| 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 | 33.6 | Very low | 36.3 | Very low | 252 Ų | 252 | 166 Ų | 166 | 100% | 1.241 | 88% | 0.881 | S | S | * | * | 0 | 147.8 | 0 | -56.2 | 178.9 | -164.4 | 0 | 0 | 108.2 | |||||
| 2 | A | 38.2 | Very low | 36.4 | Very low | 103 Ų | 103 | 157 Ų | 157 | 85% | 0.851 | 86% | 0.857 | S | S | * | * | trans | -139.2 | 139.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 3 | K | 35.4 | Very low | 36.6 | Very low | 219 Ų | 219 | 154.4 Ų | 154.4 | 95% | 0.952 | 84% | 0.838 | S | S | * | * | trans | -125.7 | 116.7 | 175.5 | -113.2 | 177.1 | 178.3 | 177.7 | 0 | 110.3 | ||||
| 4 | K | 40.9 | Very low | 37.6 | Very low | 194 Ų | 194 | 151.4 Ų | 151.4 | 84% | 0.843 | 83% | 0.827 | S | S | * | * | trans | -68.1 | 128.5 | -178.8 | 178.2 | 179.7 | 178.7 | -179.3 | 0 | 110 | ||||
| 5 | N | 31.5 | Very low | 37.6 | Very low | 157 Ų | 157 | 150.2 Ų | 150.2 | 84% | 0.84 | 81% | 0.811 | S | S | * | * | trans | -77.1 | 144.3 | 167.6 | -165.1 | 11.4 | 0 | 0 | 0 | 109.4 | ||||
| 6 | S | 31.4 | Very low | 38.1 | Very low | 92 Ų | 92 | 146 Ų | 146 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | trans | -136.6 | 127.3 | -179 | -123.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 7 | Q | 38.7 | Very low | 38.9 | Very low | 198 Ų | 198 | 145.5 Ų | 145.5 | 93% | 0.925 | 79% | 0.791 | S | S | * | * | trans | -60.8 | 145 | 171.2 | -68.5 | 167.2 | -73.5 | 0 | 0 | 110.3 | ||||
| 8 | K | 35.9 | Very low | 39.5 | Very low | 194 Ų | 194 | 145.3 Ų | 145.3 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | -149.3 | 124.1 | 162.4 | -169.7 | 175.7 | -176.2 | -179.8 | 0 | 108.9 | ||||
| 9 | D | 38.4 | Very low | 39.9 | Very low | 151 Ų | 151 | 144.2 Ų | 144.2 | 81% | 0.807 | 78% | 0.782 | S | S | * | * | trans | -66.5 | 141.3 | -176.7 | -56.1 | -88.5 | 0 | 0 | 0 | 112.8 | ||||
| 10 | T | 34.3 | Very low | 40.1 | Very low | 136 Ų | 136 | 147.1 Ų | 147.1 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | -133 | 64.7 | 169.3 | 58.8 | 0 | 0 | 0 | 0 | 110 | G12 | T10-G12 PolarHBondContact O-N 3.49Š| ||
| 11 | S | 40.9 | Very low | 40.4 | Very low | 130 Ų | 130 | 145.9 Ų | 145.9 | 91% | 0.909 | 78% | 0.778 | S | S | * | * | trans | -67.7 | 98 | 167.4 | -174.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 12 | G | 37.5 | Very low | 40.9 | Very low | 58 Ų | 58 | 137.8 Ų | 137.8 | 60% | 0.598 | 74% | 0.742 | S | S | * | * | trans | -126.2 | 83.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | T10 V14 | T10-G12 PolarHBondContact O-N 3.49Å; G12-V14 PolarHBondContact O-N 2.84Å | ||
| 13 | M | 39.4 | Very low | 41.2 | Very low | 123 Ų | 123 | 138.9 Ų | 138.9 | 61% | 0.606 | 73% | 0.731 | S | S | * | * | trans | -81.3 | 99.8 | 177.9 | -169.3 | -177.8 | -163.8 | 0 | 0 | 110.4 | F15 V22 | M13-F15 HydrophobicContact CE-CE1 4.49Å; M13-F15 HydrophobicContact CE-CE2 3.96Å; M13-F15 HydrophobicContact CE-CZ 3.63Å; M13-F15 HydrophobicContact CG-CD2 4.42Å; M13-F15 HydrophobicContact CG-CE2 3.86Å; M13-F15 HydrophobicContact CG-CZ 4.47Å; M13-F15 HydrophobicContact SD-CE2 3.72Å; M13-F15 HydrophobicContact SD-CZ 3.97Å; M13-V22 HydrophobicContact CE-CB 4.32Å; M13-V22 HydrophobicContact CE-CG1 3.54Å; M13-V22 HydrophobicContact CE-CG2 3.74Å | ||
| 14 | V | 49.9 | Very low | 41.5 | Very low | 112 Ų | 112 | 133.8 Ų | 133.8 | 68% | 0.679 | 72% | 0.723 | S | S | * | * | trans | -95.6 | 127.8 | 178 | -174.9 | 0 | 0 | 0 | 0 | 110.2 | G12 | G12-V14 PolarHBondContact O-N 2.84Š| ||
| 15 | F | 38.3 | Very low | 41.7 | Very low | 134 Ų | 134 | 133.4 Ų | 133.4 | 59% | 0.588 | 73% | 0.725 | S | S | * | * | B | Isolated β-bridge | trans | -99.5 | 125.5 | 173.8 | -75.1 | -98.5 | 0 | 0 | 0 | 110.1 | M13 V22 | M13-F15 HydrophobicContact CE-CE1 4.49Å; M13-F15 HydrophobicContact CE-CE2 3.96Å; M13-F15 HydrophobicContact CE-CZ 3.63Å; M13-F15 HydrophobicContact CG-CD2 4.42Å; M13-F15 HydrophobicContact CG-CE2 3.86Å; M13-F15 HydrophobicContact CG-CZ 4.47Å; M13-F15 HydrophobicContact SD-CE2 3.72Å; M13-F15 HydrophobicContact SD-CZ 3.97Å; F15-V22 HydrophobicContact CD1-CG2 4.17Å; F15-V22 HydrophobicContact CE1-CG2 3.59Å; F15-V22 HydrophobicContact CZ-CG2 4.04Å |
| 16 | D | 45.8 | Very low | 42.5 | Very low | 83 Ų | 83 | 129.5 Ų | 129.5 | 44% | 0.444 | 72% | 0.722 | S | S | . | * | trans | -94.4 | 114.6 | 169.5 | -167.7 | -31.3 | 0 | 0 | 0 | 110.6 | N18 L19 K20 | D16-N18 PolarHBondContact O-N 3.1Å; D16-N18 WeakPolarHBondContact OD1-CB 3.21Å; D16-N18 PolarHBondContact OD1-N 2.71Å; D16-N18 PolarHBondContact OD1-ND2 2.72Å; D16-L19 PolarHBondContact O-N 3.38Å; D16-K20 PolarHBondContact O-N 2.67Å; D16-K20 VanDerWaalsContact O-N 3.12Å | ||
| 17 | T | 50.7 | Low | 43.4 | Very low | 137 Ų | 137 | 127.7 Ų | 127.7 | 84% | 0.84 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | -18.8 | -178.6 | -28 | 0 | 0 | 0 | 0 | 113.5 | ||
| 18 | N | 50.4 | Low | 44.4 | Very low | 142 Ų | 142 | 123.2 Ų | 123.2 | 76% | 0.759 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -34.1 | -178.1 | -60.7 | -81 | 0 | 0 | 0 | 113.2 | D16 | D16-N18 PolarHBondContact O-N 3.1Å; D16-N18 WeakPolarHBondContact OD1-CB 3.21Å; D16-N18 PolarHBondContact OD1-N 2.71Å; D16-N18 PolarHBondContact OD1-ND2 2.72Å |
| 19 | L | 46.6 | Very low | 45.4 | Very low | 124 Ų | 124 | 120.8 Ų | 120.8 | 65% | 0.649 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | -13.1 | -177.9 | -95 | 71.2 | 0 | 0 | 0 | 114 | D16 M21 | D16-L19 PolarHBondContact O-N 3.38Å; L19-M21 PolarHBondContact O-N 3.1Å; L19-M21 VanDerWaalsContact O-N 3.15Å |
| 20 | K | 43.8 | Very low | 46.7 | Very low | 202 Ų | 202 | 118.5 Ų | 118.5 | 88% | 0.878 | 68% | 0.678 | S | S | * | * | trans | 57.9 | 29.6 | 173.5 | -148.9 | 179.7 | -172.8 | -179.3 | 0 | 113.8 | D16 | D16-K20 PolarHBondContact O-N 2.67Å; D16-K20 VanDerWaalsContact O-N 3.12Å | ||
| 21 | M | 47.6 | Very low | 48.9 | Very low | 123 Ų | 123 | 120.2 Ų | 120.2 | 61% | 0.606 | 67% | 0.669 | S | S | * | * | trans | -123 | 153.3 | 177.7 | -87.5 | 171.5 | 48.4 | 0 | 0 | 110.6 | L19 | L19-M21 PolarHBondContact O-N 3.1Å; L19-M21 VanDerWaalsContact O-N 3.15Å | ||
| 22 | V | 43.4 | Very low | 51.1 | Low | 81 Ų | 81 | 116.6 Ų | 116.6 | 49% | 0.491 | 64% | 0.638 | S | S | . | * | B | Isolated β-bridge | trans | -90.2 | 129.8 | 169 | 174.8 | 0 | 0 | 0 | 0 | 108.3 | M13 F15 | M13-V22 HydrophobicContact CE-CB 4.32Å; M13-V22 HydrophobicContact CE-CG1 3.54Å; M13-V22 HydrophobicContact CE-CG2 3.74Å; F15-V22 HydrophobicContact CD1-CG2 4.17Å; F15-V22 HydrophobicContact CE1-CG2 3.59Å; F15-V22 HydrophobicContact CZ-CG2 4.04Å |
| 23 | M | 44.3 | Very low | 53.6 | Low | 126 Ų | 126 | 118.9 Ų | 118.9 | 62% | 0.621 | 63% | 0.632 | S | S | * | * | trans | -112.7 | 123 | 172.2 | -66.9 | -164.2 | 73.7 | 0 | 0 | 110.9 | ||||
| 24 | S | 42.1 | Very low | 56.2 | Low | 112 Ų | 112 | 119.4 Ų | 119.4 | 78% | 0.783 | 63% | 0.633 | S | S | * | * | trans | -75.1 | 132.7 | 159.4 | -173.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 25 | Q | 45.7 | Very low | 58.3 | Low | 187 Ų | 187 | 116.5 Ų | 116.5 | 87% | 0.874 | 61% | 0.611 | S | S | * | * | trans | -88.9 | 133 | -169.2 | -167.4 | 179.4 | 21.9 | 0 | 0 | 112.5 | ||||
| 26 | G | 46.8 | Very low | 60.9 | Low | 75 Ų | 75 | 111.2 Ų | 111.2 | 77% | 0.773 | 59% | 0.589 | S | S | * | * | S | Bend | trans | 93.4 | 102.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 27 | G | 51.3 | Low | 63.3 | Low | 54 Ų | 54 | 111.1 Ų | 111.1 | 56% | 0.557 | 59% | 0.594 | S | S | * | * | S | Bend | trans | 131.5 | -45.4 | 164.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | F29 R31 | G27-F29 PolarHBondContact O-N 3.26Å; G27-R31 PolarHBondContact O-N 3.23Å |
| 28 | T | 58.4 | Low | 65.5 | Low | 104 Ų | 104 | 106.6 Ų | 106.6 | 64% | 0.638 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -65.9 | -38.7 | -177.6 | 48.7 | 0 | 0 | 0 | 0 | 113.4 | R31 M32 | T28-R31 PolarHBondContact O-N 3.07Å; T28-M32 PolarHBondContact O-N 2.93Å |
| 29 | F | 57 | Low | 67.6 | Low | 142 Ų | 142 | 99.8 Ų | 99.8 | 62% | 0.623 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.4 | -45.7 | -176.8 | -175.9 | -101.3 | 0 | 0 | 0 | 113.2 | G27 M32 K33 | G27-F29 PolarHBondContact O-N 3.26Å; F29-M32 PolarHBondContact O-N 2.94Å; F29-K33 HydrophobicContact CE1-CD 4.33Å; F29-K33 WeakPolarHBondContact O-CB 3.02Å; F29-K33 PolarHBondContact O-N 3.28Å |
| 30 | E | 67.3 | Low | 69.9 | Low | 103 Ų | 103 | 100 Ų | 100 | 48% | 0.481 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.2 | -39.9 | 176.8 | -73.2 | -62.4 | 147.5 | 0 | 0 | 111.3 | M32 K33 E34 | E30-M32 VanDerWaalsContact C-N 3.25Å; E30-M32 PolarHBondContact O-N 3.34Å; E30-K33 PolarHBondContact O-N 3.04Å; E30-K33 IonicContact OE1-NZ 2.75Å; E30-K33 PolarHBondContact OE1-NZ 3.07Å; E30-K33 IonicContact OE2-NZ 2.65Å; E30-K33 PolarHBondContact OE2-NZ 3.48Å; E30-E34 WeakPolarHBondContact O-CB 3.49Å; E30-E34 PolarHBondContact O-N 3.13Å |
| 31 | R | 79.5 | Confident | 72.4 | Confident | 172 Ų | 172 | 94.4 Ų | 94.4 | 65% | 0.649 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.2 | -30.2 | 173.4 | -162.3 | 179.5 | -168.4 | -166.9 | 4.3 | 112.9 | G27 T28 K35 | G27-R31 PolarHBondContact O-N 3.23Å; T28-R31 PolarHBondContact O-N 3.07Å; R31-K35 VanDerWaalsContact O-CG 3.27Å; R31-K35 WeakPolarHBondContact O-CG 3.39Å; R31-K35 PolarHBondContact O-N 3.39Å |
| 32 | M | 87.2 | Confident | 74.6 | Confident | 55 Ų | 55 | 92.4 Ų | 92.4 | 27% | 0.271 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -78 | -41.1 | 173.3 | 179.1 | 158.4 | -83.5 | 0 | 0 | 112 | T28 F29 E30 E34 K35 I36 V52 N60 | T28-M32 PolarHBondContact O-N 2.93Å; F29-M32 PolarHBondContact O-N 2.94Å; E30-M32 VanDerWaalsContact C-N 3.25Å; E30-M32 PolarHBondContact O-N 3.34Å; M32-E34 VanDerWaalsContact C-N 3.34Å; M32-E34 PolarHBondContact O-N 3.31Å; M32-K35 PolarHBondContact O-N 3.19Å; M32-I36 HydrophobicContact CG-CD1 3.93Å; M32-I36 HydrophobicContact CG-CG1 4.4Å; M32-I36 VanDerWaalsContact O-CG1 3.25Å; M32-I36 WeakPolarHBondContact O-CG1 3.29Å; M32-I36 PolarHBondContact O-N 3.17Å; M32-V52 HydrophobicContact SD-CG1 4.39Å; M32-V52 HydrophobicContact SD-CG2 4.28Å; M32-N60 WeakPolarHBondContact CE-OD1 3.45Å |
| 33 | K | 90.2 | Very high | 76.9 | Confident | 106 Ų | 106 | 89.2 Ų | 89.2 | 46% | 0.461 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61 | -39.9 | 175.4 | 174.8 | 173.6 | 154.7 | -129.3 | 0 | 112.4 | F29 E30 S37 | F29-K33 HydrophobicContact CE1-CD 4.33Å; F29-K33 WeakPolarHBondContact O-CB 3.02Å; F29-K33 PolarHBondContact O-N 3.28Å; E30-K33 PolarHBondContact O-N 3.04Å; E30-K33 IonicContact OE1-NZ 2.75Å; E30-K33 PolarHBondContact OE1-NZ 3.07Å; E30-K33 IonicContact OE2-NZ 2.65Å; E30-K33 PolarHBondContact OE2-NZ 3.48Å; K33-S37 WeakPolarHBondContact O-CB 3.44Å; K33-S37 PolarHBondContact O-N 3.43Å |
| 34 | E | 93.6 | Very high | 79 | Confident | 134 Ų | 134 | 86.9 Ų | 86.9 | 63% | 0.626 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -59.8 | -50.6 | 170.5 | -178.5 | 178 | -143.6 | 0 | 0 | 111.5 | E30 M32 I36 S37 A38 | E30-E34 WeakPolarHBondContact O-CB 3.49Å; E30-E34 PolarHBondContact O-N 3.13Å; M32-E34 VanDerWaalsContact C-N 3.34Å; M32-E34 PolarHBondContact O-N 3.31Å; E34-I36 PolarHBondContact O-N 3Å; E34-S37 WeakPolarHBondContact O-CA 3.45Å; E34-S37 WeakPolarHBondContact O-CB 3.2Å; E34-S37 PolarHBondContact O-N 3.39Å; E34-S37 VanDerWaalsContact O-N 3.09Å; E34-A38 PolarHBondContact O-N 3.26Å |
| 35 | K | 93.8 | Very high | 81.3 | Confident | 51 Ų | 51 | 89 Ų | 89 | 22% | 0.222 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 177.1 | -71.7 | 179.4 | 174.6 | -163.5 | 0 | 113 | R31 M32 S37 A38 V39 L55 N60 V62 | R31-K35 VanDerWaalsContact O-CG 3.27Å; R31-K35 WeakPolarHBondContact O-CG 3.39Å; R31-K35 PolarHBondContact O-N 3.39Å; M32-K35 PolarHBondContact O-N 3.19Å; K35-S37 VanDerWaalsContact C-N 3.31Å; K35-S37 PolarHBondContact O-N 2.99Å; K35-A38 PolarHBondContact O-N 3.46Å; K35-V39 WeakPolarHBondContact O-CG2 3.44Å; K35-V39 PolarHBondContact O-N 3.45Å; K35-L55 HydrophobicContact CB-CD1 3.98Å; K35-L55 HydrophobicContact CB-CD2 4.48Å; K35-N60 HydrophobicContact CD-CB 4.07Å; K35-N60 WeakPolarHBondContact CD-O 3.48Å; K35-N60 WeakPolarHBondContact CE-O 3.34Å; K35-N60 PolarHBondContact NZ-O 3.15Å; K35-V62 HydrophobicContact CB-CG2 3.86Å; K35-V62 HydrophobicContact CD-CG2 4.29Å; K35-V62 HydrophobicContact CG-CG2 3.68Å |
| 36 | I | 94.6 | Very high | 83.5 | Confident | 22 Ų | 22 | 82.7 Ų | 82.7 | 11% | 0.113 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -60.2 | -43.6 | 173.3 | -65 | 159.6 | 0 | 0 | 0 | 110.2 | M32 E34 A38 R40 N48 I51 V52 L55 | M32-I36 HydrophobicContact CG-CD1 3.93Å; M32-I36 HydrophobicContact CG-CG1 4.4Å; M32-I36 VanDerWaalsContact O-CG1 3.25Å; M32-I36 WeakPolarHBondContact O-CG1 3.29Å; M32-I36 PolarHBondContact O-N 3.17Å; E34-I36 PolarHBondContact O-N 3Å; I36-A38 PolarHBondContact O-N 3.01Å; I36-R40 WeakPolarHBondContact O-CB 3.44Å; I36-R40 PolarHBondContact O-N 2.93Å; I36-N48 HydrophobicContact CG2-CB 4.06Å; I36-I51 HydrophobicContact CB-CG2 4.22Å; I36-I51 HydrophobicContact CG1-CG2 4.12Å; I36-I51 HydrophobicContact CG2-CB 4.46Å; I36-I51 HydrophobicContact CG2-CD1 4.45Å; I36-I51 HydrophobicContact CG2-CG2 4.09Å; I36-V52 HydrophobicContact CD1-CG2 3.44Å; I36-V52 VanDerWaalsContact CD1-CG2 3.44Å; I36-V52 HydrophobicContact CG1-CG2 3.88Å; I36-L55 HydrophobicContact CG1-CD1 4.15Å |
| 37 | S | 95.5 | Very high | 85.7 | Confident | 81 Ų | 81 | 81.6 Ų | 81.6 | 57% | 0.566 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.5 | -38 | 178.1 | -164.1 | 0 | 0 | 0 | 0 | 112.5 | K33 E34 K35 R40 A41 | K33-S37 WeakPolarHBondContact O-CB 3.44Å; K33-S37 PolarHBondContact O-N 3.43Å; E34-S37 WeakPolarHBondContact O-CA 3.45Å; E34-S37 WeakPolarHBondContact O-CB 3.2Å; E34-S37 PolarHBondContact O-N 3.39Å; E34-S37 VanDerWaalsContact O-N 3.09Å; K35-S37 VanDerWaalsContact C-N 3.31Å; K35-S37 PolarHBondContact O-N 2.99Å; S37-R40 PolarHBondContact O-N 3.3Å; S37-A41 PolarHBondContact O-N 2.63Å |
| 38 | A | 95.8 | Very high | 87.7 | Confident | 42 Ų | 42 | 82.7 Ų | 82.7 | 35% | 0.347 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.9 | -49.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | E34 K35 I36 R40 A41 V62 | E34-A38 PolarHBondContact O-N 3.26Å; K35-A38 PolarHBondContact O-N 3.46Å; I36-A38 PolarHBondContact O-N 3.01Å; A38-R40 VanDerWaalsContact C-N 3.31Å; A38-R40 PolarHBondContact O-N 3.02Å; A38-A41 WeakPolarHBondContact O-CB 3.24Å; A38-A41 PolarHBondContact O-N 2.85Å; A38-V62 HydrophobicContact CB-CG1 3.94Å; A38-V62 HydrophobicContact CB-CG2 4.48Å |
| 39 | V | 95.2 | Very high | 89.4 | Confident | 0 Ų | 0 | 83.6 Ų | 83.6 | 0% | 0 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -59.3 | -43.9 | 174.6 | 178.1 | 0 | 0 | 0 | 0 | 110.7 | K35 A41 V42 V43 I51 L55 V62 A65 V66 F69 | K35-V39 WeakPolarHBondContact O-CG2 3.44Å; K35-V39 PolarHBondContact O-N 3.45Å; V39-A41 VanDerWaalsContact C-N 3.29Å; V39-A41 PolarHBondContact O-N 3.12Å; V39-V42 PolarHBondContact O-N 3.02Å; V39-V43 HydrophobicContact CG1-CG2 4.44Å; V39-V43 PolarHBondContact O-N 3.02Å; V39-I51 HydrophobicContact CB-CG2 3.77Å; V39-I51 HydrophobicContact CG1-CD1 4.32Å; V39-I51 HydrophobicContact CG1-CG1 4.09Å; V39-I51 HydrophobicContact CG1-CG2 3.87Å; V39-I51 HydrophobicContact CG2-CG2 4.12Å; V39-L55 HydrophobicContact CG2-CD1 4.38Å; V39-L55 HydrophobicContact CG2-CD2 4.07Å; V39-L55 HydrophobicContact CG2-CG 4.33Å; V39-V62 HydrophobicContact CG2-CG1 3.94Å; V39-A65 HydrophobicContact CG2-CB 4.18Å; V39-V66 HydrophobicContact CB-CG2 4.23Å; V39-V66 HydrophobicContact CG1-CG2 4.1Å; V39-V66 HydrophobicContact CG2-CG2 4.14Å; V39-F69 HydrophobicContact CG1-CD2 3.81Å; V39-F69 HydrophobicContact CG1-CE2 3.97Å |
| 40 | R | 95.4 | Very high | 91.1 | Very high | 127 Ų | 127 | 80 Ų | 80 | 48% | 0.479 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -70.2 | -20.4 | -177.5 | -165.4 | 169.6 | 179.1 | -122.8 | -5.4 | 114 | I36 S37 A38 V42 V43 P44 I51 | I36-R40 WeakPolarHBondContact O-CB 3.44Å; I36-R40 PolarHBondContact O-N 2.93Å; S37-R40 PolarHBondContact O-N 3.3Å; A38-R40 VanDerWaalsContact C-N 3.31Å; A38-R40 PolarHBondContact O-N 3.02Å; R40-V42 VanDerWaalsContact C-N 3.32Å; R40-V43 CarbonylContact O-C 3.59Å; R40-P44 VanDerWaalsContact O-CA 3.31Å; R40-P44 WeakPolarHBondContact O-CA 3.47Å; R40-I51 HydrophobicContact CB-CD1 3.87Å; R40-I51 HydrophobicContact CG-CD1 4.23Å |
| 41 | A | 95.1 | Very high | 92.3 | Very high | 86 Ų | 86 | 75.1 Ų | 75.1 | 71% | 0.711 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -68.3 | -32.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | S37 A38 V39 | S37-A41 PolarHBondContact O-N 2.63Å; A38-A41 WeakPolarHBondContact O-CB 3.24Å; A38-A41 PolarHBondContact O-N 2.85Å; V39-A41 VanDerWaalsContact C-N 3.29Å; V39-A41 PolarHBondContact O-N 3.12Å |
| 42 | V | 93.9 | Very high | 93 | Very high | 81 Ų | 81 | 68.8 Ų | 68.8 | 49% | 0.491 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -88.6 | -34.8 | 174.8 | -171 | 0 | 0 | 0 | 0 | 111.4 | V39 R40 P44 V66 L70 | V39-V42 PolarHBondContact O-N 3.02Å; R40-V42 VanDerWaalsContact C-N 3.32Å; V42-P44 WeakPolarHBondContact O-CD 3.05Å; V42-V66 HydrophobicContact CB-CG1 4.05Å; V42-V66 HydrophobicContact CB-CG2 4.33Å; V42-V66 HydrophobicContact CG1-CG1 3.71Å; V42-V66 HydrophobicContact CG2-CG1 4.34Å; V42-V66 HydrophobicContact CG2-CG2 4.35Å; V42-L70 HydrophobicContact CG1-CD1 4.45Å |
| 43 | V | 91.9 | Very high | 93.3 | Very high | 13 Ų | 13 | 68.4 Ų | 68.4 | 8% | 0.079 | 38% | 0.376 | C | S | . | . | trans | -123.2 | 71.1 | -174.6 | -151.4 | 0 | 0 | 0 | 0 | 111.6 | V39 R40 N45 K46 F69 | V39-V43 HydrophobicContact CG1-CG2 4.44Å; V39-V43 PolarHBondContact O-N 3.02Å; R40-V43 CarbonylContact O-C 3.59Å; V43-N45 PolarHBondContact O-N 3.39Å; V43-N45 VanDerWaalsContact O-N 3.16Å; V43-K46 HydrophobicContact CB-CG 4.18Å; V43-K46 HydrophobicContact CG1-CD 4.4Å; V43-K46 HydrophobicContact CG1-CG 3.5Å; V43-K46 PolarHBondContact O-N 3.06Å; V43-F69 HydrophobicContact CB-CB 4.41Å; V43-F69 HydrophobicContact CG1-CB 4.01Å; V43-F69 HydrophobicContact CG1-CG 4.42Å; V43-F69 HydrophobicContact CG2-CB 3.84Å; V43-F69 HydrophobicContact CG2-CG 4.48Å | ||
| 44 | P | 89.7 | Confident | 93.5 | Very high | 78 Ų | 78 | 63.3 Ų | 63.3 | 51% | 0.506 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -22.9 | -170.7 | 25.5 | -35.8 | 0 | 0 | 0 | 114.4 | R40 V42 K46 | R40-P44 VanDerWaalsContact O-CA 3.31Å; R40-P44 WeakPolarHBondContact O-CA 3.47Å; V42-P44 WeakPolarHBondContact O-CD 3.05Å; P44-K46 VanDerWaalsContact C-N 3.29Å; P44-K46 PolarHBondContact O-N 2.86Å |
| 45 | N | 90.3 | Very high | 93.5 | Very high | 155 Ų | 155 | 57 Ų | 57 | 83% | 0.829 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | 12.5 | -175 | -63.9 | -21.6 | 0 | 0 | 0 | 114.2 | V43 | V43-N45 PolarHBondContact O-N 3.39Å; V43-N45 VanDerWaalsContact O-N 3.16Å |
| 46 | K | 92 | Very high | 93.4 | Very high | 55 Ų | 55 | 59.6 Ų | 59.6 | 24% | 0.239 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -110.5 | 146 | 178 | -55.9 | -63.4 | 179.3 | 174.8 | 0 | 111 | V43 P44 I51 F69 | V43-K46 HydrophobicContact CB-CG 4.18Å; V43-K46 HydrophobicContact CG1-CD 4.4Å; V43-K46 HydrophobicContact CG1-CG 3.5Å; V43-K46 PolarHBondContact O-N 3.06Å; P44-K46 VanDerWaalsContact C-N 3.29Å; P44-K46 PolarHBondContact O-N 2.86Å; K46-I51 HydrophobicContact CB-CD1 4.08Å; K46-I51 HydrophobicContact CB-CG1 3.97Å; K46-F69 HydrophobicContact CB-CE1 4.35Å; K46-F69 HydrophobicContact CB-CZ 4.41Å; K46-F69 HydrophobicContact CD-CD1 3.81Å; K46-F69 HydrophobicContact CD-CE1 3.75Å; K46-F69 HydrophobicContact CG-CD1 3.83Å; K46-F69 HydrophobicContact CG-CE1 3.81Å; K46-F69 HydrophobicContact CG-CG 4.29Å; K46-F69 HydrophobicContact CG-CZ 4.27Å |
| 47 | S | 93.1 | Very high | 93.2 | Very high | 52 Ų | 52 | 62.7 Ų | 62.7 | 36% | 0.364 | 35% | 0.351 | S | S | . | . | trans | -78.3 | 152.3 | 176.4 | 71.9 | 0 | 0 | 0 | 0 | 111.7 | N49 E50 I51 | S47-N49 PolarHBondContact O-N 2.68Å; S47-N49 VanDerWaalsContact O-N 3.15Å; S47-E50 WeakPolarHBondContact CB-OE2 3.44Å; S47-E50 PolarHBondContact N-OE2 3.43Å; S47-E50 PolarHBondContact O-N 3.4Å; S47-E50 WeakPolarHBondContact OG-CG 3.21Å; S47-E50 PolarHBondContact OG-N 3.27Å; S47-E50 PolarHBondContact OG-OE2 2.88Å; S47-I51 WeakPolarHBondContact O-CG1 3.46Å; S47-I51 PolarHBondContact O-N 3.13Å | ||
| 48 | N | 93.1 | Very high | 93 | Very high | 77 Ų | 77 | 61.2 Ų | 61.2 | 41% | 0.412 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -56 | -33.1 | 177.1 | -64.8 | 5.1 | 0 | 0 | 0 | 112.2 | I36 I51 V52 | I36-N48 HydrophobicContact CG2-CB 4.06Å; N48-I51 PolarHBondContact O-N 2.89Å; N48-V52 VanDerWaalsContact O-CG2 3.3Å; N48-V52 WeakPolarHBondContact O-CG2 3.44Å; N48-V52 PolarHBondContact O-N 3.02Å |
| 49 | N | 92.5 | Very high | 92.7 | Very high | 124 Ų | 124 | 67.4 Ų | 67.4 | 66% | 0.663 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -70.6 | -42.6 | -179.6 | -66.1 | 5.5 | 0 | 0 | 0 | 111.8 | S47 I51 V52 L53 | S47-N49 PolarHBondContact O-N 2.68Å; S47-N49 VanDerWaalsContact O-N 3.15Å; N49-I51 VanDerWaalsContact C-N 3.33Å; N49-V52 PolarHBondContact O-N 3.31Å; N49-L53 WeakPolarHBondContact O-CG 3.3Å; N49-L53 PolarHBondContact O-N 2.9Å; N49-L53 VanDerWaalsContact O-N 3.09Å |
| 50 | E | 92.6 | Very high | 92.5 | Very high | 67 Ų | 67 | 69.8 Ų | 69.8 | 31% | 0.313 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 173.5 | -69 | 163.1 | 110.5 | 0 | 0 | 110.9 | S47 V52 L53 V54 F69 L78 | S47-E50 WeakPolarHBondContact CB-OE2 3.44Å; S47-E50 PolarHBondContact N-OE2 3.43Å; S47-E50 PolarHBondContact O-N 3.4Å; S47-E50 WeakPolarHBondContact OG-CG 3.21Å; S47-E50 PolarHBondContact OG-N 3.27Å; S47-E50 PolarHBondContact OG-OE2 2.88Å; E50-V52 VanDerWaalsContact C-N 3.34Å; E50-V52 PolarHBondContact O-N 3.13Å; E50-L53 PolarHBondContact O-N 3.41Å; E50-V54 WeakPolarHBondContact O-CG2 3.38Å; E50-V54 PolarHBondContact O-N 3.36Å; E50-F69 HydrophobicContact CB-CZ 4.31Å; E50-L78 HydrophobicContact CB-CD1 3.88Å; E50-L78 HydrophobicContact CB-CD2 3.92Å; E50-L78 HydrophobicContact CG-CD1 3.91Å; E50-L78 HydrophobicContact CG-CD2 4.04Å |
| 51 | I | 94.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62 | -40.8 | 177.8 | -66 | 168.5 | 0 | 0 | 0 | 111.1 | I36 V39 R40 K46 S47 N48 N49 L55 F69 | I36-I51 HydrophobicContact CB-CG2 4.22Å; I36-I51 HydrophobicContact CG1-CG2 4.12Å; I36-I51 HydrophobicContact CG2-CB 4.46Å; I36-I51 HydrophobicContact CG2-CD1 4.45Å; I36-I51 HydrophobicContact CG2-CG2 4.09Å; V39-I51 HydrophobicContact CB-CG2 3.77Å; V39-I51 HydrophobicContact CG1-CD1 4.32Å; V39-I51 HydrophobicContact CG1-CG1 4.09Å; V39-I51 HydrophobicContact CG1-CG2 3.87Å; V39-I51 HydrophobicContact CG2-CG2 4.12Å; R40-I51 HydrophobicContact CB-CD1 3.87Å; R40-I51 HydrophobicContact CG-CD1 4.23Å; K46-I51 HydrophobicContact CB-CD1 4.08Å; K46-I51 HydrophobicContact CB-CG1 3.97Å; S47-I51 WeakPolarHBondContact O-CG1 3.46Å; S47-I51 PolarHBondContact O-N 3.13Å; N48-I51 PolarHBondContact O-N 2.89Å; N49-I51 VanDerWaalsContact C-N 3.33Å; I51-L55 HydrophobicContact CG2-CD1 3.76Å; I51-L55 HydrophobicContact CG2-CG 4.28Å; I51-L55 VanDerWaalsContact O-CB 3.23Å; I51-L55 WeakPolarHBondContact O-CB 3.33Å; I51-L55 VanDerWaalsContact O-CG 3.24Å; I51-L55 WeakPolarHBondContact O-CG 3.4Å; I51-L55 PolarHBondContact O-N 3.11Å; I51-F69 HydrophobicContact CB-CE2 4.4Å; I51-F69 HydrophobicContact CG1-CE2 3.84Å; I51-F69 HydrophobicContact CG1-CZ 4.07Å |
| 52 | V | 93.8 | Very high | 92.3 | Very high | 38 Ų | 38 | 63 Ų | 63 | 23% | 0.23 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.4 | -44.9 | 174.6 | 166.2 | 0 | 0 | 0 | 0 | 112 | M32 I36 N48 N49 E50 L55 Q56 | M32-V52 HydrophobicContact SD-CG1 4.39Å; M32-V52 HydrophobicContact SD-CG2 4.28Å; I36-V52 HydrophobicContact CD1-CG2 3.44Å; I36-V52 VanDerWaalsContact CD1-CG2 3.44Å; I36-V52 HydrophobicContact CG1-CG2 3.88Å; N48-V52 VanDerWaalsContact O-CG2 3.3Å; N48-V52 WeakPolarHBondContact O-CG2 3.44Å; N48-V52 PolarHBondContact O-N 3.02Å; N49-V52 PolarHBondContact O-N 3.31Å; E50-V52 VanDerWaalsContact C-N 3.34Å; E50-V52 PolarHBondContact O-N 3.13Å; V52-L55 PolarHBondContact O-N 3.14Å; V52-Q56 VanDerWaalsContact O-CB 3.28Å; V52-Q56 WeakPolarHBondContact O-CB 3.38Å; V52-Q56 PolarHBondContact O-N 3.37Å |
| 53 | L | 93.7 | Very high | 92.4 | Very high | 47 Ų | 47 | 65 Ų | 65 | 25% | 0.246 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.4 | -43.4 | -179.7 | -69.2 | 169.8 | 0 | 0 | 0 | 112.1 | N49 E50 Q56 H57 L78 W81 | N49-L53 WeakPolarHBondContact O-CG 3.3Å; N49-L53 PolarHBondContact O-N 2.9Å; N49-L53 VanDerWaalsContact O-N 3.09Å; E50-L53 PolarHBondContact O-N 3.41Å; L53-Q56 PolarHBondContact O-N 2.99Å; L53-H57 PolarHBondContact O-N 2.97Å; L53-L78 HydrophobicContact CB-CD2 3.87Å; L53-L78 HydrophobicContact CD1-CD2 3.88Å; L53-W81 HydrophobicContact CD1-CB 4.42Å; L53-W81 HydrophobicContact CD2-CB 4.47Å; L53-W81 HydrophobicContact CD2-CD2 3.81Å; L53-W81 HydrophobicContact CD2-CE3 3.69Å; L53-W81 HydrophobicContact CD2-CG 4.17Å; L53-W81 HydrophobicContact CD2-CZ3 4.2Å |
| 54 | V | 93.5 | Very high | 92.5 | Very high | 0 Ų | 0 | 70.2 Ų | 70.2 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -70 | -40.7 | 177.7 | 177.2 | 0 | 0 | 0 | 0 | 111.3 | E50 Q56 H57 F58 A65 A68 F69 A74 I77 L78 | E50-V54 WeakPolarHBondContact O-CG2 3.38Å; E50-V54 PolarHBondContact O-N 3.36Å; V54-Q56 VanDerWaalsContact C-N 3.34Å; V54-Q56 PolarHBondContact O-N 2.94Å; V54-H57 PolarHBondContact O-N 2.87Å; V54-F58 HydrophobicContact CG1-CD2 3.88Å; V54-F58 HydrophobicContact CG1-CE2 3.87Å; V54-F58 VanDerWaalsContact O-CD2 3.31Å; V54-F58 WeakPolarHBondContact O-CD2 3.47Å; V54-F58 PolarHBondContact O-N 2.97Å; V54-F58 VanDerWaalsContact O-N 3.14Å; V54-A65 HydrophobicContact CG1-CB 3.91Å; V54-A68 HydrophobicContact CG1-CB 4.43Å; V54-F69 HydrophobicContact CB-CE2 3.98Å; V54-F69 HydrophobicContact CB-CZ 3.97Å; V54-F69 HydrophobicContact CG1-CE2 4.11Å; V54-F69 HydrophobicContact CG1-CZ 4.42Å; V54-F69 HydrophobicContact CG2-CE1 4.13Å; V54-F69 HydrophobicContact CG2-CE2 4.16Å; V54-F69 HydrophobicContact CG2-CZ 3.66Å; V54-A74 HydrophobicContact CG1-CB 4.34Å; V54-A74 HydrophobicContact CG2-CB 3.97Å; V54-I77 HydrophobicContact CG2-CG2 4.4Å; V54-L78 HydrophobicContact CG2-CD1 4.21Å; V54-L78 HydrophobicContact CG2-CD2 4.09Å; V54-L78 HydrophobicContact CG2-CG 3.93Å |
| 55 | L | 94.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -58.4 | -46.1 | 170.7 | -80.2 | 169.7 | 0 | 0 | 0 | 111 | K35 I36 V39 I51 V52 H57 F58 E59 N60 C61 V62 A65 | K35-L55 HydrophobicContact CB-CD1 3.98Å; K35-L55 HydrophobicContact CB-CD2 4.48Å; I36-L55 HydrophobicContact CG1-CD1 4.15Å; V39-L55 HydrophobicContact CG2-CD1 4.38Å; V39-L55 HydrophobicContact CG2-CD2 4.07Å; V39-L55 HydrophobicContact CG2-CG 4.33Å; I51-L55 HydrophobicContact CG2-CD1 3.76Å; I51-L55 HydrophobicContact CG2-CG 4.28Å; I51-L55 VanDerWaalsContact O-CB 3.23Å; I51-L55 WeakPolarHBondContact O-CB 3.33Å; I51-L55 VanDerWaalsContact O-CG 3.24Å; I51-L55 WeakPolarHBondContact O-CG 3.4Å; I51-L55 PolarHBondContact O-N 3.11Å; V52-L55 PolarHBondContact O-N 3.14Å; L55-H57 VanDerWaalsContact C-N 3.33Å; L55-H57 PolarHBondContact O-N 3.35Å; L55-F58 CarbonylContact O-C 3.49Å; L55-F58 PolarHBondContact O-N 3.04Å; L55-F58 VanDerWaalsContact O-N 3.17Å; L55-E59 PolarHBondContact O-N 2.75Å; L55-N60 VanDerWaalsContact O-CA 3.23Å; L55-N60 WeakPolarHBondContact O-CA 3.49Å; L55-N60 PolarHBondContact O-N 2.83Å; L55-C61 WeakPolarHBondContact CD2-O 3.34Å; L55-V62 HydrophobicContact CD2-CG2 4.38Å; L55-A65 HydrophobicContact CD2-CB 3.77Å; L55-A65 HydrophobicContact CG-CB 4.12Å |
| 56 | Q | 91.1 | Very high | 93 | Very high | 107 Ų | 107 | 60 Ų | 60 | 50% | 0.5 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.8 | -35.7 | -178.3 | -173.8 | 169.5 | 6.9 | 0 | 0 | 112.5 | V52 L53 V54 | V52-Q56 VanDerWaalsContact O-CB 3.28Å; V52-Q56 WeakPolarHBondContact O-CB 3.38Å; V52-Q56 PolarHBondContact O-N 3.37Å; L53-Q56 PolarHBondContact O-N 2.99Å; V54-Q56 VanDerWaalsContact C-N 3.34Å; V54-Q56 PolarHBondContact O-N 2.94Å |
| 57 | H | 89.7 | Confident | 93.1 | Very high | 86 Ų | 86 | 61.9 Ų | 61.9 | 40% | 0.398 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 172.5 | -178.5 | 93.7 | 0 | 0 | 0 | 112.1 | L53 V54 L55 E59 I77 | L53-H57 PolarHBondContact O-N 2.97Å; V54-H57 PolarHBondContact O-N 2.87Å; L55-H57 VanDerWaalsContact C-N 3.33Å; L55-H57 PolarHBondContact O-N 3.35Å; H57-E59 PolarHBondContact O-N 2.97Å; H57-I77 HydrophobicContact CB-CG2 3.77Å |
| 58 | F | 91.9 | Very high | 93.2 | Very high | 50 Ų | 50 | 59.5 Ų | 59.5 | 22% | 0.219 | 30% | 0.299 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.8 | 34.9 | 177.5 | -63.8 | -61.1 | 0 | 0 | 0 | 114.3 | V54 L55 N60 C61 K64 A65 A68 I77 | V54-F58 HydrophobicContact CG1-CD2 3.88Å; V54-F58 HydrophobicContact CG1-CE2 3.87Å; V54-F58 VanDerWaalsContact O-CD2 3.31Å; V54-F58 WeakPolarHBondContact O-CD2 3.47Å; V54-F58 PolarHBondContact O-N 2.97Å; V54-F58 VanDerWaalsContact O-N 3.14Å; L55-F58 CarbonylContact O-C 3.49Å; L55-F58 PolarHBondContact O-N 3.04Å; L55-F58 VanDerWaalsContact O-N 3.17Å; F58-N60 PolarHBondContact O-N 3.37Å; F58-C61 HydrophobicContact CB-CB 4.49Å; F58-C61 VanDerWaalsContact O-CB 3.25Å; F58-C61 WeakPolarHBondContact O-CB 3.39Å; F58-C61 PolarHBondContact O-N 2.73Å; F58-K64 HydrophobicContact CB-CB 3.85Å; F58-K64 HydrophobicContact CB-CD 4.34Å; F58-K64 HydrophobicContact CD1-CB 3.99Å; F58-K64 HydrophobicContact CD1-CD 4.13Å; F58-K64 HydrophobicContact CD2-CB 4.12Å; F58-K64 HydrophobicContact CG-CB 3.73Å; F58-K64 HydrophobicContact CG-CD 4.47Å; F58-A65 HydrophobicContact CD2-CB 4.47Å; F58-A68 HydrophobicContact CE2-CB 3.52Å; F58-A68 HydrophobicContact CZ-CB 3.94Å; F58-I77 HydrophobicContact CD2-CD1 4.44Å; F58-I77 HydrophobicContact CE2-CD1 3.46Å; F58-I77 VanDerWaalsContact CE2-CD1 3.46Å; F58-I77 HydrophobicContact CZ-CD1 3.53Å |
| 59 | E | 89.4 | Confident | 93.3 | Very high | 172 Ų | 172 | 56.5 Ų | 56.5 | 80% | 0.804 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.6 | 22.8 | 175.8 | -56.3 | -177.6 | 157.8 | 0 | 0 | 114.8 | L55 H57 | L55-E59 PolarHBondContact O-N 2.75Å; H57-E59 PolarHBondContact O-N 2.97Å |
| 60 | N | 90.8 | Very high | 93.4 | Very high | 50 Ų | 50 | 55.8 Ų | 55.8 | 27% | 0.267 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.9 | 25.4 | -172.6 | -43.2 | -95.5 | 0 | 0 | 0 | 114.5 | M32 K35 L55 F58 | M32-N60 WeakPolarHBondContact CE-OD1 3.45Å; K35-N60 HydrophobicContact CD-CB 4.07Å; K35-N60 WeakPolarHBondContact CD-O 3.48Å; K35-N60 WeakPolarHBondContact CE-O 3.34Å; K35-N60 PolarHBondContact NZ-O 3.15Å; L55-N60 VanDerWaalsContact O-CA 3.23Å; L55-N60 WeakPolarHBondContact O-CA 3.49Å; L55-N60 PolarHBondContact O-N 2.83Å; F58-N60 PolarHBondContact O-N 3.37Å |
| 61 | C | 92.7 | Very high | 93.3 | Very high | 40 Ų | 40 | 58.7 Ų | 58.7 | 27% | 0.27 | 29% | 0.291 | S | S | . | . | trans | -72.2 | 121.8 | 167.7 | 178.7 | 0 | 0 | 0 | 0 | 110.2 | L55 F58 K64 A65 | L55-C61 WeakPolarHBondContact CD2-O 3.34Å; F58-C61 HydrophobicContact CB-CB 4.49Å; F58-C61 VanDerWaalsContact O-CB 3.25Å; F58-C61 WeakPolarHBondContact O-CB 3.39Å; F58-C61 PolarHBondContact O-N 2.73Å; C61-K64 HydrophobicContact CB-CB 4.13Å; C61-K64 HydrophobicContact CB-CD 4.11Å; C61-K64 HydrophobicContact CB-CG 4.25Å; C61-A65 WeakPolarHBondContact O-CB 3.16Å; C61-A65 PolarHBondContact O-N 3.42Å | ||
| 62 | V | 94.6 | Very high | 93.1 | Very high | 31 Ų | 31 | 60.4 Ų | 60.4 | 19% | 0.188 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -68.1 | -44 | -179.6 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | K35 A38 V39 L55 A65 V66 | K35-V62 HydrophobicContact CB-CG2 3.86Å; K35-V62 HydrophobicContact CD-CG2 4.29Å; K35-V62 HydrophobicContact CG-CG2 3.68Å; A38-V62 HydrophobicContact CB-CG1 3.94Å; A38-V62 HydrophobicContact CB-CG2 4.48Å; V39-V62 HydrophobicContact CG2-CG1 3.94Å; L55-V62 HydrophobicContact CD2-CG2 4.38Å; V62-A65 PolarHBondContact O-N 3.31Å; V62-V66 HydrophobicContact CG1-CG2 4.27Å; V62-V66 WeakPolarHBondContact O-CG2 3.48Å; V62-V66 PolarHBondContact O-N 2.99Å |
| 63 | D | 94.6 | Very high | 92.9 | Very high | 122 Ų | 122 | 60.6 Ų | 60.6 | 65% | 0.652 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -68 | -45.4 | -171.4 | -42.2 | -81.9 | 0 | 0 | 0 | 111.1 | A65 V66 Q67 | D63-A65 VanDerWaalsContact C-N 3.32Å; D63-A65 PolarHBondContact O-N 2.87Å; D63-V66 PolarHBondContact O-N 3.36Å; D63-Q67 WeakPolarHBondContact O-CB 3.27Å; D63-Q67 PolarHBondContact O-N 3.34Å |
| 64 | K | 95.2 | Very high | 92.8 | Very high | 123 Ų | 123 | 58.4 Ų | 58.4 | 54% | 0.535 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.3 | -39.5 | 171.9 | -70.1 | 179.2 | -178.9 | -178.4 | 0 | 112.3 | F58 C61 Q67 A68 | F58-K64 HydrophobicContact CB-CB 3.85Å; F58-K64 HydrophobicContact CB-CD 4.34Å; F58-K64 HydrophobicContact CD1-CB 3.99Å; F58-K64 HydrophobicContact CD1-CD 4.13Å; F58-K64 HydrophobicContact CD2-CB 4.12Å; F58-K64 HydrophobicContact CG-CB 3.73Å; F58-K64 HydrophobicContact CG-CD 4.47Å; C61-K64 HydrophobicContact CB-CB 4.13Å; C61-K64 HydrophobicContact CB-CD 4.11Å; C61-K64 HydrophobicContact CB-CG 4.25Å; K64-Q67 PolarHBondContact O-N 3.4Å; K64-A68 WeakPolarHBondContact O-CB 3.44Å; K64-A68 PolarHBondContact O-N 3.1Å |
| 65 | A | 94 | Very high | 92.5 | Very high | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -69.4 | -40.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | V39 V54 L55 F58 C61 V62 D63 F69 | V39-A65 HydrophobicContact CG2-CB 4.18Å; V54-A65 HydrophobicContact CG1-CB 3.91Å; L55-A65 HydrophobicContact CD2-CB 3.77Å; L55-A65 HydrophobicContact CG-CB 4.12Å; F58-A65 HydrophobicContact CD2-CB 4.47Å; C61-A65 WeakPolarHBondContact O-CB 3.16Å; C61-A65 PolarHBondContact O-N 3.42Å; V62-A65 PolarHBondContact O-N 3.31Å; D63-A65 VanDerWaalsContact C-N 3.32Å; D63-A65 PolarHBondContact O-N 2.87Å; A65-F69 WeakPolarHBondContact O-CD2 3.43Å; A65-F69 PolarHBondContact O-N 2.99Å |
| 66 | V | 95.4 | Very high | 92.3 | Very high | 19 Ų | 19 | 69.4 Ų | 69.4 | 12% | 0.115 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.8 | -49.3 | 171.9 | 168.1 | 0 | 0 | 0 | 0 | 110.3 | V39 V42 V62 D63 A68 F69 L70 | V39-V66 HydrophobicContact CB-CG2 4.23Å; V39-V66 HydrophobicContact CG1-CG2 4.1Å; V39-V66 HydrophobicContact CG2-CG2 4.14Å; V42-V66 HydrophobicContact CB-CG1 4.05Å; V42-V66 HydrophobicContact CB-CG2 4.33Å; V42-V66 HydrophobicContact CG1-CG1 3.71Å; V42-V66 HydrophobicContact CG2-CG1 4.34Å; V42-V66 HydrophobicContact CG2-CG2 4.35Å; V62-V66 HydrophobicContact CG1-CG2 4.27Å; V62-V66 WeakPolarHBondContact O-CG2 3.48Å; V62-V66 PolarHBondContact O-N 2.99Å; D63-V66 PolarHBondContact O-N 3.36Å; V66-A68 PolarHBondContact O-N 2.84Å; V66-F69 PolarHBondContact O-N 3.48Å; V66-L70 HydrophobicContact CG1-CD1 3.79Å; V66-L70 HydrophobicContact CG1-CG 4.3Å; V66-L70 WeakPolarHBondContact O-CG 3.31Å; V66-L70 PolarHBondContact O-N 3.35Å |
| 67 | Q | 95.6 | Very high | 92.1 | Very high | 94 Ų | 94 | 64.9 Ų | 64.9 | 44% | 0.439 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -56.5 | -49.7 | -179.7 | -167.3 | 66.4 | 14.6 | 0 | 0 | 111.3 | D63 K64 F69 L70 E71 | D63-Q67 WeakPolarHBondContact O-CB 3.27Å; D63-Q67 PolarHBondContact O-N 3.34Å; K64-Q67 PolarHBondContact O-N 3.4Å; Q67-F69 VanDerWaalsContact C-N 3.25Å; Q67-F69 PolarHBondContact O-N 2.78Å; Q67-L70 PolarHBondContact O-N 2.71Å; Q67-E71 HydrophobicContact CG-CG 4.31Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.18Å; Q67-E71 PolarHBondContact NE2-OE1 3.2Å; Q67-E71 WeakPolarHBondContact O-CB 3.17Å; Q67-E71 WeakPolarHBondContact O-CG 3.15Å; Q67-E71 PolarHBondContact O-N 2.71Å |
| 68 | A | 94.9 | Very high | 92.1 | Very high | 3 Ų | 3 | 61.5 Ų | 61.5 | 3% | 0.025 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.7 | -29.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | V54 F58 K64 V66 G72 S73 A74 | V54-A68 HydrophobicContact CG1-CB 4.43Å; F58-A68 HydrophobicContact CE2-CB 3.52Å; F58-A68 HydrophobicContact CZ-CB 3.94Å; K64-A68 WeakPolarHBondContact O-CB 3.44Å; K64-A68 PolarHBondContact O-N 3.1Å; V66-A68 PolarHBondContact O-N 2.84Å; A68-G72 CarbonylContact O-C 3.43Å; A68-G72 PolarHBondContact O-N 2.83Å; A68-G72 VanDerWaalsContact O-N 3.1Å; A68-S73 VanDerWaalsContact CA-OG 3.31Å; A68-S73 WeakPolarHBondContact CA-OG 3Å; A68-S73 WeakPolarHBondContact CB-OG 3.33Å; A68-S73 PolarHBondContact O-N 2.89Å; A68-A74 HydrophobicContact CB-CB 4.07Å; A68-A74 VanDerWaalsContact O-CB 3.22Å; A68-A74 WeakPolarHBondContact O-CB 3.42Å; A68-A74 PolarHBondContact O-N 3.42Å |
| 69 | F | 95.1 | Very high | 91.9 | Very high | 14 Ų | 14 | 66.5 Ų | 66.5 | 6% | 0.061 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -77.1 | -26.5 | 173.6 | -83.6 | -53.5 | 0 | 0 | 0 | 113.9 | V39 V43 K46 E50 I51 V54 A65 V66 Q67 A74 L78 | V39-F69 HydrophobicContact CG1-CD2 3.81Å; V39-F69 HydrophobicContact CG1-CE2 3.97Å; V43-F69 HydrophobicContact CB-CB 4.41Å; V43-F69 HydrophobicContact CG1-CB 4.01Å; V43-F69 HydrophobicContact CG1-CG 4.42Å; V43-F69 HydrophobicContact CG2-CB 3.84Å; V43-F69 HydrophobicContact CG2-CG 4.48Å; K46-F69 HydrophobicContact CB-CE1 4.35Å; K46-F69 HydrophobicContact CB-CZ 4.41Å; K46-F69 HydrophobicContact CD-CD1 3.81Å; K46-F69 HydrophobicContact CD-CE1 3.75Å; K46-F69 HydrophobicContact CG-CD1 3.83Å; K46-F69 HydrophobicContact CG-CE1 3.81Å; K46-F69 HydrophobicContact CG-CG 4.29Å; K46-F69 HydrophobicContact CG-CZ 4.27Å; E50-F69 HydrophobicContact CB-CZ 4.31Å; I51-F69 HydrophobicContact CB-CE2 4.4Å; I51-F69 HydrophobicContact CG1-CE2 3.84Å; I51-F69 HydrophobicContact CG1-CZ 4.07Å; V54-F69 HydrophobicContact CB-CE2 3.98Å; V54-F69 HydrophobicContact CB-CZ 3.97Å; V54-F69 HydrophobicContact CG1-CE2 4.11Å; V54-F69 HydrophobicContact CG1-CZ 4.42Å; V54-F69 HydrophobicContact CG2-CE1 4.13Å; V54-F69 HydrophobicContact CG2-CE2 4.16Å; V54-F69 HydrophobicContact CG2-CZ 3.66Å; A65-F69 WeakPolarHBondContact O-CD2 3.43Å; A65-F69 PolarHBondContact O-N 2.99Å; V66-F69 PolarHBondContact O-N 3.48Å; Q67-F69 VanDerWaalsContact C-N 3.25Å; Q67-F69 PolarHBondContact O-N 2.78Å; F69-A74 HydrophobicContact CD1-CB 3.42Å; F69-A74 VanDerWaalsContact CD1-CB 3.42Å; F69-A74 HydrophobicContact CE1-CB 3.71Å; F69-A74 HydrophobicContact CG-CB 3.97Å; F69-A74 HydrophobicContact CZ-CB 4.45Å; F69-L78 HydrophobicContact CE1-CD1 4.11Å |
| 70 | L | 93.4 | Very high | 91.4 | Very high | 108 Ų | 108 | 64.3 Ų | 64.3 | 57% | 0.565 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -81.5 | -41.5 | 175.4 | -66.9 | 173.6 | 0 | 0 | 0 | 111.8 | V42 V66 Q67 G72 | V42-L70 HydrophobicContact CG1-CD1 4.45Å; V66-L70 HydrophobicContact CG1-CD1 3.79Å; V66-L70 HydrophobicContact CG1-CG 4.3Å; V66-L70 WeakPolarHBondContact O-CG 3.31Å; V66-L70 PolarHBondContact O-N 3.35Å; Q67-L70 PolarHBondContact O-N 2.71Å; L70-G72 VanDerWaalsContact C-N 3.3Å |
| 71 | E | 92.1 | Very high | 90.6 | Very high | 129 Ų | 129 | 67.2 Ų | 67.2 | 60% | 0.603 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -76.3 | -16.7 | 176.6 | -66.7 | 174.6 | 165.8 | 0 | 0 | 113.2 | Q67 S73 | Q67-E71 HydrophobicContact CG-CG 4.31Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.18Å; Q67-E71 PolarHBondContact NE2-OE1 3.2Å; Q67-E71 WeakPolarHBondContact O-CB 3.17Å; Q67-E71 WeakPolarHBondContact O-CG 3.15Å; Q67-E71 PolarHBondContact O-N 2.71Å; E71-S73 VanDerWaalsContact C-N 3.32Å; E71-S73 PolarHBondContact O-N 2.91Å |
| 72 | G | 88.6 | Confident | 89.2 | Confident | 35 Ų | 35 | 71.2 Ų | 71.2 | 36% | 0.361 | 36% | 0.359 | S | S | . | . | S | Bend | trans | 86.3 | -10.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | A68 L70 A74 V75 | A68-G72 CarbonylContact O-C 3.43Å; A68-G72 PolarHBondContact O-N 2.83Å; A68-G72 VanDerWaalsContact O-N 3.1Å; L70-G72 VanDerWaalsContact C-N 3.3Å; G72-A74 PolarHBondContact O-N 3.03Å; G72-A74 VanDerWaalsContact O-N 3.12Å; G72-V75 VanDerWaalsContact O-CB 3.31Å; G72-V75 WeakPolarHBondContact O-CB 3.49Å; G72-V75 WeakPolarHBondContact O-CG2 3.14Å; G72-V75 PolarHBondContact O-N 3.14Å |
| 73 | S | 89.6 | Confident | 87 | Confident | 42 Ų | 42 | 75.2 Ų | 75.2 | 29% | 0.294 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -24 | 176.6 | 54.4 | 0 | 0 | 0 | 0 | 113.6 | A68 E71 V75 E76 I77 | A68-S73 VanDerWaalsContact CA-OG 3.31Å; A68-S73 WeakPolarHBondContact CA-OG 3Å; A68-S73 WeakPolarHBondContact CB-OG 3.33Å; A68-S73 PolarHBondContact O-N 2.89Å; E71-S73 VanDerWaalsContact C-N 3.32Å; E71-S73 PolarHBondContact O-N 2.91Å; S73-V75 PolarHBondContact O-N 3.16Å; S73-V75 VanDerWaalsContact O-N 3.13Å; S73-E76 WeakPolarHBondContact O-CB 3.46Å; S73-E76 PolarHBondContact O-N 3.31Å; S73-I77 PolarHBondContact O-N 2.78Å |
| 74 | A | 91.2 | Very high | 84.8 | Confident | 1 Ų | 1 | 76.1 Ų | 76.1 | 1% | 0.008 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -55 | -27 | 169 | 0 | 0 | 0 | 0 | 0 | 113.8 | V54 A68 F69 G72 E76 L78 | V54-A74 HydrophobicContact CG1-CB 4.34Å; V54-A74 HydrophobicContact CG2-CB 3.97Å; A68-A74 HydrophobicContact CB-CB 4.07Å; A68-A74 VanDerWaalsContact O-CB 3.22Å; A68-A74 WeakPolarHBondContact O-CB 3.42Å; A68-A74 PolarHBondContact O-N 3.42Å; F69-A74 HydrophobicContact CD1-CB 3.42Å; F69-A74 VanDerWaalsContact CD1-CB 3.42Å; F69-A74 HydrophobicContact CE1-CB 3.71Å; F69-A74 HydrophobicContact CG-CB 3.97Å; F69-A74 HydrophobicContact CZ-CB 4.45Å; G72-A74 PolarHBondContact O-N 3.03Å; G72-A74 VanDerWaalsContact O-N 3.12Å; A74-E76 VanDerWaalsContact C-N 3.27Å; A74-E76 PolarHBondContact O-N 2.83Å; A74-L78 WeakPolarHBondContact O-CB 3.36Å; A74-L78 WeakPolarHBondContact O-CD1 3.43Å; A74-L78 WeakPolarHBondContact O-CG 3.37Å; A74-L78 PolarHBondContact O-N 3.17Å |
| 75 | V | 88.6 | Confident | 82.2 | Confident | 89 Ų | 89 | 72.6 Ų | 72.6 | 54% | 0.539 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.9 | -32.1 | 175.7 | 179 | 0 | 0 | 0 | 0 | 111.3 | G72 S73 K79 | G72-V75 VanDerWaalsContact O-CB 3.31Å; G72-V75 WeakPolarHBondContact O-CB 3.49Å; G72-V75 WeakPolarHBondContact O-CG2 3.14Å; G72-V75 PolarHBondContact O-N 3.14Å; S73-V75 PolarHBondContact O-N 3.16Å; S73-V75 VanDerWaalsContact O-N 3.13Å; V75-K79 WeakPolarHBondContact O-CB 3.41Å; V75-K79 PolarHBondContact O-N 2.98Å |
| 76 | E | 89.3 | Confident | 79.4 | Confident | 142 Ų | 142 | 83 Ų | 83 | 66% | 0.664 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -74.1 | -45.5 | 179.2 | -52.8 | -162.8 | 131.4 | 0 | 0 | 111.1 | S73 A74 L78 K79 E80 | S73-E76 WeakPolarHBondContact O-CB 3.46Å; S73-E76 PolarHBondContact O-N 3.31Å; A74-E76 VanDerWaalsContact C-N 3.27Å; A74-E76 PolarHBondContact O-N 2.83Å; E76-L78 VanDerWaalsContact C-N 3.33Å; E76-L78 PolarHBondContact O-N 2.98Å; E76-K79 WeakPolarHBondContact O-CB 3.49Å; E76-K79 PolarHBondContact O-N 3.33Å; E76-K79 VanDerWaalsContact O-N 3.12Å; E76-E80 PolarHBondContact O-N 3.43Å |
| 77 | I | 88.1 | Confident | 77.4 | Confident | 12 Ų | 12 | 91.7 Ų | 91.7 | 6% | 0.062 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -55.4 | -49.7 | 172.1 | -59.8 | 168.4 | 0 | 0 | 0 | 110.1 | V54 H57 F58 S73 K79 E80 W81 | V54-I77 HydrophobicContact CG2-CG2 4.4Å; H57-I77 HydrophobicContact CB-CG2 3.77Å; F58-I77 HydrophobicContact CD2-CD1 4.44Å; F58-I77 HydrophobicContact CE2-CD1 3.46Å; F58-I77 VanDerWaalsContact CE2-CD1 3.46Å; F58-I77 HydrophobicContact CZ-CD1 3.53Å; S73-I77 PolarHBondContact O-N 2.78Å; I77-K79 VanDerWaalsContact C-N 3.31Å; I77-K79 PolarHBondContact O-N 3.44Å; I77-E80 PolarHBondContact O-N 3.02Å; I77-W81 VanDerWaalsContact O-CD1 3.3Å; I77-W81 PolarHBondContact O-N 3.3Å |
| 78 | L | 89.1 | Confident | 74.7 | Confident | 15 Ų | 15 | 96.8 Ų | 96.8 | 8% | 0.079 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -65.9 | -32.9 | 179.1 | -69 | 167.3 | 0 | 0 | 0 | 112.3 | E50 L53 V54 F69 A74 E76 N82 | E50-L78 HydrophobicContact CB-CD1 3.88Å; E50-L78 HydrophobicContact CB-CD2 3.92Å; E50-L78 HydrophobicContact CG-CD1 3.91Å; E50-L78 HydrophobicContact CG-CD2 4.04Å; L53-L78 HydrophobicContact CB-CD2 3.87Å; L53-L78 HydrophobicContact CD1-CD2 3.88Å; V54-L78 HydrophobicContact CG2-CD1 4.21Å; V54-L78 HydrophobicContact CG2-CD2 4.09Å; V54-L78 HydrophobicContact CG2-CG 3.93Å; F69-L78 HydrophobicContact CE1-CD1 4.11Å; A74-L78 WeakPolarHBondContact O-CB 3.36Å; A74-L78 WeakPolarHBondContact O-CD1 3.43Å; A74-L78 WeakPolarHBondContact O-CG 3.37Å; A74-L78 PolarHBondContact O-N 3.17Å; E76-L78 VanDerWaalsContact C-N 3.33Å; E76-L78 PolarHBondContact O-N 2.98Å; L78-N82 WeakPolarHBondContact O-CB 3.42Å; L78-N82 PolarHBondContact O-N 3.09Å; L78-N82 VanDerWaalsContact O-N 3.11Å; L78-N82 PolarHBondContact O-ND2 2.92Å |
| 79 | K | 87 | Confident | 72.3 | Confident | 155 Ų | 155 | 102.6 Ų | 102.6 | 67% | 0.674 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.7 | -40.4 | 174.9 | 179.9 | -174.8 | 176.3 | -169.5 | 0 | 111.7 | V75 E76 I77 N82 | V75-K79 WeakPolarHBondContact O-CB 3.41Å; V75-K79 PolarHBondContact O-N 2.98Å; E76-K79 WeakPolarHBondContact O-CB 3.49Å; E76-K79 PolarHBondContact O-N 3.33Å; E76-K79 VanDerWaalsContact O-N 3.12Å; I77-K79 VanDerWaalsContact C-N 3.31Å; I77-K79 PolarHBondContact O-N 3.44Å; K79-N82 PolarHBondContact O-N 3.47Å |
| 80 | E | 79.1 | Confident | 70 | Confident | 127 Ų | 127 | 111 Ų | 111 | 59% | 0.593 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.1 | -51.3 | 174.8 | -175.3 | 179.9 | -157.4 | 0 | 0 | 111.5 | E76 I77 N82 V83 | E76-E80 PolarHBondContact O-N 3.43Å; I77-E80 PolarHBondContact O-N 3.02Å; E80-N82 PolarHBondContact O-N 3.02Å; E80-V83 WeakPolarHBondContact O-CB 3.48Å; E80-V83 WeakPolarHBondContact O-CG2 3.28Å; E80-V83 PolarHBondContact O-N 3.41Å |
| 81 | W | 74 | Confident | 67.2 | Low | 110 Ų | 110 | 116 Ų | 116 | 42% | 0.417 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -59.9 | -30.4 | 177.1 | -83.7 | 90.2 | 0 | 0 | 0 | 113.2 | L53 I77 V83 | L53-W81 HydrophobicContact CD1-CB 4.42Å; L53-W81 HydrophobicContact CD2-CB 4.47Å; L53-W81 HydrophobicContact CD2-CD2 3.81Å; L53-W81 HydrophobicContact CD2-CE3 3.69Å; L53-W81 HydrophobicContact CD2-CG 4.17Å; L53-W81 HydrophobicContact CD2-CZ3 4.2Å; I77-W81 VanDerWaalsContact O-CD1 3.3Å; I77-W81 PolarHBondContact O-N 3.3Å; W81-V83 PolarHBondContact O-N 3.41Å |
| 82 | N | 64.2 | Low | 64.7 | Low | 125 Ų | 125 | 119 Ų | 119 | 67% | 0.668 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | -6.5 | 174.6 | -88.7 | -69.2 | 0 | 0 | 0 | 114.8 | L78 K79 E80 | L78-N82 WeakPolarHBondContact O-CB 3.42Å; L78-N82 PolarHBondContact O-N 3.09Å; L78-N82 VanDerWaalsContact O-N 3.11Å; L78-N82 PolarHBondContact O-ND2 2.92Å; K79-N82 PolarHBondContact O-N 3.47Å; E80-N82 PolarHBondContact O-N 3.02Å |
| 83 | V | 48.4 | Very low | 62.2 | Low | 115 Ų | 115 | 127.8 Ų | 127.8 | 70% | 0.697 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | -29.3 | 177.3 | -176.6 | 0 | 0 | 0 | 0 | 112.2 | E80 W81 G85 | E80-V83 WeakPolarHBondContact O-CB 3.48Å; E80-V83 WeakPolarHBondContact O-CG2 3.28Å; E80-V83 PolarHBondContact O-N 3.41Å; W81-V83 PolarHBondContact O-N 3.41Å; V83-G85 PolarHBondContact O-N 3.11Å |
| 84 | T | 48.2 | Very low | 59.7 | Low | 140 Ų | 140 | 134.4 Ų | 134.4 | 86% | 0.859 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -80.5 | 54.5 | 179.8 | -73.1 | 0 | 0 | 0 | 0 | 111.9 | ||
| 85 | G | 40.6 | Very low | 57.4 | Low | 50 Ų | 50 | 140.4 Ų | 140.4 | 52% | 0.515 | 69% | 0.687 | S | S | . | * | trans | -148.8 | 89.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | V83 K87 | V83-G85 PolarHBondContact O-N 3.11Å; G85-K87 PolarHBondContact O-N 2.75Å | ||
| 86 | K | 35.1 | Very low | 54.8 | Low | 219 Ų | 219 | 142.4 Ų | 142.4 | 95% | 0.952 | 69% | 0.688 | S | S | * | * | trans | -70.2 | 96.8 | -178.2 | -71.8 | 178.1 | 178.2 | 171.9 | 0 | 113.1 | ||||
| 87 | K | 53.7 | Low | 52.2 | Low | 201 Ų | 201 | 141.8 Ų | 141.8 | 87% | 0.874 | 70% | 0.697 | S | S | * | * | trans | -66.9 | 133.8 | 173.4 | -69.9 | 178 | 177.2 | 171.9 | 0 | 113.8 | G85 | G85-K87 PolarHBondContact O-N 2.75Š| ||
| 88 | K | 38.5 | Very low | 49.6 | Very low | 200 Ų | 200 | 146.8 Ų | 146.8 | 87% | 0.87 | 72% | 0.72 | S | S | * | * | trans | -150.4 | 168.6 | 161.4 | -79.8 | -150.8 | 176.2 | -177.9 | 0 | 109.5 | ||||
| 89 | P | 44.2 | Very low | 47.4 | Very low | 125 Ų | 125 | 151.6 Ų | 151.6 | 81% | 0.812 | 75% | 0.752 | S | S | * | * | -131.8 | -176.8 | -91 | 28.9 | -3.7 | 0 | 0 | 0 | 117.1 | |||||
| 90 | K | 46.7 | Very low | 44.7 | Very low | 191 Ų | 191 | 151.3 Ų | 151.3 | 83% | 0.83 | 75% | 0.753 | S | S | * | * | trans | -57.9 | 149.2 | -169.3 | -58.7 | 168.2 | 176.5 | 173.5 | 0 | 118.7 | ||||
| 91 | K | 35.3 | Very low | 42.5 | Very low | 212 Ų | 212 | 152.6 Ų | 152.6 | 92% | 0.922 | 76% | 0.759 | S | S | * | * | trans | -135.9 | 109.2 | 134.7 | -70.1 | -178.4 | 179.1 | 176.6 | 0 | 107.2 | ||||
| 92 | K | 40.3 | Very low | 40.7 | Very low | 193 Ų | 193 | 154.2 Ų | 154.2 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | 66.6 | 104.3 | 64.5 | -84.3 | -164 | 173.4 | -176.1 | 0 | 116.1 | |||||
| 93 | K | 34.3 | Very low | 39.2 | Very low | 219 Ų | 219 | 152.6 Ų | 152.6 | 95% | 0.952 | 78% | 0.779 | S | S | * | * | -154.8 | 173.8 | 118.9 | -109.3 | 179.6 | 180 | -174.7 | 0 | 111 | |||||
| 94 | K | 37.2 | Very low | 38.3 | Very low | 182 Ų | 182 | 156.5 Ų | 156.5 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | trans | -126.6 | 179.7 | -167.3 | -123.3 | -164.4 | 177.6 | -173.3 | 0 | 108.4 | ||||
| 95 | P | 44.1 | Very low | 37.4 | Very low | 126 Ų | 126 | 157.6 Ų | 157.6 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | cis | -130.6 | -149.5 | 30.1 | 39.9 | -18.9 | 0 | 0 | 0 | 115.4 | ||||
| 96 | K | 33.9 | Very low | 37.1 | Very low | 131 Ų | 131 | 162.5 Ų | 162.5 | 57% | 0.57 | 80% | 0.799 | S | S | * | * | trans | -143.5 | 162.3 | -159 | -175.2 | -179.8 | -173.4 | -171.6 | 0 | 109.4 | Q98 | K96-Q98 VanDerWaalsContact NZ-CD 3.29Š| ||
| 97 | P | 34.7 | Very low | 37.2 | Very low | 130 Ų | 130 | 156.4 Ų | 156.4 | 84% | 0.844 | 79% | 0.789 | S | S | * | * | -130.3 | 170.6 | 125.5 | 35.6 | -26.5 | 0 | 0 | 0 | 113.9 | |||||
| 98 | Q | 33.5 | Very low | 37.1 | Very low | 116 Ų | 116 | 152.9 Ų | 152.9 | 54% | 0.542 | 79% | 0.787 | S | S | . | * | trans | -143.3 | 157 | -179.5 | -146.8 | -174.5 | -30.2 | 0 | 0 | 108.8 | K96 | K96-Q98 VanDerWaalsContact NZ-CD 3.29Š| ||
| 99 | P | 41.9 | Very low | 36.7 | Very low | 116 Ų | 116 | 148.1 Ų | 148.1 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | -123.3 | 156.4 | 111.9 | -4.8 | 26.5 | 0 | 0 | 0 | 112.3 | |||||
| 100 | E | 31.9 | Very low | 36.1 | Very low | 149 Ų | 149 | 150.9 Ų | 150.9 | 70% | 0.696 | 79% | 0.787 | S | S | * | * | cis | 73 | 139.7 | 34.8 | -66.3 | 172 | -154.4 | 0 | 0 | 113.2 | ||||
| 101 | H | 32.7 | Very low | 35.1 | Very low | 155 Ų | 155 | 148.6 Ų | 148.6 | 72% | 0.718 | 79% | 0.789 | S | S | * | * | cis | -132.2 | 156.8 | 0.4 | -139.1 | -110.4 | 0 | 0 | 0 | 107.6 | ||||
| 102 | L | 36.3 | Very low | 35.2 | Very low | 144 Ų | 144 | 146.2 Ų | 146.2 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | cis | 92.8 | 96.2 | 23.1 | -134.7 | -175.6 | 0 | 0 | 0 | 115.8 | ||||
| 103 | A | 31 | Very low | 34.7 | Very low | 91 Ų | 91 | 145.2 Ų | 145.2 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | trans | -170 | 148.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 104 | E | 29.8 | Very low | 34.9 | Very low | 196 Ų | 196 | 140.9 Ų | 140.9 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | cis | -151.5 | 178.1 | -14.3 | -166.7 | 156.1 | 179.9 | 0 | 0 | 110.2 | ||||
| 105 | E | 30.2 | Very low | 34.5 | Very low | 164 Ų | 164 | 137.3 Ų | 137.3 | 77% | 0.766 | 77% | 0.773 | S | S | * | * | trans | -103 | 161.2 | -156.9 | -173.8 | -177.5 | 130.4 | 0 | 0 | 113.9 | ||||
| 106 | L | 32.8 | Very low | 34 | Very low | 153 Ų | 153 | 139.4 Ų | 139.4 | 80% | 0.801 | 77% | 0.772 | S | S | * | * | 162.5 | 138.2 | 125.5 | -85.3 | 168.6 | 0 | 0 | 0 | 117.4 | |||||
| 107 | A | 37.2 | Very low | 33.8 | Very low | 91 Ų | 91 | 139.7 Ų | 139.7 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | 71.5 | 154.4 | 147.8 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 108 | P | 51.6 | Low | 33.5 | Very low | 127 Ų | 127 | 141.6 Ų | 141.6 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | -140 | -163.6 | -158.9 | 44 | -23 | 0 | 0 | 0 | 116.6 | ||||
| 109 | A | 31.2 | Very low | 33.3 | Very low | 99 Ų | 99 | 140.7 Ų | 140.7 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | 108.5 | 162.1 | 153.9 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 110 | E | 31.3 | Very low | 32.8 | Very low | 184 Ų | 184 | 143.3 Ų | 143.3 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -103.4 | 169.1 | -161.1 | -57.1 | 162.3 | 96.4 | 0 | 0 | 113.3 | ||||
| 111 | T | 26.4 | Very low | 32.6 | Very low | 142 Ų | 142 | 143.7 Ų | 143.7 | 87% | 0.871 | 79% | 0.791 | S | S | * | * | 163.9 | 158.9 | 116.7 | -61.8 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 112 | M | 36.3 | Very low | 32.4 | Very low | 162 Ų | 162 | 140.3 Ų | 140.3 | 80% | 0.798 | 79% | 0.789 | S | S | * | * | trans | -89.7 | -172.9 | 177.4 | -69.3 | 172.2 | 57 | 0 | 0 | 113.7 | ||||
| 113 | Q | 31.1 | Very low | 32.3 | Very low | 173 Ų | 173 | 139.5 Ų | 139.5 | 81% | 0.808 | 79% | 0.79 | S | S | * | * | trans | -40.5 | 158.3 | 176.2 | -59.5 | 172.8 | -80.1 | 0 | 0 | 117.5 | ||||
| 114 | P | 36.8 | Very low | 32.4 | Very low | 127 Ų | 127 | 142.9 Ų | 142.9 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -126.7 | 176.2 | 138.4 | 36.4 | -24 | 0 | 0 | 0 | 113.6 | ||||
| 115 | S | 30.5 | Very low | 32.3 | Very low | 107 Ų | 107 | 137.2 Ų | 137.2 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | -151.3 | 167.6 | -177 | 52.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 116 | E | 32.1 | Very low | 32.3 | Very low | 170 Ų | 170 | 139.1 Ų | 139.1 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | 98.2 | 131.7 | 159.1 | -52.2 | -154.5 | 112.5 | 0 | 0 | 121.8 | ||||
| 117 | T | 29.8 | Very low | 32.2 | Very low | 138 Ų | 138 | 139.5 Ų | 139.5 | 85% | 0.847 | 79% | 0.793 | S | S | * | * | trans | 65.7 | 150.2 | 155.2 | 51.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 118 | E | 29.2 | Very low | 32 | Very low | 169 Ų | 169 | 140 Ų | 140 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | cis | -158.2 | 160.5 | 33 | -161.9 | -158 | 127.4 | 0 | 0 | 114.2 | ||||
| 119 | S | 28.1 | Very low | 31.2 | Very low | 97 Ų | 97 | 141.7 Ų | 141.7 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | 70.2 | 153.3 | 160 | 79 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 120 | K | 31.4 | Very low | 31.2 | Very low | 172 Ų | 172 | 140.3 Ų | 140.3 | 75% | 0.748 | 79% | 0.794 | S | S | * | * | cis | -165.2 | 134.3 | -8.3 | -115.5 | 178.7 | 165 | -130.8 | 0 | 107 | ||||
| 121 | E | 27.8 | Very low | 31.3 | Very low | 157 Ų | 157 | 136.8 Ų | 136.8 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | 123.4 | 156 | 78.7 | -174.5 | 160.7 | -165.8 | 0 | 0 | 111.1 | |||||
| 122 | A | 30 | Very low | 31.6 | Very low | 83 Ų | 83 | 135.7 Ų | 135.7 | 69% | 0.686 | 78% | 0.783 | S | S | * | * | trans | 91.6 | 95.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 123 | V | 34.4 | Very low | 31.8 | Very low | 127 Ų | 127 | 135.9 Ų | 135.9 | 77% | 0.77 | 79% | 0.786 | S | S | * | * | 65.5 | 131.7 | 130 | -50.8 | 0 | 0 | 0 | 0 | 127.4 | |||||
| 124 | N | 31.3 | Very low | 32.2 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 87% | 0.872 | 79% | 0.785 | S | S | * | * | trans | 55.2 | 143 | 137.9 | -63.5 | -1.4 | 0 | 0 | 0 | 124.2 | ||||
| 125 | G | 29.4 | Very low | 32 | Very low | 77 Ų | 77 | 132.3 Ų | 132.3 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -171.9 | 1.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 125.6 | ||||
| 126 | F | 29.6 | Very low | 32.2 | Very low | 204 Ų | 204 | 135 Ų | 135 | 90% | 0.895 | 79% | 0.79 | S | S | * | * | trans | 66.5 | 166.5 | 164.4 | -112.9 | -101.9 | 0 | 0 | 0 | 122.7 | ||||
| 127 | H | 30.6 | Very low | 32.4 | Very low | 161 Ų | 161 | 131.8 Ų | 131.8 | 75% | 0.745 | 79% | 0.787 | S | S | * | * | trans | -98.4 | 160.2 | -168.5 | -49.6 | -112.8 | 0 | 0 | 0 | 114.4 | ||||
| 128 | A | 32 | Very low | 32.8 | Very low | 100 Ų | 100 | 132.6 Ų | 132.6 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | 157.8 | 166.1 | 128.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 129 | N | 34.8 | Very low | 33 | Very low | 164 Ų | 164 | 130.9 Ų | 130.9 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | cis | -172.6 | 142.3 | -49.7 | -148.6 | 2.9 | 0 | 0 | 0 | 109.2 | ||||
| 130 | G | 33 | Very low | 33.8 | Very low | 69 Ų | 69 | 130.5 Ų | 130.5 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | trans | 69.7 | 178.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 131 | S | 32.8 | Very low | 33.9 | Very low | 111 Ų | 111 | 130.3 Ų | 130.3 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | cis | -162.9 | 140.9 | -11.3 | -145.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 132 | V | 32.8 | Very low | 34.5 | Very low | 118 Ų | 118 | 127.6 Ų | 127.6 | 72% | 0.715 | 78% | 0.783 | S | S | * | * | trans | 34.2 | 122.9 | 135.6 | 177.6 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 133 | L | 40.6 | Very low | 34.8 | Very low | 167 Ų | 167 | 131.5 Ų | 131.5 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | -165.1 | 143.1 | 109.6 | -121.7 | 128.1 | 0 | 0 | 0 | 113.8 | |||||
| 134 | D | 40.1 | Very low | 35 | Very low | 147 Ų | 147 | 133 Ų | 133 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -86 | 173 | 172.4 | -75.3 | -69.7 | 0 | 0 | 0 | 112.6 | ||||
| 135 | G | 31.5 | Very low | 35.2 | Very low | 78 Ų | 78 | 133 Ų | 133 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -174.9 | 78.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 136 | D | 34.1 | Very low | 35.7 | Very low | 163 Ų | 163 | 136.5 Ų | 136.5 | 87% | 0.872 | 79% | 0.785 | S | S | * | * | trans | -64.9 | 149.9 | 173 | -62.8 | -78.8 | 0 | 0 | 0 | 113.9 | ||||
| 137 | S | 37.4 | Very low | 35.8 | Very low | 103 Ų | 103 | 131.2 Ų | 131.2 | 72% | 0.72 | 77% | 0.774 | S | S | * | * | trans | -169.6 | 123.6 | 142.5 | 178.7 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 138 | L | 38.7 | Very low | 35.9 | Very low | 155 Ų | 155 | 128 Ų | 128 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | trans | 18.2 | 148.5 | 131.1 | -40.5 | 175.6 | 0 | 0 | 0 | 119.3 | ||||
| 139 | D | 33 | Very low | 35.9 | Very low | 132 Ų | 132 | 128 Ų | 128 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | cis | -157.7 | 144.6 | 22.5 | -162.2 | 28.5 | 0 | 0 | 0 | 115.3 | ||||
| 140 | S | 43.9 | Very low | 36.1 | Very low | 89 Ų | 89 | 127.8 Ų | 127.8 | 62% | 0.622 | 77% | 0.767 | S | S | * | * | trans | 21.7 | 161.5 | 145.6 | -54.5 | 0 | 0 | 0 | 0 | 126.6 | ||||
| 141 | L | 34.7 | Very low | 36.5 | Very low | 168 Ų | 168 | 131.3 Ų | 131.3 | 88% | 0.88 | 77% | 0.77 | S | S | * | * | trans | 80 | 135.3 | 162.2 | -50.2 | -174.1 | 0 | 0 | 0 | 117.1 | ||||
| 142 | S | 38.9 | Very low | 36.7 | Very low | 101 Ų | 101 | 130 Ų | 130 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | cis | -150.6 | 148.7 | -0.2 | 54.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 143 | E | 37.8 | Very low | 36.9 | Very low | 165 Ų | 165 | 129.2 Ų | 129.2 | 77% | 0.771 | 77% | 0.771 | S | S | * | * | trans | 6.4 | 127.5 | 155.3 | -66.8 | 167.9 | 112.4 | 0 | 0 | 119.6 | ||||
| 144 | Q | 38.3 | Very low | 37 | Very low | 159 Ų | 159 | 130.1 Ų | 130.1 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | 74.7 | 110.6 | 56.1 | -175.4 | -167.6 | -76.8 | 0 | 0 | 113.8 | |||||
| 145 | L | 35.4 | Very low | 37 | Very low | 163 Ų | 163 | 131.4 Ų | 131.4 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | trans | -152.7 | 102.5 | 135 | -98.9 | -173.1 | 0 | 0 | 0 | 109.5 | ||||
| 146 | D | 39.5 | Very low | 37.1 | Very low | 149 Ų | 149 | 134 Ų | 134 | 80% | 0.797 | 77% | 0.772 | S | S | * | * | trans | -127.4 | 146.8 | 158.9 | -163 | -13.1 | 0 | 0 | 0 | 107 | ||||
| 147 | S | 31.8 | Very low | 37.2 | Very low | 94 Ų | 94 | 131.6 Ų | 131.6 | 66% | 0.657 | 77% | 0.768 | S | S | * | * | trans | -164.1 | 106.9 | -176.4 | -73.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 148 | A | 33.1 | Very low | 37.3 | Very low | 94 Ų | 94 | 134.8 Ų | 134.8 | 78% | 0.777 | 77% | 0.772 | S | S | * | * | 73.7 | 144.4 | 78.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 149 | S | 32.7 | Very low | 37.3 | Very low | 99 Ų | 99 | 133.2 Ų | 133.2 | 69% | 0.692 | 77% | 0.771 | S | S | * | * | cis | -172.7 | 173.6 | -17.1 | -171.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 150 | L | 38.7 | Very low | 37.4 | Very low | 159 Ų | 159 | 131.1 Ų | 131.1 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | trans | 66.2 | 166.5 | 166.3 | -59 | 134.6 | 0 | 0 | 0 | 117.6 | ||||
| 151 | D | 39.9 | Very low | 36.8 | Very low | 143 Ų | 143 | 132.4 Ų | 132.4 | 77% | 0.765 | 78% | 0.776 | S | S | * | * | cis | -166.2 | 165.4 | -45.3 | -168.7 | 25 | 0 | 0 | 0 | 109.7 | ||||
| 152 | A | 37.5 | Very low | 36.7 | Very low | 83 Ų | 83 | 130.5 Ų | 130.5 | 69% | 0.686 | 78% | 0.777 | S | S | * | * | trans | 35.5 | 119 | 153.6 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 153 | A | 37 | Very low | 36.4 | Very low | 102 Ų | 102 | 132.6 Ų | 132.6 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | -154.2 | 143.5 | 135.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 154 | E | 42.5 | Very low | 36.4 | Very low | 187 Ų | 187 | 132.5 Ų | 132.5 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -69.8 | 158 | 160.7 | -64 | 168.3 | 90.4 | 0 | 0 | 110.4 | ||||
| 155 | L | 39.9 | Very low | 36 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | -164.4 | 137.8 | 123 | -106.4 | 176.8 | 0 | 0 | 0 | 111.7 | |||||
| 156 | D | 34.5 | Very low | 35.6 | Very low | 131 Ų | 131 | 127.4 Ų | 127.4 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -87.8 | 158.2 | 172.4 | 179 | 32.5 | 0 | 0 | 0 | 111.2 | ||||
| 157 | S | 36.8 | Very low | 35.6 | Very low | 113 Ų | 113 | 124.5 Ų | 124.5 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -166.2 | 95.8 | 172.7 | -77.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 158 | E | 38 | Very low | 35.9 | Very low | 171 Ų | 171 | 128.5 Ų | 128.5 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 154 | 167.3 | -72.1 | -147.5 | 119.3 | 0 | 0 | 113.9 | ||
| 159 | P | 38.3 | Very low | 36.1 | Very low | 121 Ų | 121 | 128.1 Ų | 128.1 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 126.5 | 158.8 | 34.2 | -29 | 0 | 0 | 0 | 111.5 | ||
| 160 | A | 35.7 | Very low | 36.2 | Very low | 88 Ų | 88 | 131 Ų | 131 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 133.4 | -166.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 161 | T | 31.9 | Very low | 35.9 | Very low | 116 Ų | 116 | 128.3 Ų | 128.3 | 71% | 0.712 | 79% | 0.79 | S | S | * | * | trans | 41.8 | 129.3 | 136.9 | 63.6 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 162 | S | 32.8 | Very low | 35.6 | Very low | 129 Ų | 129 | 129 Ų | 129 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -159.8 | 114.9 | 132 | -78.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 163 | D | 32.3 | Very low | 35.2 | Very low | 144 Ų | 144 | 130.5 Ų | 130.5 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | trans | -77.5 | 157 | -179 | -63.6 | -87.8 | 0 | 0 | 0 | 114.3 | ||||
| 164 | I | 37.5 | Very low | 34.9 | Very low | 163 Ų | 163 | 131.3 Ų | 131.3 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | -159.8 | 110.8 | 125.5 | -104.7 | 158.8 | 0 | 0 | 0 | 112.3 | |||||
| 165 | T | 29.3 | Very low | 34.3 | Very low | 137 Ų | 137 | 126 Ų | 126 | 84% | 0.84 | 79% | 0.791 | S | S | * | * | trans | 21.1 | 124.9 | 142.6 | -38.8 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 166 | G | 28.6 | Very low | 34.6 | Very low | 78 Ų | 78 | 123.9 Ų | 123.9 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | 179.6 | 125.3 | 156.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 167 | A | 38.6 | Very low | 34.6 | Very low | 88 Ų | 88 | 122.6 Ų | 122.6 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -119.5 | -161.6 | -168.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 168 | E | 37.9 | Very low | 35.1 | Very low | 179 Ų | 179 | 123 Ų | 123 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | 73.2 | 143.4 | -174.7 | -43.5 | -55.4 | 107.7 | 0 | 0 | 116.5 | ||||
| 169 | A | 37.5 | Very low | 35.2 | Very low | 85 Ų | 85 | 120.8 Ų | 120.8 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | cis | -173.5 | 159.7 | -35.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 170 | D | 34.8 | Very low | 35.4 | Very low | 160 Ų | 160 | 120.6 Ų | 120.6 | 86% | 0.856 | 79% | 0.786 | S | S | * | * | trans | -42.4 | 155.4 | -177.7 | -58.3 | -67.7 | 0 | 0 | 0 | 116.6 | ||||
| 171 | S | 32.9 | Very low | 35.3 | Very low | 103 Ų | 103 | 125.3 Ų | 125.3 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | 175.5 | 163.6 | 60.4 | -147.6 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 172 | L | 33 | Very low | 35.6 | Very low | 158 Ų | 158 | 127.5 Ų | 127.5 | 83% | 0.827 | 80% | 0.795 | S | S | * | * | trans | 62.3 | 88.3 | 151.2 | -71.7 | 160.9 | 0 | 0 | 0 | 123.1 | ||||
| 173 | C | 30 | Very low | 35.7 | Very low | 114 Ų | 114 | 125.3 Ų | 125.3 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | 43.3 | 124.6 | 117.5 | -165.3 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 174 | S | 29.9 | Very low | 35.9 | Very low | 118 Ų | 118 | 127 Ų | 127 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | 174.1 | 132.8 | 121.3 | -80.3 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 175 | G | 30.6 | Very low | 35.6 | Very low | 75 Ų | 75 | 123.1 Ų | 123.1 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | 90.7 | 130.2 | 142.8 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 176 | P | 45.3 | Very low | 35.6 | Very low | 131 Ų | 131 | 120.8 Ų | 120.8 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | trans | -108.3 | 173.7 | 178.3 | 40.6 | -34.5 | 0 | 0 | 0 | 116.1 | ||||
| 177 | S | 35.1 | Very low | 35.8 | Very low | 104 Ų | 104 | 128.3 Ų | 128.3 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | -74.2 | 163.7 | 173.1 | -173.7 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 178 | P | 48.2 | Very low | 35.5 | Very low | 120 Ų | 120 | 130.6 Ų | 130.6 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | -149.6 | 170.6 | 114.1 | 39.4 | -23.7 | 0 | 0 | 0 | 117.9 | |||||
| 179 | T | 39.1 | Very low | 35.3 | Very low | 125 Ų | 125 | 131.4 Ų | 131.4 | 77% | 0.767 | 80% | 0.799 | S | S | * | * | trans | -82.3 | 164.7 | 169.9 | 52 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 180 | P | 43.5 | Very low | 35.4 | Very low | 117 Ų | 117 | 135.7 Ų | 135.7 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | trans | -120.3 | 136.7 | 166.8 | 37.5 | -26.6 | 0 | 0 | 0 | 116.2 | ||||
| 181 | H | 33.1 | Very low | 36.2 | Very low | 188 Ų | 188 | 132.7 Ų | 132.7 | 87% | 0.87 | 79% | 0.794 | S | S | * | * | trans | -146.8 | 164 | 169.5 | -80.3 | -4.6 | 0 | 0 | 0 | 109.2 | ||||
| 182 | H | 38.6 | Very low | 37 | Very low | 161 Ų | 161 | 133.8 Ų | 133.8 | 75% | 0.745 | 80% | 0.799 | S | S | * | * | cis | -117.8 | -98.7 | 3.8 | -174.9 | 11.6 | 0 | 0 | 0 | 112.6 | ||||
| 183 | A | 33.2 | Very low | 37.2 | Very low | 83 Ų | 83 | 138.2 Ų | 138.2 | 69% | 0.686 | 80% | 0.804 | S | S | * | * | cis | -152.1 | 123.7 | -13.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 184 | Q | 37.6 | Very low | 37.2 | Very low | 179 Ų | 179 | 136.6 Ų | 136.6 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | trans | 39.7 | 138.3 | 140.4 | -56.7 | -172.2 | -2.1 | 0 | 0 | 124.3 | ||||
| 185 | G | 29.9 | Very low | 37.4 | Very low | 83 Ų | 83 | 138.2 Ų | 138.2 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | trans | 132.6 | 132.9 | 136.8 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 186 | G | 29.7 | Very low | 37.7 | Very low | 87 Ų | 87 | 142.6 Ų | 142.6 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | trans | 104.7 | 119.4 | 145.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 187 | R | 33.4 | Very low | 37.1 | Very low | 236 Ų | 236 | 144.8 Ų | 144.8 | 89% | 0.891 | 80% | 0.8 | S | S | * | * | trans | -81.7 | 154 | 176.7 | -83.6 | 173 | 161.9 | 171.6 | -6.1 | 114.7 | ||||
| 188 | N | 32.5 | Very low | 37.1 | Very low | 137 Ų | 137 | 151.1 Ų | 151.1 | 73% | 0.733 | 81% | 0.808 | S | S | * | * | trans | 43.2 | 127.3 | 143.3 | -63.9 | -8.7 | 0 | 0 | 0 | 121.7 | ||||
| 189 | H | 33.5 | Very low | 36.4 | Very low | 195 Ų | 195 | 150.9 Ų | 150.9 | 90% | 0.903 | 81% | 0.809 | S | S | * | * | -168.6 | 165.5 | 116.8 | -98.9 | -69.9 | 0 | 0 | 0 | 111.2 | |||||
| 190 | Q | 39.4 | Very low | 36.3 | Very low | 175 Ų | 175 | 156 Ų | 156 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -158.4 | 165.6 | -177.7 | -130.3 | -152.4 | 52.2 | 0 | 0 | 109.1 | ||||
| 191 | P | 51.3 | Low | 35.8 | Very low | 98 Ų | 98 | 156.6 Ų | 156.6 | 64% | 0.636 | 82% | 0.816 | S | S | * | * | cis | -112 | -158 | -44.4 | 32.4 | -13.8 | 0 | 0 | 0 | 110 | ||||
| 192 | P | 49.8 | Very low | 36 | Very low | 126 Ų | 126 | 154.8 Ų | 154.8 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | -148.7 | 171.3 | 93.9 | 38.9 | -21.2 | 0 | 0 | 0 | 117.4 | |||||
| 193 | R | 38 | Very low | 35.9 | Very low | 251 Ų | 251 | 152.4 Ų | 152.4 | 95% | 0.947 | 81% | 0.814 | S | S | * | * | trans | -56.2 | 141.8 | -175 | -60.1 | 159.8 | 173.4 | 164.7 | -3.1 | 116 | ||||
| 194 | G | 29.7 | Very low | 36.4 | Very low | 79 Ų | 79 | 156.7 Ų | 156.7 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | trans | -138.2 | 154.4 | 156.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 195 | N | 34.4 | Very low | 36.8 | Very low | 152 Ų | 152 | 154.1 Ų | 154.1 | 81% | 0.813 | 82% | 0.819 | S | S | * | * | trans | -145.1 | 159 | -164.5 | -166.4 | 10.4 | 0 | 0 | 0 | 113.8 | ||||
| 196 | K | 36.4 | Very low | 37.3 | Very low | 168 Ų | 168 | 154.8 Ų | 154.8 | 73% | 0.73 | 81% | 0.811 | S | S | * | * | trans | 101.7 | 110.1 | 164.5 | -59.8 | 178.8 | -179.7 | 175.6 | 0 | 119.9 | ||||
| 197 | F | 32 | Very low | 37.6 | Very low | 177 Ų | 177 | 156.8 Ų | 156.8 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | 49.1 | 126.2 | 129.1 | -62.4 | -69.1 | 0 | 0 | 0 | 124.6 | |||||
| 198 | R | 35.1 | Very low | 38 | Very low | 236 Ų | 236 | 150.2 Ų | 150.2 | 89% | 0.891 | 80% | 0.796 | S | S | * | * | trans | 66.6 | 158.2 | 143.7 | -67.3 | -178.1 | 175.2 | -171.3 | -1.5 | 116.5 | ||||
| 199 | S | 33.7 | Very low | 38.3 | Very low | 116 Ų | 116 | 148.6 Ų | 148.6 | 81% | 0.811 | 80% | 0.795 | S | S | * | * | cis | -142.9 | -172.3 | 11.3 | -148.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 200 | R | 38 | Very low | 38.4 | Very low | 233 Ų | 233 | 146.3 Ų | 146.3 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | trans | -123.5 | 113.3 | -172.4 | 171.6 | -169.7 | 167.5 | -169.5 | -2.9 | 113.3 | ||||
| 201 | T | 33.4 | Very low | 38.5 | Very low | 129 Ų | 129 | 145.3 Ų | 145.3 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -161.1 | 134.5 | 162.4 | 5.4 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 202 | N | 36 | Very low | 37.9 | Very low | 150 Ų | 150 | 147.2 Ų | 147.2 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | cis | 75.9 | 80.6 | 25.9 | -162.1 | 93.1 | 0 | 0 | 0 | 115.9 | ||||
| 203 | S | 37.6 | Very low | 37.4 | Very low | 110 Ų | 110 | 146.8 Ų | 146.8 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -155.3 | 139.9 | 153.4 | 45.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 204 | Q | 43.7 | Very low | 37.3 | Very low | 174 Ų | 174 | 141.4 Ų | 141.4 | 81% | 0.813 | 79% | 0.789 | S | S | * | * | trans | -85.7 | 164.1 | 161.5 | -62 | 172.2 | -86.8 | 0 | 0 | 109.2 | ||||
| 205 | P | 45.3 | Very low | 38 | Very low | 124 Ų | 124 | 145 Ų | 145 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | trans | -118.3 | 139.5 | 143.7 | 34.6 | -26.6 | 0 | 0 | 0 | 111.6 | ||||
| 206 | S | 40.5 | Very low | 38.1 | Very low | 98 Ų | 98 | 141.8 Ų | 141.8 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | trans | -142.1 | 105 | 174.9 | -66.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 207 | T | 36.8 | Very low | 38.4 | Very low | 128 Ų | 128 | 142.7 Ų | 142.7 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | trans | -161.2 | 123 | 163.6 | 33.6 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 208 | S | 40.5 | Very low | 38.7 | Very low | 98 Ų | 98 | 142.2 Ų | 142.2 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | 62.4 | 132.6 | 65.3 | 77.4 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 209 | S | 38.3 | Very low | 38.7 | Very low | 103 Ų | 103 | 134.5 Ų | 134.5 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | cis | 179.4 | 144.6 | -6.8 | 42.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 210 | V | 35.9 | Very low | 39 | Very low | 147 Ų | 147 | 134.3 Ų | 134.3 | 89% | 0.891 | 77% | 0.767 | S | S | * | * | trans | -139.2 | 146.9 | 159 | -175.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 211 | L | 42.3 | Very low | 39.5 | Very low | 155 Ų | 155 | 129.6 Ų | 129.6 | 81% | 0.812 | 77% | 0.77 | S | S | * | * | trans | -117.2 | -176.8 | -175.5 | -71.7 | 166.8 | 0 | 0 | 0 | 111.6 | ||||
| 212 | T | 38.9 | Very low | 40.1 | Very low | 137 Ų | 137 | 126.6 Ų | 126.6 | 84% | 0.84 | 77% | 0.765 | S | S | * | * | trans | 103.5 | 138 | 179.2 | 63.5 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 213 | T | 38.8 | Very low | 40.6 | Very low | 118 Ų | 118 | 123.7 Ų | 123.7 | 72% | 0.724 | 76% | 0.761 | S | S | * | * | cis | -160.1 | 113.1 | -16.3 | -89 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 214 | D | 36.7 | Very low | 41.7 | Very low | 137 Ų | 137 | 127.7 Ų | 127.7 | 73% | 0.733 | 77% | 0.765 | S | S | * | * | 88.7 | 120 | 87.2 | -149.8 | 30.1 | 0 | 0 | 0 | 113.8 | |||||
| 215 | E | 43 | Very low | 42.3 | Very low | 155 Ų | 155 | 128.8 Ų | 128.8 | 72% | 0.724 | 77% | 0.767 | S | S | * | * | trans | 62.8 | 156.8 | 145.6 | -95.7 | -152.2 | 167.8 | 0 | 0 | 122.8 | ||||
| 216 | N | 36.8 | Very low | 42.8 | Very low | 84 Ų | 84 | 129.4 Ų | 129.4 | 45% | 0.449 | 76% | 0.762 | S | S | . | * | cis | -151.3 | 141.2 | -7.8 | -161.4 | -19.9 | 0 | 0 | 0 | 111.2 | ||||
| 217 | Q | 42.3 | Very low | 43.7 | Very low | 187 Ų | 187 | 127.5 Ų | 127.5 | 87% | 0.874 | 75% | 0.753 | S | S | * | * | 173.7 | 112.2 | 129.4 | -94.7 | 165.2 | 108.2 | 0 | 0 | 109.6 | |||||
| 218 | Q | 39.9 | Very low | 45 | Very low | 168 Ų | 168 | 125.9 Ų | 125.9 | 79% | 0.785 | 74% | 0.744 | S | S | * | * | 96.9 | 106 | 62.5 | -170.1 | 78.5 | -13.1 | 0 | 0 | 111.4 | |||||
| 219 | G | 34 | Very low | 46.3 | Very low | 74 Ų | 74 | 126.2 Ų | 126.2 | 76% | 0.763 | 74% | 0.738 | S | S | * | * | trans | 106.7 | 83.8 | 154.4 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 220 | S | 40 | Very low | 48.7 | Very low | 112 Ų | 112 | 125.1 Ų | 125.1 | 78% | 0.783 | 72% | 0.723 | S | S | * | * | trans | -161.7 | 53.5 | 139 | -159.5 | 0 | 0 | 0 | 0 | 113.2 | G222 | S220-G222 PolarHBondContact O-N 2.69Š| ||
| 221 | S | 49.1 | Very low | 51.2 | Low | 133 Ų | 133 | 122.6 Ų | 122.6 | 93% | 0.93 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 33 | 176.3 | 42.7 | 0 | 0 | 0 | 0 | 113.7 | ||
| 222 | G | 45.4 | Very low | 53.5 | Low | 67 Ų | 67 | 123.7 Ų | 123.7 | 69% | 0.691 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | -23.4 | -173.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | S220 K224 | S220-G222 PolarHBondContact O-N 2.69Å; G222-K224 PolarHBondContact O-N 3.25Å; G222-K224 VanDerWaalsContact O-N 3.12Å |
| 223 | A | 47.7 | Very low | 56.1 | Low | 88 Ų | 88 | 119.9 Ų | 119.9 | 73% | 0.727 | 68% | 0.677 | S | S | * | * | trans | -91.1 | 53 | -167.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 224 | K | 59.5 | Low | 58.8 | Low | 195 Ų | 195 | 117.2 Ų | 117.2 | 85% | 0.848 | 66% | 0.661 | S | S | * | * | trans | -118.8 | 127.1 | 174.1 | -72.3 | -179 | 179.1 | 174.9 | 0 | 111.2 | G222 | G222-K224 PolarHBondContact O-N 3.25Å; G222-K224 VanDerWaalsContact O-N 3.12Å | ||
| 225 | K | 57 | Low | 61.6 | Low | 197 Ų | 197 | 117.7 Ų | 117.7 | 86% | 0.857 | 66% | 0.656 | S | S | * | * | trans | 78.8 | 35.6 | -174.5 | -49.2 | -178.6 | -172.5 | 177 | 0 | 117 | A227 | K225-A227 PolarHBondContact O-N 3.01Š| ||
| 226 | I | 55.5 | Low | 64.1 | Low | 136 Ų | 136 | 114 Ų | 114 | 70% | 0.697 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -56.5 | 126.6 | 134.7 | -80.6 | 174.4 | 0 | 0 | 0 | 106.1 | I230 | I226-I230 HydrophobicContact CG2-CG2 3.63Š|
| 227 | A | 58.5 | Low | 66.9 | Low | 59 Ų | 59 | 115.4 Ų | 115.4 | 49% | 0.488 | 65% | 0.648 | S | S | . | * | trans | -67.4 | 135.6 | -153.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | K225 N229 I230 | K225-A227 PolarHBondContact O-N 3.01Å; A227-N229 PolarHBondContact O-N 3.29Å; A227-I230 WeakPolarHBondContact O-CG2 3.46Å; A227-I230 PolarHBondContact O-N 3.24Å | ||
| 228 | P | 64.8 | Low | 69.6 | Low | 94 Ų | 94 | 112 Ų | 112 | 61% | 0.61 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 11.2 | -175.5 | 29.2 | -37.6 | 0 | 0 | 0 | 115.2 | ||
| 229 | N | 68.7 | Low | 72.3 | Confident | 105 Ų | 105 | 111.6 Ų | 111.6 | 56% | 0.561 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -39.9 | 163.6 | -165.4 | -74.3 | 0 | 0 | 0 | 110.8 | A227 D231 R232 S233 | A227-N229 PolarHBondContact O-N 3.29Å; N229-D231 PolarHBondContact O-N 3.44Å; N229-R232 WeakPolarHBondContact O-CB 3.29Å; N229-R232 PolarHBondContact O-N 3.47Å; N229-S233 PolarHBondContact O-N 2.94Å; N229-S233 PolarHBondContact O-OG 3.49Å |
| 230 | I | 87.4 | Confident | 75.3 | Confident | 79 Ų | 79 | 110.6 Ų | 110.6 | 41% | 0.405 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64.6 | -36.9 | -173.4 | -161.8 | 62.8 | 0 | 0 | 0 | 112.5 | I226 A227 R232 S233 V234 | I226-I230 HydrophobicContact CG2-CG2 3.63Å; A227-I230 WeakPolarHBondContact O-CG2 3.46Å; A227-I230 PolarHBondContact O-N 3.24Å; I230-R232 PolarHBondContact O-N 2.66Å; I230-R232 VanDerWaalsContact O-N 3.17Å; I230-S233 CarbonylContact O-C 3.54Å; I230-S233 WeakPolarHBondContact O-CB 3.45Å; I230-S233 PolarHBondContact O-N 2.98Å; I230-V234 HydrophobicContact CG1-CG2 4.28Å; I230-V234 WeakPolarHBondContact O-CG2 3.33Å; I230-V234 PolarHBondContact O-N 3.39Å |
| 231 | D | 89.1 | Confident | 78.1 | Confident | 94 Ų | 94 | 109 Ų | 109 | 50% | 0.503 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -61.6 | -26.4 | 176.9 | -59.3 | -59.3 | 0 | 0 | 0 | 112.5 | N229 K235 | N229-D231 PolarHBondContact O-N 3.44Å; D231-K235 VanDerWaalsContact O-CG 3.29Å; D231-K235 WeakPolarHBondContact O-CG 3.24Å; D231-K235 PolarHBondContact O-N 2.99Å |
| 232 | R | 90.9 | Very high | 80.4 | Confident | 178 Ų | 178 | 107.7 Ų | 107.7 | 67% | 0.672 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -77.8 | -44.3 | 174.5 | -54.7 | 177.7 | -176.7 | 165.6 | 0.2 | 110 | N229 I230 V234 K235 D236 | N229-R232 WeakPolarHBondContact O-CB 3.29Å; N229-R232 PolarHBondContact O-N 3.47Å; I230-R232 PolarHBondContact O-N 2.66Å; I230-R232 VanDerWaalsContact O-N 3.17Å; R232-V234 VanDerWaalsContact C-N 3.33Å; R232-V234 PolarHBondContact O-N 3.07Å; R232-K235 PolarHBondContact O-N 2.73Å; R232-D236 PolarHBondContact O-N 3.44Å |
| 233 | S | 93.5 | Very high | 82.9 | Confident | 57 Ų | 57 | 106.4 Ų | 106.4 | 40% | 0.399 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.3 | -36.9 | 174 | -52 | 0 | 0 | 0 | 0 | 112.9 | N229 I230 D236 L237 | N229-S233 PolarHBondContact O-N 2.94Å; N229-S233 PolarHBondContact O-OG 3.49Å; I230-S233 CarbonylContact O-C 3.54Å; I230-S233 WeakPolarHBondContact O-CB 3.45Å; I230-S233 PolarHBondContact O-N 2.98Å; S233-D236 PolarHBondContact O-N 3.3Å; S233-L237 VanDerWaalsContact O-CB 3.29Å; S233-L237 WeakPolarHBondContact O-CB 3.32Å; S233-L237 PolarHBondContact O-N 2.94Å |
| 234 | V | 94.8 | Very high | 85.3 | Confident | 63 Ų | 63 | 106.6 Ų | 106.6 | 38% | 0.382 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.9 | -40.7 | 175.5 | 169.4 | 0 | 0 | 0 | 0 | 110.9 | I230 R232 L237 Q238 | I230-V234 HydrophobicContact CG1-CG2 4.28Å; I230-V234 WeakPolarHBondContact O-CG2 3.33Å; I230-V234 PolarHBondContact O-N 3.39Å; R232-V234 VanDerWaalsContact C-N 3.33Å; R232-V234 PolarHBondContact O-N 3.07Å; V234-L237 PolarHBondContact O-N 2.84Å; V234-Q238 VanDerWaalsContact O-CG 3.31Å; V234-Q238 WeakPolarHBondContact O-CG 3.39Å; V234-Q238 PolarHBondContact O-N 3.33Å |
| 235 | K | 95.3 | Very high | 87.2 | Confident | 146 Ų | 146 | 100.9 Ų | 100.9 | 64% | 0.635 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -67.1 | -38.4 | 174.5 | -75.9 | 174 | -179.3 | -179.9 | 0 | 112.7 | D231 R232 Q238 R239 | D231-K235 VanDerWaalsContact O-CG 3.29Å; D231-K235 WeakPolarHBondContact O-CG 3.24Å; D231-K235 PolarHBondContact O-N 2.99Å; R232-K235 PolarHBondContact O-N 2.73Å; K235-Q238 PolarHBondContact O-N 2.94Å; K235-R239 WeakPolarHBondContact O-CB 3.48Å; K235-R239 PolarHBondContact O-N 3.43Å |
| 236 | D | 95.8 | Very high | 89.1 | Confident | 78 Ų | 78 | 99.7 Ų | 99.7 | 42% | 0.417 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -71.6 | -34.6 | 174.3 | -160.1 | 46.7 | 0 | 0 | 0 | 111.6 | R232 S233 R239 C240 | R232-D236 PolarHBondContact O-N 3.44Å; S233-D236 PolarHBondContact O-N 3.3Å; D236-R239 CarbonylContact O-C 3.55Å; D236-R239 WeakPolarHBondContact O-CB 3.38Å; D236-R239 PolarHBondContact O-N 3.5Å; D236-R239 IonicContact OD1-NH1 2.98Å; D236-R239 PolarHBondContact OD1-NH1 2.95Å; D236-C240 WeakPolarHBondContact O-CB 3.34Å; D236-C240 PolarHBondContact O-N 3.4Å; D236-C240 PolarHBondContact O-SG 2.91Å; D236-C240 VanDerWaalsContact O-SG 3.33Å |
| 237 | L | 96.8 | Very high | 91.2 | Very high | 113 Ų | 113 | 99.7 Ų | 99.7 | 59% | 0.592 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.7 | -45.5 | 169.7 | 179.4 | 61.7 | 0 | 0 | 0 | 111.9 | S233 V234 R239 C240 T241 | S233-L237 VanDerWaalsContact O-CB 3.29Å; S233-L237 WeakPolarHBondContact O-CB 3.32Å; S233-L237 PolarHBondContact O-N 2.94Å; V234-L237 PolarHBondContact O-N 2.84Å; L237-R239 VanDerWaalsContact C-N 3.31Å; L237-R239 PolarHBondContact O-N 3.17Å; L237-C240 CarbonylContact O-C 3.57Å; L237-C240 WeakPolarHBondContact O-CB 3.35Å; L237-C240 PolarHBondContact O-N 2.97Å; L237-C240 VanDerWaalsContact O-N 3.17Å; L237-T241 PolarHBondContact O-N 3.38Å; L237-T241 PolarHBondContact O-OG1 2.94Å; L237-T241 VanDerWaalsContact O-OG1 3.11Å |
| 238 | Q | 97.3 | Very high | 93.1 | Very high | 115 Ų | 115 | 105.7 Ų | 105.7 | 54% | 0.537 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.1 | -42.7 | 173.7 | -74.3 | 169.7 | -13.4 | 0 | 0 | 111.5 | V234 K235 T241 V242 | V234-Q238 VanDerWaalsContact O-CG 3.31Å; V234-Q238 WeakPolarHBondContact O-CG 3.39Å; V234-Q238 PolarHBondContact O-N 3.33Å; K235-Q238 PolarHBondContact O-N 2.94Å; Q238-T241 WeakPolarHBondContact O-CB 3.2Å; Q238-T241 PolarHBondContact O-N 3.48Å; Q238-V242 WeakPolarHBondContact O-CG2 3.41Å; Q238-V242 PolarHBondContact O-N 3.25Å |
| 239 | R | 97.6 | Very high | 94.7 | Very high | 161 Ų | 161 | 105 Ų | 105 | 61% | 0.608 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.6 | -39.4 | 174.4 | 178.5 | 175.3 | 168.1 | -92.9 | -6.7 | 112 | K235 D236 L237 V242 S243 | K235-R239 WeakPolarHBondContact O-CB 3.48Å; K235-R239 PolarHBondContact O-N 3.43Å; D236-R239 CarbonylContact O-C 3.55Å; D236-R239 WeakPolarHBondContact O-CB 3.38Å; D236-R239 PolarHBondContact O-N 3.5Å; D236-R239 IonicContact OD1-NH1 2.98Å; D236-R239 PolarHBondContact OD1-NH1 2.95Å; L237-R239 VanDerWaalsContact C-N 3.31Å; L237-R239 PolarHBondContact O-N 3.17Å; R239-V242 PolarHBondContact O-N 3.4Å; R239-S243 WeakPolarHBondContact O-CB 3.5Å; R239-S243 PolarHBondContact O-N 3.37Å; R239-S243 PolarHBondContact O-OG 3.04Å |
| 240 | C | 97.6 | Very high | 96.1 | Very high | 53 Ų | 53 | 102.5 Ų | 102.5 | 36% | 0.358 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 171 | -73.7 | 0 | 0 | 0 | 0 | 111.7 | D236 L237 V242 S243 L244 | D236-C240 WeakPolarHBondContact O-CB 3.34Å; D236-C240 PolarHBondContact O-N 3.4Å; D236-C240 PolarHBondContact O-SG 2.91Å; D236-C240 VanDerWaalsContact O-SG 3.33Å; L237-C240 CarbonylContact O-C 3.57Å; L237-C240 WeakPolarHBondContact O-CB 3.35Å; L237-C240 PolarHBondContact O-N 2.97Å; L237-C240 VanDerWaalsContact O-N 3.17Å; C240-V242 PolarHBondContact O-N 3.48Å; C240-S243 CarbonylContact O-C 3.6Å; C240-S243 PolarHBondContact O-N 3.19Å; C240-S243 VanDerWaalsContact O-N 3.14Å; C240-L244 WeakPolarHBondContact O-CB 3.37Å; C240-L244 VanDerWaalsContact O-CG 3.27Å; C240-L244 WeakPolarHBondContact O-CG 3.43Å; C240-L244 PolarHBondContact O-N 2.86Å |
| 241 | T | 97.9 | Very high | 96.5 | Very high | 79 Ų | 79 | 103.1 Ų | 103.1 | 49% | 0.485 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58 | -47.2 | 175.6 | -58.3 | 0 | 0 | 0 | 0 | 111.8 | L237 Q238 S243 L244 T245 | L237-T241 PolarHBondContact O-N 3.38Å; L237-T241 PolarHBondContact O-OG1 2.94Å; L237-T241 VanDerWaalsContact O-OG1 3.11Å; Q238-T241 WeakPolarHBondContact O-CB 3.2Å; Q238-T241 PolarHBondContact O-N 3.48Å; T241-S243 VanDerWaalsContact C-N 3.32Å; T241-S243 PolarHBondContact O-N 2.89Å; T241-L244 PolarHBondContact O-N 3.09Å; T241-T245 PolarHBondContact O-N 3.48Å; T241-T245 VanDerWaalsContact O-N 3.07Å; T241-T245 PolarHBondContact O-OG1 3.46Å |
| 242 | V | 98.1 | Very high | 97 | Very high | 105 Ų | 105 | 105.1 Ų | 105.1 | 64% | 0.636 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.3 | -40.8 | 174.9 | 175.3 | 0 | 0 | 0 | 0 | 111.3 | Q238 R239 C240 T245 R246 | Q238-V242 WeakPolarHBondContact O-CG2 3.41Å; Q238-V242 PolarHBondContact O-N 3.25Å; R239-V242 PolarHBondContact O-N 3.4Å; C240-V242 PolarHBondContact O-N 3.48Å; V242-T245 PolarHBondContact O-N 2.91Å; V242-R246 PolarHBondContact O-N 2.94Å |
| 243 | S | 98.1 | Very high | 97.3 | Very high | 39 Ų | 39 | 101 Ų | 101 | 27% | 0.273 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.6 | -41 | 179.8 | -56.7 | 0 | 0 | 0 | 0 | 111.9 | R239 C240 T241 R246 Y247 | R239-S243 WeakPolarHBondContact O-CB 3.5Å; R239-S243 PolarHBondContact O-N 3.37Å; R239-S243 PolarHBondContact O-OG 3.04Å; C240-S243 CarbonylContact O-C 3.6Å; C240-S243 PolarHBondContact O-N 3.19Å; C240-S243 VanDerWaalsContact O-N 3.14Å; T241-S243 VanDerWaalsContact C-N 3.32Å; T241-S243 PolarHBondContact O-N 2.89Å; S243-R246 WeakPolarHBondContact O-CB 3.43Å; S243-R246 PolarHBondContact O-N 3.19Å; S243-Y247 WeakPolarHBondContact O-CD2 3.38Å; S243-Y247 VanDerWaalsContact O-CG 3.32Å; S243-Y247 PolarHBondContact O-N 2.99Å |
| 244 | L | 97.7 | Very high | 97.5 | Very high | 92 Ų | 92 | 103.6 Ų | 103.6 | 48% | 0.482 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 174.6 | -73.3 | 167.5 | 0 | 0 | 0 | 111.7 | C240 T241 R246 Y247 R248 | C240-L244 WeakPolarHBondContact O-CB 3.37Å; C240-L244 VanDerWaalsContact O-CG 3.27Å; C240-L244 WeakPolarHBondContact O-CG 3.43Å; C240-L244 PolarHBondContact O-N 2.86Å; T241-L244 PolarHBondContact O-N 3.09Å; L244-R246 VanDerWaalsContact C-N 3.32Å; L244-R246 PolarHBondContact O-N 3.28Å; L244-Y247 PolarHBondContact O-N 3.33Å; L244-R248 WeakPolarHBondContact O-CG 3.41Å; L244-R248 PolarHBondContact O-N 3.46Å |
| 245 | T | 98.4 | Very high | 97.6 | Very high | 76 Ų | 76 | 105.3 Ų | 105.3 | 47% | 0.466 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.2 | -41.9 | 172.8 | -62.5 | 0 | 0 | 0 | 0 | 111.5 | T241 V242 R248 | T241-T245 PolarHBondContact O-N 3.48Å; T241-T245 VanDerWaalsContact O-N 3.07Å; T241-T245 PolarHBondContact O-OG1 3.46Å; V242-T245 PolarHBondContact O-N 2.91Å; T245-R248 PolarHBondContact O-N 2.94Å |
| 246 | R | 98.4 | Very high | 97.8 | Very high | 171 Ų | 171 | 101.4 Ų | 101.4 | 65% | 0.645 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.6 | -42.8 | 173.1 | -178.5 | 176.7 | 175.8 | -111.2 | -5.4 | 112.5 | V242 S243 L244 R248 V249 V250 | V242-R246 PolarHBondContact O-N 2.94Å; S243-R246 WeakPolarHBondContact O-CB 3.43Å; S243-R246 PolarHBondContact O-N 3.19Å; L244-R246 VanDerWaalsContact C-N 3.32Å; L244-R246 PolarHBondContact O-N 3.28Å; R246-R248 VanDerWaalsContact C-N 3.31Å; R246-R248 PolarHBondContact O-N 2.97Å; R246-V249 PolarHBondContact O-N 2.92Å; R246-V249 VanDerWaalsContact O-N 3.16Å; R246-V250 HydrophobicContact CG-CG2 4.47Å; R246-V250 PolarHBondContact O-N 3.45Å |
| 247 | Y | 98.2 | Very high | 97.9 | Very high | 136 Ų | 136 | 100.3 Ų | 100.3 | 53% | 0.533 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.3 | -32.4 | 179.8 | -67.8 | -50.7 | 0 | 0 | 0 | 112.8 | S243 L244 V249 V250 V251 | S243-Y247 WeakPolarHBondContact O-CD2 3.38Å; S243-Y247 VanDerWaalsContact O-CG 3.32Å; S243-Y247 PolarHBondContact O-N 2.99Å; L244-Y247 PolarHBondContact O-N 3.33Å; Y247-V249 VanDerWaalsContact C-N 3.31Å; Y247-V249 PolarHBondContact O-N 3.39Å; Y247-V250 PolarHBondContact O-N 3.19Å; Y247-V251 WeakPolarHBondContact O-CB 3.31Å; Y247-V251 WeakPolarHBondContact O-CG2 3.43Å; Y247-V251 PolarHBondContact O-N 3.2Å |
| 248 | R | 98.2 | Very high | 98 | Very high | 185 Ų | 185 | 97.6 Ų | 97.6 | 70% | 0.698 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.1 | -40.7 | 171.4 | -71.7 | 170.1 | -178.8 | 171.4 | -1.9 | 112.4 | L244 T245 R246 K252 | L244-R248 WeakPolarHBondContact O-CG 3.41Å; L244-R248 PolarHBondContact O-N 3.46Å; T245-R248 PolarHBondContact O-N 2.94Å; R246-R248 VanDerWaalsContact C-N 3.31Å; R246-R248 PolarHBondContact O-N 2.97Å; R248-K252 PolarHBondContact O-N 3.2Å |
| 249 | V | 98.4 | Very high | 98 | Very high | 79 Ų | 79 | 96.1 Ų | 96.1 | 48% | 0.479 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.3 | -51.3 | 176.4 | -179.7 | 0 | 0 | 0 | 0 | 110 | R246 Y247 V251 K252 D253 | R246-V249 PolarHBondContact O-N 2.92Å; R246-V249 VanDerWaalsContact O-N 3.16Å; Y247-V249 VanDerWaalsContact C-N 3.31Å; Y247-V249 PolarHBondContact O-N 3.39Å; V249-V251 VanDerWaalsContact C-N 3.33Å; V249-V251 PolarHBondContact O-N 2.87Å; V249-K252 WeakPolarHBondContact O-CA 3.42Å; V249-K252 WeakPolarHBondContact O-CB 3.5Å; V249-K252 PolarHBondContact O-N 3.31Å; V249-D253 WeakPolarHBondContact CG1-OD2 3.37Å; V249-D253 VanDerWaalsContact O-CG 3.28Å; V249-D253 PolarHBondContact O-N 3.28Å |
| 250 | V | 97.9 | Very high | 98.1 | Very high | 54 Ų | 54 | 95.3 Ų | 95.3 | 33% | 0.327 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -56 | -44.9 | 178.6 | 175 | 0 | 0 | 0 | 0 | 112 | R246 Y247 K252 D253 E254 | R246-V250 HydrophobicContact CG-CG2 4.47Å; R246-V250 PolarHBondContact O-N 3.45Å; Y247-V250 PolarHBondContact O-N 3.19Å; V250-K252 VanDerWaalsContact C-N 3.31Å; V250-K252 PolarHBondContact O-N 3.02Å; V250-D253 PolarHBondContact O-N 2.94Å; V250-E254 HydrophobicContact CG1-CG 4.27Å; V250-E254 WeakPolarHBondContact O-CB 3.37Å; V250-E254 VanDerWaalsContact O-CG 3.29Å; V250-E254 WeakPolarHBondContact O-CG 3.33Å; V250-E254 PolarHBondContact O-N 3.11Å |
| 251 | V | 97.4 | Very high | 98.1 | Very high | 92 Ų | 92 | 96.7 Ų | 96.7 | 56% | 0.558 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.7 | -39.7 | 176.7 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | Y247 V249 M255 | Y247-V251 WeakPolarHBondContact O-CB 3.31Å; Y247-V251 WeakPolarHBondContact O-CG2 3.43Å; Y247-V251 PolarHBondContact O-N 3.2Å; V249-V251 VanDerWaalsContact C-N 3.33Å; V249-V251 PolarHBondContact O-N 2.87Å; V251-M255 VanDerWaalsContact O-CG 3.25Å; V251-M255 WeakPolarHBondContact O-CG 3.39Å; V251-M255 PolarHBondContact O-N 3.21Å |
| 252 | K | 98 | Very high | 98.2 | Very high | 136 Ų | 136 | 97.2 Ų | 97.2 | 59% | 0.591 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.5 | -47.4 | 176.6 | -168.1 | -174.9 | 176.2 | -172.1 | 0 | 111.6 | R248 V249 V250 E254 M255 D256 | R248-K252 PolarHBondContact O-N 3.2Å; V249-K252 WeakPolarHBondContact O-CA 3.42Å; V249-K252 WeakPolarHBondContact O-CB 3.5Å; V249-K252 PolarHBondContact O-N 3.31Å; V250-K252 VanDerWaalsContact C-N 3.31Å; V250-K252 PolarHBondContact O-N 3.02Å; K252-E254 VanDerWaalsContact C-N 3.32Å; K252-E254 PolarHBondContact O-N 2.74Å; K252-M255 PolarHBondContact O-N 3.02Å; K252-D256 PolarHBondContact O-N 3.28Å |
| 253 | D | 98.3 | Very high | 98.2 | Very high | 90 Ų | 90 | 99.4 Ų | 99.4 | 48% | 0.481 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.1 | -42 | -179.9 | -61.6 | -22.2 | 0 | 0 | 0 | 111.5 | V249 V250 D256 S257 | V249-D253 WeakPolarHBondContact CG1-OD2 3.37Å; V249-D253 VanDerWaalsContact O-CG 3.28Å; V249-D253 PolarHBondContact O-N 3.28Å; V250-D253 PolarHBondContact O-N 2.94Å; D253-D256 PolarHBondContact O-N 3.47Å; D253-S257 VanDerWaalsContact O-CB 3.23Å; D253-S257 WeakPolarHBondContact O-CB 3.4Å; D253-S257 PolarHBondContact O-N 2.72Å |
| 254 | E | 97.4 | Very high | 98.2 | Very high | 112 Ų | 112 | 102.6 Ų | 102.6 | 52% | 0.523 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.5 | -34.3 | 176.4 | -68.8 | -64.1 | 162.9 | 0 | 0 | 112.8 | V250 K252 S258 | V250-E254 HydrophobicContact CG1-CG 4.27Å; V250-E254 WeakPolarHBondContact O-CB 3.37Å; V250-E254 VanDerWaalsContact O-CG 3.29Å; V250-E254 WeakPolarHBondContact O-CG 3.33Å; V250-E254 PolarHBondContact O-N 3.11Å; K252-E254 VanDerWaalsContact C-N 3.32Å; K252-E254 PolarHBondContact O-N 2.74Å; E254-S258 VanDerWaalsContact O-CB 3.3Å; E254-S258 WeakPolarHBondContact O-CB 3.5Å; E254-S258 PolarHBondContact O-N 3.49Å; E254-S258 PolarHBondContact O-OG 3.26Å |
| 255 | M | 97.8 | Very high | 98.2 | Very high | 99 Ų | 99 | 100.4 Ų | 100.4 | 49% | 0.488 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.8 | -45.4 | 172.6 | -68.5 | -59.6 | 95.5 | 0 | 0 | 111.6 | V251 K252 S257 S258 I259 | V251-M255 VanDerWaalsContact O-CG 3.25Å; V251-M255 WeakPolarHBondContact O-CG 3.39Å; V251-M255 PolarHBondContact O-N 3.21Å; K252-M255 PolarHBondContact O-N 3.02Å; M255-S257 VanDerWaalsContact C-N 3.25Å; M255-S257 PolarHBondContact O-N 3.25Å; M255-S258 PolarHBondContact O-N 3.03Å; M255-I259 VanDerWaalsContact O-CG1 3.3Å; M255-I259 WeakPolarHBondContact O-CG1 3.49Å; M255-I259 PolarHBondContact O-N 3.26Å |
| 256 | D | 98.4 | Very high | 98.2 | Very high | 65 Ų | 65 | 100.9 Ų | 100.9 | 35% | 0.348 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.8 | -33.3 | 175.6 | -75.6 | -23.7 | 0 | 0 | 0 | 111.5 | K252 D253 K260 | K252-D256 PolarHBondContact O-N 3.28Å; D253-D256 PolarHBondContact O-N 3.47Å; D256-K260 VanDerWaalsContact O-CD 3.24Å; D256-K260 WeakPolarHBondContact O-CD 3.38Å; D256-K260 WeakPolarHBondContact O-CE 3.48Å; D256-K260 WeakPolarHBondContact O-CG 3.37Å; D256-K260 PolarHBondContact O-N 3.16Å |
| 257 | S | 98.4 | Very high | 98.3 | Very high | 54 Ų | 54 | 94.9 Ų | 94.9 | 38% | 0.378 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.6 | -49.8 | 170.7 | -172.3 | 0 | 0 | 0 | 0 | 111.7 | D253 M255 I259 K260 T261 | D253-S257 VanDerWaalsContact O-CB 3.23Å; D253-S257 WeakPolarHBondContact O-CB 3.4Å; D253-S257 PolarHBondContact O-N 2.72Å; M255-S257 VanDerWaalsContact C-N 3.25Å; M255-S257 PolarHBondContact O-N 3.25Å; S257-I259 VanDerWaalsContact C-N 3.32Å; S257-I259 PolarHBondContact O-N 3.04Å; S257-K260 PolarHBondContact O-N 3.47Å; S257-K260 VanDerWaalsContact O-N 3.15Å; S257-T261 PolarHBondContact O-N 3.12Å; S257-T261 PolarHBondContact O-OG1 3.34Å; S257-T261 VanDerWaalsContact O-OG1 3.07Å |
| 258 | S | 98.3 | Very high | 98.3 | Very high | 56 Ų | 56 | 93.4 Ų | 93.4 | 39% | 0.392 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.4 | -40.4 | 178.9 | -60.9 | 0 | 0 | 0 | 0 | 112.5 | E254 M255 T261 M262 | E254-S258 VanDerWaalsContact O-CB 3.3Å; E254-S258 WeakPolarHBondContact O-CB 3.5Å; E254-S258 PolarHBondContact O-N 3.49Å; E254-S258 PolarHBondContact O-OG 3.26Å; M255-S258 PolarHBondContact O-N 3.03Å; S258-T261 PolarHBondContact O-N 3.13Å; S258-M262 VanDerWaalsContact O-CB 3.32Å; S258-M262 WeakPolarHBondContact O-CB 3.43Å; S258-M262 PolarHBondContact O-N 2.95Å |
| 259 | I | 98.3 | Very high | 98.3 | Very high | 85 Ų | 85 | 87.9 Ų | 87.9 | 44% | 0.436 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.4 | -39.4 | 177 | -68.9 | 164.1 | 0 | 0 | 0 | 111.4 | M255 S257 K263 | M255-I259 VanDerWaalsContact O-CG1 3.3Å; M255-I259 WeakPolarHBondContact O-CG1 3.49Å; M255-I259 PolarHBondContact O-N 3.26Å; S257-I259 VanDerWaalsContact C-N 3.32Å; S257-I259 PolarHBondContact O-N 3.04Å; I259-K263 HydrophobicContact CG2-CD 4.42Å; I259-K263 WeakPolarHBondContact O-CG 3.46Å; I259-K263 PolarHBondContact O-N 3.5Å; I259-K263 VanDerWaalsContact O-N 3.07Å |
| 260 | K | 98.7 | Very high | 98.2 | Very high | 143 Ų | 143 | 90 Ų | 90 | 62% | 0.622 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.8 | -48.1 | 175.2 | -70.6 | 160.9 | -165.8 | 163.6 | 0 | 110.9 | D256 S257 M262 K263 Q264 | D256-K260 VanDerWaalsContact O-CD 3.24Å; D256-K260 WeakPolarHBondContact O-CD 3.38Å; D256-K260 WeakPolarHBondContact O-CE 3.48Å; D256-K260 WeakPolarHBondContact O-CG 3.37Å; D256-K260 PolarHBondContact O-N 3.16Å; S257-K260 PolarHBondContact O-N 3.47Å; S257-K260 VanDerWaalsContact O-N 3.15Å; K260-M262 PolarHBondContact O-N 2.99Å; K260-K263 PolarHBondContact O-N 3.37Å; K260-Q264 WeakPolarHBondContact O-CB 3.33Å; K260-Q264 PolarHBondContact O-N 3.04Å |
| 261 | T | 98.3 | Very high | 98.3 | Very high | 82 Ų | 82 | 90 Ų | 90 | 50% | 0.503 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.4 | -47.4 | 177.1 | -55.2 | 0 | 0 | 0 | 0 | 111.3 | S257 S258 K263 Q264 T265 | S257-T261 PolarHBondContact O-N 3.12Å; S257-T261 PolarHBondContact O-OG1 3.34Å; S257-T261 VanDerWaalsContact O-OG1 3.07Å; S258-T261 PolarHBondContact O-N 3.13Å; T261-K263 PolarHBondContact O-N 3.14Å; T261-Q264 PolarHBondContact O-N 2.91Å; T261-T265 PolarHBondContact O-N 2.9Å; T261-T265 PolarHBondContact O-OG1 3.35Å; T261-T265 VanDerWaalsContact O-OG1 3.13Å |
| 262 | M | 98.6 | Very high | 98.3 | Very high | 91 Ų | 91 | 89.5 Ų | 89.5 | 45% | 0.448 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -57.2 | -48.6 | 176.8 | -177 | -173.7 | -67.3 | 0 | 0 | 112 | S258 K260 Q264 T265 F266 V363 | S258-M262 VanDerWaalsContact O-CB 3.32Å; S258-M262 WeakPolarHBondContact O-CB 3.43Å; S258-M262 PolarHBondContact O-N 2.95Å; K260-M262 PolarHBondContact O-N 2.99Å; M262-Q264 VanDerWaalsContact C-N 3.34Å; M262-Q264 PolarHBondContact O-N 3.45Å; M262-T265 PolarHBondContact O-N 2.79Å; M262-F266 HydrophobicContact CG-CD2 4.05Å; M262-F266 HydrophobicContact CG-CE2 4.09Å; M262-F266 WeakPolarHBondContact O-CD2 3.45Å; M262-F266 PolarHBondContact O-N 3.1Å; M262-F266 VanDerWaalsContact O-N 3.1Å; M262-V363 HydrophobicContact CE-CG2 3.98Å |
| 263 | K | 98.6 | Very high | 98.3 | Very high | 150 Ų | 150 | 87.7 Ų | 87.7 | 65% | 0.652 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -61.4 | -42 | 177.4 | -74.4 | -179.5 | 177.8 | -171.8 | 0 | 112.3 | I259 K260 T261 F266 A267 | I259-K263 HydrophobicContact CG2-CD 4.42Å; I259-K263 WeakPolarHBondContact O-CG 3.46Å; I259-K263 PolarHBondContact O-N 3.5Å; I259-K263 VanDerWaalsContact O-N 3.07Å; K260-K263 PolarHBondContact O-N 3.37Å; T261-K263 PolarHBondContact O-N 3.14Å; K263-F266 PolarHBondContact O-N 2.7Å; K263-A267 PolarHBondContact O-N 3.44Å |
| 264 | Q | 98.6 | Very high | 98.3 | Very high | 107 Ų | 107 | 88.6 Ų | 88.6 | 50% | 0.5 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62 | -48.6 | 177.5 | -179.2 | 60.1 | 28.6 | 0 | 0 | 111.5 | K260 T261 M262 F266 A267 E268 | K260-Q264 WeakPolarHBondContact O-CB 3.33Å; K260-Q264 PolarHBondContact O-N 3.04Å; T261-Q264 PolarHBondContact O-N 2.91Å; M262-Q264 VanDerWaalsContact C-N 3.34Å; M262-Q264 PolarHBondContact O-N 3.45Å; Q264-F266 VanDerWaalsContact C-N 3.34Å; Q264-F266 PolarHBondContact O-N 2.94Å; Q264-A267 PolarHBondContact O-N 3.41Å; Q264-A267 VanDerWaalsContact O-N 3.13Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.43Å; Q264-E268 PolarHBondContact NE2-OE1 3.13Å; Q264-E268 WeakPolarHBondContact O-CG 3.46Å; Q264-E268 PolarHBondContact O-N 3.35Å |
| 265 | T | 98.5 | Very high | 98.4 | Very high | 45 Ų | 45 | 87.7 Ų | 87.7 | 28% | 0.276 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.5 | -38.4 | 178.4 | -57.7 | 0 | 0 | 0 | 0 | 112.6 | T261 M262 E268 L269 F360 | T261-T265 PolarHBondContact O-N 2.9Å; T261-T265 PolarHBondContact O-OG1 3.35Å; T261-T265 VanDerWaalsContact O-OG1 3.13Å; M262-T265 PolarHBondContact O-N 2.79Å; T265-E268 PolarHBondContact O-N 3.46Å; T265-L269 WeakPolarHBondContact O-CG 3.3Å; T265-L269 PolarHBondContact O-N 3.02Å; T265-F360 HydrophobicContact CG2-CE1 3.96Å; T265-F360 HydrophobicContact CG2-CZ 3.82Å |
| 266 | F | 98.4 | Very high | 98.4 | Very high | 86 Ų | 86 | 88.5 Ų | 88.5 | 38% | 0.377 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -70.2 | -32.9 | 174.8 | -84 | -72.3 | 0 | 0 | 0 | 113.2 | M262 K263 Q264 L269 Q270 F360 | M262-F266 HydrophobicContact CG-CD2 4.05Å; M262-F266 HydrophobicContact CG-CE2 4.09Å; M262-F266 WeakPolarHBondContact O-CD2 3.45Å; M262-F266 PolarHBondContact O-N 3.1Å; M262-F266 VanDerWaalsContact O-N 3.1Å; K263-F266 PolarHBondContact O-N 2.7Å; Q264-F266 VanDerWaalsContact C-N 3.34Å; Q264-F266 PolarHBondContact O-N 2.94Å; F266-L269 HydrophobicContact CD1-CD1 4.28Å; F266-L269 HydrophobicContact CE1-CD1 4.49Å; F266-Q270 VanDerWaalsContact O-CG 3.3Å; F266-Q270 WeakPolarHBondContact O-CG 3.43Å; F266-Q270 PolarHBondContact O-N 3.07Å; F266-F360 HydrophobicContact CE1-CD1 4.07Å; F266-F360 AromaticContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CE1 4.33Å |
| 267 | A | 98.6 | Very high | 98.4 | Very high | 46 Ų | 46 | 91.1 Ų | 91.1 | 38% | 0.38 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.1 | -39 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | K263 Q264 Q270 S271 | K263-A267 PolarHBondContact O-N 3.44Å; Q264-A267 PolarHBondContact O-N 3.41Å; Q264-A267 VanDerWaalsContact O-N 3.13Å; A267-Q270 PolarHBondContact O-N 2.94Å; A267-S271 PolarHBondContact O-N 3.01Å |
| 268 | E | 98.4 | Very high | 98.4 | Very high | 104 Ų | 104 | 92.8 Ų | 92.8 | 49% | 0.486 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 173.9 | -72.8 | 165.6 | -177.7 | 0 | 0 | 112 | Q264 T265 Q270 S271 C272 | Q264-E268 WeakPolarHBondContact CG-OE1 3.43Å; Q264-E268 PolarHBondContact NE2-OE1 3.13Å; Q264-E268 WeakPolarHBondContact O-CG 3.46Å; Q264-E268 PolarHBondContact O-N 3.35Å; T265-E268 PolarHBondContact O-N 3.46Å; E268-Q270 VanDerWaalsContact C-N 3.34Å; E268-Q270 PolarHBondContact O-N 3.23Å; E268-S271 PolarHBondContact O-N 3.46Å; E268-C272 WeakPolarHBondContact O-CB 3.35Å; E268-C272 PolarHBondContact O-N 3.47Å |
| 269 | L | 98 | Very high | 98.4 | Very high | 70 Ų | 70 | 93.3 Ų | 93.3 | 37% | 0.366 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.1 | -38.4 | 173 | -74.2 | 172.7 | 0 | 0 | 0 | 112.4 | T265 F266 C272 L273 F360 | T265-L269 WeakPolarHBondContact O-CG 3.3Å; T265-L269 PolarHBondContact O-N 3.02Å; F266-L269 HydrophobicContact CD1-CD1 4.28Å; F266-L269 HydrophobicContact CE1-CD1 4.49Å; L269-C272 PolarHBondContact O-N 3.29Å; L269-L273 WeakPolarHBondContact O-CG 3.4Å; L269-L273 PolarHBondContact O-N 3.15Å; L269-L273 VanDerWaalsContact O-N 3.16Å; L269-F360 HydrophobicContact CD1-CD1 3.9Å; L269-F360 HydrophobicContact CD1-CE1 3.54Å; L269-F360 HydrophobicContact CD1-CE2 4.43Å; L269-F360 HydrophobicContact CD1-CG 4.49Å; L269-F360 HydrophobicContact CD1-CZ 3.84Å |
| 270 | Q | 98.1 | Very high | 98.4 | Very high | 123 Ų | 123 | 91.8 Ų | 91.8 | 58% | 0.575 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -65 | -44.6 | 174.7 | -74.5 | 169.2 | -4.9 | 0 | 0 | 111.6 | F266 A267 E268 L273 M274 | F266-Q270 VanDerWaalsContact O-CG 3.3Å; F266-Q270 WeakPolarHBondContact O-CG 3.43Å; F266-Q270 PolarHBondContact O-N 3.07Å; A267-Q270 PolarHBondContact O-N 2.94Å; E268-Q270 VanDerWaalsContact C-N 3.34Å; E268-Q270 PolarHBondContact O-N 3.23Å; Q270-L273 PolarHBondContact O-N 2.77Å; Q270-M274 WeakPolarHBondContact O-CG 3.35Å; Q270-M274 PolarHBondContact O-N 2.9Å; Q270-M274 VanDerWaalsContact O-N 3.12Å |
| 271 | S | 98.6 | Very high | 98.3 | Very high | 53 Ų | 53 | 89.9 Ų | 89.9 | 37% | 0.371 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -56.5 | -52.4 | 173.1 | -165.6 | 0 | 0 | 0 | 0 | 110.7 | A267 E268 L273 M274 D275 | A267-S271 PolarHBondContact O-N 3.01Å; E268-S271 PolarHBondContact O-N 3.46Å; S271-L273 PolarHBondContact O-N 3.37Å; S271-L273 VanDerWaalsContact O-N 3.13Å; S271-M274 CarbonylContact O-C 3.58Å; S271-M274 PolarHBondContact O-N 3.47Å; S271-D275 WeakPolarHBondContact O-CB 3.42Å; S271-D275 PolarHBondContact O-N 3.29Å; S271-D275 PolarHBondContact OG-OD2 3.44Å |
| 272 | C | 98.3 | Very high | 98.3 | Very high | 83 Ų | 83 | 90.4 Ų | 90.4 | 56% | 0.561 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -55.6 | -35.6 | -178 | -174.8 | 0 | 0 | 0 | 0 | 113.5 | E268 L269 R276 | E268-C272 WeakPolarHBondContact O-CB 3.35Å; E268-C272 PolarHBondContact O-N 3.47Å; L269-C272 PolarHBondContact O-N 3.29Å; C272-R276 WeakPolarHBondContact O-CB 3.45Å; C272-R276 PolarHBondContact O-N 3.35Å; C272-R276 VanDerWaalsContact O-N 3.14Å |
| 273 | L | 97.8 | Very high | 98.2 | Very high | 97 Ų | 97 | 90.6 Ų | 90.6 | 51% | 0.508 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -71.3 | -44.8 | 174.6 | -70.3 | 171.4 | 0 | 0 | 0 | 112.3 | L269 Q270 S271 R276 E277 | L269-L273 WeakPolarHBondContact O-CG 3.4Å; L269-L273 PolarHBondContact O-N 3.15Å; L269-L273 VanDerWaalsContact O-N 3.16Å; Q270-L273 PolarHBondContact O-N 2.77Å; S271-L273 PolarHBondContact O-N 3.37Å; S271-L273 VanDerWaalsContact O-N 3.13Å; L273-R276 PolarHBondContact O-N 2.71Å; L273-E277 PolarHBondContact O-N 3.22Å |
| 274 | M | 98.5 | Very high | 98 | Very high | 109 Ų | 109 | 86.5 Ų | 86.5 | 54% | 0.537 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64.1 | -42.6 | 176.1 | -66.7 | -176.8 | -66.6 | 0 | 0 | 111.8 | Q270 S271 R276 E277 V278 | Q270-M274 WeakPolarHBondContact O-CG 3.35Å; Q270-M274 PolarHBondContact O-N 2.9Å; Q270-M274 VanDerWaalsContact O-N 3.12Å; S271-M274 CarbonylContact O-C 3.58Å; S271-M274 PolarHBondContact O-N 3.47Å; M274-R276 VanDerWaalsContact C-N 3.28Å; M274-R276 PolarHBondContact O-N 2.9Å; M274-E277 WeakPolarHBondContact O-CB 3.43Å; M274-E277 PolarHBondContact O-N 2.88Å; M274-V278 WeakPolarHBondContact O-CG2 3.3Å; M274-V278 PolarHBondContact O-N 3.13Å |
| 275 | D | 98.6 | Very high | 97.9 | Very high | 93 Ų | 93 | 86 Ų | 86 | 50% | 0.497 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -59.9 | -39.1 | 175.4 | -66.6 | -46.8 | 0 | 0 | 0 | 111 | S271 T279 | S271-D275 WeakPolarHBondContact O-CB 3.42Å; S271-D275 PolarHBondContact O-N 3.29Å; S271-D275 PolarHBondContact OG-OD2 3.44Å; D275-T279 WeakPolarHBondContact O-CB 3.32Å; D275-T279 PolarHBondContact O-N 2.88Å; D275-T279 PolarHBondContact O-OG1 2.95Å |
| 276 | R | 98.1 | Very high | 97.8 | Very high | 116 Ų | 116 | 90.4 Ų | 90.4 | 44% | 0.438 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -71.9 | -36.2 | 175.8 | -175.9 | 56.9 | -175.2 | 137.8 | -4.4 | 112.8 | C272 L273 M274 T279 L280 E283 | C272-R276 WeakPolarHBondContact O-CB 3.45Å; C272-R276 PolarHBondContact O-N 3.35Å; C272-R276 VanDerWaalsContact O-N 3.14Å; L273-R276 PolarHBondContact O-N 2.71Å; M274-R276 VanDerWaalsContact C-N 3.28Å; M274-R276 PolarHBondContact O-N 2.9Å; R276-T279 VanDerWaalsContact NH1-CG2 3.31Å; R276-T279 WeakPolarHBondContact O-CB 3.3Å; R276-T279 PolarHBondContact O-N 3.13Å; R276-L280 HydrophobicContact CG-CD1 4.21Å; R276-L280 WeakPolarHBondContact O-CG 3.38Å; R276-L280 PolarHBondContact O-N 2.92Å; R276-E283 IonicContact CZ-OE2 3.57Å; R276-E283 IonicContact NH1-OE2 2.72Å; R276-E283 PolarHBondContact NH1-OE2 2.97Å; R276-E283 IonicContact NH2-OE2 3.47Å; R276-E283 PolarHBondContact NH2-OE2 3.45Å |
| 277 | E | 97.9 | Very high | 97.7 | Very high | 120 Ų | 120 | 89.7 Ų | 89.7 | 56% | 0.561 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.2 | -51 | 173.8 | 179.6 | 172 | -151.4 | 0 | 0 | 111.3 | L273 M274 T279 L280 L281 | L273-E277 PolarHBondContact O-N 3.22Å; M274-E277 WeakPolarHBondContact O-CB 3.43Å; M274-E277 PolarHBondContact O-N 2.88Å; E277-T279 VanDerWaalsContact C-N 3.26Å; E277-T279 PolarHBondContact O-N 3.47Å; E277-L280 PolarHBondContact O-N 3.07Å; E277-L280 VanDerWaalsContact O-N 3.11Å; E277-L281 HydrophobicContact CG-CD1 4.09Å; E277-L281 WeakPolarHBondContact O-CG 3.21Å; E277-L281 PolarHBondContact O-N 3.19Å |
| 278 | V | 98.7 | Very high | 97.5 | Very high | 90 Ų | 90 | 93.3 Ų | 93.3 | 55% | 0.545 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.3 | -39.6 | 175.3 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | M274 T282 | M274-V278 WeakPolarHBondContact O-CG2 3.3Å; M274-V278 PolarHBondContact O-N 3.13Å; V278-T282 WeakPolarHBondContact O-CB 3.41Å; V278-T282 PolarHBondContact O-N 2.87Å; V278-T282 PolarHBondContact O-OG1 3.35Å |
| 279 | T | 98.5 | Very high | 97.4 | Very high | 66 Ų | 66 | 91.3 Ų | 91.3 | 41% | 0.405 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.3 | -49.2 | 174.3 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | D275 R276 E277 L281 T282 E283 | D275-T279 WeakPolarHBondContact O-CB 3.32Å; D275-T279 PolarHBondContact O-N 2.88Å; D275-T279 PolarHBondContact O-OG1 2.95Å; R276-T279 VanDerWaalsContact NH1-CG2 3.31Å; R276-T279 WeakPolarHBondContact O-CB 3.3Å; R276-T279 PolarHBondContact O-N 3.13Å; E277-T279 VanDerWaalsContact C-N 3.26Å; E277-T279 PolarHBondContact O-N 3.47Å; T279-L281 PolarHBondContact O-N 2.86Å; T279-T282 WeakPolarHBondContact O-CB 3.34Å; T279-T282 PolarHBondContact O-N 3.41Å; T279-E283 HydrophobicContact CG2-CG 4.45Å; T279-E283 WeakPolarHBondContact O-CG 3.4Å; T279-E283 PolarHBondContact O-N 3.17Å |
| 280 | L | 97.7 | Very high | 97.3 | Very high | 53 Ų | 53 | 93.1 Ų | 93.1 | 28% | 0.277 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.3 | -40.4 | -179.7 | -79 | 165.7 | 0 | 0 | 0 | 112.8 | R276 E277 E283 M284 F346 | R276-L280 HydrophobicContact CG-CD1 4.21Å; R276-L280 WeakPolarHBondContact O-CG 3.38Å; R276-L280 PolarHBondContact O-N 2.92Å; E277-L280 PolarHBondContact O-N 3.07Å; E277-L280 VanDerWaalsContact O-N 3.11Å; L280-E283 PolarHBondContact O-N 3.36Å; L280-M284 WeakPolarHBondContact O-CB 3.24Å; L280-M284 PolarHBondContact O-N 2.85Å; L280-F346 HydrophobicContact CD1-CE2 3.98Å; L280-F346 HydrophobicContact CD1-CZ 4.45Å; L280-F346 HydrophobicContact CD2-CE2 4.22Å |
| 281 | L | 97.3 | Very high | 97.1 | Very high | 104 Ų | 104 | 88 Ų | 88 | 55% | 0.545 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63 | -43.9 | 174.6 | -69 | 168.5 | 0 | 0 | 0 | 111 | E277 T279 E283 M284 D285 | E277-L281 HydrophobicContact CG-CD1 4.09Å; E277-L281 WeakPolarHBondContact O-CG 3.21Å; E277-L281 PolarHBondContact O-N 3.19Å; T279-L281 PolarHBondContact O-N 2.86Å; L281-E283 PolarHBondContact O-N 3.07Å; L281-M284 WeakPolarHBondContact O-CB 3.23Å; L281-M284 PolarHBondContact O-N 3.09Å; L281-M284 VanDerWaalsContact O-N 3.17Å; L281-D285 PolarHBondContact O-N 3.19Å |
| 282 | T | 97.8 | Very high | 97 | Very high | 92 Ų | 92 | 90.2 Ų | 90.2 | 56% | 0.564 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 175.9 | -52.2 | 0 | 0 | 0 | 0 | 112.2 | V278 T279 M284 K286 | V278-T282 WeakPolarHBondContact O-CB 3.41Å; V278-T282 PolarHBondContact O-N 2.87Å; V278-T282 PolarHBondContact O-OG1 3.35Å; T279-T282 WeakPolarHBondContact O-CB 3.34Å; T279-T282 PolarHBondContact O-N 3.41Å; T282-M284 VanDerWaalsContact C-N 3.32Å; T282-M284 PolarHBondContact O-N 2.72Å; T282-K286 WeakPolarHBondContact O-CB 3.25Å; T282-K286 PolarHBondContact O-N 3.32Å; T282-K286 VanDerWaalsContact O-N 3.09Å |
| 283 | E | 96.4 | Very high | 97 | Very high | 96 Ų | 96 | 89.1 Ų | 89.1 | 45% | 0.449 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.7 | -39.9 | 173.3 | -71.6 | -179.8 | 113.7 | 0 | 0 | 111.3 | R276 T279 L280 L281 K286 V287 | R276-E283 IonicContact CZ-OE2 3.57Å; R276-E283 IonicContact NH1-OE2 2.72Å; R276-E283 PolarHBondContact NH1-OE2 2.97Å; R276-E283 IonicContact NH2-OE2 3.47Å; R276-E283 PolarHBondContact NH2-OE2 3.45Å; T279-E283 HydrophobicContact CG2-CG 4.45Å; T279-E283 WeakPolarHBondContact O-CG 3.4Å; T279-E283 PolarHBondContact O-N 3.17Å; L280-E283 PolarHBondContact O-N 3.36Å; L281-E283 PolarHBondContact O-N 3.07Å; E283-K286 PolarHBondContact O-N 2.74Å; E283-V287 WeakPolarHBondContact O-CG2 3.49Å; E283-V287 PolarHBondContact O-N 2.84Å |
| 284 | M | 96 | Very high | 97 | Very high | 63 Ų | 63 | 88.6 Ų | 88.6 | 31% | 0.31 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -67.6 | -47 | 179.2 | -165 | 64.1 | 61.6 | 0 | 0 | 112.9 | L280 L281 T282 K286 V287 K288 V344 F346 | L280-M284 WeakPolarHBondContact O-CB 3.24Å; L280-M284 PolarHBondContact O-N 2.85Å; L281-M284 WeakPolarHBondContact O-CB 3.23Å; L281-M284 PolarHBondContact O-N 3.09Å; L281-M284 VanDerWaalsContact O-N 3.17Å; T282-M284 VanDerWaalsContact C-N 3.32Å; T282-M284 PolarHBondContact O-N 2.72Å; M284-K286 VanDerWaalsContact C-N 3.29Å; M284-K286 PolarHBondContact O-N 3.33Å; M284-V287 PolarHBondContact O-N 2.73Å; M284-K288 WeakPolarHBondContact O-CB 3.33Å; M284-K288 PolarHBondContact O-N 3.42Å; M284-V344 HydrophobicContact SD-CG1 3.54Å; M284-V344 VanDerWaalsContact SD-CG1 3.54Å; M284-F346 HydrophobicContact CE-CB 3.96Å |
| 285 | D | 96 | Very high | 96.9 | Very high | 97 Ų | 97 | 86.5 Ų | 86.5 | 52% | 0.519 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.2 | -33.6 | 176.7 | -89.5 | -36.5 | 0 | 0 | 0 | 111.9 | L281 K288 A289 | L281-D285 PolarHBondContact O-N 3.19Å; D285-K288 PolarHBondContact O-N 3.3Å; D285-K288 IonicContact OD1-NZ 3.75Å; D285-A289 WeakPolarHBondContact O-CB 3.46Å; D285-A289 PolarHBondContact O-N 3.17Å |
| 286 | K | 96.4 | Very high | 96.8 | Very high | 138 Ų | 138 | 85.5 Ų | 85.5 | 60% | 0.6 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -62.1 | -50.4 | 170.8 | -175 | -167.7 | 168.7 | -165.7 | 0 | 111.5 | T282 E283 M284 K288 A289 E290 | T282-K286 WeakPolarHBondContact O-CB 3.25Å; T282-K286 PolarHBondContact O-N 3.32Å; T282-K286 VanDerWaalsContact O-N 3.09Å; E283-K286 PolarHBondContact O-N 2.74Å; M284-K286 VanDerWaalsContact C-N 3.29Å; M284-K286 PolarHBondContact O-N 3.33Å; K286-K288 VanDerWaalsContact C-N 3.28Å; K286-K288 PolarHBondContact O-N 3.04Å; K286-A289 PolarHBondContact O-N 2.98Å; K286-E290 WeakPolarHBondContact O-CB 3.25Å; K286-E290 PolarHBondContact O-N 2.85Å |
| 287 | V | 95 | Very high | 96.8 | Very high | 71 Ų | 71 | 81.8 Ų | 81.8 | 43% | 0.43 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.8 | -40 | 179 | 167.9 | 0 | 0 | 0 | 0 | 111.2 | E283 M284 E290 A291 | E283-V287 WeakPolarHBondContact O-CG2 3.49Å; E283-V287 PolarHBondContact O-N 2.84Å; M284-V287 PolarHBondContact O-N 2.73Å; V287-E290 PolarHBondContact O-N 2.84Å; V287-A291 WeakPolarHBondContact O-CB 3.42Å; V287-A291 PolarHBondContact O-N 3.47Å |
| 288 | K | 94.8 | Very high | 96.8 | Very high | 122 Ų | 122 | 77.4 Ų | 77.4 | 53% | 0.53 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62 | -47.2 | 173.8 | 176.7 | -175 | 170.2 | -167.6 | 0 | 112.2 | M284 D285 K286 A291 M292 | M284-K288 WeakPolarHBondContact O-CB 3.33Å; M284-K288 PolarHBondContact O-N 3.42Å; D285-K288 PolarHBondContact O-N 3.3Å; D285-K288 IonicContact OD1-NZ 3.75Å; K286-K288 VanDerWaalsContact C-N 3.28Å; K286-K288 PolarHBondContact O-N 3.04Å; K288-A291 PolarHBondContact O-N 3.4Å; K288-M292 WeakPolarHBondContact O-CG 3.4Å; K288-M292 PolarHBondContact O-N 3.27Å |
| 289 | A | 96.2 | Very high | 96.8 | Very high | 62 Ų | 62 | 78.6 Ų | 78.6 | 51% | 0.512 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.1 | -39.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | D285 K286 M292 A293 | D285-A289 WeakPolarHBondContact O-CB 3.46Å; D285-A289 PolarHBondContact O-N 3.17Å; K286-A289 PolarHBondContact O-N 2.98Å; A289-M292 PolarHBondContact O-N 3.36Å; A289-A293 WeakPolarHBondContact O-CB 3.23Å; A289-A293 PolarHBondContact O-N 3.3Å |
| 290 | E | 95.7 | Very high | 96.8 | Very high | 108 Ų | 108 | 81.6 Ų | 81.6 | 51% | 0.505 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.6 | -45 | 176.4 | -167 | 171.6 | 147.8 | 0 | 0 | 111.5 | K286 V287 A293 I294 | K286-E290 WeakPolarHBondContact O-CB 3.25Å; K286-E290 PolarHBondContact O-N 2.85Å; V287-E290 PolarHBondContact O-N 2.84Å; E290-A293 PolarHBondContact O-N 3.2Å; E290-I294 WeakPolarHBondContact O-CG1 3.5Å; E290-I294 PolarHBondContact O-N 3.45Å |
| 291 | A | 95.7 | Very high | 96.8 | Very high | 14 Ų | 14 | 85.1 Ų | 85.1 | 12% | 0.116 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -62 | -43.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | V287 K288 I294 L295 L340 | V287-A291 WeakPolarHBondContact O-CB 3.42Å; V287-A291 PolarHBondContact O-N 3.47Å; K288-A291 PolarHBondContact O-N 3.4Å; A291-I294 PolarHBondContact O-N 3.48Å; A291-L295 WeakPolarHBondContact O-CG 3.39Å; A291-L295 PolarHBondContact O-N 3.43Å; A291-L295 VanDerWaalsContact O-N 3.16Å; A291-L340 HydrophobicContact CB-CD1 3.83Å; A291-L340 HydrophobicContact CB-CD2 4.4Å; A291-L340 HydrophobicContact CB-CG 4.11Å |
| 292 | M | 96.1 | Very high | 96.9 | Very high | 100 Ų | 100 | 81.9 Ų | 81.9 | 49% | 0.493 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.2 | -44.3 | 174.2 | -72.3 | -57.9 | -54 | 0 | 0 | 111.9 | K288 A289 I294 L295 D296 | K288-M292 WeakPolarHBondContact O-CG 3.4Å; K288-M292 PolarHBondContact O-N 3.27Å; A289-M292 PolarHBondContact O-N 3.36Å; M292-I294 VanDerWaalsContact C-N 3.29Å; M292-I294 PolarHBondContact O-N 3.19Å; M292-L295 PolarHBondContact O-N 3.09Å; M292-L295 VanDerWaalsContact O-N 3.14Å; M292-D296 WeakPolarHBondContact O-CB 3.42Å; M292-D296 PolarHBondContact O-N 3.5Å |
| 293 | A | 97.7 | Very high | 96.9 | Very high | 61 Ų | 61 | 82.3 Ų | 82.3 | 50% | 0.504 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.4 | -34.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | A289 E290 G297 | A289-A293 WeakPolarHBondContact O-CB 3.23Å; A289-A293 PolarHBondContact O-N 3.3Å; E290-A293 PolarHBondContact O-N 3.2Å; A293-G297 PolarHBondContact O-N 3.38Å |
| 294 | I | 96.9 | Very high | 97 | Very high | 86 Ų | 86 | 81.5 Ų | 81.5 | 44% | 0.441 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -65.3 | -47.1 | 173 | -67.8 | 163 | 0 | 0 | 0 | 110.5 | E290 A291 M292 G297 R298 L340 | E290-I294 WeakPolarHBondContact O-CG1 3.5Å; E290-I294 PolarHBondContact O-N 3.45Å; A291-I294 PolarHBondContact O-N 3.48Å; M292-I294 VanDerWaalsContact C-N 3.29Å; M292-I294 PolarHBondContact O-N 3.19Å; I294-G297 PolarHBondContact O-N 2.86Å; I294-R298 VanDerWaalsContact O-CB 3.24Å; I294-R298 WeakPolarHBondContact O-CB 3.27Å; I294-R298 PolarHBondContact O-N 3.21Å; I294-L340 HydrophobicContact CB-CD2 3.97Å; I294-L340 HydrophobicContact CD1-CD2 4.36Å; I294-L340 HydrophobicContact CG2-CD2 3.72Å |
| 295 | L | 96.6 | Very high | 97.1 | Very high | 65 Ų | 65 | 79.4 Ų | 79.4 | 34% | 0.34 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -64.9 | -43.6 | 178.7 | -66.7 | 173.5 | 0 | 0 | 0 | 112 | A291 M292 R298 Q299 D337 L340 | A291-L295 WeakPolarHBondContact O-CG 3.39Å; A291-L295 PolarHBondContact O-N 3.43Å; A291-L295 VanDerWaalsContact O-N 3.16Å; M292-L295 PolarHBondContact O-N 3.09Å; M292-L295 VanDerWaalsContact O-N 3.14Å; L295-R298 CarbonylContact O-C 3.49Å; L295-R298 WeakPolarHBondContact O-CB 3.42Å; L295-R298 PolarHBondContact O-N 2.89Å; L295-R298 VanDerWaalsContact O-N 3.17Å; L295-Q299 PolarHBondContact O-N 3.47Å; L295-D337 HydrophobicContact CD2-CB 4.45Å; L295-L340 HydrophobicContact CD2-CD2 4.25Å; L295-L340 HydrophobicContact CG-CD2 4.14Å |
| 296 | D | 98.1 | Very high | 97.3 | Very high | 71 Ų | 71 | 82.8 Ų | 82.8 | 38% | 0.38 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.7 | -45.2 | 175.2 | -76.5 | -0.8 | 0 | 0 | 0 | 112.1 | M292 R298 Q299 K300 | M292-D296 WeakPolarHBondContact O-CB 3.42Å; M292-D296 PolarHBondContact O-N 3.5Å; D296-R298 PolarHBondContact O-N 3.01Å; D296-Q299 PolarHBondContact O-N 3.16Å; D296-K300 WeakPolarHBondContact O-CD 3.41Å; D296-K300 VanDerWaalsContact O-CG 3.32Å; D296-K300 WeakPolarHBondContact O-CG 3.49Å; D296-K300 PolarHBondContact O-N 2.98Å; D296-K300 VanDerWaalsContact O-N 3.09Å |
| 297 | G | 98.1 | Very high | 97.4 | Very high | 39 Ų | 39 | 81.6 Ų | 81.6 | 40% | 0.402 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.1 | -33.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A293 I294 R301 | A293-G297 PolarHBondContact O-N 3.38Å; I294-G297 PolarHBondContact O-N 2.86Å; G297-R301 PolarHBondContact O-N 2.9Å; G297-R301 VanDerWaalsContact O-N 3.11Å |
| 298 | R | 97.6 | Very high | 97.5 | Very high | 28 Ų | 28 | 80.5 Ų | 80.5 | 11% | 0.106 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -76.9 | -36.6 | 178 | -171.2 | 167.1 | 171.3 | 75.8 | -3.4 | 113.2 | I294 L295 D296 R301 A302 F330 E333 D337 | I294-R298 VanDerWaalsContact O-CB 3.24Å; I294-R298 WeakPolarHBondContact O-CB 3.27Å; I294-R298 PolarHBondContact O-N 3.21Å; L295-R298 CarbonylContact O-C 3.49Å; L295-R298 WeakPolarHBondContact O-CB 3.42Å; L295-R298 PolarHBondContact O-N 2.89Å; L295-R298 VanDerWaalsContact O-N 3.17Å; D296-R298 PolarHBondContact O-N 3.01Å; R298-R301 PolarHBondContact O-N 3.02Å; R298-A302 PolarHBondContact O-N 2.65Å; R298-F330 HydrophobicContact CG-CE2 3.66Å; R298-F330 HydrophobicContact CG-CZ 4.21Å; R298-F330 PolarHBondContact NH2-O 3.44Å; R298-F330 WeakPolarHBondContact O-CE2 3.22Å; R298-E333 IonicContact CZ-OE2 3.32Å; R298-E333 IonicContact NH1-OE2 2.99Å; R298-E333 PolarHBondContact NH1-OE2 2.75Å; R298-E333 VanDerWaalsContact NH2-CB 3.34Å; R298-D337 WeakPolarHBondContact CD-OD1 3.36Å; R298-D337 IonicContact CZ-OD1 3.71Å; R298-D337 IonicContact CZ-OD2 3.98Å; R298-D337 IonicContact NE-OD1 3.39Å; R298-D337 PolarHBondContact NE-OD1 3.43Å; R298-D337 IonicContact NE-OD2 3.66Å; R298-D337 PolarHBondContact NE-OD2 3.22Å; R298-D337 IonicContact NH2-OD1 2.75Å; R298-D337 IonicContact NH2-OD2 3.6Å; R298-D337 PolarHBondContact NH2-OD2 2.98Å |
| 299 | Q | 98.1 | Very high | 97.7 | Very high | 115 Ų | 115 | 77.4 Ų | 77.4 | 54% | 0.537 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.3 | -46.2 | 169.5 | -177.2 | -179.1 | -37.5 | 0 | 0 | 110.5 | L295 D296 R301 A302 E303 | L295-Q299 PolarHBondContact O-N 3.47Å; D296-Q299 PolarHBondContact O-N 3.16Å; Q299-R301 VanDerWaalsContact C-N 3.29Å; Q299-R301 PolarHBondContact O-N 3.2Å; Q299-A302 WeakPolarHBondContact O-CA 3.49Å; Q299-A302 VanDerWaalsContact O-CB 3.27Å; Q299-A302 WeakPolarHBondContact O-CB 3.46Å; Q299-A302 PolarHBondContact O-N 3.42Å; Q299-E303 WeakPolarHBondContact CG-OE1 3.39Å; Q299-E303 PolarHBondContact NE2-OE1 2.96Å; Q299-E303 WeakPolarHBondContact O-CG 3.43Å; Q299-E303 PolarHBondContact O-N 3.49Å |
| 300 | K | 98.7 | Very high | 97.8 | Very high | 129 Ų | 129 | 79.6 Ų | 79.6 | 56% | 0.561 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -59.8 | -37.4 | 176.3 | -69.6 | 160.1 | -170.9 | 160.8 | 0 | 112.5 | D296 E303 E304 | D296-K300 WeakPolarHBondContact O-CD 3.41Å; D296-K300 VanDerWaalsContact O-CG 3.32Å; D296-K300 WeakPolarHBondContact O-CG 3.49Å; D296-K300 PolarHBondContact O-N 2.98Å; D296-K300 VanDerWaalsContact O-N 3.09Å; K300-E303 PolarHBondContact O-N 2.99Å; K300-E304 PolarHBondContact O-N 3.34Å |
| 301 | R | 98.3 | Very high | 97.9 | Very high | 127 Ų | 127 | 77.9 Ų | 77.9 | 48% | 0.479 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 171.4 | -175.7 | -174.3 | -77.4 | 171.6 | -2.9 | 111.8 | G297 R298 Q299 E304 L305 F330 E333 | G297-R301 PolarHBondContact O-N 2.9Å; G297-R301 VanDerWaalsContact O-N 3.11Å; R298-R301 PolarHBondContact O-N 3.02Å; Q299-R301 VanDerWaalsContact C-N 3.29Å; Q299-R301 PolarHBondContact O-N 3.2Å; R301-E304 PolarHBondContact O-N 3.06Å; R301-L305 HydrophobicContact CG-CD1 4.09Å; R301-L305 HydrophobicContact CG-CG 4.47Å; R301-L305 WeakPolarHBondContact O-CB 3.34Å; R301-L305 VanDerWaalsContact O-CG 3.29Å; R301-L305 WeakPolarHBondContact O-CG 3.39Å; R301-L305 PolarHBondContact O-N 3.42Å; R301-F330 HydrophobicContact CB-CE2 4.38Å; R301-F330 HydrophobicContact CG-CD2 4.06Å; R301-F330 HydrophobicContact CG-CE2 4.38Å; R301-E333 IonicContact NH1-OE1 3.87Å; R301-E333 IonicContact NH1-OE2 2.71Å; R301-E333 PolarHBondContact NH1-OE2 3.38Å |
| 302 | A | 98.6 | Very high | 97.9 | Very high | 35 Ų | 35 | 79.4 Ų | 79.4 | 29% | 0.289 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | R298 Q299 R306 F330 | R298-A302 PolarHBondContact O-N 2.65Å; Q299-A302 WeakPolarHBondContact O-CA 3.49Å; Q299-A302 VanDerWaalsContact O-CB 3.27Å; Q299-A302 WeakPolarHBondContact O-CB 3.46Å; Q299-A302 PolarHBondContact O-N 3.42Å; A302-R306 WeakPolarHBondContact O-CB 3.48Å; A302-R306 PolarHBondContact O-N 3.41Å; A302-F330 HydrophobicContact CB-CE1 4.06Å; A302-F330 HydrophobicContact CB-CE2 4.11Å; A302-F330 HydrophobicContact CB-CZ 3.53Å |
| 303 | E | 98.6 | Very high | 98 | Very high | 102 Ų | 102 | 79.9 Ų | 79.9 | 48% | 0.477 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -65 | -41.6 | 177.7 | -71.1 | 167.5 | -176.9 | 0 | 0 | 111.9 | Q299 K300 R306 R307 | Q299-E303 WeakPolarHBondContact CG-OE1 3.39Å; Q299-E303 PolarHBondContact NE2-OE1 2.96Å; Q299-E303 WeakPolarHBondContact O-CG 3.43Å; Q299-E303 PolarHBondContact O-N 3.49Å; K300-E303 PolarHBondContact O-N 2.99Å; E303-R306 PolarHBondContact O-N 3.3Å; E303-R307 WeakPolarHBondContact O-CB 3.31Å; E303-R307 PolarHBondContact O-N 3.5Å |
| 304 | E | 98.5 | Very high | 97.9 | Very high | 79 Ų | 79 | 81.7 Ų | 81.7 | 37% | 0.369 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -70.1 | -42.2 | 175.5 | -180 | 57 | -162.4 | 0 | 0 | 112.6 | K300 R301 R306 R307 L308 | K300-E304 PolarHBondContact O-N 3.34Å; R301-E304 PolarHBondContact O-N 3.06Å; E304-R306 VanDerWaalsContact C-N 3.25Å; E304-R306 PolarHBondContact O-N 3.04Å; E304-R307 WeakPolarHBondContact O-CB 3.47Å; E304-R307 PolarHBondContact O-N 3Å; E304-R307 VanDerWaalsContact O-N 3.13Å; E304-R307 IonicContact OE1-CZ 3.29Å; E304-R307 IonicContact OE1-NE 2.66Å; E304-R307 PolarHBondContact OE1-NE 2.89Å; E304-R307 IonicContact OE1-NH2 3.24Å; E304-R307 PolarHBondContact OE1-NH2 3.41Å; E304-R307 WeakPolarHBondContact OE2-CD 3.31Å; E304-R307 IonicContact OE2-CZ 2.69Å; E304-R307 IonicContact OE2-NE 3.76Å; E304-R307 PolarHBondContact OE2-NE 3.3Å; E304-R307 IonicContact OE2-NH2 3.25Å; E304-L308 HydrophobicContact CG-CD1 4.33Å; E304-L308 WeakPolarHBondContact O-CG 3.45Å; E304-L308 PolarHBondContact O-N 3.41Å |
| 305 | L | 98.6 | Very high | 97.9 | Very high | 18 Ų | 18 | 79.5 Ų | 79.5 | 9% | 0.094 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -61.1 | -36 | 173.6 | -71.9 | 172.2 | 0 | 0 | 0 | 111.8 | R301 T309 L323 D326 I327 F330 | R301-L305 HydrophobicContact CG-CD1 4.09Å; R301-L305 HydrophobicContact CG-CG 4.47Å; R301-L305 WeakPolarHBondContact O-CB 3.34Å; R301-L305 VanDerWaalsContact O-CG 3.29Å; R301-L305 WeakPolarHBondContact O-CG 3.39Å; R301-L305 PolarHBondContact O-N 3.42Å; L305-T309 WeakPolarHBondContact O-CB 3.48Å; L305-T309 PolarHBondContact O-N 3.03Å; L305-T309 PolarHBondContact O-OG1 3.37Å; L305-L323 HydrophobicContact CD2-CD1 4.02Å; L305-D326 HydrophobicContact CD2-CB 3.82Å; L305-I327 HydrophobicContact CB-CG1 4.39Å; L305-I327 HydrophobicContact CD2-CG1 4.35Å; L305-F330 HydrophobicContact CD1-CB 3.71Å; L305-F330 HydrophobicContact CD1-CD1 4.47Å; L305-F330 HydrophobicContact CD1-CD2 4.12Å; L305-F330 HydrophobicContact CD1-CG 3.84Å |
| 306 | R | 98.6 | Very high | 98 | Very high | 169 Ų | 169 | 79 Ų | 79 | 64% | 0.638 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.9 | -48.7 | 170.8 | 179.7 | 173.7 | 176.4 | -94.7 | -19.9 | 111.3 | A302 E303 E304 L308 T309 D310 | A302-R306 WeakPolarHBondContact O-CB 3.48Å; A302-R306 PolarHBondContact O-N 3.41Å; E303-R306 PolarHBondContact O-N 3.3Å; E304-R306 VanDerWaalsContact C-N 3.25Å; E304-R306 PolarHBondContact O-N 3.04Å; R306-L308 VanDerWaalsContact C-N 3.28Å; R306-L308 PolarHBondContact O-N 3.39Å; R306-T309 WeakPolarHBondContact O-CA 3.29Å; R306-T309 WeakPolarHBondContact O-CB 3.45Å; R306-T309 PolarHBondContact O-N 3.14Å; R306-D310 IonicContact CZ-OD2 3.93Å; R306-D310 IonicContact NH2-OD2 3.8Å; R306-D310 PolarHBondContact O-N 3.17Å |
| 307 | R | 98.4 | Very high | 98 | Very high | 113 Ų | 113 | 81 Ų | 81 | 43% | 0.426 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -54.8 | -44.7 | 176.9 | -164.4 | -166.3 | 68.7 | 80.9 | 6 | 111.2 | E303 E304 D310 Q311 | E303-R307 WeakPolarHBondContact O-CB 3.31Å; E303-R307 PolarHBondContact O-N 3.5Å; E304-R307 WeakPolarHBondContact O-CB 3.47Å; E304-R307 PolarHBondContact O-N 3Å; E304-R307 VanDerWaalsContact O-N 3.13Å; E304-R307 IonicContact OE1-CZ 3.29Å; E304-R307 IonicContact OE1-NE 2.66Å; E304-R307 PolarHBondContact OE1-NE 2.89Å; E304-R307 IonicContact OE1-NH2 3.24Å; E304-R307 PolarHBondContact OE1-NH2 3.41Å; E304-R307 WeakPolarHBondContact OE2-CD 3.31Å; E304-R307 IonicContact OE2-CZ 2.69Å; E304-R307 IonicContact OE2-NE 3.76Å; E304-R307 PolarHBondContact OE2-NE 3.3Å; E304-R307 IonicContact OE2-NH2 3.25Å; R307-D310 PolarHBondContact O-N 2.83Å; R307-Q311 VanDerWaalsContact NH1-OE1 3.12Å; R307-Q311 PolarHBondContact O-N 3.45Å; R307-Q311 PolarHBondContact O-NE2 2.86Å |
| 308 | L | 98.3 | Very high | 98 | Very high | 47 Ų | 47 | 85.1 Ų | 85.1 | 25% | 0.246 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -64.3 | -41.2 | 175.3 | -69.8 | 170.8 | 0 | 0 | 0 | 112.1 | E304 R306 D310 Q311 S312 M315 L323 | E304-L308 HydrophobicContact CG-CD1 4.33Å; E304-L308 WeakPolarHBondContact O-CG 3.45Å; E304-L308 PolarHBondContact O-N 3.41Å; R306-L308 VanDerWaalsContact C-N 3.28Å; R306-L308 PolarHBondContact O-N 3.39Å; L308-D310 VanDerWaalsContact C-N 3.31Å; L308-D310 PolarHBondContact O-N 3.48Å; L308-Q311 PolarHBondContact O-N 2.88Å; L308-S312 PolarHBondContact O-N 3.2Å; L308-M315 HydrophobicContact CB-CE 4.07Å; L308-M315 HydrophobicContact CD2-CE 3.87Å; L308-M315 WeakPolarHBondContact O-CE 3.42Å; L308-L323 HydrophobicContact CB-CD1 3.77Å; L308-L323 HydrophobicContact CB-CD2 4.17Å; L308-L323 HydrophobicContact CD1-CD1 4.3Å |
| 309 | T | 98.2 | Very high | 98 | Very high | 57 Ų | 57 | 88.4 Ų | 88.4 | 35% | 0.35 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.8 | -40.8 | 174.5 | -55.6 | 0 | 0 | 0 | 0 | 111.9 | L305 R306 Q311 S312 I327 | L305-T309 WeakPolarHBondContact O-CB 3.48Å; L305-T309 PolarHBondContact O-N 3.03Å; L305-T309 PolarHBondContact O-OG1 3.37Å; R306-T309 WeakPolarHBondContact O-CA 3.29Å; R306-T309 WeakPolarHBondContact O-CB 3.45Å; R306-T309 PolarHBondContact O-N 3.14Å; T309-Q311 PolarHBondContact O-N 3.23Å; T309-S312 WeakPolarHBondContact O-CB 3.23Å; T309-S312 PolarHBondContact O-N 3Å; T309-S312 VanDerWaalsContact O-N 3.1Å; T309-S312 PolarHBondContact O-OG 2.94Å; T309-I327 WeakPolarHBondContact OG1-CD1 3.04Å |
| 310 | D | 98.1 | Very high | 98 | Very high | 108 Ų | 108 | 84.4 Ų | 84.4 | 58% | 0.578 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -65.1 | -19.6 | 176.5 | -63 | -28.7 | 0 | 0 | 0 | 112.6 | R306 R307 L308 | R306-D310 IonicContact CZ-OD2 3.93Å; R306-D310 IonicContact NH2-OD2 3.8Å; R306-D310 PolarHBondContact O-N 3.17Å; R307-D310 PolarHBondContact O-N 2.83Å; L308-D310 VanDerWaalsContact C-N 3.31Å; L308-D310 PolarHBondContact O-N 3.48Å |
| 311 | Q | 97.6 | Very high | 98 | Very high | 73 Ų | 73 | 81.3 Ų | 81.3 | 34% | 0.341 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.4 | -1.9 | 174.9 | -79.5 | 153.8 | 105.4 | 0 | 0 | 114.1 | R307 L308 T309 A313 S314 M315 | R307-Q311 VanDerWaalsContact NH1-OE1 3.12Å; R307-Q311 PolarHBondContact O-N 3.45Å; R307-Q311 PolarHBondContact O-NE2 2.86Å; L308-Q311 PolarHBondContact O-N 2.88Å; T309-Q311 PolarHBondContact O-N 3.23Å; Q311-A313 PolarHBondContact O-N 3.48Å; Q311-S314 PolarHBondContact O-N 3.42Å; Q311-S314 PolarHBondContact O-OG 2.88Å; Q311-M315 HydrophobicContact CB-CE 3.93Å |
| 312 | S | 97 | Very high | 98 | Very high | 46 Ų | 46 | 81.3 Ų | 81.3 | 32% | 0.322 | 44% | 0.436 | S | S | . | . | G | 310 helix | trans | -51.5 | -34.8 | -170.5 | 53.5 | 0 | 0 | 0 | 0 | 115.1 | L308 T309 S314 M315 | L308-S312 PolarHBondContact O-N 3.2Å; T309-S312 WeakPolarHBondContact O-CB 3.23Å; T309-S312 PolarHBondContact O-N 3Å; T309-S312 VanDerWaalsContact O-N 3.1Å; T309-S312 PolarHBondContact O-OG 2.94Å; S312-S314 PolarHBondContact O-N 3.16Å; S312-M315 PolarHBondContact O-N 3.07Å; S312-M315 VanDerWaalsContact O-N 3.13Å |
| 313 | A | 96.8 | Very high | 98 | Very high | 110 Ų | 110 | 80.4 Ų | 80.4 | 91% | 0.909 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -64.1 | -10.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | Q311 | Q311-A313 PolarHBondContact O-N 3.48Š|
| 314 | S | 96.8 | Very high | 98 | Very high | 98 Ų | 98 | 81.6 Ų | 81.6 | 69% | 0.685 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -109.5 | 0.8 | 176.4 | 63.9 | 0 | 0 | 0 | 0 | 114.5 | Q311 S312 | Q311-S314 PolarHBondContact O-N 3.42Å; Q311-S314 PolarHBondContact O-OG 2.88Å; S312-S314 PolarHBondContact O-N 3.16Å |
| 315 | M | 97.2 | Very high | 98 | Very high | 41 Ų | 41 | 80.5 Ų | 80.5 | 20% | 0.202 | 43% | 0.431 | C | S | . | . | S | Bend | trans | -90.8 | 156.5 | -176.7 | -66.7 | -178.7 | 178.6 | 0 | 0 | 112.3 | L308 Q311 S312 Q319 L320 L323 | L308-M315 HydrophobicContact CB-CE 4.07Å; L308-M315 HydrophobicContact CD2-CE 3.87Å; L308-M315 WeakPolarHBondContact O-CE 3.42Å; Q311-M315 HydrophobicContact CB-CE 3.93Å; S312-M315 PolarHBondContact O-N 3.07Å; S312-M315 VanDerWaalsContact O-N 3.13Å; M315-Q319 HydrophobicContact CB-CB 4.04Å; M315-L320 HydrophobicContact CB-CD2 3.91Å; M315-L320 HydrophobicContact CB-CG 3.93Å; M315-L320 HydrophobicContact SD-CD2 4.12Å; M315-L323 HydrophobicContact CE-CD2 4.46Å; M315-L323 HydrophobicContact SD-CD2 3.99Å |
| 316 | S | 98.1 | Very high | 98 | Very high | 53 Ų | 53 | 83.4 Ų | 83.4 | 37% | 0.371 | 45% | 0.446 | S | S | . | . | trans | -73.1 | 158.7 | 167.5 | 73.3 | 0 | 0 | 0 | 0 | 111.3 | D318 Q319 L320 | S316-D318 PolarHBondContact O-N 2.88Å; S316-Q319 WeakPolarHBondContact O-CB 3.11Å; S316-Q319 PolarHBondContact O-N 3.34Å; S316-Q319 VanDerWaalsContact O-N 3.13Å; S316-Q319 WeakPolarHBondContact OG-CG 3.42Å; S316-Q319 PolarHBondContact OG-N 2.98Å; S316-L320 WeakPolarHBondContact O-CG 3.24Å; S316-L320 PolarHBondContact O-N 3.27Å | ||
| 317 | E | 97.9 | Very high | 98 | Very high | 113 Ų | 113 | 78.1 Ų | 78.1 | 53% | 0.528 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.9 | -29.3 | 178.1 | -178.6 | 56.3 | -162.1 | 0 | 0 | 112.5 | L320 S321 R324 | E317-L320 PolarHBondContact O-N 3.23Å; E317-S321 WeakPolarHBondContact O-CB 3.37Å; E317-S321 PolarHBondContact O-N 3.37Å; E317-R324 IonicContact OE1-CZ 3.36Å; E317-R324 IonicContact OE1-NH1 2.67Å; E317-R324 PolarHBondContact OE1-NH1 2.78Å; E317-R324 IonicContact OE1-NH2 3.1Å; E317-R324 PolarHBondContact OE1-NH2 3.14Å; E317-R324 VanDerWaalsContact OE1-NH2 3.1Å; E317-R324 IonicContact OE2-CZ 3.76Å; E317-R324 IonicContact OE2-NH1 3.77Å; E317-R324 IonicContact OE2-NH2 2.84Å; E317-R324 PolarHBondContact OE2-NH2 3.46Å |
| 318 | D | 97.9 | Very high | 98 | Very high | 126 Ų | 126 | 80.5 Ų | 80.5 | 67% | 0.674 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.2 | -48.8 | 171.8 | -58.1 | -50.6 | 0 | 0 | 0 | 111.3 | S316 L320 S321 E322 | S316-D318 PolarHBondContact O-N 2.88Å; D318-L320 VanDerWaalsContact C-N 3.31Å; D318-L320 PolarHBondContact O-N 3.07Å; D318-S321 WeakPolarHBondContact O-CA 3.33Å; D318-S321 WeakPolarHBondContact O-CB 3.25Å; D318-S321 PolarHBondContact O-N 3.46Å; D318-S321 PolarHBondContact O-OG 2.86Å; D318-E322 PolarHBondContact O-N 3.41Å |
| 319 | Q | 98.2 | Very high | 98 | Very high | 98 Ų | 98 | 83 Ų | 83 | 46% | 0.458 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.6 | -37.2 | 175.7 | -72.1 | 172.5 | -28.4 | 0 | 0 | 111.9 | M315 S316 S321 E322 L323 | M315-Q319 HydrophobicContact CB-CB 4.04Å; S316-Q319 WeakPolarHBondContact O-CB 3.11Å; S316-Q319 PolarHBondContact O-N 3.34Å; S316-Q319 VanDerWaalsContact O-N 3.13Å; S316-Q319 WeakPolarHBondContact OG-CG 3.42Å; S316-Q319 PolarHBondContact OG-N 2.98Å; Q319-S321 VanDerWaalsContact C-N 3.33Å; Q319-E322 PolarHBondContact O-N 3.46Å; Q319-L323 WeakPolarHBondContact O-CB 3.17Å; Q319-L323 PolarHBondContact O-N 3.05Å |
| 320 | L | 98.5 | Very high | 98 | Very high | 31 Ų | 31 | 82.3 Ų | 82.3 | 16% | 0.162 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -67 | -34.6 | 173 | -67 | 174.2 | 0 | 0 | 0 | 111.7 | M315 S316 E317 D318 R324 | M315-L320 HydrophobicContact CB-CD2 3.91Å; M315-L320 HydrophobicContact CB-CG 3.93Å; M315-L320 HydrophobicContact SD-CD2 4.12Å; S316-L320 WeakPolarHBondContact O-CG 3.24Å; S316-L320 PolarHBondContact O-N 3.27Å; E317-L320 PolarHBondContact O-N 3.23Å; D318-L320 VanDerWaalsContact C-N 3.31Å; D318-L320 PolarHBondContact O-N 3.07Å; L320-R324 WeakPolarHBondContact O-CB 3.31Å; L320-R324 WeakPolarHBondContact O-CD 3.27Å; L320-R324 WeakPolarHBondContact O-CG 3.47Å; L320-R324 PolarHBondContact O-N 3.11Å; L320-R324 PolarHBondContact O-NE 2.83Å |
| 321 | S | 98.5 | Very high | 98 | Very high | 63 Ų | 63 | 80.1 Ų | 80.1 | 44% | 0.441 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -65.7 | -40.1 | 174.3 | 86.2 | 0 | 0 | 0 | 0 | 112.1 | E317 D318 Q319 A325 | E317-S321 WeakPolarHBondContact O-CB 3.37Å; E317-S321 PolarHBondContact O-N 3.37Å; D318-S321 WeakPolarHBondContact O-CA 3.33Å; D318-S321 WeakPolarHBondContact O-CB 3.25Å; D318-S321 PolarHBondContact O-N 3.46Å; D318-S321 PolarHBondContact O-OG 2.86Å; Q319-S321 VanDerWaalsContact C-N 3.33Å; S321-A325 PolarHBondContact O-N 2.84Å; S321-A325 VanDerWaalsContact O-N 3.12Å |
| 322 | E | 98.2 | Very high | 98 | Very high | 128 Ų | 128 | 80.6 Ų | 80.6 | 60% | 0.598 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -66.5 | -50.2 | 175.8 | -173.4 | 169.5 | -143.2 | 0 | 0 | 111.2 | D318 Q319 R324 A325 D326 | D318-E322 PolarHBondContact O-N 3.41Å; Q319-E322 PolarHBondContact O-N 3.46Å; E322-R324 VanDerWaalsContact C-N 3.31Å; E322-R324 PolarHBondContact O-N 3.25Å; E322-A325 CarbonylContact O-C 3.6Å; E322-A325 WeakPolarHBondContact O-CA 3.42Å; E322-A325 WeakPolarHBondContact O-CB 3.34Å; E322-A325 PolarHBondContact O-N 3.33Å; E322-D326 PolarHBondContact O-N 3.13Å |
| 323 | L | 98.6 | Very high | 98 | Very high | 15 Ų | 15 | 80.2 Ų | 80.2 | 8% | 0.079 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -58.3 | -40 | 176.6 | 179.6 | 60.4 | 0 | 0 | 0 | 112.5 | L305 L308 M315 Q319 A325 D326 I327 | L305-L323 HydrophobicContact CD2-CD1 4.02Å; L308-L323 HydrophobicContact CB-CD1 3.77Å; L308-L323 HydrophobicContact CB-CD2 4.17Å; L308-L323 HydrophobicContact CD1-CD1 4.3Å; M315-L323 HydrophobicContact CE-CD2 4.46Å; M315-L323 HydrophobicContact SD-CD2 3.99Å; Q319-L323 WeakPolarHBondContact O-CB 3.17Å; Q319-L323 PolarHBondContact O-N 3.05Å; L323-A325 VanDerWaalsContact C-N 3.3Å; L323-A325 PolarHBondContact O-N 3.2Å; L323-D326 PolarHBondContact O-N 3.23Å; L323-I327 HydrophobicContact CD1-CD1 3.91Å; L323-I327 HydrophobicContact CD1-CG1 4.2Å; L323-I327 HydrophobicContact CG-CD1 3.9Å; L323-I327 WeakPolarHBondContact O-CB 3.03Å; L323-I327 WeakPolarHBondContact O-CD1 3.47Å; L323-I327 VanDerWaalsContact O-CG1 3.24Å; L323-I327 WeakPolarHBondContact O-CG1 3.48Å; L323-I327 PolarHBondContact O-N 3.45Å |
| 324 | R | 98.6 | Very high | 98 | Very high | 127 Ų | 127 | 81.4 Ų | 81.4 | 48% | 0.479 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -64.3 | -34.7 | 173.7 | -69.2 | 162.2 | -157.7 | 152.1 | 0.7 | 111.8 | E317 L320 E322 K328 | E317-R324 IonicContact OE1-CZ 3.36Å; E317-R324 IonicContact OE1-NH1 2.67Å; E317-R324 PolarHBondContact OE1-NH1 2.78Å; E317-R324 IonicContact OE1-NH2 3.1Å; E317-R324 PolarHBondContact OE1-NH2 3.14Å; E317-R324 VanDerWaalsContact OE1-NH2 3.1Å; E317-R324 IonicContact OE2-CZ 3.76Å; E317-R324 IonicContact OE2-NH1 3.77Å; E317-R324 IonicContact OE2-NH2 2.84Å; E317-R324 PolarHBondContact OE2-NH2 3.46Å; L320-R324 WeakPolarHBondContact O-CB 3.31Å; L320-R324 WeakPolarHBondContact O-CD 3.27Å; L320-R324 WeakPolarHBondContact O-CG 3.47Å; L320-R324 PolarHBondContact O-N 3.11Å; L320-R324 PolarHBondContact O-NE 2.83Å; E322-R324 VanDerWaalsContact C-N 3.31Å; E322-R324 PolarHBondContact O-N 3.25Å; R324-K328 VanDerWaalsContact O-CB 3.3Å; R324-K328 WeakPolarHBondContact O-CB 3.4Å; R324-K328 PolarHBondContact O-N 3.12Å |
| 325 | A | 98.7 | Very high | 97.9 | Very high | 56 Ų | 56 | 83.3 Ų | 83.3 | 46% | 0.463 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -71.2 | -43.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S321 E322 L323 K328 H329 | S321-A325 PolarHBondContact O-N 2.84Å; S321-A325 VanDerWaalsContact O-N 3.12Å; E322-A325 CarbonylContact O-C 3.6Å; E322-A325 WeakPolarHBondContact O-CA 3.42Å; E322-A325 WeakPolarHBondContact O-CB 3.34Å; E322-A325 PolarHBondContact O-N 3.33Å; L323-A325 VanDerWaalsContact C-N 3.3Å; L323-A325 PolarHBondContact O-N 3.2Å; A325-K328 WeakPolarHBondContact O-CB 3.18Å; A325-K328 PolarHBondContact O-N 2.9Å; A325-H329 PolarHBondContact O-N 2.97Å |
| 326 | D | 98.5 | Very high | 97.8 | Very high | 79 Ų | 79 | 88.3 Ų | 88.3 | 42% | 0.422 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.9 | -44.4 | 177.5 | -84.7 | -9.9 | 0 | 0 | 0 | 112.6 | L305 E322 L323 K328 H329 F330 | L305-D326 HydrophobicContact CD2-CB 3.82Å; E322-D326 PolarHBondContact O-N 3.13Å; L323-D326 PolarHBondContact O-N 3.23Å; D326-K328 VanDerWaalsContact C-N 3.28Å; D326-K328 PolarHBondContact O-N 3.44Å; D326-H329 PolarHBondContact O-N 2.91Å; D326-F330 WeakPolarHBondContact O-CB 3.37Å; D326-F330 PolarHBondContact O-N 2.98Å |
| 327 | I | 98.6 | Very high | 97.6 | Very high | 59 Ų | 59 | 87.7 Ų | 87.7 | 30% | 0.303 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.6 | -42.2 | 174 | -69 | 166.7 | 0 | 0 | 0 | 110.3 | L305 T309 L323 V331 | L305-I327 HydrophobicContact CB-CG1 4.39Å; L305-I327 HydrophobicContact CD2-CG1 4.35Å; T309-I327 WeakPolarHBondContact OG1-CD1 3.04Å; L323-I327 HydrophobicContact CD1-CD1 3.91Å; L323-I327 HydrophobicContact CD1-CG1 4.2Å; L323-I327 HydrophobicContact CG-CD1 3.9Å; L323-I327 WeakPolarHBondContact O-CB 3.03Å; L323-I327 WeakPolarHBondContact O-CD1 3.47Å; L323-I327 VanDerWaalsContact O-CG1 3.24Å; L323-I327 WeakPolarHBondContact O-CG1 3.48Å; L323-I327 PolarHBondContact O-N 3.45Å; I327-V331 WeakPolarHBondContact O-CB 3.35Å; I327-V331 VanDerWaalsContact O-CG2 3.29Å; I327-V331 WeakPolarHBondContact O-CG2 3.31Å; I327-V331 PolarHBondContact O-N 3.1Å |
| 328 | K | 98.4 | Very high | 97.4 | Very high | 162 Ų | 162 | 87.3 Ų | 87.3 | 70% | 0.704 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.2 | -41.5 | 176.2 | -178.5 | -177.4 | 177.4 | -175.5 | 0 | 111.9 | R324 A325 D326 S332 | R324-K328 VanDerWaalsContact O-CB 3.3Å; R324-K328 WeakPolarHBondContact O-CB 3.4Å; R324-K328 PolarHBondContact O-N 3.12Å; A325-K328 WeakPolarHBondContact O-CB 3.18Å; A325-K328 PolarHBondContact O-N 2.9Å; D326-K328 VanDerWaalsContact C-N 3.28Å; D326-K328 PolarHBondContact O-N 3.44Å; K328-S332 WeakPolarHBondContact O-CB 3.28Å; K328-S332 PolarHBondContact O-N 3.09Å |
| 329 | H | 98.3 | Very high | 97.2 | Very high | 100 Ų | 100 | 84.6 Ų | 84.6 | 46% | 0.463 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -64.1 | -51 | 176.2 | 178.4 | 23 | 0 | 0 | 0 | 111.1 | A325 D326 V331 S332 E333 | A325-H329 PolarHBondContact O-N 2.97Å; D326-H329 PolarHBondContact O-N 2.91Å; H329-V331 VanDerWaalsContact C-N 3.32Å; H329-V331 PolarHBondContact O-N 3.03Å; H329-S332 WeakPolarHBondContact O-CB 3.42Å; H329-S332 PolarHBondContact O-N 3.45Å; H329-S332 PolarHBondContact O-OG 3.37Å; H329-E333 IonicContact CE1-OE1 3.54Å; H329-E333 IonicContact NE2-OE1 2.78Å; H329-E333 PolarHBondContact O-N 2.93Å; H329-E333 VanDerWaalsContact O-N 3.17Å |
| 330 | F | 98.4 | Very high | 97 | Very high | 42 Ų | 42 | 81.8 Ų | 81.8 | 18% | 0.184 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -52.6 | -47.3 | 175.9 | 176.9 | -94.4 | 0 | 0 | 0 | 112.3 | R298 R301 A302 L305 D326 S332 E333 | R298-F330 HydrophobicContact CG-CE2 3.66Å; R298-F330 HydrophobicContact CG-CZ 4.21Å; R298-F330 PolarHBondContact NH2-O 3.44Å; R298-F330 WeakPolarHBondContact O-CE2 3.22Å; R301-F330 HydrophobicContact CB-CE2 4.38Å; R301-F330 HydrophobicContact CG-CD2 4.06Å; R301-F330 HydrophobicContact CG-CE2 4.38Å; A302-F330 HydrophobicContact CB-CE1 4.06Å; A302-F330 HydrophobicContact CB-CE2 4.11Å; A302-F330 HydrophobicContact CB-CZ 3.53Å; L305-F330 HydrophobicContact CD1-CB 3.71Å; L305-F330 HydrophobicContact CD1-CD1 4.47Å; L305-F330 HydrophobicContact CD1-CD2 4.12Å; L305-F330 HydrophobicContact CD1-CG 3.84Å; D326-F330 WeakPolarHBondContact O-CB 3.37Å; D326-F330 PolarHBondContact O-N 2.98Å; F330-S332 VanDerWaalsContact C-N 3.35Å; F330-S332 PolarHBondContact O-N 3.19Å; F330-E333 PolarHBondContact O-N 3.46Å |
| 331 | V | 98.2 | Very high | 96.5 | Very high | 63 Ų | 63 | 83.3 Ų | 83.3 | 38% | 0.382 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -66.5 | -34.7 | 177.9 | 170.5 | 0 | 0 | 0 | 0 | 112.2 | I327 H329 E333 R334 | I327-V331 WeakPolarHBondContact O-CB 3.35Å; I327-V331 VanDerWaalsContact O-CG2 3.29Å; I327-V331 WeakPolarHBondContact O-CG2 3.31Å; I327-V331 PolarHBondContact O-N 3.1Å; H329-V331 VanDerWaalsContact C-N 3.32Å; H329-V331 PolarHBondContact O-N 3.03Å; V331-E333 VanDerWaalsContact C-N 3.29Å; V331-E333 PolarHBondContact O-N 3.27Å; V331-R334 WeakPolarHBondContact O-CB 3.47Å; V331-R334 PolarHBondContact O-N 3.15Å |
| 332 | S | 97.4 | Very high | 96.1 | Very high | 82 Ų | 82 | 85.3 Ų | 85.3 | 57% | 0.573 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -66.2 | -29.8 | 177.5 | 75 | 0 | 0 | 0 | 0 | 113.4 | K328 H329 F330 R334 | K328-S332 WeakPolarHBondContact O-CB 3.28Å; K328-S332 PolarHBondContact O-N 3.09Å; H329-S332 WeakPolarHBondContact O-CB 3.42Å; H329-S332 PolarHBondContact O-N 3.45Å; H329-S332 PolarHBondContact O-OG 3.37Å; F330-S332 VanDerWaalsContact C-N 3.35Å; F330-S332 PolarHBondContact O-N 3.19Å; S332-R334 PolarHBondContact O-N 3.47Å |
| 333 | E | 96.6 | Very high | 95.1 | Very high | 38 Ų | 38 | 81.9 Ų | 81.9 | 18% | 0.178 | 42% | 0.421 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -9.6 | 178.7 | -70.5 | 177 | 129 | 0 | 0 | 113.8 | R298 R301 H329 F330 V331 K335 F336 | R298-E333 IonicContact CZ-OE2 3.32Å; R298-E333 IonicContact NH1-OE2 2.99Å; R298-E333 PolarHBondContact NH1-OE2 2.75Å; R298-E333 VanDerWaalsContact NH2-CB 3.34Å; R301-E333 IonicContact NH1-OE1 3.87Å; R301-E333 IonicContact NH1-OE2 2.71Å; R301-E333 PolarHBondContact NH1-OE2 3.38Å; H329-E333 IonicContact CE1-OE1 3.54Å; H329-E333 IonicContact NE2-OE1 2.78Å; H329-E333 PolarHBondContact O-N 2.93Å; H329-E333 VanDerWaalsContact O-N 3.17Å; F330-E333 PolarHBondContact O-N 3.46Å; V331-E333 VanDerWaalsContact C-N 3.29Å; V331-E333 PolarHBondContact O-N 3.27Å; E333-K335 PolarHBondContact O-N 3.04Å; E333-F336 HydrophobicContact CB-CD2 4.08Å; E333-F336 HydrophobicContact CG-CD2 4.36Å; E333-F336 WeakPolarHBondContact O-CB 3.3Å; E333-F336 WeakPolarHBondContact O-CD2 3.37Å; E333-F336 PolarHBondContact O-N 3.18Å |
| 334 | R | 95.9 | Very high | 94 | Very high | 136 Ų | 136 | 85 Ų | 85 | 51% | 0.513 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -48.7 | -34.5 | -173.2 | -177.6 | 179.8 | -65.5 | 117.3 | -0.1 | 114.6 | V331 S332 F336 D337 E338 | V331-R334 WeakPolarHBondContact O-CB 3.47Å; V331-R334 PolarHBondContact O-N 3.15Å; S332-R334 PolarHBondContact O-N 3.47Å; R334-F336 VanDerWaalsContact C-N 3.25Å; R334-F336 PolarHBondContact O-N 2.83Å; R334-D337 WeakPolarHBondContact CA-OD2 3.31Å; R334-D337 VanDerWaalsContact O-CB 3.31Å; R334-D337 WeakPolarHBondContact O-CB 3.45Å; R334-D337 PolarHBondContact O-N 3.37Å; R334-D337 VanDerWaalsContact O-N 3.1Å; R334-E338 PolarHBondContact O-N 3.04Å |
| 335 | K | 95 | Very high | 93.2 | Very high | 137 Ų | 137 | 86 Ų | 86 | 60% | 0.596 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -59.6 | -36 | 178.8 | -173.9 | -178 | 172.9 | -169.8 | 0 | 112.5 | E333 D337 E338 D339 | E333-K335 PolarHBondContact O-N 3.04Å; K335-D337 VanDerWaalsContact C-N 3.26Å; K335-D337 PolarHBondContact O-N 3.38Å; K335-E338 PolarHBondContact O-N 3.45Å; K335-D339 WeakPolarHBondContact CE-OD2 3.5Å; K335-D339 WeakPolarHBondContact O-CB 3.29Å; K335-D339 PolarHBondContact O-N 3.17Å |
| 336 | F | 95.4 | Very high | 92.9 | Very high | 146 Ų | 146 | 89 Ų | 89 | 64% | 0.64 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.8 | -32.5 | 177.7 | -60.8 | -64.3 | 0 | 0 | 0 | 111.8 | E333 R334 D339 L340 | E333-F336 HydrophobicContact CB-CD2 4.08Å; E333-F336 HydrophobicContact CG-CD2 4.36Å; E333-F336 WeakPolarHBondContact O-CB 3.3Å; E333-F336 WeakPolarHBondContact O-CD2 3.37Å; E333-F336 PolarHBondContact O-N 3.18Å; R334-F336 VanDerWaalsContact C-N 3.25Å; R334-F336 PolarHBondContact O-N 2.83Å; F336-D339 PolarHBondContact O-N 2.94Å; F336-L340 WeakPolarHBondContact O-CB 3.38Å; F336-L340 PolarHBondContact O-N 2.69Å |
| 337 | D | 94.8 | Very high | 92.7 | Very high | 41 Ų | 41 | 90.9 Ų | 90.9 | 22% | 0.219 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -65.7 | -46.8 | 177.2 | -49.9 | -32.6 | 0 | 0 | 0 | 110.9 | L295 R298 R334 K335 D339 G341 | L295-D337 HydrophobicContact CD2-CB 4.45Å; R298-D337 WeakPolarHBondContact CD-OD1 3.36Å; R298-D337 IonicContact CZ-OD1 3.71Å; R298-D337 IonicContact CZ-OD2 3.98Å; R298-D337 IonicContact NE-OD1 3.39Å; R298-D337 PolarHBondContact NE-OD1 3.43Å; R298-D337 IonicContact NE-OD2 3.66Å; R298-D337 PolarHBondContact NE-OD2 3.22Å; R298-D337 IonicContact NH2-OD1 2.75Å; R298-D337 IonicContact NH2-OD2 3.6Å; R298-D337 PolarHBondContact NH2-OD2 2.98Å; R334-D337 WeakPolarHBondContact CA-OD2 3.31Å; R334-D337 VanDerWaalsContact O-CB 3.31Å; R334-D337 WeakPolarHBondContact O-CB 3.45Å; R334-D337 PolarHBondContact O-N 3.37Å; R334-D337 VanDerWaalsContact O-N 3.1Å; K335-D337 VanDerWaalsContact C-N 3.26Å; K335-D337 PolarHBondContact O-N 3.38Å; D337-D339 VanDerWaalsContact C-N 3.35Å; D337-G341 PolarHBondContact O-N 2.89Å |
| 338 | E | 93.5 | Very high | 92.5 | Very high | 104 Ų | 104 | 94.8 Ų | 94.8 | 49% | 0.486 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.2 | -40.3 | 176.7 | -61.5 | -178.2 | -150.5 | 0 | 0 | 112 | R334 K335 K342 | R334-E338 PolarHBondContact O-N 3.04Å; K335-E338 PolarHBondContact O-N 3.45Å; E338-K342 WeakPolarHBondContact O-CD 3.39Å; E338-K342 WeakPolarHBondContact O-CE 3.4Å; E338-K342 WeakPolarHBondContact O-CG 3.42Å; E338-K342 PolarHBondContact O-N 2.77Å; E338-K342 PolarHBondContact O-NZ 2.98Å; E338-K342 IonicContact OE2-NZ 3.39Å; E338-K342 PolarHBondContact OE2-NZ 2.77Å |
| 339 | D | 93.6 | Very high | 92.3 | Very high | 70 Ų | 70 | 94.6 Ų | 94.6 | 37% | 0.374 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -75.5 | -33.4 | -178.7 | -70.7 | -15.7 | 0 | 0 | 0 | 111.8 | K335 F336 D337 K342 A343 | K335-D339 WeakPolarHBondContact CE-OD2 3.5Å; K335-D339 WeakPolarHBondContact O-CB 3.29Å; K335-D339 PolarHBondContact O-N 3.17Å; F336-D339 PolarHBondContact O-N 2.94Å; D337-D339 VanDerWaalsContact C-N 3.35Å; D339-K342 CarbonylContact O-C 3.59Å; D339-K342 PolarHBondContact O-N 2.84Å; D339-K342 VanDerWaalsContact O-N 3.14Å; D339-K342 IonicContact OD1-NZ 3.07Å; D339-K342 PolarHBondContact OD1-NZ 2.92Å; D339-A343 PolarHBondContact O-N 3.5Å; D339-A343 VanDerWaalsContact O-N 3.15Å |
| 340 | L | 93.6 | Very high | 92.2 | Very high | 39 Ų | 39 | 93.5 Ų | 93.5 | 20% | 0.204 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -62.3 | -45 | 170 | -178.6 | 64 | 0 | 0 | 0 | 111.4 | A291 I294 L295 F336 K342 A343 | A291-L340 HydrophobicContact CB-CD1 3.83Å; A291-L340 HydrophobicContact CB-CD2 4.4Å; A291-L340 HydrophobicContact CB-CG 4.11Å; I294-L340 HydrophobicContact CB-CD2 3.97Å; I294-L340 HydrophobicContact CD1-CD2 4.36Å; I294-L340 HydrophobicContact CG2-CD2 3.72Å; L295-L340 HydrophobicContact CD2-CD2 4.25Å; L295-L340 HydrophobicContact CG-CD2 4.14Å; F336-L340 WeakPolarHBondContact O-CB 3.38Å; F336-L340 PolarHBondContact O-N 2.69Å; L340-K342 PolarHBondContact O-N 3.48Å; L340-K342 VanDerWaalsContact O-N 3.11Å; L340-A343 VanDerWaalsContact O-CB 3.28Å; L340-A343 WeakPolarHBondContact O-CB 3.43Å; L340-A343 PolarHBondContact O-N 3.47Å |
| 341 | G | 88.3 | Confident | 92.2 | Very high | 63 Ų | 63 | 96.6 Ų | 96.6 | 65% | 0.649 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | -15.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | D337 | D337-G341 PolarHBondContact O-N 2.89Š|
| 342 | K | 89.4 | Confident | 92.2 | Very high | 104 Ų | 104 | 97.2 Ų | 97.2 | 45% | 0.452 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106 | 2.8 | 176.4 | -58.9 | 158.9 | -154.6 | 154.5 | 0 | 113 | E338 D339 L340 K345 | E338-K342 WeakPolarHBondContact O-CD 3.39Å; E338-K342 WeakPolarHBondContact O-CE 3.4Å; E338-K342 WeakPolarHBondContact O-CG 3.42Å; E338-K342 PolarHBondContact O-N 2.77Å; E338-K342 PolarHBondContact O-NZ 2.98Å; E338-K342 IonicContact OE2-NZ 3.39Å; E338-K342 PolarHBondContact OE2-NZ 2.77Å; D339-K342 CarbonylContact O-C 3.59Å; D339-K342 PolarHBondContact O-N 2.84Å; D339-K342 VanDerWaalsContact O-N 3.14Å; D339-K342 IonicContact OD1-NZ 3.07Å; D339-K342 PolarHBondContact OD1-NZ 2.92Å; L340-K342 PolarHBondContact O-N 3.48Å; L340-K342 VanDerWaalsContact O-N 3.11Å; K342-K345 WeakPolarHBondContact O-CE 3.19Å; K342-K345 PolarHBondContact O-NZ 3.28Å |
| 343 | A | 77.8 | Confident | 92.1 | Very high | 57 Ų | 57 | 97.2 Ų | 97.2 | 47% | 0.471 | 49% | 0.493 | S | S | . | . | trans | -82.9 | -28.5 | -168.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | D339 L340 K345 | D339-A343 PolarHBondContact O-N 3.5Å; D339-A343 VanDerWaalsContact O-N 3.15Å; L340-A343 VanDerWaalsContact O-CB 3.28Å; L340-A343 WeakPolarHBondContact O-CB 3.43Å; L340-A343 PolarHBondContact O-N 3.47Å; A343-K345 PolarHBondContact O-N 3.03Å | ||
| 344 | V | 75.8 | Confident | 92.2 | Very high | 79 Ų | 79 | 100 Ų | 100 | 48% | 0.479 | 50% | 0.504 | S | S | . | . | trans | -68.6 | 100.1 | -175.4 | -174 | 0 | 0 | 0 | 0 | 110.6 | M284 | M284-V344 HydrophobicContact SD-CG1 3.54Å; M284-V344 VanDerWaalsContact SD-CG1 3.54Å | ||
| 345 | K | 81.6 | Confident | 92.3 | Very high | 150 Ų | 150 | 98.4 Ų | 98.4 | 65% | 0.652 | 51% | 0.509 | S | S | * | . | trans | -140.8 | 115.4 | -174.9 | -72.1 | 171.2 | 179.3 | 145.9 | 0 | 111.3 | K342 A343 | K342-K345 WeakPolarHBondContact O-CE 3.19Å; K342-K345 PolarHBondContact O-NZ 3.28Å; A343-K345 PolarHBondContact O-N 3.03Å | ||
| 346 | F | 92.2 | Very high | 92.4 | Very high | 118 Ų | 118 | 95.8 Ų | 95.8 | 52% | 0.518 | 51% | 0.508 | S | S | . | . | trans | -83.3 | 137.6 | 163.5 | 178.7 | -120.1 | 0 | 0 | 0 | 109.9 | L280 M284 F348 | L280-F346 HydrophobicContact CD1-CE2 3.98Å; L280-F346 HydrophobicContact CD1-CZ 4.45Å; L280-F346 HydrophobicContact CD2-CE2 4.22Å; M284-F346 HydrophobicContact CE-CB 3.96Å; F346-F348 AromaticContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CE1 4.39Å; F346-F348 HydrophobicContact CE1-CB 4.1Å; F346-F348 AromaticContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CE1 4.08Å; F346-F348 AromaticContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CZ-CB 3.9Å; F346-F348 HydrophobicContact CZ-CD1 4.09Å; F346-F348 HydrophobicContact CZ-CG 4.27Å | ||
| 347 | T | 93 | Very high | 92.4 | Very high | 119 Ų | 119 | 93 Ų | 93 | 73% | 0.73 | 50% | 0.499 | S | S | * | . | trans | -137.9 | 139.2 | 178.8 | 54.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 348 | F | 94.6 | Very high | 92.5 | Very high | 140 Ų | 140 | 95.6 Ų | 95.6 | 61% | 0.614 | 53% | 0.526 | S | S | * | . | trans | -152.2 | 153.1 | -175.3 | 66.4 | -82.9 | 0 | 0 | 0 | 112.2 | F346 L350 | F346-F348 AromaticContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CE1 4.39Å; F346-F348 HydrophobicContact CE1-CB 4.1Å; F346-F348 AromaticContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CE1 4.08Å; F346-F348 AromaticContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CZ-CB 3.9Å; F346-F348 HydrophobicContact CZ-CD1 4.09Å; F346-F348 HydrophobicContact CZ-CG 4.27Å; F348-L350 HydrophobicContact CD2-CB 4.02Å; F348-L350 HydrophobicContact CE2-CB 3.99Å | ||
| 349 | E | 95.4 | Very high | 92.7 | Very high | 159 Ų | 159 | 93.6 Ų | 93.6 | 74% | 0.743 | 53% | 0.534 | S | S | * | . | trans | -118.5 | 100.3 | 174 | -68.2 | -173.3 | -176.9 | 0 | 0 | 109.9 | P352 | E349-P352 HydrophobicContact CB-CG 4.29Š| ||
| 350 | L | 96.1 | Very high | 92.9 | Very high | 77 Ų | 77 | 95 Ų | 95 | 40% | 0.403 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -82.5 | -38.5 | -171.1 | -176.2 | 59 | 0 | 0 | 0 | 114.1 | F348 L353 K354 | F348-L350 HydrophobicContact CD2-CB 4.02Å; F348-L350 HydrophobicContact CE2-CB 3.99Å; L350-L353 PolarHBondContact O-N 2.9Å; L350-K354 HydrophobicContact CD1-CG 4.3Å; L350-K354 HydrophobicContact CG-CD 3.99Å; L350-K354 HydrophobicContact CG-CG 4.23Å; L350-K354 PolarHBondContact O-N 3.12Å |
| 351 | E | 97.8 | Very high | 93 | Very high | 107 Ų | 107 | 95.9 Ų | 95.9 | 50% | 0.5 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.2 | -37.6 | -173.2 | -55.5 | -47 | 121.1 | 0 | 0 | 114.5 | L353 K354 T355 | E351-L353 VanDerWaalsContact C-N 3.3Å; E351-L353 PolarHBondContact O-N 3.11Å; E351-K354 PolarHBondContact O-N 2.93Å; E351-K354 WeakPolarHBondContact OE1-CD 3.38Å; E351-K354 IonicContact OE1-NZ 2.71Å; E351-K354 PolarHBondContact OE1-NZ 3.15Å; E351-K354 WeakPolarHBondContact OE2-CD 3.36Å; E351-K354 IonicContact OE2-NZ 3.82Å; E351-K354 PolarHBondContact OE2-NZ 3.35Å; E351-T355 WeakPolarHBondContact O-CB 3.39Å; E351-T355 PolarHBondContact O-N 2.6Å; E351-T355 PolarHBondContact O-OG1 2.96Å |
| 352 | P | 97.8 | Very high | 93.4 | Very high | 76 Ų | 76 | 98.6 Ų | 98.6 | 49% | 0.494 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61 | -39.8 | 171.1 | -23.4 | 35 | 0 | 0 | 0 | 112.2 | E349 T355 S356 | E349-P352 HydrophobicContact CB-CG 4.29Å; P352-T355 PolarHBondContact O-N 3.45Å; P352-S356 WeakPolarHBondContact O-CB 3.21Å; P352-S356 PolarHBondContact O-N 3.35Å |
| 353 | L | 96.7 | Very high | 93.7 | Very high | 82 Ų | 82 | 98.1 Ų | 98.1 | 43% | 0.429 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67 | -47.6 | 177.8 | 179.8 | 59.2 | 0 | 0 | 0 | 111.7 | L350 E351 T355 S356 I357 | L350-L353 PolarHBondContact O-N 2.9Å; E351-L353 VanDerWaalsContact C-N 3.3Å; E351-L353 PolarHBondContact O-N 3.11Å; L353-T355 VanDerWaalsContact C-N 3.29Å; L353-T355 PolarHBondContact O-N 3.2Å; L353-S356 WeakPolarHBondContact O-CB 3.32Å; L353-S356 PolarHBondContact O-N 2.75Å; L353-I357 HydrophobicContact CD1-CD1 4.04Å; L353-I357 HydrophobicContact CD1-CG1 4.3Å; L353-I357 HydrophobicContact CG-CD1 3.94Å; L353-I357 VanDerWaalsContact O-CG1 3.31Å; L353-I357 WeakPolarHBondContact O-CG1 3.35Å; L353-I357 PolarHBondContact O-N 3.39Å |
| 354 | K | 97.1 | Very high | 94.4 | Very high | 97 Ų | 97 | 103.4 Ų | 103.4 | 42% | 0.422 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -55 | -44.3 | 172.4 | -78.3 | 169.1 | 170.5 | 171.3 | 0 | 112.1 | L350 E351 S356 I357 A358 | L350-K354 HydrophobicContact CD1-CG 4.3Å; L350-K354 HydrophobicContact CG-CD 3.99Å; L350-K354 HydrophobicContact CG-CG 4.23Å; L350-K354 PolarHBondContact O-N 3.12Å; E351-K354 PolarHBondContact O-N 2.93Å; E351-K354 WeakPolarHBondContact OE1-CD 3.38Å; E351-K354 IonicContact OE1-NZ 2.71Å; E351-K354 PolarHBondContact OE1-NZ 3.15Å; E351-K354 WeakPolarHBondContact OE2-CD 3.36Å; E351-K354 IonicContact OE2-NZ 3.82Å; E351-K354 PolarHBondContact OE2-NZ 3.35Å; K354-S356 VanDerWaalsContact C-N 3.33Å; K354-S356 PolarHBondContact O-N 3.42Å; K354-I357 PolarHBondContact O-N 3.49Å; K354-A358 WeakPolarHBondContact O-CB 3.47Å; K354-A358 PolarHBondContact O-N 3.21Å |
| 355 | T | 98 | Very high | 95.2 | Very high | 101 Ų | 101 | 106.6 Ų | 106.6 | 62% | 0.62 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.3 | -41.1 | 179.6 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | E351 P352 L353 G359 | E351-T355 WeakPolarHBondContact O-CB 3.39Å; E351-T355 PolarHBondContact O-N 2.6Å; E351-T355 PolarHBondContact O-OG1 2.96Å; P352-T355 PolarHBondContact O-N 3.45Å; L353-T355 VanDerWaalsContact C-N 3.29Å; L353-T355 PolarHBondContact O-N 3.2Å; T355-G359 PolarHBondContact O-N 3.12Å |
| 356 | S | 97.3 | Very high | 95.7 | Very high | 82 Ų | 82 | 105.1 Ų | 105.1 | 57% | 0.573 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -62.9 | -46.5 | 174.7 | -168.7 | 0 | 0 | 0 | 0 | 112.2 | P352 L353 K354 G359 F360 | P352-S356 WeakPolarHBondContact O-CB 3.21Å; P352-S356 PolarHBondContact O-N 3.35Å; L353-S356 WeakPolarHBondContact O-CB 3.32Å; L353-S356 PolarHBondContact O-N 2.75Å; K354-S356 VanDerWaalsContact C-N 3.33Å; K354-S356 PolarHBondContact O-N 3.42Å; S356-G359 CarbonylContact O-C 3.35Å; S356-G359 PolarHBondContact O-N 3.17Å; S356-F360 PolarHBondContact O-N 3.06Å |
| 357 | I | 96.3 | Very high | 95.5 | Very high | 89 Ų | 89 | 107.2 Ų | 107.2 | 46% | 0.456 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -63.9 | -42.9 | 177.7 | -65.5 | 168.4 | 0 | 0 | 0 | 110.9 | L353 K354 G359 F360 | L353-I357 HydrophobicContact CD1-CD1 4.04Å; L353-I357 HydrophobicContact CD1-CG1 4.3Å; L353-I357 HydrophobicContact CG-CD1 3.94Å; L353-I357 VanDerWaalsContact O-CG1 3.31Å; L353-I357 WeakPolarHBondContact O-CG1 3.35Å; L353-I357 PolarHBondContact O-N 3.39Å; K354-I357 PolarHBondContact O-N 3.49Å; I357-G359 PolarHBondContact O-N 3.29Å; I357-F360 WeakPolarHBondContact O-CB 3.29Å; I357-F360 PolarHBondContact O-N 3.23Å |
| 358 | A | 97.1 | Very high | 95 | Very high | 94 Ų | 94 | 107.1 Ų | 107.1 | 78% | 0.777 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -65 | -24.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | K354 | K354-A358 WeakPolarHBondContact O-CB 3.47Å; K354-A358 PolarHBondContact O-N 3.21Å |
| 359 | G | 96.9 | Very high | 94.4 | Very high | 63 Ų | 63 | 104.3 Ų | 104.3 | 65% | 0.649 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | 4.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | T355 S356 I357 | T355-G359 PolarHBondContact O-N 3.12Å; S356-G359 CarbonylContact O-C 3.35Å; S356-G359 PolarHBondContact O-N 3.17Å; I357-G359 PolarHBondContact O-N 3.29Å |
| 360 | F | 97.4 | Very high | 93.9 | Very high | 98 Ų | 98 | 106.2 Ų | 106.2 | 43% | 0.43 | 62% | 0.617 | S | S | . | * | trans | -85.8 | 122.6 | -172.8 | -174.7 | -94.1 | 0 | 0 | 0 | 113 | T265 F266 L269 S356 I357 | T265-F360 HydrophobicContact CG2-CE1 3.96Å; T265-F360 HydrophobicContact CG2-CZ 3.82Å; F266-F360 HydrophobicContact CE1-CD1 4.07Å; F266-F360 AromaticContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CE1 4.33Å; L269-F360 HydrophobicContact CD1-CD1 3.9Å; L269-F360 HydrophobicContact CD1-CE1 3.54Å; L269-F360 HydrophobicContact CD1-CE2 4.43Å; L269-F360 HydrophobicContact CD1-CG 4.49Å; L269-F360 HydrophobicContact CD1-CZ 3.84Å; S356-F360 PolarHBondContact O-N 3.06Å; I357-F360 WeakPolarHBondContact O-CB 3.29Å; I357-F360 PolarHBondContact O-N 3.23Å | ||
| 361 | G | 96.4 | Very high | 93.1 | Very high | 58 Ų | 58 | 108 Ų | 108 | 60% | 0.598 | 64% | 0.636 | S | S | * | * | trans | 88.8 | 159.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 362 | S | 95.8 | Very high | 92 | Very high | 120 Ų | 120 | 108.5 Ų | 108.5 | 84% | 0.839 | 65% | 0.651 | S | S | * | * | trans | -158.6 | 162.1 | 174.4 | 62.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 363 | V | 95.8 | Very high | 90.9 | Very high | 94 Ų | 94 | 116.2 Ų | 116.2 | 57% | 0.57 | 67% | 0.67 | S | S | * | * | trans | -123.4 | 126.8 | 178.4 | -179.9 | 0 | 0 | 0 | 0 | 109.6 | M262 H365 | M262-V363 HydrophobicContact CE-CG2 3.98Å; V363-H365 PolarHBondContact O-CE1 3.2Å; V363-H365 PolarHBondContact O-ND1 2.96Å | ||
| 364 | Y | 92.9 | Very high | 89.4 | Confident | 168 Ų | 168 | 117.7 Ų | 117.7 | 66% | 0.659 | 69% | 0.688 | S | S | * | * | trans | -76.8 | 138.7 | 177.1 | -177.4 | -99.5 | 0 | 0 | 0 | 111.5 | Q367 | Y364-Q367 WeakPolarHBondContact OH-CG 3.34Š| ||
| 365 | H | 93 | Very high | 87.7 | Confident | 146 Ų | 146 | 124.1 Ų | 124.1 | 68% | 0.676 | 71% | 0.709 | S | S | * | * | trans | -105.4 | 131 | -178.1 | -70.2 | 65.3 | 0 | 0 | 0 | 110.5 | V363 Q367 | V363-H365 PolarHBondContact O-CE1 3.2Å; V363-H365 PolarHBondContact O-ND1 2.96Å; H365-Q367 PolarHBondContact O-N 3.27Å | ||
| 366 | P | 91.4 | Very high | 84.9 | Confident | 119 Ų | 119 | 124.9 Ų | 124.9 | 77% | 0.773 | 72% | 0.717 | S | S | * | * | trans | -59.5 | 127.2 | -176.8 | -25.4 | 34.3 | 0 | 0 | 0 | 113.7 | ||||
| 367 | Q | 88.9 | Confident | 82.3 | Confident | 162 Ų | 162 | 126.7 Ų | 126.7 | 76% | 0.757 | 73% | 0.73 | S | S | * | * | trans | -89.2 | 119.8 | 175.4 | -71.5 | -175.6 | 0.1 | 0 | 0 | 112 | Y364 H365 G369 | Y364-Q367 WeakPolarHBondContact OH-CG 3.34Å; H365-Q367 PolarHBondContact O-N 3.27Å; Q367-G369 PolarHBondContact O-N 3.41Å; Q367-G369 VanDerWaalsContact O-N 3.13Å | ||
| 368 | T | 82.7 | Confident | 80.3 | Confident | 118 Ų | 118 | 127.6 Ų | 127.6 | 72% | 0.724 | 74% | 0.744 | S | S | * | * | trans | -88.7 | 65.6 | -176.9 | 52.1 | 0 | 0 | 0 | 0 | 112.6 | Y370 | T368-Y370 PolarHBondContact O-N 2.88Š| ||
| 369 | G | 80.8 | Confident | 77.6 | Confident | 80 Ų | 80 | 129.5 Ų | 129.5 | 83% | 0.825 | 75% | 0.746 | S | S | * | * | trans | -69.8 | 26.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | Q367 S371 | Q367-G369 PolarHBondContact O-N 3.41Å; Q367-G369 VanDerWaalsContact O-N 3.13Å; G369-S371 PolarHBondContact O-N 3.34Å | ||
| 370 | Y | 85.1 | Confident | 74.7 | Confident | 200 Ų | 200 | 133 Ų | 133 | 78% | 0.784 | 76% | 0.756 | S | S | * | * | trans | -75.5 | 115.7 | -175.4 | -70.2 | -72 | 0 | 0 | 0 | 111.7 | T368 S372 | T368-Y370 PolarHBondContact O-N 2.88Å; Y370-S372 PolarHBondContact O-N 2.75Å | ||
| 371 | S | 80.2 | Confident | 72.2 | Confident | 114 Ų | 114 | 133.9 Ų | 133.9 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | -66.4 | 116.4 | 179 | -175.6 | 0 | 0 | 0 | 0 | 111.7 | G369 R373 | G369-S371 PolarHBondContact O-N 3.34Å; S371-R373 PolarHBondContact O-N 2.85Å; S371-R373 VanDerWaalsContact O-N 3.09Å | ||
| 372 | S | 74.7 | Confident | 69.6 | Low | 118 Ų | 118 | 136.3 Ų | 136.3 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | -72.6 | 97.1 | 169 | -72 | 0 | 0 | 0 | 0 | 110 | Y370 S374 | Y370-S372 PolarHBondContact O-N 2.75Å; S372-S374 VanDerWaalsContact C-N 3.3Å; S372-S374 PolarHBondContact O-N 3.04Å | ||
| 373 | R | 75.3 | Confident | 67.1 | Low | 237 Ų | 237 | 138 Ų | 138 | 89% | 0.894 | 78% | 0.779 | S | S | * | * | trans | -66.4 | 87.9 | 170.1 | -102.2 | -175.7 | 170.6 | -101.6 | 1.9 | 110.1 | S371 R375 | S371-R373 PolarHBondContact O-N 2.85Å; S371-R373 VanDerWaalsContact O-N 3.09Å; R373-R375 PolarHBondContact O-N 3.06Å | ||
| 374 | S | 63.5 | Low | 64.5 | Low | 113 Ų | 113 | 140.1 Ų | 140.1 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -55.2 | 135.6 | 168.9 | -171.4 | 0 | 0 | 0 | 0 | 110 | S372 | S372-S374 VanDerWaalsContact C-N 3.3Å; S372-S374 PolarHBondContact O-N 3.04Å | ||
| 375 | R | 61.2 | Low | 61.8 | Low | 233 Ų | 233 | 135.3 Ų | 135.3 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | trans | -86.8 | 120 | -176.2 | -76.3 | -177.5 | 166.6 | -166.1 | -3.6 | 110.2 | R373 | R373-R375 PolarHBondContact O-N 3.06Š| ||
| 376 | C | 41.1 | Very low | 60.1 | Low | 117 Ų | 117 | 135 Ų | 135 | 79% | 0.791 | 81% | 0.805 | S | S | * | * | trans | 61.9 | 70.7 | 157.7 | -56.8 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 377 | S | 41.8 | Very low | 57.4 | Low | 120 Ų | 120 | 133 Ų | 133 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | trans | -100 | 108.9 | 143.5 | -65.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 378 | S | 53.9 | Low | 54.9 | Low | 108 Ų | 108 | 131 Ų | 131 | 76% | 0.755 | 81% | 0.81 | S | S | * | * | trans | -153 | 61.4 | -175.1 | -64.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 379 | T | 40.3 | Very low | 53.2 | Low | 133 Ų | 133 | 131.3 Ų | 131.3 | 82% | 0.816 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -156.4 | 162.1 | 158.5 | -2.7 | 0 | 0 | 0 | 0 | 109.5 | ||
| 380 | T | 35.9 | Very low | 51 | Low | 138 Ų | 138 | 136.1 Ų | 136.1 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | trans | 50.5 | 89.5 | 173 | 52.3 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 381 | S | 45.2 | Very low | 49.1 | Very low | 115 Ų | 115 | 132.3 Ų | 132.3 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -69.7 | 125.1 | 143.9 | 50.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 382 | S | 41.1 | Very low | 47.3 | Very low | 109 Ų | 109 | 132.5 Ų | 132.5 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | 160.9 | 146.8 | 127.9 | -74.8 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 383 | I | 43.9 | Very low | 45.9 | Very low | 155 Ų | 155 | 131.9 Ų | 131.9 | 80% | 0.795 | 80% | 0.802 | S | S | * | * | trans | 83.5 | 127.8 | 152 | -122.1 | 166 | 0 | 0 | 0 | 119.8 | ||||
| 384 | T | 42.3 | Very low | 44.7 | Very low | 140 Ų | 140 | 126.7 Ų | 126.7 | 86% | 0.859 | 80% | 0.799 | S | S | * | * | trans | 58.5 | 141.4 | 173.3 | 59.3 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 385 | G | 34.7 | Very low | 43.4 | Very low | 66 Ų | 66 | 126.5 Ų | 126.5 | 68% | 0.68 | 80% | 0.798 | S | S | * | * | cis | -167.4 | 174.8 | -5.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 386 | P | 58.5 | Low | 42.1 | Very low | 141 Ų | 141 | 120.7 Ų | 120.7 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | trans | -89.1 | 146.4 | -176.6 | 34.5 | -34.1 | 0 | 0 | 0 | 114 | ||||
| 387 | G | 33.7 | Very low | 41.6 | Very low | 77 Ų | 77 | 125.1 Ų | 125.1 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | 111.9 | 148.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 388 | S | 37.2 | Very low | 41.1 | Very low | 118 Ų | 118 | 128.6 Ų | 128.6 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | cis | -143.8 | 179.6 | -1.1 | -162.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 389 | V | 47.3 | Very low | 39.8 | Very low | 125 Ų | 125 | 127.2 Ų | 127.2 | 76% | 0.758 | 80% | 0.799 | S | S | * | * | trans | -61.1 | 148.9 | 166.1 | -75.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 390 | E | 34.8 | Very low | 39.5 | Very low | 182 Ų | 182 | 129.1 Ų | 129.1 | 85% | 0.85 | 79% | 0.792 | S | S | * | * | -153.4 | 143.7 | 122.6 | -144.4 | 165.9 | 123.3 | 0 | 0 | 112 | |||||
| 391 | T | 43.5 | Very low | 39.7 | Very low | 120 Ų | 120 | 127.5 Ų | 127.5 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | trans | -111.8 | 120.7 | 172.9 | -57.4 | 0 | 0 | 0 | 0 | 107.3 | P393 | T391-P393 WeakPolarHBondContact O-CD 3.33Š| ||
| 392 | P | 43.8 | Very low | 39 | Very low | 117 Ų | 117 | 127.6 Ų | 127.6 | 76% | 0.76 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 124.9 | 178.7 | 27.3 | -33.1 | 0 | 0 | 0 | 110.4 | ||
| 393 | P | 45.7 | Very low | 38.8 | Very low | 106 Ų | 106 | 129.1 Ų | 129.1 | 69% | 0.688 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 151 | 178.5 | 33.6 | -34.5 | 0 | 0 | 0 | 111.8 | T391 | T391-P393 WeakPolarHBondContact O-CD 3.33Š|
| 394 | P | 49.2 | Very low | 38.7 | Very low | 127 Ų | 127 | 127.3 Ų | 127.3 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 135.1 | 164.3 | 29.7 | -32.8 | 0 | 0 | 0 | 110.3 | ||
| 395 | S | 36.8 | Very low | 38.5 | Very low | 110 Ų | 110 | 127.6 Ų | 127.6 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 144.5 | 177.7 | 50.4 | 0 | 0 | 0 | 0 | 112.4 | ||
| 396 | S | 33.4 | Very low | 38.6 | Very low | 110 Ų | 110 | 133.3 Ų | 133.3 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 146.5 | -177.2 | 55.6 | 0 | 0 | 0 | 0 | 114 | ||
| 397 | Y | 31.4 | Very low | 37.4 | Very low | 210 Ų | 210 | 132 Ų | 132 | 82% | 0.824 | 77% | 0.765 | S | S | * | * | trans | -133.8 | 120.1 | 141.5 | 18.9 | -92.4 | 0 | 0 | 0 | 109.8 | ||||
| 398 | E | 30.4 | Very low | 37.1 | Very low | 194 Ų | 194 | 134.2 Ų | 134.2 | 91% | 0.907 | 76% | 0.763 | S | S | * | * | trans | 38.3 | 135.4 | 144.2 | -56.2 | 179.4 | 142.6 | 0 | 0 | 120.6 | ||||
| 399 | G | 27.5 | Very low | 36.7 | Very low | 78 Ų | 78 | 137.4 Ų | 137.4 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | cis | -156.5 | 173.9 | 11.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 400 | R | 33.2 | Very low | 35.9 | Very low | 173 Ų | 173 | 139.1 Ų | 139.1 | 65% | 0.653 | 77% | 0.767 | S | S | * | * | trans | -156.3 | 146.9 | -172.7 | -177.2 | -177.4 | -172.4 | -67.9 | -22.7 | 110.8 | T402 Q403 | R400-T402 VanDerWaalsContact NH1-N 3.19Å; R400-Q403 VanDerWaalsContact NH2-CG 3.33Å | ||
| 401 | P | 39.4 | Very low | 35.6 | Very low | 104 Ų | 104 | 134.2 Ų | 134.2 | 68% | 0.675 | 77% | 0.765 | S | S | * | * | trans | -121.5 | 157.5 | 144.2 | 35.5 | -27.2 | 0 | 0 | 0 | 114 | ||||
| 402 | T | 32.2 | Very low | 35.3 | Very low | 117 Ų | 117 | 136.4 Ų | 136.4 | 72% | 0.718 | 77% | 0.772 | S | S | * | * | trans | 25.9 | 113.9 | 149.8 | 53.4 | 0 | 0 | 0 | 0 | 118.6 | R400 | R400-T402 VanDerWaalsContact NH1-N 3.19Š| ||
| 403 | Q | 36 | Very low | 34.8 | Very low | 142 Ų | 142 | 140.8 Ų | 140.8 | 66% | 0.664 | 77% | 0.773 | S | S | * | * | cis | 53.7 | 141.8 | 41.5 | -88.4 | -114.4 | 16.6 | 0 | 0 | 112.8 | R400 | R400-Q403 VanDerWaalsContact NH2-CG 3.33Š| ||
| 404 | P | 42.3 | Very low | 34.7 | Very low | 117 Ų | 117 | 146.5 Ų | 146.5 | 76% | 0.76 | 78% | 0.781 | S | S | * | * | cis | -125 | 176.8 | 25.2 | 42.2 | -29.8 | 0 | 0 | 0 | 116.6 | ||||
| 405 | N | 38.2 | Very low | 34 | Very low | 145 Ų | 145 | 149.3 Ų | 149.3 | 78% | 0.775 | 78% | 0.777 | S | S | * | * | trans | -146.8 | 111.4 | 166.5 | -176.3 | -1.1 | 0 | 0 | 0 | 110.8 | ||||
| 406 | K | 36.6 | Very low | 33.9 | Very low | 186 Ų | 186 | 149.7 Ų | 149.7 | 81% | 0.809 | 78% | 0.775 | S | S | * | * | trans | -153.2 | 106.8 | 169.6 | -76.5 | -162.6 | 179.5 | 179.3 | 0 | 109.3 | ||||
| 407 | T | 32.9 | Very low | 33.9 | Very low | 115 Ų | 115 | 149.3 Ų | 149.3 | 71% | 0.706 | 78% | 0.778 | S | S | * | * | 82.6 | 143.4 | 96.7 | 67.3 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 408 | T | 27.3 | Very low | 33.8 | Very low | 122 Ų | 122 | 142.8 Ų | 142.8 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | 99.8 | 95.5 | 144.6 | -52.6 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 409 | F | 28.2 | Very low | 34.5 | Very low | 185 Ų | 185 | 140 Ų | 140 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | 82.8 | 155.1 | 128.8 | -126.1 | -137.3 | 0 | 0 | 0 | 123.4 | |||||
| 410 | L | 31 | Very low | 34.7 | Very low | 162 Ų | 162 | 139 Ų | 139 | 85% | 0.848 | 76% | 0.763 | S | S | * | * | trans | 69.4 | 139.9 | 166 | -59.2 | 169.8 | 0 | 0 | 0 | 119.4 | ||||
| 411 | G | 28.4 | Very low | 35 | Very low | 79 Ų | 79 | 141.3 Ų | 141.3 | 81% | 0.814 | 77% | 0.774 | S | S | * | * | trans | 168.2 | 10.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | R413 | G411-R413 PolarHBondContact O-N 3.12Š| ||
| 412 | N | 37.5 | Very low | 34.8 | Very low | 166 Ų | 166 | 145 Ų | 145 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | trans | -88.9 | 108.5 | -174.4 | -166.2 | 26.4 | 0 | 0 | 0 | 112.6 | ||||
| 413 | R | 34.1 | Very low | 34.9 | Very low | 208 Ų | 208 | 145.4 Ų | 145.4 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -156.3 | 126.8 | 168.1 | -162.6 | 171.8 | -79.6 | -138.3 | 2.9 | 113.1 | G411 Y415 | G411-R413 PolarHBondContact O-N 3.12Å; R413-Y415 HydrophobicContact CG-CD2 3.81Å; R413-Y415 HydrophobicContact CG-CE2 3.77Å | ||
| 414 | R | 42.3 | Very low | 34.9 | Very low | 227 Ų | 227 | 142.5 Ų | 142.5 | 86% | 0.857 | 80% | 0.797 | S | S | * | * | trans | -100.7 | 141.1 | 165.6 | -61.5 | 174.3 | 175.9 | 177.5 | -3.2 | 109.5 | ||||
| 415 | Y | 35.3 | Very low | 34.3 | Very low | 185 Ų | 185 | 140.8 Ų | 140.8 | 73% | 0.725 | 80% | 0.801 | S | S | * | * | trans | -164.9 | 162.4 | 156 | -75.9 | -65.8 | 0 | 0 | 0 | 109 | R413 | R413-Y415 HydrophobicContact CG-CD2 3.81Å; R413-Y415 HydrophobicContact CG-CE2 3.77Å | ||
| 416 | T | 33.5 | Very low | 34.2 | Very low | 119 Ų | 119 | 142.4 Ų | 142.4 | 73% | 0.73 | 80% | 0.804 | S | S | * | * | -166.5 | 138.9 | -61.8 | 25.7 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 417 | A | 33.3 | Very low | 34 | Very low | 102 Ų | 102 | 143.6 Ų | 143.6 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | 59.8 | 111.5 | 145.8 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 418 | G | 29.9 | Very low | 34.1 | Very low | 73 Ų | 73 | 148.8 Ų | 148.8 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | 79.7 | 172.1 | 130 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 419 | P | 46.3 | Very low | 34.3 | Very low | 136 Ų | 136 | 150 Ų | 150 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | cis | -96 | -147.9 | -3.2 | 43.3 | -37.5 | 0 | 0 | 0 | 111 | ||||
| 420 | G | 30.7 | Very low | 34.4 | Very low | 57 Ų | 57 | 144.8 Ų | 144.8 | 59% | 0.588 | 81% | 0.812 | S | S | * | * | cis | 177 | 178.7 | 0.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 421 | Y | 38.8 | Very low | 34.3 | Very low | 221 Ų | 221 | 142.3 Ų | 142.3 | 87% | 0.867 | 81% | 0.808 | S | S | * | * | trans | 68.4 | 155 | 168 | -63.8 | -72.2 | 0 | 0 | 0 | 120.9 | ||||
| 422 | H | 35.8 | Very low | 34.5 | Very low | 180 Ų | 180 | 144.1 Ų | 144.1 | 83% | 0.833 | 81% | 0.808 | S | S | * | * | trans | -151.5 | 147.9 | -158.4 | -44.6 | -43.9 | 0 | 0 | 0 | 114.8 | ||||
| 423 | S | 35.6 | Very low | 34.3 | Very low | 127 Ų | 127 | 147.2 Ų | 147.2 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | trans | -176.4 | 146.1 | 147.1 | -78.1 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 424 | G | 34.3 | Very low | 34.3 | Very low | 80 Ų | 80 | 149.4 Ų | 149.4 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | cis | 113.3 | 116.3 | 24.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 425 | G | 30.9 | Very low | 33.8 | Very low | 82 Ų | 82 | 146 Ų | 146 | 85% | 0.845 | 82% | 0.816 | S | S | * | * | cis | -160.7 | -159.6 | 3.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 426 | Q | 36.3 | Very low | 33.8 | Very low | 178 Ų | 178 | 148 Ų | 148 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | -77.2 | 144.3 | -167.4 | -83.4 | -86.4 | -5.6 | 0 | 0 | 116.4 | ||||
| 427 | R | 32.6 | Very low | 33.5 | Very low | 211 Ų | 211 | 149.8 Ų | 149.8 | 80% | 0.796 | 83% | 0.827 | S | S | * | * | 159.6 | 120.5 | 112.9 | -85.2 | 175.9 | -166.2 | -138.2 | 1.1 | 113.1 | |||||
| 428 | Y | 34.1 | Very low | 33.7 | Very low | 224 Ų | 224 | 149.6 Ų | 149.6 | 88% | 0.878 | 82% | 0.816 | S | S | * | * | -176.3 | 165.9 | 107.8 | -112.9 | -87.3 | 0 | 0 | 0 | 111.6 | |||||
| 429 | N | 31.8 | Very low | 33.8 | Very low | 148 Ų | 148 | 153.8 Ų | 153.8 | 79% | 0.791 | 82% | 0.821 | S | S | * | * | trans | -115.5 | 148.8 | -171 | -179.9 | 22.3 | 0 | 0 | 0 | 111.2 | ||||
| 430 | G | 29.6 | Very low | 33.2 | Very low | 76 Ų | 76 | 159.6 Ų | 159.6 | 78% | 0.784 | 83% | 0.826 | S | S | * | * | trans | -179.7 | 54.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 431 | S | 29.3 | Very low | 33.2 | Very low | 109 Ų | 109 | 160.7 Ų | 160.7 | 76% | 0.762 | 84% | 0.837 | S | S | * | * | trans | -75.1 | 139.6 | 174.1 | -64.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 432 | S | 33.3 | Very low | 32.8 | Very low | 117 Ų | 117 | 153.3 Ų | 153.3 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | -171.4 | 123 | 126.9 | 39.1 | 0 | 0 | 0 | 0 | 113 | |||||
| 433 | Y | 32.9 | Very low | 32.6 | Very low | 232 Ų | 232 | 155.8 Ų | 155.8 | 91% | 0.91 | 83% | 0.831 | S | S | * | * | trans | -83.3 | 146.6 | 159.8 | -73.2 | -102.5 | 0 | 0 | 0 | 108.8 | ||||
| 434 | R | 34.4 | Very low | 32.3 | Very low | 253 Ų | 253 | 160.8 Ų | 160.8 | 96% | 0.955 | 83% | 0.831 | S | S | * | * | trans | -118.8 | 109.8 | 163.4 | -104.5 | -161.2 | 179.9 | -143.2 | 5.3 | 109.9 | ||||
| 435 | D | 32 | Very low | 32.1 | Very low | 156 Ų | 156 | 161.1 Ų | 161.1 | 83% | 0.834 | 82% | 0.82 | S | S | * | * | trans | -139.3 | 123.9 | 165.4 | -146.6 | -31.3 | 0 | 0 | 0 | 107.8 | ||||
| 436 | R | 33.8 | Very low | 32.3 | Very low | 228 Ų | 228 | 166.1 Ų | 166.1 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | trans | -158.5 | 68.6 | -178.8 | -147.4 | 176.2 | -162.4 | -176 | 5.1 | 114.2 | T438 | R436-T438 PolarHBondContact O-N 2.87Å; R436-T438 PolarHBondContact O-OG1 3.04Å | ||
| 437 | N | 28.4 | Very low | 31.9 | Very low | 155 Ų | 155 | 161.1 Ų | 161.1 | 83% | 0.829 | 82% | 0.818 | S | S | * | * | trans | -53.1 | 133.9 | 162.9 | -174.2 | -2.5 | 0 | 0 | 0 | 110.8 | ||||
| 438 | T | 37.8 | Very low | 32 | Very low | 99 Ų | 99 | 161.5 Ų | 161.5 | 61% | 0.607 | 82% | 0.821 | S | S | * | * | trans | -142.5 | 100.9 | -176.3 | -52.5 | 0 | 0 | 0 | 0 | 111.3 | R436 | R436-T438 PolarHBondContact O-N 2.87Å; R436-T438 PolarHBondContact O-OG1 3.04Å | ||
| 439 | N | 30.4 | Very low | 32 | Very low | 161 Ų | 161 | 160 Ų | 160 | 86% | 0.861 | 82% | 0.822 | S | S | * | * | trans | 178.4 | 121.6 | 142.2 | -98.4 | -27.3 | 0 | 0 | 0 | 112.8 | ||||
| 440 | R | 33.9 | Very low | 31.8 | Very low | 258 Ų | 258 | 156 Ų | 156 | 97% | 0.974 | 82% | 0.816 | S | S | * | * | trans | -160.6 | 127.8 | 158 | -149.2 | 179.6 | -167.5 | -146.5 | 2.8 | 112.7 | ||||
| 441 | G | 30.7 | Very low | 32 | Very low | 80 Ų | 80 | 162.5 Ų | 162.5 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | trans | 100.4 | 138.4 | 173 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 442 | G | 30.1 | Very low | 32 | Very low | 65 Ų | 65 | 160.4 Ų | 160.4 | 67% | 0.67 | 82% | 0.822 | S | S | * | * | cis | 174.5 | 149.7 | -10.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 443 | Y | 32.1 | Very low | 31.9 | Very low | 233 Ų | 233 | 163.2 Ų | 163.2 | 91% | 0.914 | 83% | 0.827 | S | S | * | * | trans | 63.2 | 113.1 | 153.1 | -60.4 | -70.7 | 0 | 0 | 0 | 122.7 | ||||
| 444 | R | 30.7 | Very low | 31.7 | Very low | 232 Ų | 232 | 155.7 Ų | 155.7 | 88% | 0.875 | 82% | 0.82 | S | S | * | * | 98.2 | 94.5 | 117.4 | -160.8 | 176.4 | -157.2 | -156.2 | 4.8 | 122.4 | |||||
| 445 | S | 28.6 | Very low | 32.6 | Very low | 86 Ų | 86 | 149.6 Ų | 149.6 | 60% | 0.601 | 81% | 0.814 | S | S | * | * | 88.3 | 121.4 | 120.8 | -148.5 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 446 | Q | 35.5 | Very low | 32.8 | Very low | 187 Ų | 187 | 148.2 Ų | 148.2 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | 61.7 | 136.4 | 140 | -71.5 | 170 | -34.2 | 0 | 0 | 122.3 | ||||
| 447 | G | 27.8 | Very low | 32.8 | Very low | 73 Ų | 73 | 146.3 Ų | 146.3 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | 179.9 | 23.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 448 | Y | 34.1 | Very low | 34 | Very low | 220 Ų | 220 | 143.9 Ų | 143.9 | 86% | 0.863 | 81% | 0.809 | S | S | * | * | trans | 52.9 | 158.3 | 158.7 | -87 | -88.2 | 0 | 0 | 0 | 124.2 | ||||
| 449 | Q | 34.5 | Very low | 33.7 | Very low | 191 Ų | 191 | 146.2 Ų | 146.2 | 89% | 0.893 | 82% | 0.824 | S | S | * | * | trans | 68.2 | 146.4 | 165.1 | -68.3 | 155.3 | -39.5 | 0 | 0 | 118.3 | ||||
| 450 | G | 28.7 | Very low | 33.8 | Very low | 65 Ų | 65 | 142.9 Ų | 142.9 | 67% | 0.67 | 82% | 0.818 | S | S | * | * | cis | 161.1 | 139.1 | -14.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 451 | Q | 33.3 | Very low | 33.8 | Very low | 212 Ų | 212 | 136.5 Ų | 136.5 | 99% | 0.991 | 81% | 0.808 | S | S | * | * | trans | 63 | 164.3 | 176.3 | -67.1 | 170.6 | -19 | 0 | 0 | 115.3 | ||||
| 452 | G | 28.7 | Very low | 34 | Very low | 66 Ų | 66 | 141 Ų | 141 | 68% | 0.68 | 81% | 0.808 | S | S | * | * | cis | -172.9 | 178.7 | -1.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 453 | D | 32.2 | Very low | 34.2 | Very low | 175 Ų | 175 | 142.7 Ų | 142.7 | 94% | 0.936 | 81% | 0.809 | S | S | * | * | trans | -47 | 163.4 | -172.4 | -51.6 | -88.2 | 0 | 0 | 0 | 119.5 | ||||
| 454 | G | 28.7 | Very low | 34.3 | Very low | 74 Ų | 74 | 135.9 Ų | 135.9 | 76% | 0.763 | 80% | 0.796 | S | S | * | * | trans | 149.3 | 132 | 148.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 455 | P | 53.8 | Low | 34.3 | Very low | 126 Ų | 126 | 132.2 Ų | 132.2 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -120.7 | 158.1 | -174.7 | 41 | -30.6 | 0 | 0 | 0 | 116.1 | ||||
| 456 | S | 34.2 | Very low | 34.5 | Very low | 127 Ų | 127 | 133 Ų | 133 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | trans | -150.5 | 136.2 | 160 | -68.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 457 | H | 34.9 | Very low | 34.3 | Very low | 187 Ų | 187 | 130.7 Ų | 130.7 | 87% | 0.866 | 80% | 0.798 | S | S | * | * | trans | -133.9 | -177.1 | 168.3 | -110.7 | -63.4 | 0 | 0 | 0 | 105.9 | ||||
| 458 | P | 54.1 | Low | 34.6 | Very low | 104 Ų | 104 | 136.7 Ų | 136.7 | 68% | 0.675 | 80% | 0.804 | S | S | * | * | cis | -131.3 | -177.6 | -26.9 | 39.3 | -24.3 | 0 | 0 | 0 | 112.3 | ||||
| 459 | T | 30.9 | Very low | 34.5 | Very low | 149 Ų | 149 | 130.7 Ų | 130.7 | 91% | 0.914 | 80% | 0.799 | S | S | * | * | trans | -147.5 | 149.8 | 135.7 | -26.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 460 | A | 31.8 | Very low | 35.1 | Very low | 90 Ų | 90 | 127.6 Ų | 127.6 | 74% | 0.744 | 80% | 0.796 | S | S | * | * | trans | -151.2 | 143.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 461 | T | 34.1 | Very low | 35.3 | Very low | 124 Ų | 124 | 129.3 Ų | 129.3 | 76% | 0.761 | 80% | 0.797 | S | S | * | * | trans | -140 | 111.8 | 164.6 | 32.5 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 462 | Q | 35.8 | Very low | 35.2 | Very low | 175 Ų | 175 | 126.5 Ų | 126.5 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | 68.5 | 127.3 | 95.5 | -71 | -175.8 | 72.8 | 0 | 0 | 113.4 | |||||
| 463 | S | 33.4 | Very low | 35.4 | Very low | 100 Ų | 100 | 129 Ų | 129 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | cis | -163.7 | 162.4 | 2.1 | 48.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 464 | S | 33.8 | Very low | 35.8 | Very low | 90 Ų | 90 | 125 Ų | 125 | 63% | 0.629 | 79% | 0.788 | S | S | * | * | trans | 13.1 | 151.1 | 148.4 | 59.8 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 465 | N | 31.3 | Very low | 36.5 | Very low | 156 Ų | 156 | 127.6 Ų | 127.6 | 83% | 0.834 | 79% | 0.791 | S | S | * | * | cis | -169.5 | 157.9 | -6.8 | -104.7 | -15 | 0 | 0 | 0 | 110.7 | ||||
| 466 | S | 32.5 | Very low | 35.6 | Very low | 103 Ų | 103 | 127.2 Ų | 127.2 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | trans | -43.9 | 145.3 | 163.6 | -45.9 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 467 | T | 32.6 | Very low | 35.5 | Very low | 138 Ų | 138 | 125.9 Ų | 125.9 | 85% | 0.847 | 78% | 0.782 | S | S | * | * | -176.5 | 121 | 104.5 | 32.1 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 468 | K | 33.8 | Very low | 35.4 | Very low | 199 Ų | 199 | 121.2 Ų | 121.2 | 87% | 0.865 | 77% | 0.77 | S | S | * | * | 37.8 | 105 | 128.4 | -160.7 | 175 | -176.3 | -178.8 | 0 | 122.6 | |||||
| 469 | A | 30.6 | Very low | 34.3 | Very low | 94 Ų | 94 | 126.6 Ų | 126.6 | 78% | 0.777 | 78% | 0.779 | S | S | * | * | trans | 81 | 154.5 | 136 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 470 | P | 48.3 | Very low | 34.4 | Very low | 125 Ų | 125 | 129.2 Ų | 129.2 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | trans | -123.5 | 169.2 | -168.5 | 43.3 | -30.1 | 0 | 0 | 0 | 116.1 | ||||
| 471 | S | 32.6 | Very low | 34.6 | Very low | 101 Ų | 101 | 130.8 Ų | 130.8 | 71% | 0.706 | 76% | 0.764 | S | S | * | * | trans | -166.4 | 139.9 | 157.9 | 52 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 472 | N | 31.9 | Very low | 34.5 | Very low | 153 Ų | 153 | 130.8 Ų | 130.8 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | trans | 68.3 | 152.8 | 155.7 | -53.4 | -16.2 | 0 | 0 | 0 | 118.4 | ||||
| 473 | S | 32.3 | Very low | 34.6 | Very low | 120 Ų | 120 | 130.8 Ų | 130.8 | 84% | 0.839 | 76% | 0.759 | S | S | * | * | cis | -137.3 | 167.2 | 18.7 | -65.5 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 474 | A | 40.1 | Very low | 35 | Very low | 90 Ų | 90 | 132.1 Ų | 132.1 | 74% | 0.744 | 77% | 0.765 | S | S | * | * | trans | -81.7 | -171.9 | -172 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 475 | P | 43.3 | Very low | 35.4 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | -128 | 173.2 | 90.7 | 13.5 | 7.4 | 0 | 0 | 0 | 116.4 | |||||
| 476 | S | 36.4 | Very low | 35.7 | Very low | 117 Ų | 117 | 134.7 Ų | 134.7 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -63.7 | 166.8 | -177.9 | -144.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 477 | S | 31.3 | Very low | 36.1 | Very low | 100 Ų | 100 | 137.6 Ų | 137.6 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | cis | -166.8 | 155.5 | 25.7 | -179.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 478 | S | 33.1 | Very low | 36.2 | Very low | 89 Ų | 89 | 134.6 Ų | 134.6 | 62% | 0.622 | 78% | 0.778 | S | S | * | * | cis | -164.1 | -162.9 | -12.9 | 45.9 | 0 | 0 | 0 | 0 | 106 | ||||
| 479 | Y | 31.5 | Very low | 37 | Very low | 216 Ų | 216 | 133 Ų | 133 | 85% | 0.847 | 78% | 0.778 | S | S | * | * | cis | -151.8 | -177.5 | 2.4 | -127.2 | -55.3 | 0 | 0 | 0 | 108.6 | ||||
| 480 | R | 31.7 | Very low | 37.9 | Very low | 204 Ų | 204 | 134.5 Ų | 134.5 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | trans | -155.5 | 157.6 | -176.1 | -83.6 | 174.9 | 173.4 | -104 | -1 | 108.3 | ||||
| 481 | Q | 35.9 | Very low | 37.9 | Very low | 124 Ų | 124 | 137.5 Ų | 137.5 | 58% | 0.579 | 78% | 0.783 | S | S | * | * | cis | -156.3 | -164.1 | -0.8 | -126.3 | 168.7 | -77.7 | 0 | 0 | 107.2 | ||||
| 482 | D | 31.8 | Very low | 38.6 | Very low | 123 Ų | 123 | 143.9 Ų | 143.9 | 66% | 0.658 | 79% | 0.792 | S | S | * | * | cis | -158 | -177.8 | 8.9 | -136.6 | -26.4 | 0 | 0 | 0 | 112.8 | ||||
| 483 | H | 37.4 | Very low | 39.8 | Very low | 176 Ų | 176 | 141.9 Ų | 141.9 | 82% | 0.815 | 79% | 0.787 | S | S | * | * | trans | -93.4 | 160.8 | 164.9 | -72.1 | -78.9 | 0 | 0 | 0 | 113.2 | ||||
| 484 | P | 43.7 | Very low | 40.8 | Very low | 128 Ų | 128 | 141.7 Ų | 141.7 | 83% | 0.831 | 78% | 0.783 | S | S | * | * | -137 | 162.7 | 120.8 | 38.4 | -28.9 | 0 | 0 | 0 | 114.9 | |||||
| 485 | S | 41.6 | Very low | 41.3 | Very low | 111 Ų | 111 | 149.2 Ų | 149.2 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | -83.3 | 151 | -176.8 | -39.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 486 | H | 38.3 | Very low | 41.5 | Very low | 189 Ų | 189 | 149.2 Ų | 149.2 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | trans | -158.5 | 140.4 | 148.3 | -119.2 | -77.4 | 0 | 0 | 0 | 114.3 | ||||
| 487 | N | 40.7 | Very low | 41.9 | Very low | 163 Ų | 163 | 152.3 Ų | 152.3 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | trans | -79.1 | 145.5 | 161.4 | -78.5 | -26.3 | 0 | 0 | 0 | 109.8 | ||||
| 488 | G | 34.3 | Very low | 42.2 | Very low | 76 Ų | 76 | 153 Ų | 153 | 78% | 0.784 | 80% | 0.795 | S | S | * | * | trans | -169.1 | 113.9 | 171 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 489 | L | 50.1 | Low | 43.3 | Very low | 164 Ų | 164 | 158.4 Ų | 158.4 | 86% | 0.859 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 143.1 | 161.6 | -72.2 | 165.5 | 0 | 0 | 0 | 109 | ||
| 490 | P | 48.7 | Very low | 43.8 | Very low | 126 Ų | 126 | 155.6 Ų | 155.6 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 136.6 | 175.4 | 27.2 | -33.7 | 0 | 0 | 0 | 111.1 | ||
| 491 | Q | 48.3 | Very low | 44.5 | Very low | 188 Ų | 188 | 153 Ų | 153 | 88% | 0.879 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -81 | 159.4 | 179 | -64.3 | -168.4 | 24.1 | 0 | 0 | 112.4 | ||
| 492 | R | 48.3 | Very low | 45 | Very low | 236 Ų | 236 | 154.6 Ų | 154.6 | 89% | 0.891 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 133.5 | -179.2 | -172.8 | -176.1 | -172.7 | 168 | 5.4 | 111.4 | ||
| 493 | P | 57.5 | Low | 45.7 | Very low | 110 Ų | 110 | 156.5 Ų | 156.5 | 71% | 0.714 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 151 | 172.7 | -24.4 | 34.8 | 0 | 0 | 0 | 113.6 | ||
| 494 | P | 52.2 | Low | 46.3 | Very low | 116 Ų | 116 | 155.3 Ų | 155.3 | 75% | 0.753 | 86% | 0.857 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 159.3 | 178.6 | 32.2 | -35.8 | 0 | 0 | 0 | 112.5 | ||
| 495 | R | 51.3 | Low | 46.4 | Very low | 248 Ų | 248 | 157.1 Ų | 157.1 | 94% | 0.936 | 86% | 0.859 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 124 | 167.3 | -82 | 178.5 | 165.2 | 160.3 | -7 | 110 | ||
| 496 | T | 47.8 | Very low | 46.8 | Very low | 129 Ų | 129 | 160.4 Ų | 160.4 | 79% | 0.791 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 147.8 | 159.9 | 43.2 | 0 | 0 | 0 | 0 | 110.2 | ||
| 497 | H | 44.9 | Very low | 47.4 | Very low | 183 Ų | 183 | 158.2 Ų | 158.2 | 85% | 0.847 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 159.3 | 165.4 | -85.1 | -106 | 0 | 0 | 0 | 110.3 | ||
| 498 | C | 36.5 | Very low | 48 | Very low | 115 Ų | 115 | 157.8 Ų | 157.8 | 78% | 0.777 | 86% | 0.863 | S | S | * | * | trans | -132.7 | 162.4 | 164.2 | -91.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 499 | P | 55.9 | Low | 49.2 | Very low | 202 Ų | 202 | 165.2 Ų | 165.2 | 100% | 1.312 | 87% | 0.871 | S | S | * | * | trans | -77.3 | 0 | -150.3 | 30.9 | -37 | 0 | 0 | 0 | 115.3 |
Retrieved 499 of 499 residues in 872.9 ms
(Link to these results)