.44Å; V178-Y180 HydrophobicContact CG1-CE2 4.41Å; Y180-Y182 PolarHBondContact O-N 3.27Å | ||
| 181 | P | 42.6 | Very low | 39.8 | Very low | 125 Ų | 125 | 151.6 Ų | 151.6 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -83.1 | 82.4 | -173.5 | 32.3 | -35.5 | 0 | 0 | 0 | 113.7 | E179 | E179-P181 WeakPolarHBondContact O-CD 3.28Š| ||
| 182 | Y | 34.4 | Very low | 39.2 | Very low | 228 Ų | 228 | 149.5 Ų | 149.5 | 89% | 0.894 | 78% | 0.784 | S | S | * | * | trans | 47.8 | 163.7 | 135.8 | -119.5 | -98.9 | 0 | 0 | 0 | 124 | Y180 | Y180-Y182 PolarHBondContact O-N 3.27Š| ||
| 183 | S | 42.8 | Very low | 38.9 | Very low | 92 Ų | 92 | 145.4 Ų | 145.4 | 64% | 0.643 | 78% | 0.776 | S | S | * | * | trans | -102 | 142.9 | -174 | -71.3 | 0 | 0 | 0 | 0 | 115 | ||||
| 184 | L | 41.7 | Very low | 38.3 | Very low | 147 Ų | 147 | 149.6 Ų | 149.6 | 77% | 0.77 | 78% | 0.779 | S | S | * | * | trans | 53 | 122.2 | 152.3 | -80.3 | 86.8 | 0 | 0 | 0 | 121.1 | ||||
| 185 | M | 33.1 | Very low | 37.6 | Very low | 157 Ų | 157 | 147.3 Ų | 147.3 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | trans | 146.2 | 157 | 136.5 | -82.6 | -59.7 | 111.7 | 0 | 0 | 111.4 | ||||
| 186 | P | 40.4 | Very low | 37.5 | Very low | 122 Ų | 122 | 148.7 Ų | 148.7 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | cis | -120.3 | -164.3 | -29.6 | 38.6 | -22.8 | 0 | 0 | 0 | 111 | ||||
| 187 | N | 34.5 | Very low | 37.5 | Very low | 156 Ų | 156 | 145 Ų | 145 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | -120.1 | 116.6 | -169.5 | 179.4 | 25.1 | 0 | 0 | 0 | 114.7 | ||||
| 188 | S | 32.7 | Very low | 37.2 | Very low | 110 Ų | 110 | 144.6 Ų | 144.6 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -167 | 117.4 | 156.7 | 58.2 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 189 | L | 40.2 | Very low | 36.9 | Very low | 157 Ų | 157 | 143.7 Ų | 143.7 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | 34.5 | 103 | 142.7 | -71.2 | 163.5 | 0 | 0 | 0 | 121.3 | ||||
| 190 | A | 35.7 | Very low | 36.5 | Very low | 103 Ų | 103 | 144.6 Ų | 144.6 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | -162.8 | 147.9 | 125.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 191 | H | 34.4 | Very low | 36.3 | Very low | 179 Ų | 179 | 141.2 Ų | 141.2 | 83% | 0.829 | 80% | 0.803 | S | S | * | * | trans | -101.7 | 140.7 | -179.7 | -65.8 | 79.6 | 0 | 0 | 0 | 112 | ||||
| 192 | S | 29.4 | Very low | 36.7 | Very low | 104 Ų | 104 | 140.6 Ų | 140.6 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -165.2 | 122.8 | 130.9 | -159.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 193 | N | 33.1 | Very low | 36.7 | Very low | 122 Ų | 122 | 138.6 Ų | 138.6 | 65% | 0.652 | 80% | 0.803 | S | S | * | * | trans | 20.3 | 136.6 | 142.8 | -47.4 | -18.5 | 0 | 0 | 0 | 118.9 | ||||
| 194 | Y | 31 | Very low | 36.5 | Very low | 220 Ų | 220 | 138.6 Ų | 138.6 | 86% | 0.863 | 81% | 0.809 | S | S | * | * | cis | -142.4 | 157 | 42.3 | -91.1 | -94.3 | 0 | 0 | 0 | 115.1 | ||||
| 195 | T | 33.3 | Very low | 36.2 | Very low | 129 Ų | 129 | 139 Ų | 139 | 79% | 0.791 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 137.1 | -178.8 | -48.1 | 0 | 0 | 0 | 0 | 112.6 | ||
| 196 | L | 38.1 | Very low | 36.4 | Very low | 163 Ų | 163 | 139.1 Ų | 139.1 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -95.6 | 132.2 | 160.9 | -70 | 171.9 | 0 | 0 | 0 | 109.6 | ||
| 197 | P | 41.1 | Very low | 36.2 | Very low | 121 Ų | 121 | 138.5 Ų | 138.5 | 79% | 0.786 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 146 | 177.5 | 31.4 | -34.1 | 0 | 0 | 0 | 112.1 | ||
| 198 | A | 34.6 | Very low | 36.4 | Very low | 100 Ų | 100 | 136.9 Ų | 136.9 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | -91.1 | 175.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 199 | A | 39.2 | Very low | 37.1 | Very low | 104 Ų | 104 | 137.1 Ų | 137.1 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | trans | -74.7 | 148.1 | -170 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 200 | E | 32.6 | Very low | 37.1 | Very low | 190 Ų | 190 | 132.2 Ų | 132.2 | 89% | 0.888 | 80% | 0.795 | S | S | * | * | trans | -124.3 | 149.4 | 162.8 | -71 | -167.2 | 161.8 | 0 | 0 | 111.1 | ||||
| 201 | T | 37.4 | Very low | 37.8 | Very low | 136 Ų | 136 | 133.5 Ų | 133.5 | 83% | 0.834 | 80% | 0.795 | S | S | * | * | trans | -156.2 | 163.5 | 168.8 | 52.5 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 202 | P | 51.1 | Low | 38.3 | Very low | 112 Ų | 112 | 131.4 Ų | 131.4 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | cis | -129 | 149.1 | -23 | 34.1 | -18.4 | 0 | 0 | 0 | 113.3 | ||||
| 203 | L | 34.5 | Very low | 39.1 | Very low | 187 Ų | 187 | 137.2 Ų | 137.2 | 98% | 0.979 | 80% | 0.801 | S | S | * | * | trans | -139.3 | 162.5 | 158.7 | -79.2 | -177.5 | 0 | 0 | 0 | 111.4 | ||||
| 204 | A | 38.8 | Very low | 39.9 | Very low | 91 Ų | 91 | 135.6 Ų | 135.6 | 75% | 0.752 | 80% | 0.804 | S | S | * | * | trans | -100 | -165.3 | -157.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 205 | L | 35.9 | Very low | 40.5 | Very low | 157 Ų | 157 | 133.3 Ų | 133.3 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | 82.8 | 129.3 | -173.5 | -51.4 | 167.1 | 0 | 0 | 0 | 113.5 | ||||
| 206 | E | 36.4 | Very low | 40.9 | Very low | 159 Ų | 159 | 132.4 Ų | 132.4 | 74% | 0.743 | 80% | 0.795 | S | S | * | * | cis | -149.8 | 146.6 | -11.9 | -97.3 | -64.2 | 85.3 | 0 | 0 | 108.8 | S208 | E206-S208 PolarHBondContact O-N 3.29Š| ||
| 207 | P | 36.8 | Very low | 41.3 | Very low | 108 Ų | 108 | 131 Ų | 131 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | -81.3 | 103.1 | 178.2 | 31.9 | -32.2 | 0 | 0 | 0 | 112.2 | S209 | P207-S209 PolarHBondContact O-N 3.15Š| ||
| 208 | S | 38.8 | Very low | 41.8 | Very low | 122 Ų | 122 | 129.7 Ų | 129.7 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | -62.9 | 99.2 | 179 | -174.1 | 0 | 0 | 0 | 0 | 113 | E206 G210 | E206-S208 PolarHBondContact O-N 3.29Å; S208-G210 VanDerWaalsContact C-N 3.34Å; S208-G210 PolarHBondContact O-N 3.49Å | ||
| 209 | S | 47.1 | Very low | 42.2 | Very low | 115 Ų | 115 | 136.3 Ų | 136.3 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -82.3 | 68.9 | -175.8 | 61.6 | 0 | 0 | 0 | 0 | 113 | P207 | P207-S209 PolarHBondContact O-N 3.15Š| ||
| 210 | G | 39.6 | Very low | 42.6 | Very low | 54 Ų | 54 | 135.3 Ų | 135.3 | 56% | 0.557 | 80% | 0.796 | S | S | * | * | trans | -80.8 | 119.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | S208 V212 | S208-G210 VanDerWaalsContact C-N 3.34Å; S208-G210 PolarHBondContact O-N 3.49Å; G210-V212 VanDerWaalsContact C-N 3.26Å; G210-V212 PolarHBondContact O-N 2.82Å | ||
| 211 | P | 49.7 | Very low | 43.6 | Very low | 130 Ų | 130 | 131.3 Ų | 131.3 | 84% | 0.844 | 78% | 0.777 | S | S | * | * | trans | -79.9 | 67.6 | -174.7 | 33.5 | -36.8 | 0 | 0 | 0 | 112.4 | R213 | P211-R213 VanDerWaalsContact C-N 3.32Å; P211-R213 PolarHBondContact O-N 3.05Å | ||
| 212 | V | 46.5 | Very low | 44.4 | Very low | 136 Ų | 136 | 130.4 Ų | 130.4 | 82% | 0.824 | 78% | 0.783 | S | S | * | * | trans | -64.8 | 98.3 | 163.1 | -179.8 | 0 | 0 | 0 | 0 | 107.2 | G210 A214 | G210-V212 VanDerWaalsContact C-N 3.26Å; G210-V212 PolarHBondContact O-N 2.82Å; V212-A214 PolarHBondContact O-N 2.94Å | ||
| 213 | R | 46.1 | Very low | 45.2 | Very low | 226 Ų | 226 | 126.7 Ų | 126.7 | 85% | 0.853 | 77% | 0.765 | S | S | * | * | trans | -67.5 | 77.5 | -177.1 | -172.1 | -176.1 | -176.2 | -177.5 | 4 | 110.4 | P211 K215 | P211-R213 VanDerWaalsContact C-N 3.32Å; P211-R213 PolarHBondContact O-N 3.05Å; R213-K215 PolarHBondContact O-N 3.01Å | ||
| 214 | A | 49.7 | Very low | 47.7 | Very low | 88 Ų | 88 | 120.6 Ų | 120.6 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | trans | -57.3 | 92 | 164.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | V212 P216 | V212-A214 PolarHBondContact O-N 2.94Å; A214-P216 WeakPolarHBondContact O-CD 3.04Å; A214-P216 VanDerWaalsContact O-N 3.09Å | ||
| 215 | K | 42.4 | Very low | 50.4 | Low | 171 Ų | 171 | 123.2 Ų | 123.2 | 74% | 0.743 | 73% | 0.729 | S | S | * | * | trans | -64.1 | 110.3 | -170.6 | -173.6 | 176.2 | -176.3 | 178.2 | 0 | 107.7 | R213 T217 | R213-K215 PolarHBondContact O-N 3.01Å; K215-T217 PolarHBondContact O-N 3.25Å | ||
| 216 | P | 42 | Very low | 53.2 | Low | 111 Ų | 111 | 116.8 Ų | 116.8 | 72% | 0.721 | 70% | 0.695 | S | S | * | * | trans | -65.6 | 112.4 | -175.6 | 26.1 | -33 | 0 | 0 | 0 | 108.1 | A214 A218 | A214-P216 WeakPolarHBondContact O-CD 3.04Å; A214-P216 VanDerWaalsContact O-N 3.09Å; P216-A218 PolarHBondContact O-N 3.44Å | ||
| 217 | T | 46.5 | Very low | 56 | Low | 134 Ų | 134 | 112.6 Ų | 112.6 | 82% | 0.822 | 68% | 0.676 | S | S | * | * | trans | -75.9 | 66.1 | 175.4 | 49.9 | 0 | 0 | 0 | 0 | 109.3 | K215 R219 | K215-T217 PolarHBondContact O-N 3.25Å; T217-R219 PolarHBondContact O-N 3.28Å | ||
| 218 | A | 51.8 | Low | 58.8 | Low | 92 Ų | 92 | 113.7 Ų | 113.7 | 76% | 0.76 | 67% | 0.666 | S | S | * | * | trans | -72 | 71 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | P216 | P216-A218 PolarHBondContact O-N 3.44Š| ||
| 219 | R | 43.2 | Very low | 61.5 | Low | 240 Ų | 240 | 113 Ų | 113 | 91% | 0.906 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -157 | 109.3 | 161 | -105.2 | 168.2 | -170 | -161 | -0.5 | 107.3 | T217 E221 | T217-R219 PolarHBondContact O-N 3.28Å; R219-E221 PolarHBondContact O-N 2.83Å |
| 220 | G | 47.9 | Very low | 63.9 | Low | 82 Ų | 82 | 107.8 Ų | 107.8 | 85% | 0.845 | 61% | 0.609 | S | S | * | * | trans | -78.6 | 111 | -166.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 221 | E | 52.8 | Low | 66.5 | Low | 106 Ų | 106 | 110.6 Ų | 110.6 | 50% | 0.495 | 61% | 0.61 | S | S | . | * | trans | -131.8 | 62.5 | 154.2 | -74.4 | -162.5 | 168.8 | 0 | 0 | 109.6 | R219 G223 R228 | R219-E221 PolarHBondContact O-N 2.83Å; E221-G223 PolarHBondContact O-N 2.99Å; E221-R228 PolarHBondContact O-NH2 3.37Å; E221-R228 VanDerWaalsContact O-NH2 3.14Å; E221-R228 IonicContact OE2-CZ 3.57Å; E221-R228 IonicContact OE2-NE 2.74Å; E221-R228 PolarHBondContact OE2-NE 3.4Å; E221-R228 IonicContact OE2-NH2 3.62Å | ||
| 222 | A | 55.2 | Low | 68.8 | Low | 117 Ų | 117 | 108.3 Ų | 108.3 | 97% | 0.967 | 60% | 0.602 | S | S | * | * | trans | -76.5 | 36.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 223 | G | 66.9 | Low | 71.1 | Confident | 34 Ų | 34 | 105.1 Ų | 105.1 | 35% | 0.351 | 58% | 0.579 | S | S | . | * | trans | -99.9 | 159.4 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | E221 E227 | E221-G223 PolarHBondContact O-N 2.99Å; G223-E227 WeakPolarHBondContact CA-OE2 3.24Å | ||
| 224 | S | 87.9 | Confident | 73.5 | Confident | 60 Ų | 60 | 102.8 Ų | 102.8 | 42% | 0.42 | 58% | 0.575 | S | S | . | * | trans | -55.1 | 154.4 | 171.4 | -177.1 | 0 | 0 | 0 | 0 | 112 | D226 E227 R228 | S224-D226 PolarHBondContact O-N 3.3Å; S224-D226 VanDerWaalsContact O-N 3.11Å; S224-E227 VanDerWaalsContact CB-CD 3.41Å; S224-E227 WeakPolarHBondContact CB-OE1 3.39Å; S224-E227 VanDerWaalsContact N-CD 3.29Å; S224-E227 PolarHBondContact N-OE2 3.04Å; S224-E227 WeakPolarHBondContact O-CA 3.47Å; S224-E227 WeakPolarHBondContact O-CB 3.32Å; S224-E227 PolarHBondContact O-N 3.42Å; S224-R228 PolarHBondContact O-N 2.92Å | ||
| 225 | R | 94.3 | Very high | 75.7 | Confident | 146 Ų | 146 | 99.3 Ų | 99.3 | 55% | 0.551 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -45.7 | -42.8 | 169.5 | 162.4 | -177.1 | 148.4 | 160.2 | -1.7 | 112.1 | R229 R273 | R225-R229 WeakPolarHBondContact O-CG 3.45Å; R225-R229 PolarHBondContact O-N 3.38Å; R225-R273 VanDerWaalsContact NH2-NH1 3.12Å |
| 226 | D | 95.3 | Very high | 78.3 | Confident | 22 Ų | 22 | 94.2 Ų | 94.2 | 12% | 0.118 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -82.4 | -21.1 | -175.6 | -73.6 | -21.1 | 0 | 0 | 0 | 112.1 | S224 A230 I270 R273 | S224-D226 PolarHBondContact O-N 3.3Å; S224-D226 VanDerWaalsContact O-N 3.11Å; D226-A230 WeakPolarHBondContact O-CB 3.44Å; D226-A230 PolarHBondContact O-N 3.44Å; D226-I270 HydrophobicContact CB-CD1 4.08Å; D226-I270 HydrophobicContact CB-CG1 3.87Å; D226-I270 HydrophobicContact CB-CG2 4.25Å; D226-I270 WeakPolarHBondContact O-CD1 3.3Å; D226-R273 IonicContact OD1-NH1 2.69Å; D226-R273 PolarHBondContact OD1-NH1 2.87Å; D226-R273 WeakPolarHBondContact OD2-CD 3.47Å; D226-R273 IonicContact OD2-NH1 3.61Å; D226-R273 PolarHBondContact OD2-NH1 3.5Å |
| 227 | E | 96 | Very high | 80.8 | Confident | 71 Ų | 71 | 89.7 Ų | 89.7 | 33% | 0.332 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -70.8 | -47.5 | 167.9 | -74.3 | 146.5 | -133.9 | 0 | 0 | 111.4 | G223 S224 R229 A230 L231 T239 | G223-E227 WeakPolarHBondContact CA-OE2 3.24Å; S224-E227 VanDerWaalsContact CB-CD 3.41Å; S224-E227 WeakPolarHBondContact CB-OE1 3.39Å; S224-E227 VanDerWaalsContact N-CD 3.29Å; S224-E227 PolarHBondContact N-OE2 3.04Å; S224-E227 WeakPolarHBondContact O-CA 3.47Å; S224-E227 WeakPolarHBondContact O-CB 3.32Å; S224-E227 PolarHBondContact O-N 3.42Å; E227-R229 PolarHBondContact O-N 3.23Å; E227-A230 PolarHBondContact O-N 2.93Å; E227-A230 VanDerWaalsContact O-N 3.08Å; E227-L231 WeakPolarHBondContact O-CG 3.39Å; E227-L231 PolarHBondContact O-N 3.35Å; E227-T239 HydrophobicContact CB-CG2 4.32Å; E227-T239 HydrophobicContact CG-CG2 3.66Å; E227-T239 WeakPolarHBondContact CG-OG1 3.1Å; E227-T239 PolarHBondContact OE1-OG1 3.17Å |
| 228 | R | 95.7 | Very high | 83.2 | Confident | 130 Ų | 130 | 86.9 Ų | 86.9 | 49% | 0.491 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59 | -36 | 174.7 | -173.1 | 177.2 | -70.3 | 143.1 | 10.7 | 111.5 | E221 S224 A232 | E221-R228 PolarHBondContact O-NH2 3.37Å; E221-R228 VanDerWaalsContact O-NH2 3.14Å; E221-R228 IonicContact OE2-CZ 3.57Å; E221-R228 IonicContact OE2-NE 2.74Å; E221-R228 PolarHBondContact OE2-NE 3.4Å; E221-R228 IonicContact OE2-NH2 3.62Å; S224-R228 PolarHBondContact O-N 2.92Å; R228-A232 VanDerWaalsContact O-CB 3.28Å; R228-A232 WeakPolarHBondContact O-CB 3.31Å; R228-A232 PolarHBondContact O-N 3.34Å |
| 229 | R | 95.6 | Very high | 85.3 | Confident | 108 Ų | 108 | 83.4 Ų | 83.4 | 41% | 0.408 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.2 | -43.5 | 172.9 | -74.2 | 173.8 | 173.2 | -134.6 | -3.7 | 112.6 | R225 E227 A232 M233 L266 | R225-R229 WeakPolarHBondContact O-CG 3.45Å; R225-R229 PolarHBondContact O-N 3.38Å; E227-R229 PolarHBondContact O-N 3.23Å; R229-A232 PolarHBondContact O-N 3.44Å; R229-M233 WeakPolarHBondContact O-CB 3.33Å; R229-M233 PolarHBondContact O-N 2.72Å; R229-L266 HydrophobicContact CB-CD1 4.18Å; R229-L266 HydrophobicContact CB-CD2 4.14Å |
| 230 | A | 96.3 | Very high | 87.8 | Confident | 6 Ų | 6 | 76.7 Ų | 76.7 | 5% | 0.05 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | D226 E227 M233 K234 I235 T239 I270 | D226-A230 WeakPolarHBondContact O-CB 3.44Å; D226-A230 PolarHBondContact O-N 3.44Å; E227-A230 PolarHBondContact O-N 2.93Å; E227-A230 VanDerWaalsContact O-N 3.08Å; A230-M233 CarbonylContact O-C 3.51Å; A230-M233 PolarHBondContact O-N 2.98Å; A230-K234 PolarHBondContact O-N 2.84Å; A230-K234 VanDerWaalsContact O-N 3.07Å; A230-I235 HydrophobicContact CB-CB 4.12Å; A230-I235 HydrophobicContact CB-CG1 4.09Å; A230-I235 WeakPolarHBondContact O-CG1 3.23Å; A230-I235 PolarHBondContact O-N 2.6Å; A230-T239 HydrophobicContact CB-CG2 3.95Å; A230-I270 HydrophobicContact CB-CD1 4.31Å |
| 231 | L | 95.8 | Very high | 90.1 | Very high | 113 Ų | 113 | 78 Ų | 78 | 59% | 0.592 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -63.5 | -46.9 | 175.2 | -69.4 | 170.4 | 0 | 0 | 0 | 111.9 | E227 M233 K234 | E227-L231 WeakPolarHBondContact O-CG 3.39Å; E227-L231 PolarHBondContact O-N 3.35Å; L231-M233 VanDerWaalsContact C-N 3.31Å; L231-M233 PolarHBondContact O-N 3.33Å; L231-K234 WeakPolarHBondContact O-CA 3.14Å; L231-K234 PolarHBondContact O-N 3.25Å |
| 232 | A | 96.3 | Very high | 92.2 | Very high | 81 Ų | 81 | 73 Ų | 73 | 67% | 0.669 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -61 | -38 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | R228 R229 K234 | R228-A232 VanDerWaalsContact O-CB 3.28Å; R228-A232 WeakPolarHBondContact O-CB 3.31Å; R228-A232 PolarHBondContact O-N 3.34Å; R229-A232 PolarHBondContact O-N 3.44Å; A232-K234 VanDerWaalsContact C-N 3.27Å; A232-K234 PolarHBondContact O-N 2.85Å |
| 233 | M | 95.8 | Very high | 94.2 | Very high | 70 Ų | 70 | 68.5 Ų | 68.5 | 35% | 0.345 | 35% | 0.353 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | 7 | 173.8 | -71 | -64.8 | -70.1 | 0 | 0 | 113.8 | R229 A230 L231 I235 Q263 L266 | R229-M233 WeakPolarHBondContact O-CB 3.33Å; R229-M233 PolarHBondContact O-N 2.72Å; A230-M233 CarbonylContact O-C 3.51Å; A230-M233 PolarHBondContact O-N 2.98Å; L231-M233 VanDerWaalsContact C-N 3.31Å; L231-M233 PolarHBondContact O-N 3.33Å; M233-I235 VanDerWaalsContact C-N 3.29Å; M233-I235 HydrophobicContact CB-CD1 4.3Å; M233-I235 HydrophobicContact CB-CG1 4.3Å; M233-I235 PolarHBondContact O-N 3.27Å; M233-Q263 HydrophobicContact CE-CG 3.93Å; M233-Q263 PolarHBondContact O-NE2 3.31Å; M233-L266 HydrophobicContact CB-CD2 3.81Å; M233-L266 HydrophobicContact CG-CD2 3.61Å |
| 234 | K | 95.9 | Very high | 95.7 | Very high | 177 Ų | 177 | 71.1 Ų | 71.1 | 77% | 0.77 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 40.3 | 179.2 | -56.3 | -178.6 | -178.7 | 178.4 | 0 | 114.1 | A230 L231 A232 | A230-K234 PolarHBondContact O-N 2.84Å; A230-K234 VanDerWaalsContact O-N 3.07Å; L231-K234 WeakPolarHBondContact O-CA 3.14Å; L231-K234 PolarHBondContact O-N 3.25Å; A232-K234 VanDerWaalsContact C-N 3.27Å; A232-K234 PolarHBondContact O-N 2.85Å |
| 235 | I | 96.9 | Very high | 96.1 | Very high | 15 Ų | 15 | 70.2 Ų | 70.2 | 8% | 0.077 | 35% | 0.349 | C | S | . | . | trans | -65.5 | 125.6 | 174.5 | -56.7 | -56 | 0 | 0 | 0 | 109.1 | A230 M233 F237 I242 L259 Q263 V267 | A230-I235 HydrophobicContact CB-CB 4.12Å; A230-I235 HydrophobicContact CB-CG1 4.09Å; A230-I235 WeakPolarHBondContact O-CG1 3.23Å; A230-I235 PolarHBondContact O-N 2.6Å; M233-I235 VanDerWaalsContact C-N 3.29Å; M233-I235 HydrophobicContact CB-CD1 4.3Å; M233-I235 HydrophobicContact CB-CG1 4.3Å; M233-I235 PolarHBondContact O-N 3.27Å; I235-F237 HydrophobicContact CG2-CD2 3.59Å; I235-F237 HydrophobicContact CG2-CE1 4.38Å; I235-F237 HydrophobicContact CG2-CE2 3.37Å; I235-F237 HydrophobicContact CG2-CG 4.18Å; I235-F237 HydrophobicContact CG2-CZ 3.82Å; I235-F237 PolarHBondContact O-N 3.47Å; I235-F237 VanDerWaalsContact O-N 3.13Å; I235-I242 HydrophobicContact CG2-CD1 4.34Å; I235-L259 HydrophobicContact CD1-CD2 4.5Å; I235-Q263 HydrophobicContact CD1-CB 3.62Å; I235-Q263 HydrophobicContact CD1-CG 3.69Å; I235-V267 HydrophobicContact CD1-CG2 3.78Å; I235-V267 HydrophobicContact CG1-CG2 4.14Å; I235-V267 HydrophobicContact CG2-CG2 4Å | ||
| 236 | P | 95.7 | Very high | 96.2 | Very high | 64 Ų | 64 | 66.3 Ų | 66.3 | 42% | 0.416 | 34% | 0.343 | S | S | . | . | S | Bend | trans | -81.3 | 12.9 | -169.6 | 32.7 | -35.8 | 0 | 0 | 0 | 114.7 | Y257 L259 | P236-Y257 HydrophobicContact CB-CD1 3.84Å; P236-Y257 HydrophobicContact CB-CE1 3.76Å; P236-Y257 HydrophobicContact CB-CG 4.49Å; P236-Y257 HydrophobicContact CG-CD1 3.37Å; P236-Y257 HydrophobicContact CG-CD2 4.2Å; P236-Y257 HydrophobicContact CG-CE1 3.77Å; P236-Y257 HydrophobicContact CG-CG 3.61Å; P236-L259 HydrophobicContact CG-CD2 4.29Å |
| 237 | F | 95.6 | Very high | 96.3 | Very high | 15 Ų | 15 | 68.9 Ų | 68.9 | 7% | 0.066 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -146.6 | 151.2 | -179.6 | 43.3 | -105.8 | 0 | 0 | 0 | 111.5 | I235 I242 L253 L254 Y257 L259 V267 | I235-F237 HydrophobicContact CG2-CD2 3.59Å; I235-F237 HydrophobicContact CG2-CE1 4.38Å; I235-F237 HydrophobicContact CG2-CE2 3.37Å; I235-F237 HydrophobicContact CG2-CG 4.18Å; I235-F237 HydrophobicContact CG2-CZ 3.82Å; I235-F237 PolarHBondContact O-N 3.47Å; I235-F237 VanDerWaalsContact O-N 3.13Å; F237-I242 HydrophobicContact CD2-CD1 4.01Å; F237-I242 HydrophobicContact CD2-CG1 3.74Å; F237-I242 HydrophobicContact CE2-CD1 3.79Å; F237-I242 HydrophobicContact CE2-CG1 3.63Å; F237-L253 HydrophobicContact CB-CD1 4.47Å; F237-L253 HydrophobicContact CB-CD2 4.5Å; F237-L253 HydrophobicContact CD1-CD1 3.88Å; F237-L253 HydrophobicContact CD1-CD2 4.22Å; F237-L253 HydrophobicContact CD1-CG 3.98Å; F237-L253 HydrophobicContact CD2-CD2 4.05Å; F237-L253 HydrophobicContact CE1-CD1 4.37Å; F237-L253 HydrophobicContact CE1-CD2 4.46Å; F237-L253 HydrophobicContact CE1-CG 4.06Å; F237-L253 HydrophobicContact CE2-CD2 4.31Å; F237-L253 HydrophobicContact CG-CD1 4.24Å; F237-L253 HydrophobicContact CG-CD2 4Å; F237-L253 HydrophobicContact CG-CG 4.27Å; F237-L253 HydrophobicContact CZ-CG 4.43Å; F237-L254 HydrophobicContact CZ-CD2 4.13Å; F237-Y257 AromaticContact CD1-CD2 3.68Å; F237-Y257 HydrophobicContact CD1-CD2 3.68Å; F237-Y257 AromaticContact CD1-CE2 3.74Å; F237-Y257 HydrophobicContact CD1-CE2 3.74Å; F237-Y257 HydrophobicContact CD1-CG 4.4Å; F237-Y257 AromaticContact CE1-CD2 3.73Å; F237-Y257 HydrophobicContact CE1-CD2 3.73Å; F237-Y257 HydrophobicContact CE1-CE2 4.27Å; F237-Y257 HydrophobicContact CE1-CG 4.29Å; F237-L259 HydrophobicContact CE1-CD1 4.08Å; F237-L259 HydrophobicContact CZ-CD1 3.84Å; F237-V267 HydrophobicContact CE2-CG1 4.15Å; F237-V267 HydrophobicContact CE2-CG2 4.14Å; F237-V267 HydrophobicContact CZ-CG1 4.45Å; F237-V267 HydrophobicContact CZ-CG2 4.35Å |
| 238 | P | 95.9 | Very high | 96.3 | Very high | 76 Ų | 76 | 70.8 Ų | 70.8 | 49% | 0.494 | 37% | 0.371 | S | S | . | . | trans | -70 | 152.4 | -176.6 | 29.1 | -36.3 | 0 | 0 | 0 | 112.9 | D240 K241 I242 | P238-D240 PolarHBondContact O-N 2.85Å; P238-K241 HydrophobicContact CG-CB 4.49Å; P238-K241 HydrophobicContact CG-CD 4.3Å; P238-K241 HydrophobicContact CG-CG 4.13Å; P238-K241 PolarHBondContact O-N 3.45Å; P238-I242 PolarHBondContact O-N 3.38Å | ||
| 239 | T | 96.4 | Very high | 96.4 | Very high | 18 Ų | 18 | 68.4 Ų | 68.4 | 11% | 0.11 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -58.4 | -29.7 | 175.7 | 50 | 0 | 0 | 0 | 0 | 113.9 | E227 A230 K241 I242 V243 I270 | E227-T239 HydrophobicContact CB-CG2 4.32Å; E227-T239 HydrophobicContact CG-CG2 3.66Å; E227-T239 WeakPolarHBondContact CG-OG1 3.1Å; E227-T239 PolarHBondContact OE1-OG1 3.17Å; A230-T239 HydrophobicContact CB-CG2 3.95Å; T239-K241 PolarHBondContact O-N 2.99Å; T239-I242 WeakPolarHBondContact O-CB 3.14Å; T239-I242 PolarHBondContact O-N 3.41Å; T239-I242 VanDerWaalsContact O-N 3.13Å; T239-V243 WeakPolarHBondContact O-CG2 3.41Å; T239-V243 PolarHBondContact O-N 3.43Å; T239-I270 HydrophobicContact CG2-CD1 4.37Å; T239-I270 HydrophobicContact CG2-CG2 4.2Å |
| 240 | D | 95.8 | Very high | 96.5 | Very high | 100 Ų | 100 | 63.8 Ų | 63.8 | 54% | 0.535 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -58.1 | -47.6 | 176.3 | -170.3 | 84.6 | 0 | 0 | 0 | 111.4 | P238 I242 V243 N244 | P238-D240 PolarHBondContact O-N 2.85Å; D240-I242 VanDerWaalsContact C-N 3.32Å; D240-I242 PolarHBondContact O-N 3.28Å; D240-V243 PolarHBondContact O-N 3.3Å; D240-V243 VanDerWaalsContact O-N 3.15Å; D240-N244 VanDerWaalsContact O-CB 3.3Å; D240-N244 WeakPolarHBondContact O-CB 3.37Å; D240-N244 PolarHBondContact O-N 3.08Å; D240-N244 PolarHBondContact O-ND2 3.3Å; D240-N244 PolarHBondContact OD1-ND2 3.46Å; D240-N244 PolarHBondContact OD2-ND2 2.98Å |
| 241 | K | 96.7 | Very high | 96.5 | Very high | 110 Ų | 110 | 67.5 Ų | 67.5 | 48% | 0.478 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.6 | -37.2 | 174.3 | -71.6 | -171.3 | 176.3 | -170.1 | 0 | 112.5 | P238 T239 V243 L245 L253 | P238-K241 HydrophobicContact CG-CB 4.49Å; P238-K241 HydrophobicContact CG-CD 4.3Å; P238-K241 HydrophobicContact CG-CG 4.13Å; P238-K241 PolarHBondContact O-N 3.45Å; T239-K241 PolarHBondContact O-N 2.99Å; K241-V243 VanDerWaalsContact C-N 3.28Å; K241-V243 PolarHBondContact O-N 2.97Å; K241-L245 HydrophobicContact CB-CD1 4.12Å; K241-L245 HydrophobicContact CB-CG 4.4Å; K241-L245 WeakPolarHBondContact O-CB 3.38Å; K241-L245 WeakPolarHBondContact O-CD1 3.44Å; K241-L245 VanDerWaalsContact O-CG 3.23Å; K241-L245 WeakPolarHBondContact O-CG 3.3Å; K241-L245 PolarHBondContact O-N 3.45Å; K241-L253 HydrophobicContact CB-CD2 4.23Å |
| 242 | I | 96.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -58.8 | -41.9 | 175.5 | -61.5 | 176.5 | 0 | 0 | 0 | 110.9 | I235 F237 P238 T239 D240 F250 V267 I270 R271 | I235-I242 HydrophobicContact CG2-CD1 4.34Å; F237-I242 HydrophobicContact CD2-CD1 4.01Å; F237-I242 HydrophobicContact CD2-CG1 3.74Å; F237-I242 HydrophobicContact CE2-CD1 3.79Å; F237-I242 HydrophobicContact CE2-CG1 3.63Å; P238-I242 PolarHBondContact O-N 3.38Å; T239-I242 WeakPolarHBondContact O-CB 3.14Å; T239-I242 PolarHBondContact O-N 3.41Å; T239-I242 VanDerWaalsContact O-N 3.13Å; D240-I242 VanDerWaalsContact C-N 3.32Å; D240-I242 PolarHBondContact O-N 3.28Å; I242-F250 HydrophobicContact CG2-CE2 4.22Å; I242-V267 HydrophobicContact CD1-CB 4.43Å; I242-V267 HydrophobicContact CD1-CG1 3.98Å; I242-V267 HydrophobicContact CD1-CG2 4.05Å; I242-V267 HydrophobicContact CG1-CG1 4.04Å; I242-V267 HydrophobicContact CG2-CG1 3.88Å; I242-V267 VanDerWaalsContact CG2-O 3.24Å; I242-V267 WeakPolarHBondContact CG2-O 3.34Å; I242-I270 HydrophobicContact CB-CG2 4.33Å; I242-I270 HydrophobicContact CD1-CG2 4.4Å; I242-I270 HydrophobicContact CG2-CB 4.08Å; I242-I270 HydrophobicContact CG2-CG2 3.81Å; I242-R271 HydrophobicContact CG2-CB 3.74Å; I242-R271 WeakPolarHBondContact O-CD 3.01Å; I242-R271 WeakPolarHBondContact O-CG 3.46Å; I242-R271 PolarHBondContact O-NE 2.86Å |
| 243 | V | 97.1 | Very high | 96.6 | Very high | 23 Ų | 23 | 63.8 Ų | 63.8 | 14% | 0.139 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -85.2 | -40.6 | -175.6 | 176.3 | 0 | 0 | 0 | 0 | 112.5 | T239 D240 K241 I270 K275 | T239-V243 WeakPolarHBondContact O-CG2 3.41Å; T239-V243 PolarHBondContact O-N 3.43Å; D240-V243 PolarHBondContact O-N 3.3Å; D240-V243 VanDerWaalsContact O-N 3.15Å; K241-V243 VanDerWaalsContact C-N 3.28Å; K241-V243 PolarHBondContact O-N 2.97Å; V243-I270 HydrophobicContact CG2-CG2 4.35Å; V243-K275 WeakPolarHBondContact O-CD 3.28Å; V243-K275 WeakPolarHBondContact O-CE 3.44Å; V243-K275 PolarHBondContact O-NZ 3.29Å |
| 244 | N | 97.3 | Very high | 96.6 | Very high | 89 Ų | 89 | 61.5 Ų | 61.5 | 48% | 0.476 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -87.2 | -36.7 | -165.7 | -67.8 | -20.6 | 0 | 0 | 0 | 113.7 | D240 K275 | D240-N244 VanDerWaalsContact O-CB 3.3Å; D240-N244 WeakPolarHBondContact O-CB 3.37Å; D240-N244 PolarHBondContact O-N 3.08Å; D240-N244 PolarHBondContact O-ND2 3.3Å; D240-N244 PolarHBondContact OD1-ND2 3.46Å; D240-N244 PolarHBondContact OD2-ND2 2.98Å; N244-K275 PolarHBondContact O-NZ 2.91Å |
| 245 | L | 97.4 | Very high | 96.6 | Very high | 40 Ų | 40 | 57.2 Ų | 57.2 | 21% | 0.209 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -55.2 | 149 | -175.6 | -71.7 | 176.8 | 0 | 0 | 0 | 113.5 | K241 D249 F250 L253 R271 K275 | K241-L245 HydrophobicContact CB-CD1 4.12Å; K241-L245 HydrophobicContact CB-CG 4.4Å; K241-L245 WeakPolarHBondContact O-CB 3.38Å; K241-L245 WeakPolarHBondContact O-CD1 3.44Å; K241-L245 VanDerWaalsContact O-CG 3.23Å; K241-L245 WeakPolarHBondContact O-CG 3.3Å; K241-L245 PolarHBondContact O-N 3.45Å; L245-D249 HydrophobicContact CB-CB 4.23Å; L245-D249 HydrophobicContact CD1-CB 4.24Å; L245-D249 HydrophobicContact CD2-CB 3.94Å; L245-D249 HydrophobicContact CG-CB 4.35Å; L245-F250 HydrophobicContact CB-CB 4.19Å; L245-L253 HydrophobicContact CD1-CB 4.38Å; L245-L253 HydrophobicContact CD1-CD2 3.73Å; L245-R271 PolarHBondContact O-NH2 2.76Å; L245-K275 PolarHBondContact O-NZ 2.91Å |
| 246 | P | 96.8 | Very high | 96.5 | Very high | 65 Ų | 65 | 64.3 Ų | 64.3 | 42% | 0.422 | 35% | 0.349 | S | S | . | . | trans | -62.2 | 176.5 | 167.1 | 31.2 | -37 | 0 | 0 | 0 | 110.6 | D249 F250 R271 | P246-D249 WeakPolarHBondContact CD-OD2 3.26Å; P246-D249 HydrophobicContact CG-CB 3.82Å; P246-D249 VanDerWaalsContact CG-OD2 3.3Å; P246-D249 WeakPolarHBondContact CG-OD2 3.32Å; P246-F250 WeakPolarHBondContact O-CB 3.02Å; P246-F250 PolarHBondContact O-N 3.34Å; P246-R271 VanDerWaalsContact C-NH2 3.29Å; P246-R271 PolarHBondContact O-NH2 3.44Å | ||
| 247 | V | 96.2 | Very high | 96.5 | Very high | 75 Ų | 75 | 65.9 Ų | 65.9 | 46% | 0.455 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -68.4 | -36.4 | -175.4 | 64.5 | 0 | 0 | 0 | 0 | 112.2 | F250 N251 | V247-F250 PolarHBondContact O-N 2.89Å; V247-N251 WeakPolarHBondContact O-CB 3.41Å; V247-N251 PolarHBondContact O-N 2.85Å; V247-N251 PolarHBondContact O-ND2 2.91Å |
| 248 | D | 97.1 | Very high | 96.4 | Very high | 111 Ų | 111 | 71.4 Ų | 71.4 | 59% | 0.594 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -75.1 | -55 | -173.3 | -46.8 | -74.8 | 0 | 0 | 0 | 111.5 | F250 N251 E252 | D248-F250 PolarHBondContact O-N 3.49Å; D248-F250 VanDerWaalsContact O-N 3.15Å; D248-N251 PolarHBondContact O-N 3.49Å; D248-E252 PolarHBondContact O-N 3.39Å |
| 249 | D | 97.7 | Very high | 96.4 | Very high | 81 Ų | 81 | 69.1 Ų | 69.1 | 43% | 0.433 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -54.1 | -34.8 | 171.6 | -57.5 | 8.1 | 0 | 0 | 0 | 112.5 | L245 P246 L253 | L245-D249 HydrophobicContact CB-CB 4.23Å; L245-D249 HydrophobicContact CD1-CB 4.24Å; L245-D249 HydrophobicContact CD2-CB 3.94Å; L245-D249 HydrophobicContact CG-CB 4.35Å; P246-D249 WeakPolarHBondContact CD-OD2 3.26Å; P246-D249 HydrophobicContact CG-CB 3.82Å; P246-D249 VanDerWaalsContact CG-OD2 3.3Å; P246-D249 WeakPolarHBondContact CG-OD2 3.32Å; D249-L253 WeakPolarHBondContact O-CB 3.37Å; D249-L253 PolarHBondContact O-N 2.87Å |
| 250 | F | 97.6 | Very high | 96.4 | Very high | 10 Ų | 10 | 71.7 Ų | 71.7 | 4% | 0.044 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -70.2 | -43.2 | 176.8 | 172.9 | -102.6 | 0 | 0 | 0 | 111.4 | I242 L245 P246 V247 D248 E252 L253 L254 V267 R271 | I242-F250 HydrophobicContact CG2-CE2 4.22Å; L245-F250 HydrophobicContact CB-CB 4.19Å; P246-F250 WeakPolarHBondContact O-CB 3.02Å; P246-F250 PolarHBondContact O-N 3.34Å; V247-F250 PolarHBondContact O-N 2.89Å; D248-F250 PolarHBondContact O-N 3.49Å; D248-F250 VanDerWaalsContact O-N 3.15Å; F250-E252 VanDerWaalsContact C-N 3.35Å; F250-L253 PolarHBondContact O-N 3.4Å; F250-L254 HydrophobicContact CD1-CD1 4.32Å; F250-L254 HydrophobicContact CE1-CD1 3.67Å; F250-L254 HydrophobicContact CE1-CG 4.31Å; F250-L254 HydrophobicContact CE2-CD1 4.49Å; F250-L254 HydrophobicContact CE2-CD2 4.43Å; F250-L254 HydrophobicContact CE2-CG 4.4Å; F250-L254 HydrophobicContact CZ-CD1 3.78Å; F250-L254 HydrophobicContact CZ-CD2 4.36Å; F250-L254 HydrophobicContact CZ-CG 4.16Å; F250-L254 WeakPolarHBondContact O-CG 3.44Å; F250-L254 PolarHBondContact O-N 3.17Å; F250-V267 HydrophobicContact CE2-CG1 3.76Å; F250-V267 HydrophobicContact CZ-CG1 3.9Å; F250-R271 HydrophobicContact CZ-CB 4.47Å |
| 251 | N | 96.4 | Very high | 96.5 | Very high | 84 Ų | 84 | 74.9 Ų | 74.9 | 45% | 0.449 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.1 | -39.7 | 175 | -70 | -21.8 | 0 | 0 | 0 | 111.2 | V247 D248 L254 A255 | V247-N251 WeakPolarHBondContact O-CB 3.41Å; V247-N251 PolarHBondContact O-N 2.85Å; V247-N251 PolarHBondContact O-ND2 2.91Å; D248-N251 PolarHBondContact O-N 3.49Å; N251-L254 PolarHBondContact O-N 2.97Å; N251-A255 PolarHBondContact O-N 2.85Å |
| 252 | E | 97.1 | Very high | 96.5 | Very high | 98 Ų | 98 | 73 Ų | 73 | 46% | 0.458 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.9 | -41.8 | 174.9 | -150.1 | -140.8 | 155.5 | 0 | 0 | 111.5 | D248 F250 L254 A255 R256 | D248-E252 PolarHBondContact O-N 3.39Å; F250-E252 VanDerWaalsContact C-N 3.35Å; E252-L254 VanDerWaalsContact C-N 3.29Å; E252-L254 PolarHBondContact O-N 3.19Å; E252-A255 PolarHBondContact O-N 3.37Å; E252-A255 VanDerWaalsContact O-N 3.13Å; E252-R256 VanDerWaalsContact CD-NE 3.27Å; E252-R256 VanDerWaalsContact O-CG 3.3Å; E252-R256 WeakPolarHBondContact O-CG 3.36Å; E252-R256 PolarHBondContact O-N 3.08Å; E252-R256 IonicContact OE1-CZ 3.13Å; E252-R256 IonicContact OE1-NE 2.77Å; E252-R256 PolarHBondContact OE1-NE 3.06Å; E252-R256 IonicContact OE1-NH2 2.71Å; E252-R256 PolarHBondContact OE1-NH2 3.4Å; E252-R256 IonicContact OE2-CZ 3.43Å; E252-R256 IonicContact OE2-NE 3.54Å; E252-R256 IonicContact OE2-NH2 2.84Å; E252-R256 PolarHBondContact OE2-NH2 3.14Å |
| 253 | L | 95.8 | Very high | 96.6 | Very high | 19 Ų | 19 | 74.3 Ų | 74.3 | 10% | 0.099 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.2 | -38.9 | 172.8 | -179.4 | 67.1 | 0 | 0 | 0 | 111.8 | F237 K241 L245 D249 F250 Y257 | F237-L253 HydrophobicContact CB-CD1 4.47Å; F237-L253 HydrophobicContact CB-CD2 4.5Å; F237-L253 HydrophobicContact CD1-CD1 3.88Å; F237-L253 HydrophobicContact CD1-CD2 4.22Å; F237-L253 HydrophobicContact CD1-CG 3.98Å; F237-L253 HydrophobicContact CD2-CD2 4.05Å; F237-L253 HydrophobicContact CE1-CD1 4.37Å; F237-L253 HydrophobicContact CE1-CD2 4.46Å; F237-L253 HydrophobicContact CE1-CG 4.06Å; F237-L253 HydrophobicContact CE2-CD2 4.31Å; F237-L253 HydrophobicContact CG-CD1 4.24Å; F237-L253 HydrophobicContact CG-CD2 4Å; F237-L253 HydrophobicContact CG-CG 4.27Å; F237-L253 HydrophobicContact CZ-CG 4.43Å; K241-L253 HydrophobicContact CB-CD2 4.23Å; L245-L253 HydrophobicContact CD1-CB 4.38Å; L245-L253 HydrophobicContact CD1-CD2 3.73Å; D249-L253 WeakPolarHBondContact O-CB 3.37Å; D249-L253 PolarHBondContact O-N 2.87Å; F250-L253 PolarHBondContact O-N 3.4Å; L253-Y257 HydrophobicContact CD1-CD2 4.28Å; L253-Y257 HydrophobicContact CD1-CE2 3.83Å; L253-Y257 WeakPolarHBondContact O-CD2 3.49Å |
| 254 | L | 96.4 | Very high | 96.6 | Very high | 21 Ų | 21 | 75 Ų | 75 | 11% | 0.11 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -67.6 | -39.9 | 173.7 | -68.6 | -175.3 | 0 | 0 | 0 | 112.2 | F237 F250 N251 E252 R256 Y257 L259 L264 V267 | F237-L254 HydrophobicContact CZ-CD2 4.13Å; F250-L254 HydrophobicContact CD1-CD1 4.32Å; F250-L254 HydrophobicContact CE1-CD1 3.67Å; F250-L254 HydrophobicContact CE1-CG 4.31Å; F250-L254 HydrophobicContact CE2-CD1 4.49Å; F250-L254 HydrophobicContact CE2-CD2 4.43Å; F250-L254 HydrophobicContact CE2-CG 4.4Å; F250-L254 HydrophobicContact CZ-CD1 3.78Å; F250-L254 HydrophobicContact CZ-CD2 4.36Å; F250-L254 HydrophobicContact CZ-CG 4.16Å; F250-L254 WeakPolarHBondContact O-CG 3.44Å; F250-L254 PolarHBondContact O-N 3.17Å; N251-L254 PolarHBondContact O-N 2.97Å; E252-L254 VanDerWaalsContact C-N 3.29Å; E252-L254 PolarHBondContact O-N 3.19Å; L254-R256 VanDerWaalsContact C-N 3.34Å; L254-R256 PolarHBondContact O-N 3.44Å; L254-Y257 PolarHBondContact O-N 3.36Å; L254-L259 HydrophobicContact CD2-CD1 3.83Å; L254-L264 HydrophobicContact CD1-CD2 4.19Å; L254-L264 HydrophobicContact CD2-CD2 3.88Å; L254-L264 HydrophobicContact CG-CD2 4.43Å; L254-V267 HydrophobicContact CD2-CG1 3.87Å |
| 255 | A | 95.5 | Very high | 96.7 | Very high | 87 Ų | 87 | 73.4 Ų | 73.4 | 72% | 0.719 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -68.4 | -30.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | N251 E252 Y257 | N251-A255 PolarHBondContact O-N 2.85Å; E252-A255 PolarHBondContact O-N 3.37Å; E252-A255 VanDerWaalsContact O-N 3.13Å; A255-Y257 VanDerWaalsContact C-N 3.27Å; A255-Y257 PolarHBondContact O-N 3.39Å |
| 256 | R | 95.4 | Very high | 96.7 | Very high | 164 Ų | 164 | 72.5 Ų | 72.5 | 62% | 0.619 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -11.2 | 179.3 | -74.2 | 173.7 | -179.6 | -164.6 | 10.1 | 114.9 | E252 L254 | E252-R256 VanDerWaalsContact CD-NE 3.27Å; E252-R256 VanDerWaalsContact O-CG 3.3Å; E252-R256 WeakPolarHBondContact O-CG 3.36Å; E252-R256 PolarHBondContact O-N 3.08Å; E252-R256 IonicContact OE1-CZ 3.13Å; E252-R256 IonicContact OE1-NE 2.77Å; E252-R256 PolarHBondContact OE1-NE 3.06Å; E252-R256 IonicContact OE1-NH2 2.71Å; E252-R256 PolarHBondContact OE1-NH2 3.4Å; E252-R256 IonicContact OE2-CZ 3.43Å; E252-R256 IonicContact OE2-NE 3.54Å; E252-R256 IonicContact OE2-NH2 2.84Å; E252-R256 PolarHBondContact OE2-NH2 3.14Å; L254-R256 VanDerWaalsContact C-N 3.34Å; L254-R256 PolarHBondContact O-N 3.44Å |
| 257 | Y | 94.7 | Very high | 96.7 | Very high | 98 Ų | 98 | 69.4 Ų | 69.4 | 38% | 0.384 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -130 | 133.7 | -177.7 | -68.6 | -82.2 | 0 | 0 | 0 | 112.6 | P236 F237 L253 L254 A255 L259 | P236-Y257 HydrophobicContact CB-CD1 3.84Å; P236-Y257 HydrophobicContact CB-CE1 3.76Å; P236-Y257 HydrophobicContact CB-CG 4.49Å; P236-Y257 HydrophobicContact CG-CD1 3.37Å; P236-Y257 HydrophobicContact CG-CD2 4.2Å; P236-Y257 HydrophobicContact CG-CE1 3.77Å; P236-Y257 HydrophobicContact CG-CG 3.61Å; F237-Y257 AromaticContact CD1-CD2 3.68Å; F237-Y257 HydrophobicContact CD1-CD2 3.68Å; F237-Y257 AromaticContact CD1-CE2 3.74Å; F237-Y257 HydrophobicContact CD1-CE2 3.74Å; F237-Y257 HydrophobicContact CD1-CG 4.4Å; F237-Y257 AromaticContact CE1-CD2 3.73Å; F237-Y257 HydrophobicContact CE1-CD2 3.73Å; F237-Y257 HydrophobicContact CE1-CE2 4.27Å; F237-Y257 HydrophobicContact CE1-CG 4.29Å; L253-Y257 HydrophobicContact CD1-CD2 4.28Å; L253-Y257 HydrophobicContact CD1-CE2 3.83Å; L253-Y257 WeakPolarHBondContact O-CD2 3.49Å; L254-Y257 PolarHBondContact O-N 3.36Å; A255-Y257 VanDerWaalsContact C-N 3.27Å; A255-Y257 PolarHBondContact O-N 3.39Å; Y257-L259 PolarHBondContact O-N 2.98Å |
| 258 | P | 94 | Very high | 96.8 | Very high | 131 Ų | 131 | 72.7 Ų | 72.7 | 85% | 0.851 | 38% | 0.383 | S | S | * | . | trans | -75 | 86.6 | 176.4 | 31.1 | -34.5 | 0 | 0 | 0 | 110.7 | ||||
| 259 | L | 95.9 | Very high | 96.8 | Very high | 28 Ų | 28 | 69 Ų | 69 | 15% | 0.147 | 36% | 0.364 | C | S | . | . | trans | -95.4 | 142.2 | -179.7 | -62.6 | 172.8 | 0 | 0 | 0 | 111.8 | I235 P236 F237 L254 Y257 Q263 L264 | I235-L259 HydrophobicContact CD1-CD2 4.5Å; P236-L259 HydrophobicContact CG-CD2 4.29Å; F237-L259 HydrophobicContact CE1-CD1 4.08Å; F237-L259 HydrophobicContact CZ-CD1 3.84Å; L254-L259 HydrophobicContact CD2-CD1 3.83Å; Y257-L259 PolarHBondContact O-N 2.98Å; L259-Q263 HydrophobicContact CB-CB 4.2Å; L259-Q263 HydrophobicContact CD2-CB 4.3Å; L259-L264 HydrophobicContact CB-CD2 3.96Å; L259-L264 HydrophobicContact CB-CG 3.93Å; L259-L264 HydrophobicContact CD1-CD2 3.86Å | ||
| 260 | T | 97.4 | Very high | 96.8 | Very high | 71 Ų | 71 | 65.3 Ų | 65.3 | 44% | 0.436 | 34% | 0.344 | S | S | . | . | trans | -70.8 | 159.8 | 171.1 | 70.7 | 0 | 0 | 0 | 0 | 111.3 | S262 Q263 L264 | T260-S262 PolarHBondContact O-N 3.35Å; T260-S262 PolarHBondContact OG1-OG 2.86Å; T260-Q263 WeakPolarHBondContact O-CB 3.48Å; T260-Q263 PolarHBondContact O-N 3.21Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.43Å; T260-Q263 PolarHBondContact OG1-N 3.02Å; T260-Q263 VanDerWaalsContact OG1-N 3.09Å; T260-L264 WeakPolarHBondContact O-CG 2.75Å; T260-L264 PolarHBondContact O-N 2.99Å | ||
| 261 | E | 97.1 | Very high | 96.8 | Very high | 167 Ų | 167 | 67 Ų | 67 | 78% | 0.78 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -55.2 | -40.5 | 173.4 | -176 | 175.2 | -153.9 | 0 | 0 | 112.5 | Q263 L264 A265 | E261-Q263 PolarHBondContact O-N 3.12Å; E261-L264 PolarHBondContact O-N 3.46Å; E261-A265 WeakPolarHBondContact O-CB 3.48Å; E261-A265 PolarHBondContact O-N 2.91Å |
| 262 | S | 97.6 | Very high | 96.9 | Very high | 70 Ų | 70 | 70.8 Ų | 70.8 | 49% | 0.49 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -67.2 | -33.1 | 176.5 | 54.1 | 0 | 0 | 0 | 0 | 113.5 | T260 L266 | T260-S262 PolarHBondContact O-N 3.35Å; T260-S262 PolarHBondContact OG1-OG 2.86Å; S262-L266 PolarHBondContact O-N 3.13Å |
| 263 | Q | 97.9 | Very high | 97 | Very high | 29 Ų | 29 | 69.3 Ų | 69.3 | 14% | 0.136 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -69.1 | -45.6 | 170.1 | -73.6 | 173.3 | -37.6 | 0 | 0 | 111.1 | M233 I235 L259 T260 E261 A265 L266 V267 | M233-Q263 HydrophobicContact CE-CG 3.93Å; M233-Q263 PolarHBondContact O-NE2 3.31Å; I235-Q263 HydrophobicContact CD1-CB 3.62Å; I235-Q263 HydrophobicContact CD1-CG 3.69Å; L259-Q263 HydrophobicContact CB-CB 4.2Å; L259-Q263 HydrophobicContact CD2-CB 4.3Å; T260-Q263 WeakPolarHBondContact O-CB 3.48Å; T260-Q263 PolarHBondContact O-N 3.21Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.43Å; T260-Q263 PolarHBondContact OG1-N 3.02Å; T260-Q263 VanDerWaalsContact OG1-N 3.09Å; E261-Q263 PolarHBondContact O-N 3.12Å; Q263-A265 VanDerWaalsContact C-N 3.34Å; Q263-A265 PolarHBondContact O-N 2.96Å; Q263-L266 PolarHBondContact O-N 2.76Å; Q263-V267 VanDerWaalsContact O-CG2 3.31Å; Q263-V267 WeakPolarHBondContact O-CG2 3.36Å; Q263-V267 PolarHBondContact O-N 3.44Å |
| 264 | L | 97.8 | Very high | 97 | Very high | 38 Ų | 38 | 69 Ų | 69 | 20% | 0.199 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.9 | -41.2 | 177.6 | -69.9 | 170.1 | 0 | 0 | 0 | 112.1 | L254 L259 T260 E261 V267 R268 | L254-L264 HydrophobicContact CD1-CD2 4.19Å; L254-L264 HydrophobicContact CD2-CD2 3.88Å; L254-L264 HydrophobicContact CG-CD2 4.43Å; L259-L264 HydrophobicContact CB-CD2 3.96Å; L259-L264 HydrophobicContact CB-CG 3.93Å; L259-L264 HydrophobicContact CD1-CD2 3.86Å; T260-L264 WeakPolarHBondContact O-CG 2.75Å; T260-L264 PolarHBondContact O-N 2.99Å; E261-L264 PolarHBondContact O-N 3.46Å; L264-V267 PolarHBondContact O-N 2.89Å; L264-R268 WeakPolarHBondContact O-CB 3.33Å; L264-R268 VanDerWaalsContact O-CG 3.26Å; L264-R268 WeakPolarHBondContact O-CG 3.42Å; L264-R268 PolarHBondContact O-N 3.46Å |
| 265 | A | 97.9 | Very high | 97.1 | Very high | 55 Ų | 55 | 72 Ų | 72 | 46% | 0.455 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.8 | -45.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E261 Q263 D269 | E261-A265 WeakPolarHBondContact O-CB 3.48Å; E261-A265 PolarHBondContact O-N 2.91Å; Q263-A265 VanDerWaalsContact C-N 3.34Å; Q263-A265 PolarHBondContact O-N 2.96Å; A265-D269 WeakPolarHBondContact O-CB 3.42Å; A265-D269 PolarHBondContact O-N 3.05Å |
| 266 | L | 97.8 | Very high | 97.2 | Very high | 21 Ų | 21 | 73.3 Ų | 73.3 | 11% | 0.11 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.6 | -48.4 | 174.6 | 176.3 | 63.5 | 0 | 0 | 0 | 111.6 | R229 M233 S262 Q263 R268 D269 I270 | R229-L266 HydrophobicContact CB-CD1 4.18Å; R229-L266 HydrophobicContact CB-CD2 4.14Å; M233-L266 HydrophobicContact CB-CD2 3.81Å; M233-L266 HydrophobicContact CG-CD2 3.61Å; S262-L266 PolarHBondContact O-N 3.13Å; Q263-L266 PolarHBondContact O-N 2.76Å; L266-R268 VanDerWaalsContact C-N 3.32Å; L266-R268 PolarHBondContact O-N 3.27Å; L266-D269 PolarHBondContact O-N 3.5Å; L266-D269 VanDerWaalsContact O-N 3.17Å; L266-I270 HydrophobicContact CD1-CD1 3.84Å; L266-I270 HydrophobicContact CD1-CG1 3.93Å; L266-I270 HydrophobicContact CD2-CD1 4.31Å; L266-I270 HydrophobicContact CG-CD1 3.77Å; L266-I270 HydrophobicContact CG-CG1 4.23Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.39Å; L266-I270 PolarHBondContact O-N 2.89Å |
| 267 | V | 98.1 | Very high | 97.3 | Very high | 0 Ų | 0 | 72 Ų | 72 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61 | -40.7 | -178 | 171.5 | 0 | 0 | 0 | 0 | 111.3 | I235 F237 I242 F250 L254 Q263 L264 I270 R271 | I235-V267 HydrophobicContact CD1-CG2 3.78Å; I235-V267 HydrophobicContact CG1-CG2 4.14Å; I235-V267 HydrophobicContact CG2-CG2 4Å; F237-V267 HydrophobicContact CE2-CG1 4.15Å; F237-V267 HydrophobicContact CE2-CG2 4.14Å; F237-V267 HydrophobicContact CZ-CG1 4.45Å; F237-V267 HydrophobicContact CZ-CG2 4.35Å; I242-V267 HydrophobicContact CD1-CB 4.43Å; I242-V267 HydrophobicContact CD1-CG1 3.98Å; I242-V267 HydrophobicContact CD1-CG2 4.05Å; I242-V267 HydrophobicContact CG1-CG1 4.04Å; I242-V267 HydrophobicContact CG2-CG1 3.88Å; I242-V267 VanDerWaalsContact CG2-O 3.24Å; I242-V267 WeakPolarHBondContact CG2-O 3.34Å; F250-V267 HydrophobicContact CE2-CG1 3.76Å; F250-V267 HydrophobicContact CZ-CG1 3.9Å; L254-V267 HydrophobicContact CD2-CG1 3.87Å; Q263-V267 VanDerWaalsContact O-CG2 3.31Å; Q263-V267 WeakPolarHBondContact O-CG2 3.36Å; Q263-V267 PolarHBondContact O-N 3.44Å; L264-V267 PolarHBondContact O-N 2.89Å; V267-I270 PolarHBondContact O-N 2.99Å; V267-R271 PolarHBondContact O-N 2.84Å |
| 268 | R | 97.5 | Very high | 97.4 | Very high | 143 Ų | 143 | 70.2 Ų | 70.2 | 54% | 0.54 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.8 | -43.3 | 173.8 | -71.5 | 168.9 | -178.8 | 146.9 | -0.6 | 112.5 | L264 L266 R271 R272 | L264-R268 WeakPolarHBondContact O-CB 3.33Å; L264-R268 VanDerWaalsContact O-CG 3.26Å; L264-R268 WeakPolarHBondContact O-CG 3.42Å; L264-R268 PolarHBondContact O-N 3.46Å; L266-R268 VanDerWaalsContact C-N 3.32Å; L266-R268 PolarHBondContact O-N 3.27Å; R268-R271 PolarHBondContact O-N 2.83Å; R268-R272 WeakPolarHBondContact O-CB 3.25Å; R268-R272 PolarHBondContact O-N 3.24Å |
| 269 | D | 97.9 | Very high | 97.6 | Very high | 35 Ų | 35 | 66.6 Ų | 66.6 | 19% | 0.187 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -66.2 | -39.5 | 177.5 | 175.7 | 50.6 | 0 | 0 | 0 | 112.5 | A265 L266 R272 R273 | A265-D269 WeakPolarHBondContact O-CB 3.42Å; A265-D269 PolarHBondContact O-N 3.05Å; L266-D269 PolarHBondContact O-N 3.5Å; L266-D269 VanDerWaalsContact O-N 3.17Å; D269-R272 PolarHBondContact O-N 3.31Å; D269-R272 IonicContact OD1-CZ 2.77Å; D269-R272 IonicContact OD1-NE 3.34Å; D269-R272 IonicContact OD1-NH2 3.36Å; D269-R272 PolarHBondContact OD1-NH2 3.46Å; D269-R273 WeakPolarHBondContact O-CG 3.31Å; D269-R273 PolarHBondContact O-N 3.46Å; D269-R273 IonicContact OD1-CZ 2.83Å; D269-R273 IonicContact OD1-NE 3.33Å; D269-R273 PolarHBondContact OD1-NE 2.95Å; D269-R273 IonicContact OD1-NH2 3.52Å; D269-R273 PolarHBondContact OD1-NH2 3.41Å; D269-R273 IonicContact OD2-CZ 3.44Å; D269-R273 IonicContact OD2-NE 3.35Å; D269-R273 IonicContact OD2-NH1 2.6Å; D269-R273 PolarHBondContact OD2-NH1 3.25Å; D269-R273 IonicContact OD2-NH2 2.91Å; D269-R273 PolarHBondContact OD2-NH2 3.46Å |
| 270 | I | 97.4 | Very high | 97.7 | Very high | 3 Ų | 3 | 67.1 Ų | 67.1 | 2% | 0.015 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.7 | -49.4 | 171.7 | -66.8 | 177.3 | 0 | 0 | 0 | 110.4 | D226 A230 T239 I242 V243 L266 V267 R272 R273 G274 | D226-I270 HydrophobicContact CB-CD1 4.08Å; D226-I270 HydrophobicContact CB-CG1 3.87Å; D226-I270 HydrophobicContact CB-CG2 4.25Å; D226-I270 WeakPolarHBondContact O-CD1 3.3Å; A230-I270 HydrophobicContact CB-CD1 4.31Å; T239-I270 HydrophobicContact CG2-CD1 4.37Å; T239-I270 HydrophobicContact CG2-CG2 4.2Å; I242-I270 HydrophobicContact CB-CG2 4.33Å; I242-I270 HydrophobicContact CD1-CG2 4.4Å; I242-I270 HydrophobicContact CG2-CB 4.08Å; I242-I270 HydrophobicContact CG2-CG2 3.81Å; V243-I270 HydrophobicContact CG2-CG2 4.35Å; L266-I270 HydrophobicContact CD1-CD1 3.84Å; L266-I270 HydrophobicContact CD1-CG1 3.93Å; L266-I270 HydrophobicContact CD2-CD1 4.31Å; L266-I270 HydrophobicContact CG-CD1 3.77Å; L266-I270 HydrophobicContact CG-CG1 4.23Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.39Å; L266-I270 PolarHBondContact O-N 2.89Å; V267-I270 PolarHBondContact O-N 2.99Å; I270-R272 PolarHBondContact O-N 3.44Å; I270-R273 PolarHBondContact O-N 3.35Å; I270-G274 PolarHBondContact O-N 2.75Å |
| 271 | R | 98.1 | Very high | 97.8 | Very high | 44 Ų | 44 | 68.8 Ų | 68.8 | 17% | 0.166 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57.9 | -47.4 | 177.7 | -172.9 | 162.5 | -164 | -109.8 | 7.2 | 111.6 | I242 L245 P246 F250 V267 R268 R273 G274 K275 | I242-R271 HydrophobicContact CG2-CB 3.74Å; I242-R271 WeakPolarHBondContact O-CD 3.01Å; I242-R271 WeakPolarHBondContact O-CG 3.46Å; I242-R271 PolarHBondContact O-NE 2.86Å; L245-R271 PolarHBondContact O-NH2 2.76Å; P246-R271 VanDerWaalsContact C-NH2 3.29Å; P246-R271 PolarHBondContact O-NH2 3.44Å; F250-R271 HydrophobicContact CZ-CB 4.47Å; V267-R271 PolarHBondContact O-N 2.84Å; R268-R271 PolarHBondContact O-N 2.83Å; R271-R273 PolarHBondContact O-N 3.4Å; R271-G274 PolarHBondContact O-N 3.02Å; R271-K275 HydrophobicContact CG-CG 4.35Å; R271-K275 WeakPolarHBondContact O-CG 3.33Å; R271-K275 PolarHBondContact O-N 2.92Å |
| 272 | R | 98 | Very high | 97.8 | Very high | 165 Ų | 165 | 64.6 Ų | 64.6 | 62% | 0.623 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -57.7 | -46.3 | 178.3 | -175 | -174.8 | 66.5 | 101.3 | 1.1 | 112 | R268 D269 I270 N276 | R268-R272 WeakPolarHBondContact O-CB 3.25Å; R268-R272 PolarHBondContact O-N 3.24Å; D269-R272 PolarHBondContact O-N 3.31Å; D269-R272 IonicContact OD1-CZ 2.77Å; D269-R272 IonicContact OD1-NE 3.34Å; D269-R272 IonicContact OD1-NH2 3.36Å; D269-R272 PolarHBondContact OD1-NH2 3.46Å; I270-R272 PolarHBondContact O-N 3.44Å; R272-N276 VanDerWaalsContact O-CB 3.25Å; R272-N276 WeakPolarHBondContact O-CB 3.41Å; R272-N276 PolarHBondContact O-N 3.26Å |
| 273 | R | 97.8 | Very high | 97.9 | Very high | 67 Ų | 67 | 65.4 Ų | 65.4 | 25% | 0.253 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -65.5 | -44.4 | 176.4 | -72.9 | 175.5 | -173.3 | 155.8 | 11.5 | 112.6 | R225 D226 D269 I270 R271 N276 K277 | R225-R273 VanDerWaalsContact NH2-NH1 3.12Å; D226-R273 IonicContact OD1-NH1 2.69Å; D226-R273 PolarHBondContact OD1-NH1 2.87Å; D226-R273 WeakPolarHBondContact OD2-CD 3.47Å; D226-R273 IonicContact OD2-NH1 3.61Å; D226-R273 PolarHBondContact OD2-NH1 3.5Å; D269-R273 WeakPolarHBondContact O-CG 3.31Å; D269-R273 PolarHBondContact O-N 3.46Å; D269-R273 IonicContact OD1-CZ 2.83Å; D269-R273 IonicContact OD1-NE 3.33Å; D269-R273 PolarHBondContact OD1-NE 2.95Å; D269-R273 IonicContact OD1-NH2 3.52Å; D269-R273 PolarHBondContact OD1-NH2 3.41Å; D269-R273 IonicContact OD2-CZ 3.44Å; D269-R273 IonicContact OD2-NE 3.35Å; D269-R273 IonicContact OD2-NH1 2.6Å; D269-R273 PolarHBondContact OD2-NH1 3.25Å; D269-R273 IonicContact OD2-NH2 2.91Å; D269-R273 PolarHBondContact OD2-NH2 3.46Å; I270-R273 PolarHBondContact O-N 3.35Å; R271-R273 PolarHBondContact O-N 3.4Å; R273-N276 PolarHBondContact O-N 2.86Å; R273-K277 WeakPolarHBondContact O-CB 3.44Å; R273-K277 PolarHBondContact O-N 3.43Å |
| 274 | G | 97.2 | Very high | 97.9 | Very high | 12 Ų | 12 | 72.9 Ų | 72.9 | 12% | 0.124 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61.9 | -49.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I270 R271 N276 K277 V278 | I270-G274 PolarHBondContact O-N 2.75Å; R271-G274 PolarHBondContact O-N 3.02Å; G274-N276 VanDerWaalsContact C-N 3.33Å; G274-N276 PolarHBondContact O-N 2.91Å; G274-K277 WeakPolarHBondContact O-CB 3.4Å; G274-K277 PolarHBondContact O-N 3.39Å; G274-V278 WeakPolarHBondContact O-CG2 3.48Å; G274-V278 PolarHBondContact O-N 2.77Å; G274-V278 VanDerWaalsContact O-N 3.08Å |
| 275 | K | 97.3 | Very high | 98 | Very high | 85 Ų | 85 | 76.7 Ų | 76.7 | 37% | 0.37 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.5 | -39.1 | 174.5 | -64.9 | -62 | -162.5 | -161.1 | 0 | 111.6 | V243 N244 L245 R271 V278 A279 | V243-K275 WeakPolarHBondContact O-CD 3.28Å; V243-K275 WeakPolarHBondContact O-CE 3.44Å; V243-K275 PolarHBondContact O-NZ 3.29Å; N244-K275 PolarHBondContact O-NZ 2.91Å; L245-K275 PolarHBondContact O-NZ 2.91Å; R271-K275 HydrophobicContact CG-CG 4.35Å; R271-K275 WeakPolarHBondContact O-CG 3.33Å; R271-K275 PolarHBondContact O-N 2.92Å; K275-V278 PolarHBondContact O-N 3.36Å; K275-A279 WeakPolarHBondContact O-CB 3.44Å; K275-A279 PolarHBondContact O-N 3Å |
| 276 | N | 98.3 | Very high | 98 | Very high | 113 Ų | 113 | 82.4 Ų | 82.4 | 60% | 0.604 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -64.3 | -42.4 | 175.4 | -178 | -84.9 | 0 | 0 | 0 | 112.7 | R272 R273 G274 V278 A279 A280 | R272-N276 VanDerWaalsContact O-CB 3.25Å; R272-N276 WeakPolarHBondContact O-CB 3.41Å; R272-N276 PolarHBondContact O-N 3.26Å; R273-N276 PolarHBondContact O-N 2.86Å; G274-N276 VanDerWaalsContact C-N 3.33Å; G274-N276 PolarHBondContact O-N 2.91Å; N276-V278 VanDerWaalsContact C-N 3.35Å; N276-V278 PolarHBondContact O-N 3.17Å; N276-A279 PolarHBondContact O-N 3.06Å; N276-A280 WeakPolarHBondContact O-CB 3.34Å; N276-A280 PolarHBondContact O-N 3.4Å |
| 277 | K | 97.1 | Very high | 98.1 | Very high | 138 Ų | 138 | 87.6 Ų | 87.6 | 60% | 0.6 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -56.6 | -47.9 | 173.5 | 179.7 | -172.4 | 172.9 | -170.7 | 0 | 111.2 | R273 G274 A280 Q281 | R273-K277 WeakPolarHBondContact O-CB 3.44Å; R273-K277 PolarHBondContact O-N 3.43Å; G274-K277 WeakPolarHBondContact O-CB 3.4Å; G274-K277 PolarHBondContact O-N 3.39Å; K277-A280 PolarHBondContact O-N 2.94Å; K277-Q281 WeakPolarHBondContact O-CG 3.49Å; K277-Q281 PolarHBondContact O-N 2.69Å |
| 278 | V | 97 | Very high | 98.1 | Very high | 59 Ų | 59 | 93 Ų | 93 | 36% | 0.358 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65.4 | -41.6 | 177.5 | 175.1 | 0 | 0 | 0 | 0 | 111.4 | G274 K275 N276 A280 Q281 N282 | G274-V278 WeakPolarHBondContact O-CG2 3.48Å; G274-V278 PolarHBondContact O-N 2.77Å; G274-V278 VanDerWaalsContact O-N 3.08Å; K275-V278 PolarHBondContact O-N 3.36Å; N276-V278 VanDerWaalsContact C-N 3.35Å; N276-V278 PolarHBondContact O-N 3.17Å; V278-A280 PolarHBondContact O-N 3.22Å; V278-Q281 PolarHBondContact O-N 3.18Å; V278-N282 WeakPolarHBondContact O-CB 3.28Å; V278-N282 PolarHBondContact O-N 3.48Å |
| 279 | A | 98.2 | Very high | 98.2 | Very high | 55 Ų | 55 | 90.7 Ų | 90.7 | 46% | 0.455 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.9 | -42 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K275 N276 N282 C283 | K275-A279 WeakPolarHBondContact O-CB 3.44Å; K275-A279 PolarHBondContact O-N 3Å; N276-A279 PolarHBondContact O-N 3.06Å; A279-N282 PolarHBondContact O-N 2.94Å; A279-C283 VanDerWaalsContact O-CB 3.28Å; A279-C283 WeakPolarHBondContact O-CB 3.36Å; A279-C283 PolarHBondContact O-N 2.89Å |
| 280 | A | 98.7 | Very high | 98.2 | Very high | 39 Ų | 39 | 92.4 Ų | 92.4 | 32% | 0.322 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66 | -38.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N276 K277 V278 R284 | N276-A280 WeakPolarHBondContact O-CB 3.34Å; N276-A280 PolarHBondContact O-N 3.4Å; K277-A280 PolarHBondContact O-N 2.94Å; V278-A280 PolarHBondContact O-N 3.22Å; A280-R284 VanDerWaalsContact O-CG 3.28Å; A280-R284 WeakPolarHBondContact O-CG 3.35Å; A280-R284 PolarHBondContact O-N 2.96Å; A280-R284 VanDerWaalsContact O-N 3.08Å |
| 281 | Q | 98.4 | Very high | 98.3 | Very high | 106 Ų | 106 | 95.2 Ų | 95.2 | 50% | 0.495 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.1 | -46.3 | 172.8 | -73.3 | 176.5 | -63.8 | 0 | 0 | 111.5 | K277 V278 C283 R284 K285 | K277-Q281 WeakPolarHBondContact O-CG 3.49Å; K277-Q281 PolarHBondContact O-N 2.69Å; V278-Q281 PolarHBondContact O-N 3.18Å; Q281-C283 PolarHBondContact O-N 3.25Å; Q281-R284 PolarHBondContact O-N 3.36Å; Q281-K285 WeakPolarHBondContact O-CB 3.42Å; Q281-K285 PolarHBondContact O-N 3.44Å |
| 282 | N | 98.6 | Very high | 98.3 | Very high | 80 Ų | 80 | 96 Ų | 96 | 43% | 0.428 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.3 | -36.4 | 178.5 | -72.5 | -10.7 | 0 | 0 | 0 | 112.6 | V278 A279 K285 R286 | V278-N282 WeakPolarHBondContact O-CB 3.28Å; V278-N282 PolarHBondContact O-N 3.48Å; A279-N282 PolarHBondContact O-N 2.94Å; N282-K285 PolarHBondContact O-N 3.47Å; N282-R286 WeakPolarHBondContact O-CB 3.4Å; N282-R286 VanDerWaalsContact O-CG 3.31Å; N282-R286 WeakPolarHBondContact O-CG 3.35Å; N282-R286 PolarHBondContact O-N 3.44Å |
| 283 | C | 98.7 | Very high | 98.3 | Very high | 87 Ų | 87 | 92 Ų | 92 | 59% | 0.588 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -63.3 | -48.2 | 173.9 | -177.6 | 0 | 0 | 0 | 0 | 111.4 | A279 Q281 R286 K287 | A279-C283 VanDerWaalsContact O-CB 3.28Å; A279-C283 WeakPolarHBondContact O-CB 3.36Å; A279-C283 PolarHBondContact O-N 2.89Å; Q281-C283 PolarHBondContact O-N 3.25Å; C283-R286 PolarHBondContact O-N 3.29Å; C283-K287 WeakPolarHBondContact O-CB 3.31Å; C283-K287 PolarHBondContact O-N 2.94Å |
| 284 | R | 98.8 | Very high | 98.4 | Very high | 186 Ų | 186 | 93 Ų | 93 | 70% | 0.702 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -61.5 | -44.3 | 175.1 | -70.6 | 170.3 | -176.3 | -174.3 | 0 | 112 | A280 Q281 K287 L288 | A280-R284 VanDerWaalsContact O-CG 3.28Å; A280-R284 WeakPolarHBondContact O-CG 3.35Å; A280-R284 PolarHBondContact O-N 2.96Å; A280-R284 VanDerWaalsContact O-N 3.08Å; Q281-R284 PolarHBondContact O-N 3.36Å; R284-K287 PolarHBondContact O-N 2.97Å; R284-L288 WeakPolarHBondContact O-CG 3.46Å; R284-L288 PolarHBondContact O-N 3Å |
| 285 | K | 98.6 | Very high | 98.5 | Very high | 118 Ų | 118 | 97.7 Ų | 97.7 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57.1 | -55.3 | 176.1 | 178.5 | 179.8 | 164.6 | 176.3 | 0 | 110.6 | Q281 N282 K287 L288 E289 | Q281-K285 WeakPolarHBondContact O-CB 3.42Å; Q281-K285 PolarHBondContact O-N 3.44Å; N282-K285 PolarHBondContact O-N 3.47Å; K285-K287 VanDerWaalsContact C-N 3.33Å; K285-K287 PolarHBondContact O-N 2.92Å; K285-L288 PolarHBondContact O-N 2.96Å; K285-L288 VanDerWaalsContact O-N 3.14Å; K285-E289 WeakPolarHBondContact CE-OE1 3.27Å; K285-E289 WeakPolarHBondContact CE-OE2 3.33Å; K285-E289 HydrophobicContact CG-CG 4.37Å; K285-E289 IonicContact NZ-OE1 3.54Å; K285-E289 PolarHBondContact NZ-OE1 3.25Å; K285-E289 WeakPolarHBondContact O-CG 3.48Å; K285-E289 PolarHBondContact O-N 3.41Å |
| 286 | R | 98.9 | Very high | 98.5 | Very high | 175 Ų | 175 | 100.4 Ų | 100.4 | 66% | 0.66 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -56.1 | -44.4 | 177.7 | -74.3 | 175.4 | -178.3 | 178.6 | -1.2 | 112.3 | N282 C283 L288 E289 T290 | N282-R286 WeakPolarHBondContact O-CB 3.4Å; N282-R286 VanDerWaalsContact O-CG 3.31Å; N282-R286 WeakPolarHBondContact O-CG 3.35Å; N282-R286 PolarHBondContact O-N 3.44Å; C283-R286 PolarHBondContact O-N 3.29Å; R286-L288 VanDerWaalsContact C-N 3.32Å; R286-L288 PolarHBondContact O-N 2.96Å; R286-E289 PolarHBondContact O-N 2.87Å; R286-T290 PolarHBondContact O-N 3.37Å; R286-T290 PolarHBondContact O-OG1 2.73Å |
| 287 | K | 98.8 | Very high | 98.6 | Very high | 130 Ų | 130 | 98.6 Ų | 98.6 | 57% | 0.565 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.8 | -37.6 | 179.5 | -177.7 | 57.1 | 179.1 | 174.1 | 0 | 112.4 | C283 R284 K285 I291 | C283-K287 WeakPolarHBondContact O-CB 3.31Å; C283-K287 PolarHBondContact O-N 2.94Å; R284-K287 PolarHBondContact O-N 2.97Å; K285-K287 VanDerWaalsContact C-N 3.33Å; K285-K287 PolarHBondContact O-N 2.92Å; K287-I291 HydrophobicContact CD-CD1 4.5Å; K287-I291 HydrophobicContact CG-CD1 4.32Å; K287-I291 WeakPolarHBondContact O-CD1 3.3Å; K287-I291 VanDerWaalsContact O-CG1 3.27Å; K287-I291 WeakPolarHBondContact O-CG1 3.29Å; K287-I291 PolarHBondContact O-N 3.43Å; K287-I291 VanDerWaalsContact O-N 3.12Å |
| 288 | L | 98.8 | Very high | 98.6 | Very high | 112 Ų | 112 | 97.8 Ų | 97.8 | 59% | 0.586 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -70.2 | -41.3 | 173.4 | -68.5 | 169.7 | 0 | 0 | 0 | 111.9 | R284 K285 R286 T290 I291 V292 | R284-L288 WeakPolarHBondContact O-CG 3.46Å; R284-L288 PolarHBondContact O-N 3Å; K285-L288 PolarHBondContact O-N 2.96Å; K285-L288 VanDerWaalsContact O-N 3.14Å; R286-L288 VanDerWaalsContact C-N 3.32Å; R286-L288 PolarHBondContact O-N 2.96Å; L288-T290 VanDerWaalsContact C-N 3.32Å; L288-T290 PolarHBondContact O-N 3.1Å; L288-I291 PolarHBondContact O-N 3.26Å; L288-V292 WeakPolarHBondContact O-CG2 3.46Å; L288-V292 PolarHBondContact O-N 2.89Å |
| 289 | E | 98.8 | Very high | 98.7 | Very high | 96 Ų | 96 | 101 Ų | 101 | 45% | 0.449 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.2 | -40.8 | 174.6 | -70.6 | 171 | 140.3 | 0 | 0 | 111.7 | K285 R286 Q293 | K285-E289 WeakPolarHBondContact CE-OE1 3.27Å; K285-E289 WeakPolarHBondContact CE-OE2 3.33Å; K285-E289 HydrophobicContact CG-CG 4.37Å; K285-E289 IonicContact NZ-OE1 3.54Å; K285-E289 PolarHBondContact NZ-OE1 3.25Å; K285-E289 WeakPolarHBondContact O-CG 3.48Å; K285-E289 PolarHBondContact O-N 3.41Å; R286-E289 PolarHBondContact O-N 2.87Å; E289-Q293 WeakPolarHBondContact O-CB 3.45Å; E289-Q293 PolarHBondContact O-N 2.94Å |
| 290 | T | 98.8 | Very high | 98.7 | Very high | 71 Ų | 71 | 105.7 Ų | 105.7 | 44% | 0.436 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -41 | 173.2 | -54.4 | 0 | 0 | 0 | 0 | 112.5 | R286 L288 Q293 L294 | R286-T290 PolarHBondContact O-N 3.37Å; R286-T290 PolarHBondContact O-OG1 2.73Å; L288-T290 VanDerWaalsContact C-N 3.32Å; L288-T290 PolarHBondContact O-N 3.1Å; T290-Q293 PolarHBondContact O-N 3.47Å; T290-L294 HydrophobicContact CG2-CD1 4Å; T290-L294 HydrophobicContact CG2-CG 4.46Å; T290-L294 VanDerWaalsContact O-CG 3.29Å; T290-L294 WeakPolarHBondContact O-CG 3.33Å; T290-L294 PolarHBondContact O-N 3.2Å |
| 291 | I | 98.8 | Very high | 98.8 | Very high | 62 Ų | 62 | 108.4 Ų | 108.4 | 32% | 0.318 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -51.6 | 177 | -72 | 162.2 | 0 | 0 | 0 | 110.1 | K287 L288 Q293 L294 E295 | K287-I291 HydrophobicContact CD-CD1 4.5Å; K287-I291 HydrophobicContact CG-CD1 4.32Å; K287-I291 WeakPolarHBondContact O-CD1 3.3Å; K287-I291 VanDerWaalsContact O-CG1 3.27Å; K287-I291 WeakPolarHBondContact O-CG1 3.29Å; K287-I291 PolarHBondContact O-N 3.43Å; K287-I291 VanDerWaalsContact O-N 3.12Å; L288-I291 PolarHBondContact O-N 3.26Å; I291-Q293 PolarHBondContact O-N 3.49Å; I291-L294 PolarHBondContact O-N 3.09Å; I291-L294 VanDerWaalsContact O-N 3.13Å; I291-E295 HydrophobicContact CG2-CG 4.42Å; I291-E295 WeakPolarHBondContact CG2-OE1 3.47Å; I291-E295 WeakPolarHBondContact O-CG 3.42Å; I291-E295 PolarHBondContact O-N 3.03Å |
| 292 | V | 98.8 | Very high | 98.8 | Very high | 61 Ų | 61 | 106.7 Ų | 106.7 | 37% | 0.37 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -30.6 | 179.6 | 174.9 | 0 | 0 | 0 | 0 | 112.3 | L288 E295 R296 | L288-V292 WeakPolarHBondContact O-CG2 3.46Å; L288-V292 PolarHBondContact O-N 2.89Å; V292-E295 WeakPolarHBondContact CA-OE2 3.49Å; V292-R296 WeakPolarHBondContact O-CG 3.31Å; V292-R296 PolarHBondContact O-N 3.36Å |
| 293 | Q | 98.8 | Very high | 98.8 | Very high | 80 Ų | 80 | 107.1 Ų | 107.1 | 37% | 0.374 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -70.5 | -44.4 | 173.7 | -176.8 | 57.5 | 22.6 | 0 | 0 | 112.2 | E289 T290 I291 E295 R296 E297 | E289-Q293 WeakPolarHBondContact O-CB 3.45Å; E289-Q293 PolarHBondContact O-N 2.94Å; T290-Q293 PolarHBondContact O-N 3.47Å; I291-Q293 PolarHBondContact O-N 3.49Å; Q293-E295 VanDerWaalsContact C-N 3.33Å; Q293-E295 PolarHBondContact O-N 3.48Å; Q293-R296 PolarHBondContact O-N 2.92Å; Q293-E297 WeakPolarHBondContact CG-OE1 3.41Å; Q293-E297 PolarHBondContact NE2-OE1 3.41Å; Q293-E297 WeakPolarHBondContact O-CG 3.26Å; Q293-E297 PolarHBondContact O-N 3.43Å |
| 294 | L | 98.8 | Very high | 98.8 | Very high | 88 Ų | 88 | 106.3 Ų | 106.3 | 46% | 0.461 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.3 | -36.3 | 176.2 | -70.3 | 167.5 | 0 | 0 | 0 | 112.1 | T290 I291 R296 E297 L298 | T290-L294 HydrophobicContact CG2-CD1 4Å; T290-L294 HydrophobicContact CG2-CG 4.46Å; T290-L294 VanDerWaalsContact O-CG 3.29Å; T290-L294 WeakPolarHBondContact O-CG 3.33Å; T290-L294 PolarHBondContact O-N 3.2Å; I291-L294 PolarHBondContact O-N 3.09Å; I291-L294 VanDerWaalsContact O-N 3.13Å; L294-R296 PolarHBondContact O-N 2.9Å; L294-E297 PolarHBondContact O-N 3.45Å; L294-L298 WeakPolarHBondContact O-CB 3.38Å; L294-L298 VanDerWaalsContact O-CG 3.31Å; L294-L298 WeakPolarHBondContact O-CG 3.23Å; L294-L298 PolarHBondContact O-N 3.36Å |
| 295 | E | 98.8 | Very high | 98.8 | Very high | 111 Ų | 111 | 105.7 Ų | 105.7 | 52% | 0.519 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.9 | -45.8 | 174.4 | -73.6 | 166.7 | 170 | 0 | 0 | 111.6 | I291 V292 Q293 L298 E299 | I291-E295 HydrophobicContact CG2-CG 4.42Å; I291-E295 WeakPolarHBondContact CG2-OE1 3.47Å; I291-E295 WeakPolarHBondContact O-CG 3.42Å; I291-E295 PolarHBondContact O-N 3.03Å; V292-E295 WeakPolarHBondContact CA-OE2 3.49Å; Q293-E295 VanDerWaalsContact C-N 3.33Å; Q293-E295 PolarHBondContact O-N 3.48Å; E295-L298 PolarHBondContact O-N 3.02Å; E295-E299 PolarHBondContact O-N 3.02Å |
| 296 | R | 98.8 | Very high | 98.8 | Very high | 141 Ų | 141 | 104.5 Ų | 104.5 | 53% | 0.532 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.2 | -37.4 | 174.5 | -64.5 | 167.5 | -169.8 | 148.5 | -1 | 112.9 | V292 Q293 L294 E299 R300 | V292-R296 WeakPolarHBondContact O-CG 3.31Å; V292-R296 PolarHBondContact O-N 3.36Å; Q293-R296 PolarHBondContact O-N 2.92Å; L294-R296 PolarHBondContact O-N 2.9Å; R296-E299 PolarHBondContact O-N 3.01Å; R296-R300 WeakPolarHBondContact O-CB 3.45Å; R296-R300 PolarHBondContact O-N 2.99Å |
| 297 | E | 98.8 | Very high | 98.8 | Very high | 76 Ų | 76 | 102 Ų | 102 | 36% | 0.355 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -69.4 | -39.3 | 179.5 | -75.9 | 171 | -161.2 | 0 | 0 | 111.4 | Q293 L294 R300 L301 | Q293-E297 WeakPolarHBondContact CG-OE1 3.41Å; Q293-E297 PolarHBondContact NE2-OE1 3.41Å; Q293-E297 WeakPolarHBondContact O-CG 3.26Å; Q293-E297 PolarHBondContact O-N 3.43Å; L294-E297 PolarHBondContact O-N 3.45Å; E297-R300 PolarHBondContact O-N 3.26Å; E297-L301 WeakPolarHBondContact O-CB 3.41Å; E297-L301 VanDerWaalsContact O-CG 3.23Å; E297-L301 WeakPolarHBondContact O-CG 3.27Å; E297-L301 PolarHBondContact O-N 3.46Å |
| 298 | L | 98.9 | Very high | 98.8 | Very high | 121 Ų | 121 | 100.1 Ų | 100.1 | 63% | 0.634 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.8 | -44.8 | 170.9 | -72.1 | 169.8 | 0 | 0 | 0 | 111.8 | L294 E295 L301 S302 | L294-L298 WeakPolarHBondContact O-CB 3.38Å; L294-L298 VanDerWaalsContact O-CG 3.31Å; L294-L298 WeakPolarHBondContact O-CG 3.23Å; L294-L298 PolarHBondContact O-N 3.36Å; E295-L298 PolarHBondContact O-N 3.02Å; L298-L301 PolarHBondContact O-N 2.96Å; L298-S302 VanDerWaalsContact O-CB 3.3Å; L298-S302 WeakPolarHBondContact O-CB 3.23Å; L298-S302 PolarHBondContact O-N 3.39Å |
| 299 | E | 98.8 | Very high | 98.8 | Very high | 125 Ų | 125 | 99.1 Ų | 99.1 | 58% | 0.584 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -60.2 | -47.6 | 175.1 | -178.6 | 175.4 | -143.4 | 0 | 0 | 111.5 | E295 R296 L301 S302 N303 | E295-E299 PolarHBondContact O-N 3.02Å; R296-E299 PolarHBondContact O-N 3.01Å; E299-L301 PolarHBondContact O-N 3.5Å; E299-S302 PolarHBondContact O-N 3.34Å; E299-N303 WeakPolarHBondContact O-CB 3.44Å; E299-N303 VanDerWaalsContact O-CG 3.22Å; E299-N303 PolarHBondContact O-N 3.37Å; E299-N303 PolarHBondContact O-ND2 2.87Å |
| 300 | R | 98.8 | Very high | 98.8 | Very high | 154 Ų | 154 | 100.5 Ų | 100.5 | 58% | 0.581 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -58.5 | -45.9 | 176.6 | -172.6 | -172.8 | 70.2 | 84.4 | -0.5 | 112 | R296 E297 E304 | R296-R300 WeakPolarHBondContact O-CB 3.45Å; R296-R300 PolarHBondContact O-N 2.99Å; E297-R300 PolarHBondContact O-N 3.26Å; R300-E304 WeakPolarHBondContact O-CB 3.34Å; R300-E304 PolarHBondContact O-N 2.67Å |
| 301 | L | 98.9 | Very high | 98.8 | Very high | 96 Ų | 96 | 99.1 Ų | 99.1 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -69.1 | -35.2 | 179 | -71.1 | 170 | 0 | 0 | 0 | 112.2 | E297 L298 E299 R305 | E297-L301 WeakPolarHBondContact O-CB 3.41Å; E297-L301 VanDerWaalsContact O-CG 3.23Å; E297-L301 WeakPolarHBondContact O-CG 3.27Å; E297-L301 PolarHBondContact O-N 3.46Å; L298-L301 PolarHBondContact O-N 2.96Å; E299-L301 PolarHBondContact O-N 3.5Å; L301-R305 VanDerWaalsContact O-CB 3.26Å; L301-R305 WeakPolarHBondContact O-CB 3.47Å; L301-R305 PolarHBondContact O-N 2.99Å |
| 302 | S | 98.8 | Very high | 98.8 | Very high | 71 Ų | 71 | 103.1 Ų | 103.1 | 50% | 0.497 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.8 | -48.4 | 173.7 | -171.3 | 0 | 0 | 0 | 0 | 111.5 | L298 E299 E304 R305 E306 | L298-S302 VanDerWaalsContact O-CB 3.3Å; L298-S302 WeakPolarHBondContact O-CB 3.23Å; L298-S302 PolarHBondContact O-N 3.39Å; E299-S302 PolarHBondContact O-N 3.34Å; S302-E304 PolarHBondContact O-N 3.43Å; S302-R305 PolarHBondContact O-N 3.44Å; S302-E306 PolarHBondContact O-N 3.06Å |
| 303 | N | 98.8 | Very high | 98.8 | Very high | 89 Ų | 89 | 101 Ų | 101 | 48% | 0.476 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 179.2 | -68.5 | -20.9 | 0 | 0 | 0 | 112 | E299 E306 R307 | E299-N303 WeakPolarHBondContact O-CB 3.44Å; E299-N303 VanDerWaalsContact O-CG 3.22Å; E299-N303 PolarHBondContact O-N 3.37Å; E299-N303 PolarHBondContact O-ND2 2.87Å; N303-E306 PolarHBondContact O-N 3.16Å; N303-R307 WeakPolarHBondContact O-CB 3.43Å; N303-R307 PolarHBondContact O-N 2.9Å |
| 304 | E | 98.8 | Very high | 98.8 | Very high | 69 Ų | 69 | 102.2 Ų | 102.2 | 32% | 0.322 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.7 | -41.4 | 175.4 | 179.6 | 57.1 | -165.9 | 0 | 0 | 112.1 | R300 S302 E306 R307 L308 | R300-E304 WeakPolarHBondContact O-CB 3.34Å; R300-E304 PolarHBondContact O-N 2.67Å; S302-E304 PolarHBondContact O-N 3.43Å; E304-E306 VanDerWaalsContact C-N 3.3Å; E304-E306 PolarHBondContact O-N 2.98Å; E304-R307 WeakPolarHBondContact O-CB 3.37Å; E304-R307 PolarHBondContact O-N 2.74Å; E304-R307 IonicContact OE1-CZ 2.75Å; E304-R307 IonicContact OE1-NE 3.44Å; E304-R307 PolarHBondContact OE1-NE 3.45Å; E304-R307 IonicContact OE1-NH2 2.83Å; E304-R307 PolarHBondContact OE1-NH2 3.42Å; E304-R307 IonicContact OE2-CZ 3.84Å; E304-R307 IonicContact OE2-NE 3.62Å; E304-R307 PolarHBondContact OE2-NE 3.32Å; E304-R307 IonicContact OE2-NH2 2.84Å; E304-L308 HydrophobicContact CG-CD1 4.16Å; E304-L308 WeakPolarHBondContact O-CG 3.48Å; E304-L308 PolarHBondContact O-N 2.99Å |
| 305 | R | 98.8 | Very high | 98.8 | Very high | 173 Ų | 173 | 100.3 Ų | 100.3 | 65% | 0.653 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -58.5 | -42.7 | 172.2 | 177.4 | 177.6 | 177.8 | -105.1 | 0.8 | 111.4 | L301 S302 L308 L309 | L301-R305 VanDerWaalsContact O-CB 3.26Å; L301-R305 WeakPolarHBondContact O-CB 3.47Å; L301-R305 PolarHBondContact O-N 2.99Å; S302-R305 PolarHBondContact O-N 3.44Å; R305-L308 PolarHBondContact O-N 3.43Å; R305-L309 HydrophobicContact CG-CD1 4.07Å; R305-L309 WeakPolarHBondContact O-CB 3.42Å; R305-L309 VanDerWaalsContact O-CG 3.27Å; R305-L309 WeakPolarHBondContact O-CG 3.42Å; R305-L309 PolarHBondContact O-N 3.39Å |
| 306 | E | 98.8 | Very high | 98.8 | Very high | 93 Ų | 93 | 98.3 Ų | 98.3 | 44% | 0.435 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 177.4 | -150 | -144.3 | 135.7 | 0 | 0 | 111.6 | S302 N303 E304 L308 L309 R310 | S302-E306 PolarHBondContact O-N 3.06Å; N303-E306 PolarHBondContact O-N 3.16Å; E304-E306 VanDerWaalsContact C-N 3.3Å; E304-E306 PolarHBondContact O-N 2.98Å; E306-L308 PolarHBondContact O-N 3.28Å; E306-L309 PolarHBondContact O-N 3.02Å; E306-R310 WeakPolarHBondContact O-CG 3.34Å; E306-R310 PolarHBondContact O-N 3.31Å; E306-R310 IonicContact OE1-CZ 3.44Å; E306-R310 IonicContact OE1-NE 3.64Å; E306-R310 PolarHBondContact OE1-NE 2.79Å; E306-R310 IonicContact OE1-NH2 3.19Å; E306-R310 PolarHBondContact OE1-NH2 3.47Å; E306-R310 IonicContact OE2-CZ 3.66Å; E306-R310 IonicContact OE2-NH2 2.76Å; E306-R310 PolarHBondContact OE2-NH2 2.95Å |
| 307 | R | 98.8 | Very high | 98.7 | Very high | 123 Ų | 123 | 99.2 Ų | 99.2 | 46% | 0.464 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -56.5 | -47.6 | 174.1 | -170.1 | -169.4 | 73.1 | 82.8 | -0.2 | 111.7 | N303 E304 R310 A311 | N303-R307 WeakPolarHBondContact O-CB 3.43Å; N303-R307 PolarHBondContact O-N 2.9Å; E304-R307 WeakPolarHBondContact O-CB 3.37Å; E304-R307 PolarHBondContact O-N 2.74Å; E304-R307 IonicContact OE1-CZ 2.75Å; E304-R307 IonicContact OE1-NE 3.44Å; E304-R307 PolarHBondContact OE1-NE 3.45Å; E304-R307 IonicContact OE1-NH2 2.83Å; E304-R307 PolarHBondContact OE1-NH2 3.42Å; E304-R307 IonicContact OE2-CZ 3.84Å; E304-R307 IonicContact OE2-NE 3.62Å; E304-R307 PolarHBondContact OE2-NE 3.32Å; E304-R307 IonicContact OE2-NH2 2.84Å; R307-R310 PolarHBondContact O-N 2.71Å; R307-A311 PolarHBondContact O-N 3.3Å |
| 308 | L | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 99.1 Ų | 99.1 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.1 | -37.9 | 178.4 | -69.3 | 170.3 | 0 | 0 | 0 | 112.2 | E304 R305 E306 A311 R312 | E304-L308 HydrophobicContact CG-CD1 4.16Å; E304-L308 WeakPolarHBondContact O-CG 3.48Å; E304-L308 PolarHBondContact O-N 2.99Å; R305-L308 PolarHBondContact O-N 3.43Å; E306-L308 PolarHBondContact O-N 3.28Å; L308-A311 PolarHBondContact O-N 3Å; L308-R312 VanDerWaalsContact O-CB 3.31Å; L308-R312 WeakPolarHBondContact O-CB 3.43Å; L308-R312 PolarHBondContact O-N 3.44Å |
| 309 | L | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 97.9 Ų | 97.9 | 48% | 0.476 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.7 | -38.8 | 174.5 | -74.5 | 169.8 | 0 | 0 | 0 | 112.4 | R305 E306 G313 | R305-L309 HydrophobicContact CG-CD1 4.07Å; R305-L309 WeakPolarHBondContact O-CB 3.42Å; R305-L309 VanDerWaalsContact O-CG 3.27Å; R305-L309 WeakPolarHBondContact O-CG 3.42Å; R305-L309 PolarHBondContact O-N 3.39Å; E306-L309 PolarHBondContact O-N 3.02Å; L309-G313 PolarHBondContact O-N 3.27Å |
| 310 | R | 98.8 | Very high | 98.7 | Very high | 124 Ų | 124 | 95.9 Ų | 95.9 | 47% | 0.468 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64 | -50 | 173.5 | -68.7 | -171.7 | -126.9 | 117.2 | -6.8 | 111.4 | E306 R307 R312 G313 E314 | E306-R310 WeakPolarHBondContact O-CG 3.34Å; E306-R310 PolarHBondContact O-N 3.31Å; E306-R310 IonicContact OE1-CZ 3.44Å; E306-R310 IonicContact OE1-NE 3.64Å; E306-R310 PolarHBondContact OE1-NE 2.79Å; E306-R310 IonicContact OE1-NH2 3.19Å; E306-R310 PolarHBondContact OE1-NH2 3.47Å; E306-R310 IonicContact OE2-CZ 3.66Å; E306-R310 IonicContact OE2-NH2 2.76Å; E306-R310 PolarHBondContact OE2-NH2 2.95Å; R307-R310 PolarHBondContact O-N 2.71Å; R310-R312 VanDerWaalsContact C-N 3.35Å; R310-R312 PolarHBondContact O-N 3.2Å; R310-G313 CarbonylContact O-C 3.58Å; R310-G313 WeakPolarHBondContact O-CA 3.42Å; R310-G313 PolarHBondContact O-N 3.35Å; R310-E314 PolarHBondContact O-N 3.05Å |
| 311 | A | 98.6 | Very high | 98.7 | Very high | 42 Ų | 42 | 92.1 Ų | 92.1 | 35% | 0.347 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.9 | -41.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | R307 L308 G313 E314 A315 | R307-A311 PolarHBondContact O-N 3.3Å; L308-A311 PolarHBondContact O-N 3Å; A311-G313 VanDerWaalsContact C-N 3.34Å; A311-G313 PolarHBondContact O-N 3.45Å; A311-E314 PolarHBondContact O-N 2.91Å; A311-A315 PolarHBondContact O-N 3.07Å |
| 312 | R | 98.7 | Very high | 98.6 | Very high | 146 Ų | 146 | 92.9 Ų | 92.9 | 55% | 0.551 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -60.2 | -43.4 | 172.7 | -171.6 | -168 | 163.1 | -62.8 | -26.8 | 111.5 | L308 R310 E314 A315 D316 | L308-R312 VanDerWaalsContact O-CB 3.31Å; L308-R312 WeakPolarHBondContact O-CB 3.43Å; L308-R312 PolarHBondContact O-N 3.44Å; R310-R312 VanDerWaalsContact C-N 3.35Å; R310-R312 PolarHBondContact O-N 3.2Å; R312-E314 VanDerWaalsContact C-N 3.28Å; R312-E314 PolarHBondContact O-N 3.47Å; R312-A315 PolarHBondContact O-N 3.36Å; R312-D316 IonicContact CZ-OD1 3.71Å; R312-D316 IonicContact CZ-OD2 3.12Å; R312-D316 IonicContact NH1-OD1 3.95Å; R312-D316 IonicContact NH1-OD2 2.67Å; R312-D316 PolarHBondContact NH1-OD2 3.43Å; R312-D316 IonicContact NH2-OD1 3.16Å; R312-D316 PolarHBondContact NH2-OD1 3.12Å; R312-D316 VanDerWaalsContact NH2-OD1 3.16Å; R312-D316 IonicContact NH2-OD2 2.87Å; R312-D316 PolarHBondContact NH2-OD2 3.15Å; R312-D316 WeakPolarHBondContact O-CB 3.23Å; R312-D316 PolarHBondContact O-N 3.25Å |
| 313 | G | 98.6 | Very high | 98.6 | Very high | 16 Ų | 16 | 96.9 Ų | 96.9 | 17% | 0.165 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -66.7 | -25.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | L309 R310 A311 R317 | L309-G313 PolarHBondContact O-N 3.27Å; R310-G313 CarbonylContact O-C 3.58Å; R310-G313 WeakPolarHBondContact O-CA 3.42Å; R310-G313 PolarHBondContact O-N 3.35Å; A311-G313 VanDerWaalsContact C-N 3.34Å; A311-G313 PolarHBondContact O-N 3.45Å; G313-R317 WeakPolarHBondContact O-CD 3.5Å; G313-R317 VanDerWaalsContact O-CG 3.23Å; G313-R317 WeakPolarHBondContact O-CG 3.26Å; G313-R317 PolarHBondContact O-N 3.09Å; G313-R317 PolarHBondContact O-NE 3.23Å |
| 314 | E | 98.7 | Very high | 98.5 | Very high | 106 Ų | 106 | 97.4 Ų | 97.4 | 50% | 0.495 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -78.4 | -40.1 | 173.1 | -72.7 | 157.5 | -165.6 | 0 | 0 | 111.7 | R310 A311 R312 R317 T318 | R310-E314 PolarHBondContact O-N 3.05Å; A311-E314 PolarHBondContact O-N 2.91Å; R312-E314 VanDerWaalsContact C-N 3.28Å; R312-E314 PolarHBondContact O-N 3.47Å; E314-R317 PolarHBondContact O-N 3.25Å; E314-T318 WeakPolarHBondContact O-CB 3.44Å; E314-T318 PolarHBondContact O-N 2.83Å; E314-T318 PolarHBondContact O-OG1 3.39Å |
| 315 | A | 98.5 | Very high | 98.4 | Very high | 49 Ų | 49 | 99.7 Ų | 99.7 | 41% | 0.405 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.9 | -47 | 171 | 0 | 0 | 0 | 0 | 0 | 112.2 | A311 R312 R317 T318 L319 | A311-A315 PolarHBondContact O-N 3.07Å; R312-A315 PolarHBondContact O-N 3.36Å; A315-R317 VanDerWaalsContact C-N 3.34Å; A315-R317 PolarHBondContact O-N 3.01Å; A315-T318 PolarHBondContact O-N 2.88Å; A315-T318 VanDerWaalsContact O-N 3.09Å; A315-L319 WeakPolarHBondContact O-CG 3.46Å; A315-L319 PolarHBondContact O-N 3.48Å |
| 316 | D | 98.6 | Very high | 98.2 | Very high | 68 Ų | 68 | 96.8 Ų | 96.8 | 36% | 0.364 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -55.1 | -46.6 | 176.4 | -78.8 | -5.1 | 0 | 0 | 0 | 111.5 | R312 T318 E320 | R312-D316 IonicContact CZ-OD1 3.71Å; R312-D316 IonicContact CZ-OD2 3.12Å; R312-D316 IonicContact NH1-OD1 3.95Å; R312-D316 IonicContact NH1-OD2 2.67Å; R312-D316 PolarHBondContact NH1-OD2 3.43Å; R312-D316 IonicContact NH2-OD1 3.16Å; R312-D316 PolarHBondContact NH2-OD1 3.12Å; R312-D316 VanDerWaalsContact NH2-OD1 3.16Å; R312-D316 IonicContact NH2-OD2 2.87Å; R312-D316 PolarHBondContact NH2-OD2 3.15Å; R312-D316 WeakPolarHBondContact O-CB 3.23Å; R312-D316 PolarHBondContact O-N 3.25Å; D316-T318 PolarHBondContact O-N 3.1Å; D316-E320 WeakPolarHBondContact O-CB 3.5Å; D316-E320 PolarHBondContact O-N 3.32Å |
| 317 | R | 98.6 | Very high | 98 | Very high | 160 Ų | 160 | 96.9 Ų | 96.9 | 60% | 0.604 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.9 | -40 | 175.9 | -70.6 | 169.9 | -153.9 | 135.4 | 5.9 | 112.4 | G313 E314 A315 E320 V321 | G313-R317 WeakPolarHBondContact O-CD 3.5Å; G313-R317 VanDerWaalsContact O-CG 3.23Å; G313-R317 WeakPolarHBondContact O-CG 3.26Å; G313-R317 PolarHBondContact O-N 3.09Å; G313-R317 PolarHBondContact O-NE 3.23Å; E314-R317 PolarHBondContact O-N 3.25Å; A315-R317 VanDerWaalsContact C-N 3.34Å; A315-R317 PolarHBondContact O-N 3.01Å; R317-E320 PolarHBondContact O-N 2.94Å; R317-V321 WeakPolarHBondContact O-CG2 3.32Å; R317-V321 PolarHBondContact O-N 2.87Å |
| 318 | T | 98.4 | Very high | 97.8 | Very high | 75 Ų | 75 | 96.1 Ų | 96.1 | 46% | 0.46 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -68.7 | -43.7 | -177.4 | -56.3 | 0 | 0 | 0 | 0 | 110.8 | E314 A315 D316 E320 V321 M322 | E314-T318 WeakPolarHBondContact O-CB 3.44Å; E314-T318 PolarHBondContact O-N 2.83Å; E314-T318 PolarHBondContact O-OG1 3.39Å; A315-T318 PolarHBondContact O-N 2.88Å; A315-T318 VanDerWaalsContact O-N 3.09Å; D316-T318 PolarHBondContact O-N 3.1Å; T318-E320 VanDerWaalsContact C-N 3.3Å; T318-E320 PolarHBondContact O-N 3.48Å; T318-V321 PolarHBondContact O-N 3.48Å; T318-M322 HydrophobicContact CG2-CE 3.99Å; T318-M322 HydrophobicContact CG2-SD 4.36Å; T318-M322 WeakPolarHBondContact O-CG 3.33Å; T318-M322 PolarHBondContact O-N 2.85Å |
| 319 | L | 98.6 | Very high | 97.6 | Very high | 94 Ų | 94 | 96.7 Ų | 96.7 | 49% | 0.492 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.1 | -39.5 | 172.3 | -71.9 | 170.5 | 0 | 0 | 0 | 112 | A315 M322 R323 | A315-L319 WeakPolarHBondContact O-CG 3.46Å; A315-L319 PolarHBondContact O-N 3.48Å; L319-M322 PolarHBondContact O-N 2.96Å; L319-R323 WeakPolarHBondContact O-CB 3.39Å; L319-R323 VanDerWaalsContact O-CG 3.23Å; L319-R323 WeakPolarHBondContact O-CG 3.44Å; L319-R323 PolarHBondContact O-N 3Å |
| 320 | E | 98.5 | Very high | 97.2 | Very high | 84 Ų | 84 | 95.3 Ų | 95.3 | 39% | 0.393 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -68.6 | -41.6 | 178.7 | -173 | 50.9 | -146.3 | 0 | 0 | 112.4 | D316 R317 T318 R323 Q324 | D316-E320 WeakPolarHBondContact O-CB 3.5Å; D316-E320 PolarHBondContact O-N 3.32Å; R317-E320 PolarHBondContact O-N 2.94Å; T318-E320 VanDerWaalsContact C-N 3.3Å; T318-E320 PolarHBondContact O-N 3.48Å; E320-R323 PolarHBondContact O-N 2.92Å; E320-R323 IonicContact OE2-NH1 3.81Å; E320-Q324 VanDerWaalsContact O-CG 3.32Å; E320-Q324 WeakPolarHBondContact O-CG 3.35Å; E320-Q324 PolarHBondContact O-N 3.14Å; E320-Q324 PolarHBondContact OE1-NE2 3.36Å |
| 321 | V | 98.3 | Very high | 96.9 | Very high | 75 Ų | 75 | 95.1 Ų | 95.1 | 46% | 0.455 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 171.9 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | R317 T318 R323 Q324 Q325 | R317-V321 WeakPolarHBondContact O-CG2 3.32Å; R317-V321 PolarHBondContact O-N 2.87Å; T318-V321 PolarHBondContact O-N 3.48Å; V321-R323 VanDerWaalsContact C-N 3.35Å; V321-R323 PolarHBondContact O-N 2.91Å; V321-Q324 PolarHBondContact O-N 2.71Å; V321-Q325 HydrophobicContact CG1-CG 4.5Å; V321-Q325 WeakPolarHBondContact O-CG 3.38Å; V321-Q325 PolarHBondContact O-N 3.4Å |
| 322 | M | 98.1 | Very high | 96.6 | Very high | 111 Ų | 111 | 96 Ų | 96 | 55% | 0.547 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.6 | -37.8 | 177.2 | -72.8 | 177 | 173.6 | 0 | 0 | 112.4 | T318 L319 L326 | T318-M322 HydrophobicContact CG2-CE 3.99Å; T318-M322 HydrophobicContact CG2-SD 4.36Å; T318-M322 WeakPolarHBondContact O-CG 3.33Å; T318-M322 PolarHBondContact O-N 2.85Å; L319-M322 PolarHBondContact O-N 2.96Å; M322-L326 VanDerWaalsContact O-CB 3.32Å; M322-L326 WeakPolarHBondContact O-CB 3.45Å; M322-L326 PolarHBondContact O-N 3.32Å |
| 323 | R | 97.1 | Very high | 96.3 | Very high | 156 Ų | 156 | 91.6 Ų | 91.6 | 59% | 0.589 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -64.2 | -41 | 173.7 | -77.5 | 167.1 | 173.3 | -178.9 | -2 | 112.4 | L319 E320 V321 L326 T327 | L319-R323 WeakPolarHBondContact O-CB 3.39Å; L319-R323 VanDerWaalsContact O-CG 3.23Å; L319-R323 WeakPolarHBondContact O-CG 3.44Å; L319-R323 PolarHBondContact O-N 3Å; E320-R323 PolarHBondContact O-N 2.92Å; E320-R323 IonicContact OE2-NH1 3.81Å; V321-R323 VanDerWaalsContact C-N 3.35Å; V321-R323 PolarHBondContact O-N 2.91Å; R323-L326 PolarHBondContact O-N 2.66Å; R323-T327 WeakPolarHBondContact O-CB 3.19Å; R323-T327 PolarHBondContact O-N 3.16Å; R323-T327 PolarHBondContact O-OG1 3.32Å |
| 324 | Q | 97.9 | Very high | 96 | Very high | 100 Ų | 100 | 91.2 Ų | 91.2 | 47% | 0.467 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -64.7 | -48.8 | 177 | -70.8 | 168.4 | 18.4 | 0 | 0 | 110.3 | E320 V321 L326 T327 E328 | E320-Q324 VanDerWaalsContact O-CG 3.32Å; E320-Q324 WeakPolarHBondContact O-CG 3.35Å; E320-Q324 PolarHBondContact O-N 3.14Å; E320-Q324 PolarHBondContact OE1-NE2 3.36Å; V321-Q324 PolarHBondContact O-N 2.71Å; Q324-L326 PolarHBondContact O-N 3.09Å; Q324-T327 WeakPolarHBondContact O-CB 3.32Å; Q324-T327 PolarHBondContact O-N 2.88Å; Q324-T327 VanDerWaalsContact O-N 3.1Å; Q324-E328 WeakPolarHBondContact O-CG 3.48Å; Q324-E328 PolarHBondContact O-N 2.65Å |
| 325 | Q | 97.3 | Very high | 95.5 | Very high | 116 Ų | 116 | 91 Ų | 91 | 54% | 0.542 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -57.8 | -43.4 | 175 | -71.8 | 174.5 | -22.2 | 0 | 0 | 112.9 | V321 T327 E328 L329 | V321-Q325 HydrophobicContact CG1-CG 4.5Å; V321-Q325 WeakPolarHBondContact O-CG 3.38Å; V321-Q325 PolarHBondContact O-N 3.4Å; Q325-T327 VanDerWaalsContact C-N 3.35Å; Q325-E328 PolarHBondContact O-N 3.18Å; Q325-L329 WeakPolarHBondContact O-CB 3.36Å; Q325-L329 PolarHBondContact O-N 2.77Å |
| 326 | L | 94.6 | Very high | 95 | Very high | 113 Ų | 113 | 95.8 Ų | 95.8 | 59% | 0.592 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.9 | -39.7 | 175.4 | -179.6 | 62.7 | 0 | 0 | 0 | 111.8 | M322 R323 Q324 Y330 | M322-L326 VanDerWaalsContact O-CB 3.32Å; M322-L326 WeakPolarHBondContact O-CB 3.45Å; M322-L326 PolarHBondContact O-N 3.32Å; R323-L326 PolarHBondContact O-N 2.66Å; Q324-L326 PolarHBondContact O-N 3.09Å; L326-Y330 WeakPolarHBondContact O-CB 3.46Å; L326-Y330 PolarHBondContact O-N 3.02Å |
| 327 | T | 93.7 | Very high | 94.6 | Very high | 95 Ų | 95 | 95 Ų | 95 | 58% | 0.583 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -68.2 | -40.8 | 178.9 | -56.7 | 0 | 0 | 0 | 0 | 111.6 | R323 Q324 Q325 R331 | R323-T327 WeakPolarHBondContact O-CB 3.19Å; R323-T327 PolarHBondContact O-N 3.16Å; R323-T327 PolarHBondContact O-OG1 3.32Å; Q324-T327 WeakPolarHBondContact O-CB 3.32Å; Q324-T327 PolarHBondContact O-N 2.88Å; Q324-T327 VanDerWaalsContact O-N 3.1Å; Q325-T327 VanDerWaalsContact C-N 3.35Å; T327-R331 WeakPolarHBondContact O-CB 3.36Å; T327-R331 PolarHBondContact O-N 3.38Å |
| 328 | E | 95.6 | Very high | 94.2 | Very high | 106 Ų | 106 | 92.9 Ų | 92.9 | 50% | 0.495 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.1 | -49 | 173.8 | -70.1 | -177.5 | 145.7 | 0 | 0 | 111.3 | Q324 Q325 Y330 R331 D332 | Q324-E328 WeakPolarHBondContact O-CG 3.48Å; Q324-E328 PolarHBondContact O-N 2.65Å; Q325-E328 PolarHBondContact O-N 3.18Å; E328-Y330 VanDerWaalsContact C-N 3.34Å; E328-Y330 PolarHBondContact O-N 3.28Å; E328-R331 PolarHBondContact O-N 3.35Å; E328-D332 WeakPolarHBondContact O-CB 3.35Å; E328-D332 VanDerWaalsContact O-CG 3.22Å; E328-D332 PolarHBondContact O-N 3.34Å |
| 329 | L | 93 | Very high | 93.6 | Very high | 103 Ų | 103 | 91.6 Ų | 91.6 | 54% | 0.539 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.6 | -42.3 | 177.1 | -179.8 | 62 | 0 | 0 | 0 | 112 | Q325 D332 I333 | Q325-L329 WeakPolarHBondContact O-CB 3.36Å; Q325-L329 PolarHBondContact O-N 2.77Å; L329-D332 PolarHBondContact O-N 2.88Å; L329-I333 HydrophobicContact CD1-CD1 3.93Å; L329-I333 HydrophobicContact CD1-CG1 4.17Å; L329-I333 HydrophobicContact CG-CD1 3.85Å; L329-I333 HydrophobicContact CG-CG1 4.49Å; L329-I333 WeakPolarHBondContact O-CB 3.32Å; L329-I333 VanDerWaalsContact O-CG1 3.25Å; L329-I333 WeakPolarHBondContact O-CG1 3.25Å; L329-I333 PolarHBondContact O-N 3.06Å |
| 330 | Y | 91.8 | Very high | 93 | Very high | 63 Ų | 63 | 96.7 Ų | 96.7 | 25% | 0.247 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -61.3 | -50.9 | 176.7 | -171 | -86.9 | 0 | 0 | 0 | 110.8 | L326 E328 D332 I333 F334 P347 Y350 A351 L352 | L326-Y330 WeakPolarHBondContact O-CB 3.46Å; L326-Y330 PolarHBondContact O-N 3.02Å; E328-Y330 VanDerWaalsContact C-N 3.34Å; E328-Y330 PolarHBondContact O-N 3.28Å; Y330-D332 VanDerWaalsContact C-N 3.3Å; Y330-D332 PolarHBondContact O-N 3.31Å; Y330-I333 PolarHBondContact O-N 3.31Å; Y330-F334 AromaticContact CD1-CD2 3.84Å; Y330-F334 HydrophobicContact CD1-CD2 3.84Å; Y330-F334 HydrophobicContact CD1-CE2 4.07Å; Y330-F334 HydrophobicContact CD2-CE2 4.26Å; Y330-F334 AromaticContact CE1-CD2 3.66Å; Y330-F334 HydrophobicContact CE1-CD2 3.66Å; Y330-F334 AromaticContact CE1-CE2 3.52Å; Y330-F334 HydrophobicContact CE1-CE2 3.52Å; Y330-F334 HydrophobicContact CE1-CZ 4.41Å; Y330-F334 HydrophobicContact CE2-CD2 4.44Å; Y330-F334 AromaticContact CE2-CE2 3.75Å; Y330-F334 HydrophobicContact CE2-CE2 3.75Å; Y330-F334 HydrophobicContact CG-CD2 4.31Å; Y330-F334 HydrophobicContact CG-CE2 4.41Å; Y330-F334 AromaticContact CZ-CD2 3.98Å; Y330-F334 AromaticContact CZ-CE2 3.34Å; Y330-F334 WeakPolarHBondContact O-CD2 3.48Å; Y330-F334 PolarHBondContact O-N 3.44Å; Y330-P347 HydrophobicContact CD1-CB 4.46Å; Y330-P347 HydrophobicContact CE1-CB 3.66Å; Y330-Y350 PolarHBondContact OH-O 2.8Å; Y330-A351 WeakPolarHBondContact OH-CA 3.38Å; Y330-L352 HydrophobicContact CD2-CD1 4.19Å; Y330-L352 HydrophobicContact CE2-CB 4.27Å; Y330-L352 HydrophobicContact CE2-CD1 4.36Å; Y330-L352 HydrophobicContact CE2-CG 4.45Å |
| 331 | R | 91 | Very high | 92.3 | Very high | 120 Ų | 120 | 97.4 Ų | 97.4 | 45% | 0.453 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -54.1 | -47.6 | 174.4 | -178.5 | -161.5 | 68.8 | -147.9 | -7.7 | 111.3 | T327 E328 F334 Q335 | T327-R331 WeakPolarHBondContact O-CB 3.36Å; T327-R331 PolarHBondContact O-N 3.38Å; E328-R331 PolarHBondContact O-N 3.35Å; R331-F334 PolarHBondContact O-N 2.9Å; R331-Q335 WeakPolarHBondContact O-CG 3.37Å; R331-Q335 PolarHBondContact O-N 3.36Å |
| 332 | D | 92.9 | Very high | 91.6 | Very high | 59 Ų | 59 | 96.2 Ų | 96.2 | 32% | 0.316 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -73.3 | -31.7 | -173.1 | -68.5 | -0.9 | 0 | 0 | 0 | 112.1 | E328 L329 Y330 H336 | E328-D332 WeakPolarHBondContact O-CB 3.35Å; E328-D332 VanDerWaalsContact O-CG 3.22Å; E328-D332 PolarHBondContact O-N 3.34Å; L329-D332 PolarHBondContact O-N 2.88Å; Y330-D332 VanDerWaalsContact C-N 3.3Å; Y330-D332 PolarHBondContact O-N 3.31Å; D332-H336 PolarHBondContact O-N 2.9Å; D332-H336 PolarHBondContact O-ND1 3.25Å |
| 333 | I | 92.9 | Very high | 91 | Very high | 55 Ų | 55 | 95.5 Ų | 95.5 | 28% | 0.282 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.2 | -49.7 | 169.1 | -69 | 165.1 | 0 | 0 | 0 | 110.2 | L329 Y330 Q335 H336 L337 L352 | L329-I333 HydrophobicContact CD1-CD1 3.93Å; L329-I333 HydrophobicContact CD1-CG1 4.17Å; L329-I333 HydrophobicContact CG-CD1 3.85Å; L329-I333 HydrophobicContact CG-CG1 4.49Å; L329-I333 WeakPolarHBondContact O-CB 3.32Å; L329-I333 VanDerWaalsContact O-CG1 3.25Å; L329-I333 WeakPolarHBondContact O-CG1 3.25Å; L329-I333 PolarHBondContact O-N 3.06Å; Y330-I333 PolarHBondContact O-N 3.31Å; I333-Q335 VanDerWaalsContact C-N 3.28Å; I333-Q335 PolarHBondContact O-N 2.99Å; I333-H336 PolarHBondContact O-N 2.91Å; I333-L337 HydrophobicContact CG2-CD1 3.69Å; I333-L337 HydrophobicContact CG2-CG 3.85Å; I333-L337 WeakPolarHBondContact O-CG 3.25Å; I333-L337 PolarHBondContact O-N 3.42Å; I333-L352 HydrophobicContact CB-CD1 4.18Å; I333-L352 HydrophobicContact CD1-CD1 4.13Å; I333-L352 HydrophobicContact CG2-CD1 3.69Å |
| 334 | F | 91.4 | Very high | 90.5 | Very high | 7 Ų | 7 | 91.7 Ų | 91.7 | 3% | 0.031 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -62.5 | -32.6 | 178.5 | -87.4 | -86.4 | 0 | 0 | 0 | 113.1 | Y330 R331 H336 S346 P347 Y350 L352 L362 | Y330-F334 AromaticContact CD1-CD2 3.84Å; Y330-F334 HydrophobicContact CD1-CD2 3.84Å; Y330-F334 HydrophobicContact CD1-CE2 4.07Å; Y330-F334 HydrophobicContact CD2-CE2 4.26Å; Y330-F334 AromaticContact CE1-CD2 3.66Å; Y330-F334 HydrophobicContact CE1-CD2 3.66Å; Y330-F334 AromaticContact CE1-CE2 3.52Å; Y330-F334 HydrophobicContact CE1-CE2 3.52Å; Y330-F334 HydrophobicContact CE1-CZ 4.41Å; Y330-F334 HydrophobicContact CE2-CD2 4.44Å; Y330-F334 AromaticContact CE2-CE2 3.75Å; Y330-F334 HydrophobicContact CE2-CE2 3.75Å; Y330-F334 HydrophobicContact CG-CD2 4.31Å; Y330-F334 HydrophobicContact CG-CE2 4.41Å; Y330-F334 AromaticContact CZ-CD2 3.98Å; Y330-F334 AromaticContact CZ-CE2 3.34Å; Y330-F334 WeakPolarHBondContact O-CD2 3.48Å; Y330-F334 PolarHBondContact O-N 3.44Å; R331-F334 PolarHBondContact O-N 2.9Å; F334-H336 PolarHBondContact O-N 2.86Å; F334-S346 WeakPolarHBondContact CE1-O 3.48Å; F334-P347 HydrophobicContact CB-CB 4.42Å; F334-P347 HydrophobicContact CB-CG 4.47Å; F334-P347 HydrophobicContact CD1-CB 3.95Å; F334-P347 HydrophobicContact CD1-CG 4.45Å; F334-P347 HydrophobicContact CD2-CB 4.08Å; F334-P347 HydrophobicContact CE1-CB 4.22Å; F334-P347 HydrophobicContact CE2-CB 4.35Å; F334-P347 HydrophobicContact CG-CB 3.87Å; F334-P347 HydrophobicContact CG-CG 4.39Å; F334-P347 HydrophobicContact CZ-CB 4.41Å; F334-Y350 VanDerWaalsContact CZ-O 3.28Å; F334-Y350 WeakPolarHBondContact CZ-O 3.16Å; F334-L352 HydrophobicContact CD2-CD1 4.24Å; F334-L352 HydrophobicContact CE2-CD1 3.79Å; F334-L352 HydrophobicContact CE2-CG 3.74Å; F334-L352 HydrophobicContact CZ-CG 4.21Å; F334-L362 HydrophobicContact CE1-CD1 3.95Å; F334-L362 HydrophobicContact CZ-CD1 3.68Å |
| 335 | Q | 88.8 | Confident | 89.9 | Confident | 103 Ų | 103 | 90 Ų | 90 | 48% | 0.481 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.5 | -24.8 | 171.1 | -76.9 | 178.5 | 17 | 0 | 0 | 113.7 | R331 I333 R338 | R331-Q335 WeakPolarHBondContact O-CG 3.37Å; R331-Q335 PolarHBondContact O-N 3.36Å; I333-Q335 VanDerWaalsContact C-N 3.28Å; I333-Q335 PolarHBondContact O-N 2.99Å; Q335-R338 VanDerWaalsContact O-CZ 3.27Å; Q335-R338 PolarHBondContact O-NH1 3.31Å; Q335-R338 PolarHBondContact O-NH2 2.8Å |
| 336 | H | 88.4 | Confident | 89.4 | Confident | 148 Ų | 148 | 85.8 Ų | 85.8 | 69% | 0.685 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -106.6 | -21.7 | -177.7 | -67.8 | 88.5 | 0 | 0 | 0 | 114.5 | D332 I333 F334 R338 | D332-H336 PolarHBondContact O-N 2.9Å; D332-H336 PolarHBondContact O-ND1 3.25Å; I333-H336 PolarHBondContact O-N 2.91Å; F334-H336 PolarHBondContact O-N 2.86Å; H336-R338 PolarHBondContact O-N 2.86Å |
| 337 | L | 90.5 | Very high | 88.9 | Confident | 51 Ų | 51 | 82.2 Ų | 82.2 | 27% | 0.267 | 43% | 0.427 | S | S | . | . | trans | -64.4 | 130.1 | 176.1 | -75.7 | 175.4 | 0 | 0 | 0 | 111.8 | I333 Y345 L352 L362 | I333-L337 HydrophobicContact CG2-CD1 3.69Å; I333-L337 HydrophobicContact CG2-CG 3.85Å; I333-L337 WeakPolarHBondContact O-CG 3.25Å; I333-L337 PolarHBondContact O-N 3.42Å; L337-Y345 HydrophobicContact CB-CD2 3.94Å; L337-L352 HydrophobicContact CD1-CD2 4.24Å; L337-L362 HydrophobicContact CD1-CD1 4.11Å; L337-L362 HydrophobicContact CD1-CD2 4.43Å | ||
| 338 | R | 89.3 | Confident | 88.5 | Confident | 117 Ų | 117 | 84.4 Ų | 84.4 | 44% | 0.442 | 43% | 0.43 | S | S | . | . | B | Isolated β-bridge | trans | -131.1 | 146.6 | 176.9 | -61.1 | -64.5 | 176.7 | -85.1 | -3.2 | 111.3 | Q335 H336 N343 S344 Y345 | Q335-R338 VanDerWaalsContact O-CZ 3.27Å; Q335-R338 PolarHBondContact O-NH1 3.31Å; Q335-R338 PolarHBondContact O-NH2 2.8Å; H336-R338 PolarHBondContact O-N 2.86Å; R338-N343 CarbonylContact C-O 3.55Å; R338-N343 WeakPolarHBondContact CA-O 3.44Å; R338-N343 VanDerWaalsContact CD-O 3.24Å; R338-N343 WeakPolarHBondContact CD-O 3.43Å; R338-S344 PolarHBondContact NE-OG 3.36Å; R338-S344 PolarHBondContact NH1-OG 3.41Å; R338-Y345 VanDerWaalsContact C-CE2 3.43Å; R338-Y345 WeakPolarHBondContact O-CE2 3.44Å |
| 339 | D | 85.5 | Confident | 88.1 | Confident | 47 Ų | 47 | 84.8 Ų | 84.8 | 25% | 0.251 | 43% | 0.432 | S | S | . | . | trans | -79 | 173.5 | 172.3 | 75.7 | 4.1 | 0 | 0 | 0 | 112 | S341 G342 N343 Y345 | D339-S341 PolarHBondContact O-N 2.81Å; D339-S341 VanDerWaalsContact OD1-C 3.23Å; D339-S341 VanDerWaalsContact OD1-CA 3.26Å; D339-S341 WeakPolarHBondContact OD1-CA 3.48Å; D339-S341 WeakPolarHBondContact OD1-CB 3.28Å; D339-S341 PolarHBondContact OD1-N 3.33Å; D339-G342 PolarHBondContact O-N 3.25Å; D339-G342 PolarHBondContact OD1-N 2.95Å; D339-N343 PolarHBondContact N-O 3.47Å; D339-N343 PolarHBondContact OD1-N 3.32Å; D339-N343 PolarHBondContact OD1-ND2 3.34Å; D339-N343 WeakPolarHBondContact OD2-CB 3.43Å; D339-N343 PolarHBondContact OD2-ND2 2.73Å; D339-Y345 HydrophobicContact CB-CE1 4.41Å; D339-Y345 HydrophobicContact CB-CE2 3.93Å | ||
| 340 | E | 85.9 | Confident | 87.8 | Confident | 201 Ų | 201 | 83.1 Ų | 83.1 | 94% | 0.939 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -12.2 | 176.3 | -63 | -68.7 | 137.8 | 0 | 0 | 113.9 | ||
| 341 | S | 84.3 | Confident | 87.8 | Confident | 100 Ų | 100 | 81.3 Ų | 81.3 | 70% | 0.699 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.4 | -1.9 | 176.6 | -60.4 | 0 | 0 | 0 | 0 | 113.4 | D339 | D339-S341 PolarHBondContact O-N 2.81Å; D339-S341 VanDerWaalsContact OD1-C 3.23Å; D339-S341 VanDerWaalsContact OD1-CA 3.26Å; D339-S341 WeakPolarHBondContact OD1-CA 3.48Å; D339-S341 WeakPolarHBondContact OD1-CB 3.28Å; D339-S341 PolarHBondContact OD1-N 3.33Å |
| 342 | G | 83.3 | Confident | 87.8 | Confident | 50 Ų | 50 | 77.7 Ų | 77.7 | 52% | 0.515 | 41% | 0.407 | S | S | . | . | S | Bend | trans | 85.3 | 6.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | D339 | D339-G342 PolarHBondContact O-N 3.25Å; D339-G342 PolarHBondContact OD1-N 2.95Å |
| 343 | N | 85.2 | Confident | 87.7 | Confident | 95 Ų | 95 | 80.6 Ų | 80.6 | 51% | 0.508 | 42% | 0.418 | S | S | . | . | P | Polyproline II helix | trans | -74.8 | 158.1 | 174 | -50.7 | -64.4 | 0 | 0 | 0 | 110.7 | R338 D339 | R338-N343 CarbonylContact C-O 3.55Å; R338-N343 WeakPolarHBondContact CA-O 3.44Å; R338-N343 VanDerWaalsContact CD-O 3.24Å; R338-N343 WeakPolarHBondContact CD-O 3.43Å; D339-N343 PolarHBondContact N-O 3.47Å; D339-N343 PolarHBondContact OD1-N 3.32Å; D339-N343 PolarHBondContact OD1-ND2 3.34Å; D339-N343 WeakPolarHBondContact OD2-CB 3.43Å; D339-N343 PolarHBondContact OD2-ND2 2.73Å |
| 344 | S | 86.4 | Confident | 87.5 | Confident | 77 Ų | 77 | 84.5 Ų | 84.5 | 54% | 0.538 | 44% | 0.435 | S | S | . | . | B | Isolated β-bridge | trans | -90.6 | 137.2 | 175.8 | -52.9 | 0 | 0 | 0 | 0 | 111 | R338 | R338-S344 PolarHBondContact NE-OG 3.36Å; R338-S344 PolarHBondContact NH1-OG 3.41Å |
| 345 | Y | 86.9 | Confident | 87.5 | Confident | 65 Ų | 65 | 86 Ų | 86 | 26% | 0.255 | 45% | 0.449 | S | S | . | . | P | Polyproline II helix | trans | -72.6 | 138.7 | 173.7 | -74.1 | -80.5 | 0 | 0 | 0 | 111.3 | L337 R338 D339 Y350 L362 | L337-Y345 HydrophobicContact CB-CD2 3.94Å; R338-Y345 VanDerWaalsContact C-CE2 3.43Å; R338-Y345 WeakPolarHBondContact O-CE2 3.44Å; D339-Y345 HydrophobicContact CB-CE1 4.41Å; D339-Y345 HydrophobicContact CB-CE2 3.93Å; Y345-Y350 HydrophobicContact CD1-CD1 4.17Å; Y345-Y350 AromaticContact CD1-CD2 3.81Å; Y345-Y350 HydrophobicContact CD1-CD2 3.81Å; Y345-Y350 HydrophobicContact CD1-CE1 4.13Å; Y345-Y350 AromaticContact CD1-CE2 3.81Å; Y345-Y350 HydrophobicContact CD1-CE2 3.81Å; Y345-Y350 HydrophobicContact CD1-CG 4.02Å; Y345-Y350 AromaticContact CD1-CZ 3.97Å; Y345-Y350 HydrophobicContact CE1-CD1 4.4Å; Y345-Y350 HydrophobicContact CE1-CE1 4.05Å; Y345-Y350 HydrophobicContact CE1-CE2 4.36Å; Y345-L362 HydrophobicContact CD1-CD2 3.67Å; Y345-L362 HydrophobicContact CD2-CD2 3.88Å; Y345-L362 HydrophobicContact CE1-CD2 3.77Å; Y345-L362 HydrophobicContact CE2-CD2 3.93Å; Y345-L362 HydrophobicContact CG-CD2 3.72Å |
| 346 | S | 85.4 | Confident | 87.6 | Confident | 27 Ų | 27 | 86.8 Ų | 86.8 | 19% | 0.189 | 47% | 0.473 | C | S | . | . | P | Polyproline II helix | trans | -84.7 | 132.7 | 174.2 | 153.8 | 0 | 0 | 0 | 0 | 111.1 | F334 E348 E349 Y350 | F334-S346 WeakPolarHBondContact CE1-O 3.48Å; S346-E348 PolarHBondContact O-N 2.84Å; S346-E348 WeakPolarHBondContact OG-CB 3.39Å; S346-E348 PolarHBondContact OG-N 2.81Å; S346-E348 PolarHBondContact OG-OE2 2.77Å; S346-E349 PolarHBondContact O-N 3.11Å; S346-E349 PolarHBondContact OG-N 3.23Å; S346-Y350 PolarHBondContact O-N 2.6Å |
| 347 | P | 84.5 | Confident | 87.7 | Confident | 38 Ų | 38 | 85.3 Ų | 85.3 | 25% | 0.247 | 47% | 0.47 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | -12.6 | 170.3 | 25.9 | -30.3 | 0 | 0 | 0 | 114 | Y330 F334 Y350 R365 | Y330-P347 HydrophobicContact CD1-CB 4.46Å; Y330-P347 HydrophobicContact CE1-CB 3.66Å; F334-P347 HydrophobicContact CB-CB 4.42Å; F334-P347 HydrophobicContact CB-CG 4.47Å; F334-P347 HydrophobicContact CD1-CB 3.95Å; F334-P347 HydrophobicContact CD1-CG 4.45Å; F334-P347 HydrophobicContact CD2-CB 4.08Å; F334-P347 HydrophobicContact CE1-CB 4.22Å; F334-P347 HydrophobicContact CE2-CB 4.35Å; F334-P347 HydrophobicContact CG-CB 3.87Å; F334-P347 HydrophobicContact CG-CG 4.39Å; F334-P347 HydrophobicContact CZ-CB 4.41Å; P347-Y350 CarbonylContact C-O 3.47Å; P347-Y350 VanDerWaalsContact O-O 3.12Å; P347-R365 WeakPolarHBondContact O-CD 3.29Å; P347-R365 PolarHBondContact O-NH1 2.84Å |
| 348 | E | 85.1 | Confident | 87.6 | Confident | 141 Ų | 141 | 84.6 Ų | 84.6 | 66% | 0.659 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | -36.2 | 171.8 | -57.7 | 69.5 | -149.9 | 0 | 0 | 111.6 | S346 R365 | S346-E348 PolarHBondContact O-N 2.84Å; S346-E348 WeakPolarHBondContact OG-CB 3.39Å; S346-E348 PolarHBondContact OG-N 2.81Å; S346-E348 PolarHBondContact OG-OE2 2.77Å; E348-R365 WeakPolarHBondContact O-CD 3.24Å |
| 349 | E | 86.6 | Confident | 87.7 | Confident | 114 Ų | 114 | 81.8 Ų | 81.8 | 53% | 0.533 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | -24.7 | 179.2 | -67.7 | 179.2 | -176.7 | 0 | 0 | 113.8 | S346 P364 R365 | S346-E349 PolarHBondContact O-N 3.11Å; S346-E349 PolarHBondContact OG-N 3.23Å; E349-P364 CarbonylContact O-C 3.6Å; E349-P364 WeakPolarHBondContact O-CA 3.26Å; E349-R365 PolarHBondContact O-N 3.28Å |
| 350 | Y | 88.5 | Confident | 87.9 | Confident | 67 Ų | 67 | 84.4 Ų | 84.4 | 26% | 0.263 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 150.9 | -176.8 | -59.2 | -100.3 | 0 | 0 | 0 | 111.7 | Y330 F334 Y345 S346 P347 L362 V363 P364 | Y330-Y350 PolarHBondContact OH-O 2.8Å; F334-Y350 VanDerWaalsContact CZ-O 3.28Å; F334-Y350 WeakPolarHBondContact CZ-O 3.16Å; Y345-Y350 HydrophobicContact CD1-CD1 4.17Å; Y345-Y350 AromaticContact CD1-CD2 3.81Å; Y345-Y350 HydrophobicContact CD1-CD2 3.81Å; Y345-Y350 HydrophobicContact CD1-CE1 4.13Å; Y345-Y350 AromaticContact CD1-CE2 3.81Å; Y345-Y350 HydrophobicContact CD1-CE2 3.81Å; Y345-Y350 HydrophobicContact CD1-CG 4.02Å; Y345-Y350 AromaticContact CD1-CZ 3.97Å; Y345-Y350 HydrophobicContact CE1-CD1 4.4Å; Y345-Y350 HydrophobicContact CE1-CE1 4.05Å; Y345-Y350 HydrophobicContact CE1-CE2 4.36Å; S346-Y350 PolarHBondContact O-N 2.6Å; P347-Y350 CarbonylContact C-O 3.47Å; P347-Y350 VanDerWaalsContact O-O 3.12Å; Y350-L362 HydrophobicContact CD1-CD2 4.32Å; Y350-L362 HydrophobicContact CD1-CG 4.2Å; Y350-L362 HydrophobicContact CG-CG 4.46Å; Y350-V363 CarbonylContact C-O 3.58Å; Y350-V363 WeakPolarHBondContact CA-O 3.37Å; Y350-P364 HydrophobicContact CD1-CB 4.34Å; Y350-P364 HydrophobicContact CD1-CG 4.15Å; Y350-P364 HydrophobicContact CE1-CB 4.32Å; Y350-P364 HydrophobicContact CE1-CG 3.96Å |
| 351 | A | 91.5 | Very high | 88.1 | Confident | 25 Ų | 25 | 80.1 Ų | 80.1 | 21% | 0.207 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.4 | 148.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y330 V363 R365 | Y330-A351 WeakPolarHBondContact OH-CA 3.38Å; A351-V363 PolarHBondContact N-O 2.85Å; A351-V363 PolarHBondContact O-N 2.97Å; A351-R365 HydrophobicContact CB-CG 3.68Å |
| 352 | L | 90.9 | Very high | 88.4 | Confident | 45 Ų | 45 | 78.1 Ų | 78.1 | 24% | 0.236 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.2 | 125.6 | 171.6 | -64.8 | 166.2 | 0 | 0 | 0 | 109 | Y330 I333 F334 L337 I360 F361 L362 | Y330-L352 HydrophobicContact CD2-CD1 4.19Å; Y330-L352 HydrophobicContact CE2-CB 4.27Å; Y330-L352 HydrophobicContact CE2-CD1 4.36Å; Y330-L352 HydrophobicContact CE2-CG 4.45Å; I333-L352 HydrophobicContact CB-CD1 4.18Å; I333-L352 HydrophobicContact CD1-CD1 4.13Å; I333-L352 HydrophobicContact CG2-CD1 3.69Å; F334-L352 HydrophobicContact CD2-CD1 4.24Å; F334-L352 HydrophobicContact CE2-CD1 3.79Å; F334-L352 HydrophobicContact CE2-CG 3.74Å; F334-L352 HydrophobicContact CZ-CG 4.21Å; L337-L352 HydrophobicContact CD1-CD2 4.24Å; L352-I360 HydrophobicContact CB-CG2 4.05Å; L352-I360 HydrophobicContact CD2-CG2 3.86Å; L352-I360 HydrophobicContact CG-CG2 4.46Å; L352-F361 WeakPolarHBondContact CA-O 3.39Å; L352-L362 HydrophobicContact CD2-CD1 3.84Å; L352-L362 HydrophobicContact CG-CD1 4.39Å |
| 353 | Q | 89.8 | Confident | 88.8 | Confident | 119 Ų | 119 | 78.2 Ų | 78.2 | 56% | 0.556 | 43% | 0.434 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 125.8 | 177.2 | -172.5 | 170.8 | 12.4 | 0 | 0 | 109.9 | F361 V363 | Q353-F361 PolarHBondContact N-O 2.98Å; Q353-F361 PolarHBondContact O-N 2.77Å; Q353-V363 HydrophobicContact CB-CG2 4.04Å |
| 354 | Q | 89.9 | Confident | 89 | Confident | 137 Ų | 137 | 78 Ų | 78 | 64% | 0.64 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 132.2 | 173.8 | -166.2 | 175.1 | 33.2 | 0 | 0 | 110.1 | G358 T359 I360 | Q354-G358 PolarHBondContact NE2-O 3.39Å; Q354-T359 WeakPolarHBondContact CA-O 3.46Å; Q354-I360 HydrophobicContact CG-CG1 4.41Å |
| 355 | A | 91 | Very high | 88.9 | Confident | 39 Ų | 39 | 80.5 Ų | 80.5 | 32% | 0.322 | 44% | 0.436 | S | S | . | . | trans | -88.9 | 167.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | D357 G358 T359 F361 | A355-D357 VanDerWaalsContact CB-OD1 3.25Å; A355-D357 WeakPolarHBondContact CB-OD1 3.46Å; A355-D357 PolarHBondContact O-N 2.93Å; A355-D357 VanDerWaalsContact O-N 3.14Å; A355-G358 PolarHBondContact O-N 3.07Å; A355-T359 PolarHBondContact N-O 3.41Å; A355-F361 HydrophobicContact CB-CD2 4.2Å; A355-F361 HydrophobicContact CB-CE2 3.78Å | ||
| 356 | A | 90 | Very high | 88.2 | Confident | 119 Ų | 119 | 81 Ų | 81 | 98% | 0.983 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | -11 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 357 | D | 91.6 | Very high | 86.9 | Confident | 117 Ų | 117 | 85.1 Ų | 85.1 | 63% | 0.626 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.1 | -4.7 | 170.7 | 66.7 | -22.4 | 0 | 0 | 0 | 113.1 | A355 T359 | A355-D357 VanDerWaalsContact CB-OD1 3.25Å; A355-D357 WeakPolarHBondContact CB-OD1 3.46Å; A355-D357 PolarHBondContact O-N 2.93Å; A355-D357 VanDerWaalsContact O-N 3.14Å; D357-T359 VanDerWaalsContact CG-OG1 3.23Å; D357-T359 VanDerWaalsContact OD1-CB 3.32Å; D357-T359 WeakPolarHBondContact OD1-CB 3.5Å; D357-T359 PolarHBondContact OD1-N 3.01Å; D357-T359 PolarHBondContact OD1-OG1 3.02Å; D357-T359 WeakPolarHBondContact OD2-CB 3.45Å; D357-T359 PolarHBondContact OD2-OG1 3.39Å |
| 358 | G | 88.3 | Confident | 85.4 | Confident | 36 Ų | 36 | 93.4 Ų | 93.4 | 37% | 0.371 | 52% | 0.517 | S | S | . | . | S | Bend | trans | 91.8 | -7.6 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q354 A355 | Q354-G358 PolarHBondContact NE2-O 3.39Å; A355-G358 PolarHBondContact O-N 3.07Å |
| 359 | T | 91.5 | Very high | 83.5 | Confident | 59 Ų | 59 | 94.8 Ų | 94.8 | 36% | 0.362 | 53% | 0.526 | S | S | . | . | trans | -68 | 135.2 | -178.6 | -60 | 0 | 0 | 0 | 0 | 110.9 | Q354 A355 D357 F361 | Q354-T359 WeakPolarHBondContact CA-O 3.46Å; A355-T359 PolarHBondContact N-O 3.41Å; D357-T359 VanDerWaalsContact CG-OG1 3.23Å; D357-T359 VanDerWaalsContact OD1-CB 3.32Å; D357-T359 WeakPolarHBondContact OD1-CB 3.5Å; D357-T359 PolarHBondContact OD1-N 3.01Å; D357-T359 PolarHBondContact OD1-OG1 3.02Å; D357-T359 WeakPolarHBondContact OD2-CB 3.45Å; D357-T359 PolarHBondContact OD2-OG1 3.39Å; T359-F361 HydrophobicContact CG2-CD2 4.23Å; T359-F361 HydrophobicContact CG2-CE1 4.25Å; T359-F361 HydrophobicContact CG2-CE2 3.54Å; T359-F361 HydrophobicContact CG2-CZ 3.55Å | ||
| 360 | I | 89.5 | Confident | 81.6 | Confident | 102 Ų | 102 | 97.6 Ų | 97.6 | 52% | 0.523 | 54% | 0.539 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.3 | 126.7 | -179.7 | -57.9 | 174.7 | 0 | 0 | 0 | 109.8 | L352 Q354 | L352-I360 HydrophobicContact CB-CG2 4.05Å; L352-I360 HydrophobicContact CD2-CG2 3.86Å; L352-I360 HydrophobicContact CG-CG2 4.46Å; Q354-I360 HydrophobicContact CG-CG1 4.41Å |
| 361 | F | 90.1 | Very high | 79.7 | Confident | 111 Ų | 111 | 99.5 Ų | 99.5 | 49% | 0.487 | 57% | 0.569 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -112.9 | 144 | 176.8 | -63.4 | -87.8 | 0 | 0 | 0 | 110.8 | L352 Q353 A355 T359 V363 | L352-F361 WeakPolarHBondContact CA-O 3.39Å; Q353-F361 PolarHBondContact N-O 2.98Å; Q353-F361 PolarHBondContact O-N 2.77Å; A355-F361 HydrophobicContact CB-CD2 4.2Å; A355-F361 HydrophobicContact CB-CE2 3.78Å; T359-F361 HydrophobicContact CG2-CD2 4.23Å; T359-F361 HydrophobicContact CG2-CE1 4.25Å; T359-F361 HydrophobicContact CG2-CE2 3.54Å; T359-F361 HydrophobicContact CG2-CZ 3.55Å; F361-V363 HydrophobicContact CB-CG2 4.24Å |
| 362 | L | 91.3 | Very high | 77.6 | Confident | 57 Ų | 57 | 104 Ų | 104 | 30% | 0.298 | 59% | 0.593 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91.3 | 119.9 | 168.8 | -171.4 | 69.4 | 0 | 0 | 0 | 108.9 | F334 L337 Y345 Y350 L352 | F334-L362 HydrophobicContact CE1-CD1 3.95Å; F334-L362 HydrophobicContact CZ-CD1 3.68Å; L337-L362 HydrophobicContact CD1-CD1 4.11Å; L337-L362 HydrophobicContact CD1-CD2 4.43Å; Y345-L362 HydrophobicContact CD1-CD2 3.67Å; Y345-L362 HydrophobicContact CD2-CD2 3.88Å; Y345-L362 HydrophobicContact CE1-CD2 3.77Å; Y345-L362 HydrophobicContact CE2-CD2 3.93Å; Y345-L362 HydrophobicContact CG-CD2 3.72Å; Y350-L362 HydrophobicContact CD1-CD2 4.32Å; Y350-L362 HydrophobicContact CD1-CG 4.2Å; Y350-L362 HydrophobicContact CG-CG 4.46Å; L352-L362 HydrophobicContact CD2-CD1 3.84Å; L352-L362 HydrophobicContact CG-CD1 4.39Å |
| 363 | V | 91.3 | Very high | 75 | Confident | 53 Ų | 53 | 113.7 Ų | 113.7 | 32% | 0.321 | 65% | 0.646 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -123.7 | 131.5 | -173 | -174.6 | 0 | 0 | 0 | 0 | 109.4 | Y350 A351 Q353 F361 R365 | Y350-V363 CarbonylContact C-O 3.58Å; Y350-V363 WeakPolarHBondContact CA-O 3.37Å; A351-V363 PolarHBondContact N-O 2.85Å; A351-V363 PolarHBondContact O-N 2.97Å; Q353-V363 HydrophobicContact CB-CG2 4.04Å; F361-V363 HydrophobicContact CB-CG2 4.24Å; V363-R365 PolarHBondContact O-N 3.32Å |
| 364 | P | 89.4 | Confident | 74.3 | Confident | 90 Ų | 90 | 113.5 Ų | 113.5 | 58% | 0.584 | 65% | 0.65 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -59.3 | 132.1 | 173.8 | -22.5 | 33 | 0 | 0 | 0 | 111.5 | E349 Y350 G366 | E349-P364 CarbonylContact O-C 3.6Å; E349-P364 WeakPolarHBondContact O-CA 3.26Å; Y350-P364 HydrophobicContact CD1-CB 4.34Å; Y350-P364 HydrophobicContact CD1-CG 4.15Å; Y350-P364 HydrophobicContact CE1-CB 4.32Å; Y350-P364 HydrophobicContact CE1-CG 3.96Å; P364-G366 PolarHBondContact O-N 2.86Å |
| 365 | R | 84 | Confident | 73.4 | Confident | 129 Ų | 129 | 112.2 Ų | 112.2 | 49% | 0.487 | 65% | 0.651 | S | S | . | * | trans | -74.7 | 111.8 | 169.5 | -59.4 | -179.1 | 95.2 | 168.3 | 2 | 106.6 | P347 E348 E349 A351 V363 T367 | P347-R365 WeakPolarHBondContact O-CD 3.29Å; P347-R365 PolarHBondContact O-NH1 2.84Å; E348-R365 WeakPolarHBondContact O-CD 3.24Å; E349-R365 PolarHBondContact O-N 3.28Å; A351-R365 HydrophobicContact CB-CG 3.68Å; V363-R365 PolarHBondContact O-N 3.32Å; R365-T367 PolarHBondContact O-N 3.21Å | ||
| 366 | G | 73.1 | Confident | 72.5 | Confident | 76 Ų | 76 | 116.3 Ų | 116.3 | 78% | 0.784 | 67% | 0.669 | S | S | * | * | trans | -53.6 | 115.4 | -179 | 0 | 0 | 0 | 0 | 0 | 110.8 | P364 K368 | P364-G366 PolarHBondContact O-N 2.86Å; G366-K368 PolarHBondContact O-N 3.04Å | ||
| 367 | T | 56.8 | Low | 71.4 | Confident | 114 Ų | 114 | 116.1 Ų | 116.1 | 70% | 0.699 | 65% | 0.651 | S | S | * | * | trans | -63.8 | 120.5 | -176.6 | 42.4 | 0 | 0 | 0 | 0 | 109.8 | R365 M369 | R365-T367 PolarHBondContact O-N 3.21Å; T367-M369 PolarHBondContact O-N 3.19Å | ||
| 368 | K | 53.1 | Low | 70.2 | Confident | 211 Ų | 211 | 116.1 Ų | 116.1 | 92% | 0.917 | 65% | 0.652 | S | S | * | * | trans | -68.1 | 89.8 | 157.2 | -82.4 | -170.3 | 172.4 | -173.5 | 0 | 107.2 | G366 E370 | G366-K368 PolarHBondContact O-N 3.04Å; K368-E370 PolarHBondContact O-N 3.33Å | ||
| 369 | M | 45.6 | Very low | 69 | Low | 171 Ų | 171 | 121.4 Ų | 121.4 | 84% | 0.842 | 67% | 0.671 | S | S | * | * | trans | -58.2 | 116.3 | 158.3 | -79.9 | 174.9 | 153.3 | 0 | 0 | 107.5 | T367 A371 | T367-M369 PolarHBondContact O-N 3.19Å; M369-A371 PolarHBondContact O-N 2.91Å | ||
| 370 | E | 47.4 | Very low | 67.3 | Low | 172 Ų | 172 | 125.9 Ų | 125.9 | 80% | 0.804 | 69% | 0.693 | S | S | * | * | trans | -62.8 | 122.8 | 158.9 | -70.1 | -170.2 | 116.1 | 0 | 0 | 107.4 | K368 T372 | K368-E370 PolarHBondContact O-N 3.33Å; E370-T372 VanDerWaalsContact C-N 3.35Å; E370-T372 HydrophobicContact CB-CG2 4.39Å; E370-T372 PolarHBondContact O-N 3.08Å; E370-T372 VanDerWaalsContact O-N 3.08Å | ||
| 371 | A | 48 | Very low | 65.6 | Low | 108 Ų | 108 | 127.7 Ų | 127.7 | 89% | 0.893 | 71% | 0.706 | S | S | * | * | trans | -78.7 | 88.5 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | M369 | M369-A371 PolarHBondContact O-N 2.91Š| ||
| 372 | T | 47 | Very low | 63.6 | Low | 118 Ų | 118 | 129.1 Ų | 129.1 | 72% | 0.724 | 72% | 0.724 | S | S | * | * | trans | -91.5 | 131.7 | 171.5 | 53.4 | 0 | 0 | 0 | 0 | 110.8 | E370 | E370-T372 VanDerWaalsContact C-N 3.35Å; E370-T372 HydrophobicContact CB-CG2 4.39Å; E370-T372 PolarHBondContact O-N 3.08Å; E370-T372 VanDerWaalsContact O-N 3.08Å | ||
| 373 | D | 36.3 | Very low | 61.1 | Low | 250 Ų | 250 | 135.6 Ų | 135.6 | 100% | 1.337 | 76% | 0.763 | S | S | * | * | trans | 64.9 | 0 | -174.2 | -84.4 | -11.6 | 0 | 0 | 0 | 116.5 |
Retrieved 373 of 373 residues in 118.3 ms
(Link to these results)