| 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 | 45.7 | Very low | 60.3 | Low | 244 Ų | 244 | 143.8 Ų | 143.8 | 100% | 1.202 | 75% | 0.749 | S | S | * | * | 0 | 99.3 | 0 | -74.2 | -170.3 | -179.3 | 0 | 0 | 108 | |||||
| 2 | Y | 44.6 | Very low | 61.8 | Low | 232 Ų | 232 | 144.9 Ų | 144.9 | 91% | 0.91 | 74% | 0.744 | S | S | * | * | trans | -86.7 | 116.8 | 174.4 | -99.3 | -95.3 | 0 | 0 | 0 | 108.2 | V4 | Y2-V4 PolarHBondContact O-N 3.05Š| ||
| 3 | K | 49.8 | Very low | 63.4 | Low | 189 Ų | 189 | 141.6 Ų | 141.6 | 82% | 0.822 | 73% | 0.728 | S | S | * | * | trans | -71.7 | 119.3 | 169.3 | -77.5 | 178.9 | 175.7 | -179 | 0 | 107.3 | D5 | K3-D5 PolarHBondContact O-N 3.3Š| ||
| 4 | V | 53.9 | Low | 65 | Low | 123 Ų | 123 | 141.3 Ų | 141.3 | 75% | 0.745 | 72% | 0.719 | S | S | * | * | trans | -88.4 | 99 | 172.6 | 177.1 | 0 | 0 | 0 | 0 | 106.1 | Y2 L6 | Y2-V4 PolarHBondContact O-N 3.05Å; V4-L6 PolarHBondContact O-N 3.15Å | ||
| 5 | D | 61.5 | Low | 66.4 | Low | 145 Ų | 145 | 138.4 Ų | 138.4 | 78% | 0.775 | 71% | 0.711 | S | S | * | * | trans | -75.8 | 107.8 | 171.9 | -64.6 | -35.2 | 0 | 0 | 0 | 107.9 | K3 | K3-D5 PolarHBondContact O-N 3.3Š| ||
| 6 | L | 65.5 | Low | 67.7 | Low | 148 Ų | 148 | 133.9 Ų | 133.9 | 78% | 0.775 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 135.5 | 172.2 | -81.4 | 149 | 0 | 0 | 0 | 109.2 | V4 V8 | V4-L6 PolarHBondContact O-N 3.15Å; L6-V8 PolarHBondContact O-N 2.69Å |
| 7 | P | 64.3 | Low | 68.9 | Low | 120 Ų | 120 | 133.5 Ų | 133.5 | 78% | 0.779 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 128 | 179.5 | 25.8 | -31.6 | 0 | 0 | 0 | 110.3 | ||
| 8 | V | 65 | Low | 70.1 | Confident | 116 Ų | 116 | 129.1 Ų | 129.1 | 70% | 0.703 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 131.2 | 174.9 | 178.8 | 0 | 0 | 0 | 0 | 108.8 | L6 D10 | L6-V8 PolarHBondContact O-N 2.69Å; V8-D10 PolarHBondContact O-N 3.43Å |
| 9 | D | 66.8 | Low | 71.2 | Confident | 118 Ų | 118 | 131.8 Ų | 131.8 | 63% | 0.631 | 67% | 0.673 | S | S | * | * | trans | -77.2 | 82.2 | -178.9 | -175.4 | 13.8 | 0 | 0 | 0 | 111.2 | S11 | D9-S11 PolarHBondContact O-N 2.76Å; D9-S11 VanDerWaalsContact O-N 3.08Å; D9-S11 WeakPolarHBondContact OD1-CB 3.11Å; D9-S11 PolarHBondContact OD1-N 3.49Å | ||
| 10 | D | 71.8 | Confident | 72.2 | Confident | 79 Ų | 79 | 132.5 Ų | 132.5 | 42% | 0.422 | 67% | 0.666 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.2 | 1 | 179.2 | -60.6 | -24.3 | 0 | 0 | 0 | 113.9 | V8 K12 D13 K14 | V8-D10 PolarHBondContact O-N 3.43Å; D10-K12 VanDerWaalsContact C-N 3.31Å; D10-K12 PolarHBondContact O-N 3.17Å; D10-D13 PolarHBondContact O-N 2.98Å; D10-K14 WeakPolarHBondContact O-CG 3.41Å; D10-K14 PolarHBondContact O-N 3.48Å |
| 11 | S | 75.1 | Confident | 73.1 | Confident | 68 Ų | 68 | 129 Ų | 129 | 48% | 0.476 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -59.1 | -42.2 | -175.6 | -179.1 | 0 | 0 | 0 | 0 | 112.2 | D9 K14 V15 | D9-S11 PolarHBondContact O-N 2.76Å; D9-S11 VanDerWaalsContact O-N 3.08Å; D9-S11 WeakPolarHBondContact OD1-CB 3.11Å; D9-S11 PolarHBondContact OD1-N 3.49Å; S11-K14 PolarHBondContact O-N 2.96Å; S11-V15 WeakPolarHBondContact O-CG2 3.18Å; S11-V15 PolarHBondContact O-N 3.44Å; S11-V15 VanDerWaalsContact O-N 3.15Å |
| 12 | K | 78.1 | Confident | 75.2 | Confident | 157 Ų | 157 | 120.1 Ų | 120.1 | 68% | 0.683 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -68 | -40 | -179.5 | -66.8 | 179.5 | -177.3 | 172.6 | 0 | 111.8 | D10 V15 V16 | D10-K12 VanDerWaalsContact C-N 3.31Å; D10-K12 PolarHBondContact O-N 3.17Å; K12-V15 PolarHBondContact O-N 3.43Å; K12-V16 WeakPolarHBondContact O-CG2 3.4Å; K12-V16 PolarHBondContact O-N 3.3Å |
| 13 | D | 82.1 | Confident | 77.4 | Confident | 102 Ų | 102 | 113.5 Ų | 113.5 | 55% | 0.545 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.1 | -38.9 | 179.6 | -68.3 | -26.7 | 0 | 0 | 0 | 111.4 | D10 V15 V16 E17 | D10-D13 PolarHBondContact O-N 2.98Å; D13-V15 VanDerWaalsContact C-N 3.33Å; D13-V15 PolarHBondContact O-N 3.27Å; D13-V16 PolarHBondContact O-N 3.5Å; D13-E17 WeakPolarHBondContact O-CB 3.5Å; D13-E17 WeakPolarHBondContact O-CG 3.36Å; D13-E17 PolarHBondContact O-N 3.14Å |
| 14 | K | 85.3 | Confident | 79.4 | Confident | 137 Ų | 137 | 112 Ų | 112 | 60% | 0.596 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -60.3 | -40.3 | 172.7 | -71.1 | 171.7 | -173.1 | 172.5 | 0 | 112.5 | D10 S11 A18 | D10-K14 WeakPolarHBondContact O-CG 3.41Å; D10-K14 PolarHBondContact O-N 3.48Å; S11-K14 PolarHBondContact O-N 2.96Å; K14-A18 VanDerWaalsContact O-CB 3.29Å; K14-A18 WeakPolarHBondContact O-CB 3.3Å; K14-A18 PolarHBondContact O-N 3.16Å |
| 15 | V | 86.6 | Confident | 81 | Confident | 98 Ų | 98 | 108.4 Ų | 108.4 | 59% | 0.594 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.5 | -41.7 | 176 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | S11 K12 D13 A18 R19 | S11-V15 WeakPolarHBondContact O-CG2 3.18Å; S11-V15 PolarHBondContact O-N 3.44Å; S11-V15 VanDerWaalsContact O-N 3.15Å; K12-V15 PolarHBondContact O-N 3.43Å; D13-V15 VanDerWaalsContact C-N 3.33Å; D13-V15 PolarHBondContact O-N 3.27Å; V15-A18 PolarHBondContact O-N 3.12Å; V15-R19 PolarHBondContact O-N 3.44Å |
| 16 | V | 87.4 | Confident | 82.3 | Confident | 66 Ų | 66 | 109.2 Ų | 109.2 | 40% | 0.4 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -66 | -41.8 | 177.5 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | K12 D13 R19 R20 | K12-V16 WeakPolarHBondContact O-CG2 3.4Å; K12-V16 PolarHBondContact O-N 3.3Å; D13-V16 PolarHBondContact O-N 3.5Å; V16-R19 PolarHBondContact O-N 3.32Å; V16-R20 WeakPolarHBondContact O-CG 3.24Å; V16-R20 PolarHBondContact O-N 3.02Å |
| 17 | E | 88.7 | Confident | 83.5 | Confident | 128 Ų | 128 | 107.8 Ų | 107.8 | 60% | 0.598 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -67.1 | -39.9 | 176.8 | -73.4 | -167.5 | 156.7 | 0 | 0 | 112.7 | D13 R19 R20 S21 | D13-E17 WeakPolarHBondContact O-CB 3.5Å; D13-E17 WeakPolarHBondContact O-CG 3.36Å; D13-E17 PolarHBondContact O-N 3.14Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.7Å; E17-R20 PolarHBondContact O-N 3.49Å; E17-S21 WeakPolarHBondContact O-CB 3.43Å; E17-S21 PolarHBondContact O-N 2.86Å; E17-S21 PolarHBondContact O-OG 3.49Å |
| 18 | A | 89 | Confident | 84.6 | Confident | 54 Ų | 54 | 105.3 Ų | 105.3 | 45% | 0.446 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.5 | -39.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.8 | K14 V15 S21 A22 | K14-A18 VanDerWaalsContact O-CB 3.29Å; K14-A18 WeakPolarHBondContact O-CB 3.3Å; K14-A18 PolarHBondContact O-N 3.16Å; V15-A18 PolarHBondContact O-N 3.12Å; A18-S21 WeakPolarHBondContact CA-OG 3.44Å; A18-S21 PolarHBondContact O-N 2.94Å; A18-S21 PolarHBondContact O-OG 2.85Å; A18-A22 VanDerWaalsContact O-CB 3.32Å; A18-A22 WeakPolarHBondContact O-CB 3.5Å; A18-A22 PolarHBondContact O-N 2.76Å |
| 19 | R | 91.5 | Very high | 85.5 | Confident | 180 Ų | 180 | 107.3 Ų | 107.3 | 68% | 0.679 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.3 | -43.8 | 174.7 | -172.3 | 173.6 | -179.5 | 162.2 | 1.3 | 111.6 | V15 V16 E17 A22 E23 | V15-R19 PolarHBondContact O-N 3.44Å; V16-R19 PolarHBondContact O-N 3.32Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.7Å; R19-A22 PolarHBondContact O-N 3.29Å; R19-E23 WeakPolarHBondContact O-CB 3.47Å; R19-E23 PolarHBondContact O-N 3.08Å |
| 20 | R | 91.9 | Very high | 86.4 | Confident | 145 Ų | 145 | 107 Ų | 107 | 55% | 0.547 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 176.5 | -73.5 | 174.9 | 178.2 | 177.2 | 0.5 | 111.7 | V16 E17 E23 R24 | V16-R20 WeakPolarHBondContact O-CG 3.24Å; V16-R20 PolarHBondContact O-N 3.02Å; E17-R20 PolarHBondContact O-N 3.49Å; R20-E23 PolarHBondContact O-N 2.94Å; R20-R24 WeakPolarHBondContact O-CG 3.46Å; R20-R24 PolarHBondContact O-N 3.44Å |
| 21 | S | 91.1 | Very high | 87.2 | Confident | 61 Ų | 61 | 110.7 Ų | 110.7 | 43% | 0.427 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -68.2 | -41.6 | 177.6 | 68.6 | 0 | 0 | 0 | 0 | 111.8 | E17 A18 E23 R24 A25 | E17-S21 WeakPolarHBondContact O-CB 3.43Å; E17-S21 PolarHBondContact O-N 2.86Å; E17-S21 PolarHBondContact O-OG 3.49Å; A18-S21 WeakPolarHBondContact CA-OG 3.44Å; A18-S21 PolarHBondContact O-N 2.94Å; A18-S21 PolarHBondContact O-OG 2.85Å; S21-E23 PolarHBondContact O-N 3.45Å; S21-R24 PolarHBondContact O-N 3.44Å; S21-A25 PolarHBondContact O-N 3.17Å |
| 22 | A | 90.2 | Very high | 87.8 | Confident | 57 Ų | 57 | 110.5 Ų | 110.5 | 47% | 0.471 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A18 R19 A25 R26 | A18-A22 VanDerWaalsContact O-CB 3.32Å; A18-A22 WeakPolarHBondContact O-CB 3.5Å; A18-A22 PolarHBondContact O-N 2.76Å; R19-A22 PolarHBondContact O-N 3.29Å; A22-A25 PolarHBondContact O-N 3.05Å; A22-R26 WeakPolarHBondContact O-CB 3.49Å; A22-R26 PolarHBondContact O-N 3.01Å |
| 23 | E | 90.6 | Very high | 88.2 | Confident | 93 Ų | 93 | 106.8 Ų | 106.8 | 44% | 0.435 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.4 | -39.7 | 175 | -86.9 | -171.8 | -175.7 | 0 | 0 | 112.7 | R19 R20 S21 R26 K27 | R19-E23 WeakPolarHBondContact O-CB 3.47Å; R19-E23 PolarHBondContact O-N 3.08Å; R20-E23 PolarHBondContact O-N 2.94Å; S21-E23 PolarHBondContact O-N 3.45Å; E23-R26 PolarHBondContact O-N 2.95Å; E23-K27 WeakPolarHBondContact O-CB 3.29Å; E23-K27 WeakPolarHBondContact O-CG 3.32Å; E23-K27 PolarHBondContact O-N 2.9Å |
| 24 | R | 91.1 | Very high | 88.3 | Confident | 157 Ų | 157 | 111.1 Ų | 111.1 | 59% | 0.592 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.2 | -45.6 | 173.4 | -73.3 | -177 | -140.1 | 113 | -3.1 | 111.1 | R20 S21 R26 K27 A28 | R20-R24 WeakPolarHBondContact O-CG 3.46Å; R20-R24 PolarHBondContact O-N 3.44Å; S21-R24 PolarHBondContact O-N 3.44Å; R24-R26 VanDerWaalsContact C-N 3.31Å; R24-R26 PolarHBondContact O-N 2.95Å; R24-K27 PolarHBondContact O-N 3.5Å; R24-A28 WeakPolarHBondContact O-CB 3.33Å; R24-A28 PolarHBondContact O-N 2.99Å |
| 25 | A | 88.6 | Confident | 88.2 | Confident | 47 Ų | 47 | 108.9 Ų | 108.9 | 39% | 0.388 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.5 | -33.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | S21 A22 R29 | S21-A25 PolarHBondContact O-N 3.17Å; A22-A25 PolarHBondContact O-N 3.05Å; A25-R29 WeakPolarHBondContact O-CG 3.4Å; A25-R29 PolarHBondContact O-N 3.26Å; A25-R29 PolarHBondContact O-NE 3.01Å |
| 26 | R | 87.8 | Confident | 88 | Confident | 163 Ų | 163 | 111.5 Ų | 111.5 | 62% | 0.615 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -70 | -47 | 173.5 | -176.4 | 177.9 | 178.3 | -96.8 | -1.3 | 111.6 | A22 E23 R24 A28 R29 F30 | A22-R26 WeakPolarHBondContact O-CB 3.49Å; A22-R26 PolarHBondContact O-N 3.01Å; E23-R26 PolarHBondContact O-N 2.95Å; R24-R26 VanDerWaalsContact C-N 3.31Å; R24-R26 PolarHBondContact O-N 2.95Å; R26-A28 PolarHBondContact O-N 2.96Å; R26-R29 PolarHBondContact O-N 3.49Å; R26-F30 WeakPolarHBondContact O-CB 3.36Å; R26-F30 PolarHBondContact O-N 3.41Å |
| 27 | K | 90.1 | Very high | 87.8 | Confident | 117 Ų | 117 | 113.6 Ų | 113.6 | 51% | 0.509 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.1 | -46.3 | 177.7 | -76.7 | -179.4 | 179.3 | 178.5 | 0 | 110.8 | E23 R24 R29 F30 F31 | E23-K27 WeakPolarHBondContact O-CB 3.29Å; E23-K27 WeakPolarHBondContact O-CG 3.32Å; E23-K27 PolarHBondContact O-N 2.9Å; R24-K27 PolarHBondContact O-N 3.5Å; K27-R29 PolarHBondContact O-N 3.19Å; K27-F30 PolarHBondContact O-N 3.37Å; K27-F30 VanDerWaalsContact O-N 3.15Å; K27-F31 HydrophobicContact CB-CD2 3.98Å; K27-F31 HydrophobicContact CB-CE2 4.04Å; K27-F31 HydrophobicContact CD-CE2 4.48Å; K27-F31 HydrophobicContact CG-CD2 4.49Å; K27-F31 HydrophobicContact CG-CE2 4.05Å; K27-F31 WeakPolarHBondContact O-CB 3.36Å; K27-F31 WeakPolarHBondContact O-CD2 3.3Å; K27-F31 PolarHBondContact O-N 2.95Å |
| 28 | A | 88 | Confident | 87.5 | Confident | 68 Ų | 68 | 113.8 Ų | 113.8 | 56% | 0.562 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -56.2 | -36.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | R24 R26 N32 | R24-A28 WeakPolarHBondContact O-CB 3.33Å; R24-A28 PolarHBondContact O-N 2.99Å; R26-A28 PolarHBondContact O-N 2.96Å; A28-N32 WeakPolarHBondContact O-CB 3.4Å |
| 29 | R | 84.6 | Confident | 87.2 | Confident | 159 Ų | 159 | 113.6 Ų | 113.6 | 60% | 0.6 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -73.8 | -44.5 | 175.1 | -72.1 | 179.7 | -79.7 | -179.3 | -3.4 | 112.6 | A25 R26 K27 N32 | A25-R29 WeakPolarHBondContact O-CG 3.4Å; A25-R29 PolarHBondContact O-N 3.26Å; A25-R29 PolarHBondContact O-NE 3.01Å; R26-R29 PolarHBondContact O-N 3.49Å; K27-R29 PolarHBondContact O-N 3.19Å; R29-N32 PolarHBondContact O-N 3.34Å |
| 30 | F | 84.9 | Confident | 87 | Confident | 112 Ų | 112 | 109.5 Ų | 109.5 | 49% | 0.491 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69.2 | -37.9 | -175.6 | -173.1 | -97.8 | 0 | 0 | 0 | 113.3 | R26 K27 N32 | R26-F30 WeakPolarHBondContact O-CB 3.36Å; R26-F30 PolarHBondContact O-N 3.41Å; K27-F30 PolarHBondContact O-N 3.37Å; K27-F30 VanDerWaalsContact O-N 3.15Å; F30-N32 VanDerWaalsContact C-N 3.32Å |
| 31 | F | 88.8 | Confident | 86.8 | Confident | 155 Ų | 155 | 107.5 Ų | 107.5 | 68% | 0.68 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -9.7 | 179.3 | -72.2 | -68.1 | 0 | 0 | 0 | 113.5 | K27 P33 | K27-F31 HydrophobicContact CB-CD2 3.98Å; K27-F31 HydrophobicContact CB-CE2 4.04Å; K27-F31 HydrophobicContact CD-CE2 4.48Å; K27-F31 HydrophobicContact CG-CD2 4.49Å; K27-F31 HydrophobicContact CG-CE2 4.05Å; K27-F31 WeakPolarHBondContact O-CB 3.36Å; K27-F31 WeakPolarHBondContact O-CD2 3.3Å; K27-F31 PolarHBondContact O-N 2.95Å; F31-P33 VanDerWaalsContact O-CD 3.25Å; F31-P33 WeakPolarHBondContact O-CD 3.39Å |
| 32 | N | 86.8 | Confident | 86.8 | Confident | 65 Ų | 65 | 110 Ų | 110 | 35% | 0.348 | 55% | 0.549 | S | S | . | . | trans | -87.9 | 106.6 | 172.7 | -172.9 | -31.6 | 0 | 0 | 0 | 110.2 | A28 R29 F30 R34 L35 R36 | A28-N32 WeakPolarHBondContact O-CB 3.4Å; R29-N32 PolarHBondContact O-N 3.34Å; F30-N32 VanDerWaalsContact C-N 3.32Å; N32-R34 VanDerWaalsContact C-N 3.27Å; N32-R34 PolarHBondContact O-N 3.43Å; N32-R34 PolarHBondContact OD1-N 3.38Å; N32-R34 VanDerWaalsContact OD1-N 3.09Å; N32-L35 HydrophobicContact CB-CB 4.17Å; N32-L35 HydrophobicContact CB-CD1 4.09Å; N32-L35 HydrophobicContact CB-CG 4.27Å; N32-L35 PolarHBondContact O-N 2.9Å; N32-L35 PolarHBondContact OD1-N 3.04Å; N32-R36 WeakPolarHBondContact O-CB 3.49Å; N32-R36 PolarHBondContact O-N 3.49Å | ||
| 33 | P | 86.1 | Confident | 86.9 | Confident | 79 Ų | 79 | 112.8 Ų | 112.8 | 51% | 0.513 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.3 | -30.6 | -175.3 | 26 | -34 | 0 | 0 | 0 | 112.7 | F31 R36 V37 | F31-P33 VanDerWaalsContact O-CD 3.25Å; F31-P33 WeakPolarHBondContact O-CD 3.39Å; P33-R36 PolarHBondContact O-N 3.25Å; P33-V37 VanDerWaalsContact O-CG2 3.28Å; P33-V37 WeakPolarHBondContact O-CG2 3.37Å; P33-V37 PolarHBondContact O-N 2.93Å |
| 34 | R | 84.9 | Confident | 87 | Confident | 192 Ų | 192 | 109.9 Ų | 109.9 | 73% | 0.725 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -71.5 | -43.6 | 180 | -172.9 | 174.5 | 176.1 | 146.2 | -1.6 | 111.8 | N32 R36 V37 M38 | N32-R34 VanDerWaalsContact C-N 3.27Å; N32-R34 PolarHBondContact O-N 3.43Å; N32-R34 PolarHBondContact OD1-N 3.38Å; N32-R34 VanDerWaalsContact OD1-N 3.09Å; R34-R36 VanDerWaalsContact C-N 3.29Å; R34-V37 PolarHBondContact O-N 3.38Å; R34-M38 CarbonylContact O-C 3.51Å; R34-M38 PolarHBondContact O-N 3.5Å |
| 35 | L | 83.8 | Confident | 87.2 | Confident | 91 Ų | 91 | 106 Ų | 106 | 48% | 0.476 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.9 | -29.3 | 174.1 | -66.9 | 177.4 | 0 | 0 | 0 | 112.2 | N32 G39 | N32-L35 HydrophobicContact CB-CB 4.17Å; N32-L35 HydrophobicContact CB-CD1 4.09Å; N32-L35 HydrophobicContact CB-CG 4.27Å; N32-L35 PolarHBondContact O-N 2.9Å; N32-L35 PolarHBondContact OD1-N 3.04Å; L35-G39 WeakPolarHBondContact O-CA 3.32Å; L35-G39 PolarHBondContact O-N 2.94Å |
| 36 | R | 81.8 | Confident | 87.5 | Confident | 153 Ų | 153 | 108.2 Ų | 108.2 | 58% | 0.577 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -70.4 | -36.7 | 175.9 | -170.8 | 176.7 | 70.6 | -150.7 | 5.6 | 112.9 | N32 P33 R34 | N32-R36 WeakPolarHBondContact O-CB 3.49Å; N32-R36 PolarHBondContact O-N 3.49Å; P33-R36 PolarHBondContact O-N 3.25Å; R34-R36 VanDerWaalsContact C-N 3.29Å |
| 37 | V | 83.4 | Confident | 87.9 | Confident | 110 Ų | 110 | 106.9 Ų | 106.9 | 67% | 0.667 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -90.9 | -37.8 | -177.9 | -179.7 | 0 | 0 | 0 | 0 | 112 | P33 R34 | P33-V37 VanDerWaalsContact O-CG2 3.28Å; P33-V37 WeakPolarHBondContact O-CG2 3.37Å; P33-V37 PolarHBondContact O-N 2.93Å; R34-V37 PolarHBondContact O-N 3.38Å |
| 38 | M | 82.7 | Confident | 88.1 | Confident | 131 Ų | 131 | 106.4 Ų | 106.4 | 65% | 0.645 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -137.5 | 46.5 | -175 | -61.9 | -177.6 | -72.5 | 0 | 0 | 111.8 | R34 V40 | R34-M38 CarbonylContact O-C 3.51Å; R34-M38 PolarHBondContact O-N 3.5Å; M38-V40 PolarHBondContact O-N 3.2Å |
| 39 | G | 83.1 | Confident | 88.5 | Confident | 50 Ų | 50 | 107.7 Ų | 107.7 | 52% | 0.515 | 55% | 0.545 | S | S | . | . | trans | -75.6 | 102.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | L35 | L35-G39 WeakPolarHBondContact O-CA 3.32Å; L35-G39 PolarHBondContact O-N 2.94Å | ||
| 40 | V | 86.8 | Confident | 89.1 | Confident | 94 Ų | 94 | 105.8 Ų | 105.8 | 57% | 0.57 | 55% | 0.546 | S | S | * | . | trans | -123.3 | 130.2 | 176.6 | -179.3 | 0 | 0 | 0 | 0 | 109.4 | M38 L42 L45 | M38-V40 PolarHBondContact O-N 3.2Å; V40-L42 HydrophobicContact CG1-CD2 4.32Å; V40-L42 PolarHBondContact O-N 3.4Å; V40-L45 HydrophobicContact CG1-CD1 3.28Å; V40-L45 HydrophobicContact CG1-CG 4.44Å | ||
| 41 | D | 88.6 | Confident | 89.6 | Confident | 104 Ų | 104 | 105.2 Ų | 105.2 | 56% | 0.556 | 55% | 0.545 | S | S | * | . | trans | -84.6 | 95.1 | 173.9 | -170.2 | -21.1 | 0 | 0 | 0 | 109.6 | D43 A44 L45 | D41-D43 VanDerWaalsContact C-N 3.32Å; D41-D43 PolarHBondContact O-N 2.84Å; D41-D43 PolarHBondContact OD1-N 3.37Å; D41-A44 HydrophobicContact CB-CB 3.98Å; D41-A44 VanDerWaalsContact CG-CB 3.44Å; D41-A44 PolarHBondContact OD1-N 2.9Å; D41-L45 WeakPolarHBondContact O-CG 3.48Å; D41-L45 PolarHBondContact O-N 2.91Å; D41-L45 VanDerWaalsContact O-N 3.1Å | ||
| 42 | L | 89.4 | Confident | 90 | Very high | 114 Ų | 114 | 101.9 Ų | 101.9 | 60% | 0.597 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.2 | -34.9 | -176.9 | -67.2 | 175.3 | 0 | 0 | 0 | 112.1 | V40 L45 N46 | V40-L42 HydrophobicContact CG1-CD2 4.32Å; V40-L42 PolarHBondContact O-N 3.4Å; L42-L45 PolarHBondContact O-N 3.5Å; L42-N46 VanDerWaalsContact O-CB 3.31Å; L42-N46 WeakPolarHBondContact O-CB 3.37Å; L42-N46 PolarHBondContact O-N 2.93Å; L42-N46 PolarHBondContact O-ND2 3.45Å; L42-N46 VanDerWaalsContact O-ND2 3.09Å |
| 43 | D | 92.8 | Very high | 90.5 | Very high | 115 Ų | 115 | 105.7 Ų | 105.7 | 62% | 0.615 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -71.4 | -43.4 | -177.8 | -67 | -27.7 | 0 | 0 | 0 | 110.5 | D41 L45 N46 Q47 | D41-D43 VanDerWaalsContact C-N 3.32Å; D41-D43 PolarHBondContact O-N 2.84Å; D41-D43 PolarHBondContact OD1-N 3.37Å; D43-L45 PolarHBondContact O-N 2.91Å; D43-N46 PolarHBondContact O-N 3.25Å; D43-Q47 WeakPolarHBondContact O-CG 3.43Å; D43-Q47 PolarHBondContact O-N 2.95Å |
| 44 | A | 93.7 | Very high | 90.9 | Very high | 32 Ų | 32 | 108 Ų | 108 | 26% | 0.264 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.9 | -42.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112 | D41 Q47 Q48 | D41-A44 HydrophobicContact CB-CB 3.98Å; D41-A44 VanDerWaalsContact CG-CB 3.44Å; D41-A44 PolarHBondContact OD1-N 2.9Å; A44-Q47 PolarHBondContact O-N 3.36Å; A44-Q48 WeakPolarHBondContact O-CG 3.4Å; A44-Q48 PolarHBondContact O-N 3.38Å |
| 45 | L | 94.3 | Very high | 91.4 | Very high | 75 Ų | 75 | 103.5 Ų | 103.5 | 39% | 0.393 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.2 | -42.5 | 175.9 | -77 | 175.5 | 0 | 0 | 0 | 112.2 | V40 D41 L42 D43 Q47 Q48 V49 | V40-L45 HydrophobicContact CG1-CD1 3.28Å; V40-L45 HydrophobicContact CG1-CG 4.44Å; D41-L45 WeakPolarHBondContact O-CG 3.48Å; D41-L45 PolarHBondContact O-N 2.91Å; D41-L45 VanDerWaalsContact O-N 3.1Å; L42-L45 PolarHBondContact O-N 3.5Å; D43-L45 PolarHBondContact O-N 2.91Å; L45-Q47 VanDerWaalsContact C-N 3.32Å; L45-Q47 PolarHBondContact O-N 2.99Å; L45-Q48 PolarHBondContact O-N 2.98Å; L45-V49 WeakPolarHBondContact O-CG2 3.44Å; L45-V49 PolarHBondContact O-N 3.24Å |
| 46 | N | 95.3 | Very high | 92 | Very high | 93 Ų | 93 | 107.4 Ų | 107.4 | 50% | 0.497 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.9 | -41.1 | 176.4 | -74.3 | -28.8 | 0 | 0 | 0 | 111.3 | L42 D43 V49 L50 | L42-N46 VanDerWaalsContact O-CB 3.31Å; L42-N46 WeakPolarHBondContact O-CB 3.37Å; L42-N46 PolarHBondContact O-N 2.93Å; L42-N46 PolarHBondContact O-ND2 3.45Å; L42-N46 VanDerWaalsContact O-ND2 3.09Å; D43-N46 PolarHBondContact O-N 3.25Å; N46-V49 PolarHBondContact O-N 3.16Å; N46-L50 WeakPolarHBondContact O-CG 3.35Å; N46-L50 PolarHBondContact O-N 3.28Å |
| 47 | Q | 95.9 | Very high | 92.6 | Very high | 135 Ų | 135 | 102.9 Ų | 102.9 | 63% | 0.631 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.5 | -45.3 | 173.4 | -73 | 176.5 | 6.3 | 0 | 0 | 111.9 | D43 A44 L45 V49 L50 E51 | D43-Q47 WeakPolarHBondContact O-CG 3.43Å; D43-Q47 PolarHBondContact O-N 2.95Å; A44-Q47 PolarHBondContact O-N 3.36Å; L45-Q47 VanDerWaalsContact C-N 3.32Å; L45-Q47 PolarHBondContact O-N 2.99Å; Q47-V49 VanDerWaalsContact C-N 3.32Å; Q47-V49 PolarHBondContact O-N 3.38Å; Q47-L50 PolarHBondContact O-N 2.89Å; Q47-E51 WeakPolarHBondContact O-CB 3.49Å; Q47-E51 PolarHBondContact O-N 3.44Å |
| 48 | Q | 94.5 | Very high | 93.1 | Very high | 108 Ų | 108 | 100.4 Ų | 100.4 | 51% | 0.505 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.4 | -39.4 | 176.3 | -74 | 178.6 | -4.6 | 0 | 0 | 112.5 | A44 L45 E51 N52 | A44-Q48 WeakPolarHBondContact O-CG 3.4Å; A44-Q48 PolarHBondContact O-N 3.38Å; L45-Q48 PolarHBondContact O-N 2.98Å; Q48-E51 PolarHBondContact O-N 2.9Å; Q48-N52 WeakPolarHBondContact O-CB 3.41Å; Q48-N52 PolarHBondContact O-N 2.94Å; Q48-N52 PolarHBondContact O-ND2 3.43Å |
| 49 | V | 96.8 | Very high | 93.7 | Very high | 95 Ų | 95 | 99.8 Ų | 99.8 | 58% | 0.576 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.5 | -43.9 | 176.1 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | L45 N46 Q47 N52 K53 | L45-V49 WeakPolarHBondContact O-CG2 3.44Å; L45-V49 PolarHBondContact O-N 3.24Å; N46-V49 PolarHBondContact O-N 3.16Å; Q47-V49 VanDerWaalsContact C-N 3.32Å; Q47-V49 PolarHBondContact O-N 3.38Å; V49-N52 PolarHBondContact O-N 3.29Å; V49-K53 WeakPolarHBondContact O-CB 3.39Å; V49-K53 PolarHBondContact O-N 3.02Å |
| 50 | L | 96.5 | Very high | 94.3 | Very high | 119 Ų | 119 | 104.8 Ų | 104.8 | 62% | 0.623 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63 | -43.9 | 176 | -71 | 174.1 | 0 | 0 | 0 | 111.6 | N46 Q47 K53 H54 | N46-L50 WeakPolarHBondContact O-CG 3.35Å; N46-L50 PolarHBondContact O-N 3.28Å; Q47-L50 PolarHBondContact O-N 2.89Å; L50-K53 PolarHBondContact O-N 3.46Å; L50-H54 WeakPolarHBondContact O-CB 3.5Å; L50-H54 PolarHBondContact O-N 2.88Å |
| 51 | E | 96.3 | Very high | 94.8 | Very high | 100 Ų | 100 | 104.3 Ų | 104.3 | 47% | 0.467 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.7 | -45.3 | 177.2 | -165.2 | -169.6 | 159.3 | 0 | 0 | 111.3 | Q47 Q48 K53 H54 K55 | Q47-E51 WeakPolarHBondContact O-CB 3.49Å; Q47-E51 PolarHBondContact O-N 3.44Å; Q48-E51 PolarHBondContact O-N 2.9Å; E51-K53 VanDerWaalsContact C-N 3.34Å; E51-K53 PolarHBondContact O-N 3.41Å; E51-H54 WeakPolarHBondContact O-CB 3.42Å; E51-H54 PolarHBondContact O-N 3.47Å; E51-K55 WeakPolarHBondContact O-CG 3.34Å; E51-K55 PolarHBondContact O-N 3.3Å; E51-K55 WeakPolarHBondContact OE1-CE 3.47Å; E51-K55 IonicContact OE1-NZ 2.86Å; E51-K55 PolarHBondContact OE1-NZ 3.49Å |
| 52 | N | 96.4 | Very high | 95.1 | Very high | 85 Ų | 85 | 107.1 Ų | 107.1 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.9 | -38.7 | 176.4 | -79.4 | -24.4 | 0 | 0 | 0 | 112.4 | Q48 V49 H54 K55 R56 | Q48-N52 WeakPolarHBondContact O-CB 3.41Å; Q48-N52 PolarHBondContact O-N 2.94Å; Q48-N52 PolarHBondContact O-ND2 3.43Å; V49-N52 PolarHBondContact O-N 3.29Å; N52-H54 VanDerWaalsContact C-N 3.34Å; N52-K55 PolarHBondContact O-N 3.1Å; N52-R56 WeakPolarHBondContact O-CB 3.37Å; N52-R56 VanDerWaalsContact O-CG 3.29Å; N52-R56 WeakPolarHBondContact O-CG 3.5Å; N52-R56 PolarHBondContact O-N 3.01Å |
| 53 | K | 96.8 | Very high | 95.3 | Very high | 145 Ų | 145 | 106.2 Ų | 106.2 | 63% | 0.63 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.4 | -41.5 | 174.9 | -170.7 | 176.7 | -179.7 | -179.6 | 0 | 110.9 | V49 L50 E51 S57 | V49-K53 WeakPolarHBondContact O-CB 3.39Å; V49-K53 PolarHBondContact O-N 3.02Å; L50-K53 PolarHBondContact O-N 3.46Å; E51-K53 VanDerWaalsContact C-N 3.34Å; E51-K53 PolarHBondContact O-N 3.41Å; K53-S57 PolarHBondContact O-N 3.3Å; K53-S57 PolarHBondContact O-OG 2.98Å |
| 54 | H | 95.6 | Very high | 95.5 | Very high | 128 Ų | 128 | 107.2 Ų | 107.2 | 59% | 0.593 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.8 | -49.4 | 175.6 | -175.8 | 67.7 | 0 | 0 | 0 | 111.5 | L50 E51 N52 R56 S57 C58 | L50-H54 WeakPolarHBondContact O-CB 3.5Å; L50-H54 PolarHBondContact O-N 2.88Å; E51-H54 WeakPolarHBondContact O-CB 3.42Å; E51-H54 PolarHBondContact O-N 3.47Å; N52-H54 VanDerWaalsContact C-N 3.34Å; H54-R56 PolarHBondContact O-N 3.15Å; H54-S57 WeakPolarHBondContact O-CB 3.48Å; H54-S57 PolarHBondContact O-N 3.05Å; H54-S57 VanDerWaalsContact O-N 3.07Å; H54-C58 PolarHBondContact O-N 3.02Å; H54-C58 PolarHBondContact O-SG 2.93Å |
| 55 | K | 95.2 | Very high | 95.6 | Very high | 97 Ų | 97 | 110 Ų | 110 | 42% | 0.422 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -54.1 | -49.7 | 175.4 | -74.4 | 175.3 | -177.6 | 166.6 | 0 | 111.9 | E51 N52 S57 C58 E59 | E51-K55 WeakPolarHBondContact O-CG 3.34Å; E51-K55 PolarHBondContact O-N 3.3Å; E51-K55 WeakPolarHBondContact OE1-CE 3.47Å; E51-K55 IonicContact OE1-NZ 2.86Å; E51-K55 PolarHBondContact OE1-NZ 3.49Å; N52-K55 PolarHBondContact O-N 3.1Å; K55-S57 VanDerWaalsContact C-N 3.31Å; K55-S57 PolarHBondContact O-N 3.47Å; K55-C58 PolarHBondContact O-N 3.42Å; K55-E59 WeakPolarHBondContact O-CG 3.33Å; K55-E59 PolarHBondContact O-N 3.47Å |
| 56 | R | 95.8 | Very high | 95.6 | Very high | 172 Ų | 172 | 111.6 Ų | 111.6 | 65% | 0.649 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -59.6 | -39.4 | 176.4 | -73.9 | 175.1 | -179.6 | -174.2 | 1 | 112.6 | N52 H54 K60 | N52-R56 WeakPolarHBondContact O-CB 3.37Å; N52-R56 VanDerWaalsContact O-CG 3.29Å; N52-R56 WeakPolarHBondContact O-CG 3.5Å; N52-R56 PolarHBondContact O-N 3.01Å; H54-R56 PolarHBondContact O-N 3.15Å; R56-K60 VanDerWaalsContact O-CG 3.32Å; R56-K60 WeakPolarHBondContact O-CG 3.41Å; R56-K60 PolarHBondContact O-N 2.88Å |
| 57 | S | 94.8 | Very high | 95.7 | Very high | 58 Ų | 58 | 111.1 Ų | 111.1 | 41% | 0.406 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.4 | -43.1 | 175.8 | -75.5 | 0 | 0 | 0 | 0 | 111.8 | K53 H54 K55 K60 L61 | K53-S57 PolarHBondContact O-N 3.3Å; K53-S57 PolarHBondContact O-OG 2.98Å; H54-S57 WeakPolarHBondContact O-CB 3.48Å; H54-S57 PolarHBondContact O-N 3.05Å; H54-S57 VanDerWaalsContact O-N 3.07Å; K55-S57 VanDerWaalsContact C-N 3.31Å; K55-S57 PolarHBondContact O-N 3.47Å; S57-K60 PolarHBondContact O-N 3.28Å; S57-L61 WeakPolarHBondContact O-CD1 3.3Å; S57-L61 PolarHBondContact O-N 2.85Å |
| 58 | C | 94.4 | Very high | 95.7 | Very high | 58 Ų | 58 | 107.2 Ų | 107.2 | 39% | 0.392 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 175.8 | -69.2 | 0 | 0 | 0 | 0 | 112.2 | H54 K55 L61 R62 | H54-C58 PolarHBondContact O-N 3.02Å; H54-C58 PolarHBondContact O-SG 2.93Å; K55-C58 PolarHBondContact O-N 3.42Å; C58-L61 WeakPolarHBondContact O-CB 3.49Å; C58-L61 PolarHBondContact O-N 3.3Å; C58-R62 WeakPolarHBondContact O-CB 3.46Å; C58-R62 PolarHBondContact O-N 3.41Å |
| 59 | E | 94.4 | Very high | 95.8 | Very high | 118 Ų | 118 | 106 Ų | 106 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.8 | -44.1 | 174.4 | -75.1 | 175.5 | 174.2 | 0 | 0 | 111.9 | K55 L61 R62 N63 | K55-E59 WeakPolarHBondContact O-CG 3.33Å; K55-E59 PolarHBondContact O-N 3.47Å; E59-L61 VanDerWaalsContact C-N 3.34Å; E59-L61 PolarHBondContact O-N 3.06Å; E59-R62 PolarHBondContact O-N 3.14Å; E59-N63 VanDerWaalsContact O-CG 3.28Å; E59-N63 PolarHBondContact O-N 3.05Å; E59-N63 PolarHBondContact O-OD1 3.49Å |
| 60 | K | 96.1 | Very high | 95.7 | Very high | 155 Ų | 155 | 106.7 Ų | 106.7 | 67% | 0.674 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.1 | -41.9 | 175.7 | -75.9 | 179.4 | -179.7 | -170.8 | 0 | 112.5 | R56 S57 R64 | R56-K60 VanDerWaalsContact O-CG 3.32Å; R56-K60 WeakPolarHBondContact O-CG 3.41Å; R56-K60 PolarHBondContact O-N 2.88Å; S57-K60 PolarHBondContact O-N 3.28Å; K60-R64 WeakPolarHBondContact O-CB 3.48Å; K60-R64 PolarHBondContact O-N 3Å |
| 61 | L | 96.4 | Very high | 95.7 | Very high | 85 Ų | 85 | 107.7 Ų | 107.7 | 45% | 0.445 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -48.3 | 174.8 | -86.8 | 147.9 | 0 | 0 | 0 | 110.9 | S57 C58 E59 N63 R64 D65 | S57-L61 WeakPolarHBondContact O-CD1 3.3Å; S57-L61 PolarHBondContact O-N 2.85Å; C58-L61 WeakPolarHBondContact O-CB 3.49Å; C58-L61 PolarHBondContact O-N 3.3Å; E59-L61 VanDerWaalsContact C-N 3.34Å; E59-L61 PolarHBondContact O-N 3.06Å; L61-N63 PolarHBondContact O-N 3.42Å; L61-R64 WeakPolarHBondContact O-CB 3.2Å; L61-R64 PolarHBondContact O-N 3.08Å; L61-D65 VanDerWaalsContact O-CG 3.28Å; L61-D65 PolarHBondContact O-N 3.48Å |
| 62 | R | 95.3 | Very high | 95.7 | Very high | 163 Ų | 163 | 111.1 Ų | 111.1 | 62% | 0.615 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60 | -45.4 | 178.1 | -175 | 178.7 | -179 | -168.5 | -3.4 | 112.4 | C58 E59 R64 D65 F66 | C58-R62 WeakPolarHBondContact O-CB 3.46Å; C58-R62 PolarHBondContact O-N 3.41Å; E59-R62 PolarHBondContact O-N 3.14Å; R62-R64 VanDerWaalsContact C-N 3.35Å; R62-D65 PolarHBondContact O-N 3.31Å; R62-F66 HydrophobicContact CG-CD2 3.94Å; R62-F66 HydrophobicContact CG-CE2 3.54Å; R62-F66 HydrophobicContact CG-CZ 4.46Å; R62-F66 WeakPolarHBondContact O-CD2 3.44Å; R62-F66 PolarHBondContact O-N 2.97Å |
| 63 | N | 94.8 | Very high | 95.6 | Very high | 95 Ų | 95 | 112.4 Ų | 112.4 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62 | -44.1 | 177.1 | -69.8 | -6.1 | 0 | 0 | 0 | 111.2 | E59 L61 D65 F66 D67 | E59-N63 VanDerWaalsContact O-CG 3.28Å; E59-N63 PolarHBondContact O-N 3.05Å; E59-N63 PolarHBondContact O-OD1 3.49Å; L61-N63 PolarHBondContact O-N 3.42Å; N63-D65 VanDerWaalsContact C-N 3.27Å; N63-D65 PolarHBondContact O-N 3.23Å; N63-F66 PolarHBondContact O-N 2.94Å; N63-F66 VanDerWaalsContact O-N 3.16Å; N63-D67 VanDerWaalsContact O-CG 3.26Å; N63-D67 PolarHBondContact O-N 3.49Å |
| 64 | R | 96.4 | Very high | 95.6 | Very high | 136 Ų | 136 | 109 Ų | 109 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -39.2 | 175.8 | -172.5 | -174.2 | 70 | 170.5 | 2.7 | 112.1 | K60 L61 R62 D67 N68 | K60-R64 WeakPolarHBondContact O-CB 3.48Å; K60-R64 PolarHBondContact O-N 3Å; L61-R64 WeakPolarHBondContact O-CB 3.2Å; L61-R64 PolarHBondContact O-N 3.08Å; R62-R64 VanDerWaalsContact C-N 3.35Å; R64-D67 PolarHBondContact O-N 3.28Å; R64-N68 WeakPolarHBondContact O-CB 3.26Å; R64-N68 PolarHBondContact O-N 3.39Å; R64-N68 PolarHBondContact O-ND2 3.07Å; R64-N68 VanDerWaalsContact O-ND2 3.17Å |
| 65 | D | 95.2 | Very high | 95.6 | Very high | 90 Ų | 90 | 108.8 Ų | 108.8 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.7 | -37.4 | 178.5 | -66.1 | -17.7 | 0 | 0 | 0 | 111.6 | L61 R62 N63 N68 L69 | L61-D65 VanDerWaalsContact O-CG 3.28Å; L61-D65 PolarHBondContact O-N 3.48Å; R62-D65 PolarHBondContact O-N 3.31Å; N63-D65 VanDerWaalsContact C-N 3.27Å; N63-D65 PolarHBondContact O-N 3.23Å; D65-N68 PolarHBondContact O-N 2.97Å; D65-L69 PolarHBondContact O-N 3.35Å |
| 66 | F | 95.9 | Very high | 95.6 | Very high | 108 Ų | 108 | 109.2 Ų | 109.2 | 47% | 0.474 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.6 | -44.5 | 171.1 | -74.9 | -58 | 0 | 0 | 0 | 112.6 | R62 N63 N68 L69 Q70 | R62-F66 HydrophobicContact CG-CD2 3.94Å; R62-F66 HydrophobicContact CG-CE2 3.54Å; R62-F66 HydrophobicContact CG-CZ 4.46Å; R62-F66 WeakPolarHBondContact O-CD2 3.44Å; R62-F66 PolarHBondContact O-N 2.97Å; N63-F66 PolarHBondContact O-N 2.94Å; N63-F66 VanDerWaalsContact O-N 3.16Å; F66-N68 PolarHBondContact O-N 3.25Å; F66-L69 WeakPolarHBondContact O-CB 3.44Å; F66-L69 PolarHBondContact O-N 3.26Å; F66-L69 VanDerWaalsContact O-N 3.1Å; F66-Q70 PolarHBondContact O-N 3.46Å |
| 67 | D | 96.4 | Very high | 95.6 | Very high | 83 Ų | 83 | 106 Ų | 106 | 44% | 0.444 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.7 | -35.4 | 177 | -64.5 | -22.5 | 0 | 0 | 0 | 111.8 | N63 R64 R71 | N63-D67 VanDerWaalsContact O-CG 3.26Å; N63-D67 PolarHBondContact O-N 3.49Å; R64-D67 PolarHBondContact O-N 3.28Å; D67-R71 WeakPolarHBondContact O-CG 3.35Å; D67-R71 PolarHBondContact O-N 2.93Å; D67-R71 VanDerWaalsContact O-N 3.14Å; D67-R71 PolarHBondContact O-NE 3.42Å |
| 68 | N | 96.3 | Very high | 95.7 | Very high | 54 Ų | 54 | 108.7 Ų | 108.7 | 29% | 0.289 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -69.9 | -39.7 | 174.7 | -72.2 | -26.6 | 0 | 0 | 0 | 111.6 | R64 D65 F66 R71 R72 | R64-N68 WeakPolarHBondContact O-CB 3.26Å; R64-N68 PolarHBondContact O-N 3.39Å; R64-N68 PolarHBondContact O-ND2 3.07Å; R64-N68 VanDerWaalsContact O-ND2 3.17Å; D65-N68 PolarHBondContact O-N 2.97Å; F66-N68 PolarHBondContact O-N 3.25Å; N68-R71 PolarHBondContact O-N 3.46Å; N68-R71 PolarHBondContact OD1-NH2 2.97Å; N68-R72 WeakPolarHBondContact O-CG 3.43Å; N68-R72 PolarHBondContact O-N 2.92Å; N68-R72 VanDerWaalsContact O-N 3.14Å |
| 69 | L | 96.3 | Very high | 95.8 | Very high | 81 Ų | 81 | 110.8 Ų | 110.8 | 42% | 0.424 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 176.2 | -179.8 | 63.5 | 0 | 0 | 0 | 111.1 | D65 F66 R71 R72 Q73 | D65-L69 PolarHBondContact O-N 3.35Å; F66-L69 WeakPolarHBondContact O-CB 3.44Å; F66-L69 PolarHBondContact O-N 3.26Å; F66-L69 VanDerWaalsContact O-N 3.1Å; L69-R71 PolarHBondContact O-N 3.24Å; L69-R72 PolarHBondContact O-N 3.03Å; L69-Q73 WeakPolarHBondContact O-CG 3.48Å; L69-Q73 PolarHBondContact O-N 3.3Å |
| 70 | Q | 95 | Very high | 95.8 | Very high | 111 Ų | 111 | 110.1 Ų | 110.1 | 52% | 0.519 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.8 | -47.9 | 176.8 | -175 | 177.7 | -12.8 | 0 | 0 | 111 | F66 R72 Q73 D74 | F66-Q70 PolarHBondContact O-N 3.46Å; Q70-R72 VanDerWaalsContact C-N 3.31Å; Q70-R72 PolarHBondContact O-N 2.84Å; Q70-Q73 WeakPolarHBondContact O-CB 3.31Å; Q70-Q73 PolarHBondContact O-N 2.79Å; Q70-D74 PolarHBondContact O-N 3.38Å |
| 71 | R | 96.8 | Very high | 95.7 | Very high | 140 Ų | 140 | 105.9 Ų | 105.9 | 53% | 0.528 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -55.9 | -43.2 | 175.8 | -81.5 | -177.3 | -89.3 | 168.1 | -7.9 | 113.1 | D67 N68 L69 Q73 D74 E75 | D67-R71 WeakPolarHBondContact O-CG 3.35Å; D67-R71 PolarHBondContact O-N 2.93Å; D67-R71 VanDerWaalsContact O-N 3.14Å; D67-R71 PolarHBondContact O-NE 3.42Å; N68-R71 PolarHBondContact O-N 3.46Å; N68-R71 PolarHBondContact OD1-NH2 2.97Å; L69-R71 PolarHBondContact O-N 3.24Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; R71-Q73 PolarHBondContact O-N 3.49Å; R71-D74 PolarHBondContact O-N 3.25Å; R71-E75 WeakPolarHBondContact O-CG 3.45Å; R71-E75 PolarHBondContact O-N 2.93Å |
| 72 | R | 95.1 | Very high | 95.7 | Very high | 172 Ų | 172 | 104.6 Ų | 104.6 | 65% | 0.649 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.6 | -38.3 | 176.4 | -71 | 176.2 | -177.4 | 175.9 | 1.5 | 112.3 | N68 L69 Q70 M76 | N68-R72 WeakPolarHBondContact O-CG 3.43Å; N68-R72 PolarHBondContact O-N 2.92Å; N68-R72 VanDerWaalsContact O-N 3.14Å; L69-R72 PolarHBondContact O-N 3.03Å; Q70-R72 VanDerWaalsContact C-N 3.31Å; Q70-R72 PolarHBondContact O-N 2.84Å; R72-M76 VanDerWaalsContact O-CG 3.31Å; R72-M76 WeakPolarHBondContact O-CG 3.35Å; R72-M76 PolarHBondContact O-N 3.01Å; R72-M76 VanDerWaalsContact O-N 3.07Å |
| 73 | Q | 94.8 | Very high | 95.6 | Very high | 112 Ų | 112 | 100.9 Ų | 100.9 | 52% | 0.523 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.4 | -43 | 176.6 | -72.2 | 177.1 | -13.8 | 0 | 0 | 111.1 | L69 Q70 R71 M76 L77 | L69-Q73 WeakPolarHBondContact O-CG 3.48Å; L69-Q73 PolarHBondContact O-N 3.3Å; Q70-Q73 WeakPolarHBondContact O-CB 3.31Å; Q70-Q73 PolarHBondContact O-N 2.79Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; R71-Q73 PolarHBondContact O-N 3.49Å; Q73-M76 PolarHBondContact O-N 3.48Å; Q73-L77 WeakPolarHBondContact O-CG 3.4Å; Q73-L77 PolarHBondContact O-N 3.26Å |
| 74 | D | 95.9 | Very high | 95.6 | Very high | 74 Ų | 74 | 101 Ų | 101 | 40% | 0.396 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 176.5 | -66.6 | -23.1 | 0 | 0 | 0 | 111.4 | Q70 R71 M76 L77 L78 | Q70-D74 PolarHBondContact O-N 3.38Å; R71-D74 PolarHBondContact O-N 3.25Å; D74-M76 PolarHBondContact O-N 3.4Å; D74-L77 PolarHBondContact O-N 3.47Å; D74-L78 WeakPolarHBondContact O-CG 3.31Å; D74-L78 PolarHBondContact O-N 3.17Å |
| 75 | E | 96.5 | Very high | 95.5 | Very high | 122 Ų | 122 | 99.5 Ų | 99.5 | 57% | 0.57 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -58.8 | -45 | 174.4 | -75.2 | 172 | -175.9 | 0 | 0 | 112 | R71 L77 L78 L79 | R71-E75 WeakPolarHBondContact O-CG 3.45Å; R71-E75 PolarHBondContact O-N 2.93Å; E75-L77 PolarHBondContact O-N 2.91Å; E75-L78 PolarHBondContact O-N 2.96Å; E75-L79 WeakPolarHBondContact O-CG 3.36Å; E75-L79 PolarHBondContact O-N 2.95Å |
| 76 | M | 94.9 | Very high | 95.5 | Very high | 107 Ų | 107 | 101.3 Ų | 101.3 | 53% | 0.527 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.1 | -40.8 | 177.2 | -76.1 | -63.8 | -57.6 | 0 | 0 | 112.4 | R72 Q73 D74 L79 Q80 | R72-M76 VanDerWaalsContact O-CG 3.31Å; R72-M76 WeakPolarHBondContact O-CG 3.35Å; R72-M76 PolarHBondContact O-N 3.01Å; R72-M76 VanDerWaalsContact O-N 3.07Å; Q73-M76 PolarHBondContact O-N 3.48Å; D74-M76 PolarHBondContact O-N 3.4Å; M76-L79 PolarHBondContact O-N 3.01Å; M76-Q80 WeakPolarHBondContact O-CG 3.35Å; M76-Q80 PolarHBondContact O-N 2.86Å |
| 77 | L | 95.9 | Very high | 95.4 | Very high | 103 Ų | 103 | 103.1 Ų | 103.1 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 176.3 | -75.4 | 172.1 | 0 | 0 | 0 | 111.6 | Q73 D74 E75 L79 Q80 D81 | Q73-L77 WeakPolarHBondContact O-CG 3.4Å; Q73-L77 PolarHBondContact O-N 3.26Å; D74-L77 PolarHBondContact O-N 3.47Å; E75-L77 PolarHBondContact O-N 2.91Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-L79 PolarHBondContact O-N 2.95Å; L77-Q80 PolarHBondContact O-N 2.97Å; L77-D81 PolarHBondContact O-N 2.99Å |
| 78 | L | 96.4 | Very high | 95.2 | Very high | 115 Ų | 115 | 107 Ų | 107 | 60% | 0.602 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.1 | -39.4 | 176.8 | -72.3 | 171.4 | 0 | 0 | 0 | 112.4 | D74 E75 S82 | D74-L78 WeakPolarHBondContact O-CG 3.31Å; D74-L78 PolarHBondContact O-N 3.17Å; E75-L78 PolarHBondContact O-N 2.96Å; L78-S82 WeakPolarHBondContact O-CB 3.46Å; L78-S82 PolarHBondContact O-N 3.32Å; L78-S82 PolarHBondContact O-OG 2.89Å |
| 79 | L | 96.2 | Very high | 95.1 | Very high | 102 Ų | 102 | 111.2 Ų | 111.2 | 53% | 0.534 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.4 | -42.1 | 174.7 | -72.5 | 171.6 | 0 | 0 | 0 | 111.5 | E75 M76 L77 S82 N83 | E75-L79 WeakPolarHBondContact O-CG 3.36Å; E75-L79 PolarHBondContact O-N 2.95Å; M76-L79 PolarHBondContact O-N 3.01Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-L79 PolarHBondContact O-N 2.95Å; L79-S82 PolarHBondContact O-N 3.24Å; L79-N83 WeakPolarHBondContact O-CB 3.34Å; L79-N83 VanDerWaalsContact O-CG 3.23Å; L79-N83 PolarHBondContact O-N 3.46Å; L79-N83 PolarHBondContact O-ND2 3.32Å |
| 80 | Q | 94.8 | Very high | 95 | Very high | 104 Ų | 104 | 109.5 Ų | 109.5 | 49% | 0.486 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.5 | -48.6 | 176.6 | -75.8 | 177.9 | -7.3 | 0 | 0 | 111.8 | M76 L77 S82 N83 E84 | M76-Q80 WeakPolarHBondContact O-CG 3.35Å; M76-Q80 PolarHBondContact O-N 2.86Å; L77-Q80 PolarHBondContact O-N 2.97Å; Q80-S82 VanDerWaalsContact C-N 3.33Å; Q80-S82 PolarHBondContact O-N 3.43Å; Q80-N83 PolarHBondContact O-N 3.16Å; Q80-E84 WeakPolarHBondContact O-CG 3.5Å; Q80-E84 PolarHBondContact O-N 3.23Å |
| 81 | D | 94.7 | Very high | 95 | Very high | 66 Ų | 66 | 109.4 Ų | 109.4 | 35% | 0.353 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.8 | -40.9 | 177.7 | -179.6 | 54.5 | 0 | 0 | 0 | 112.1 | L77 E84 K85 | L77-D81 PolarHBondContact O-N 2.99Å; D81-E84 PolarHBondContact O-N 3.17Å; D81-K85 WeakPolarHBondContact O-CB 3.44Å; D81-K85 VanDerWaalsContact O-CG 3.31Å; D81-K85 WeakPolarHBondContact O-CG 3.27Å; D81-K85 PolarHBondContact O-N 2.88Å; D81-K85 WeakPolarHBondContact OD1-CE 3.31Å; D81-K85 IonicContact OD1-NZ 3.49Å; D81-K85 WeakPolarHBondContact OD2-CE 3.45Å; D81-K85 IonicContact OD2-NZ 3.49Å; D81-K85 PolarHBondContact OD2-NZ 3.36Å |
| 82 | S | 95.3 | Very high | 94.7 | Very high | 59 Ų | 59 | 107.3 Ų | 107.3 | 41% | 0.413 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.8 | -47.4 | 175 | -60.1 | 0 | 0 | 0 | 0 | 111.8 | L78 L79 Q80 E84 K85 E86 | L78-S82 WeakPolarHBondContact O-CB 3.46Å; L78-S82 PolarHBondContact O-N 3.32Å; L78-S82 PolarHBondContact O-OG 2.89Å; L79-S82 PolarHBondContact O-N 3.24Å; Q80-S82 VanDerWaalsContact C-N 3.33Å; Q80-S82 PolarHBondContact O-N 3.43Å; S82-E84 VanDerWaalsContact C-N 3.35Å; S82-E84 PolarHBondContact O-N 3.49Å; S82-K85 WeakPolarHBondContact O-CB 3.46Å; S82-K85 PolarHBondContact O-N 3.1Å; S82-E86 WeakPolarHBondContact O-CG 3.45Å; S82-E86 PolarHBondContact O-N 3.44Å |
| 83 | N | 94.7 | Very high | 94.6 | Very high | 84 Ų | 84 | 105.8 Ų | 105.8 | 45% | 0.449 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -40.3 | 177.3 | -73.1 | -23.8 | 0 | 0 | 0 | 112.1 | L79 Q80 E86 K87 | L79-N83 WeakPolarHBondContact O-CB 3.34Å; L79-N83 VanDerWaalsContact O-CG 3.23Å; L79-N83 PolarHBondContact O-N 3.46Å; L79-N83 PolarHBondContact O-ND2 3.32Å; Q80-N83 PolarHBondContact O-N 3.16Å; N83-E86 PolarHBondContact O-N 3.03Å; N83-K87 WeakPolarHBondContact O-CG 3.43Å; N83-K87 PolarHBondContact O-N 2.97Å |
| 84 | E | 93.9 | Very high | 94.5 | Very high | 97 Ų | 97 | 104.8 Ų | 104.8 | 45% | 0.453 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.7 | -43.3 | 175.1 | -76.9 | -166.5 | -174.6 | 0 | 0 | 112.1 | Q80 D81 S82 E86 K87 R88 | Q80-E84 WeakPolarHBondContact O-CG 3.5Å; Q80-E84 PolarHBondContact O-N 3.23Å; D81-E84 PolarHBondContact O-N 3.17Å; S82-E84 VanDerWaalsContact C-N 3.35Å; S82-E84 PolarHBondContact O-N 3.49Å; E84-E86 VanDerWaalsContact C-N 3.3Å; E84-E86 PolarHBondContact O-N 3.14Å; E84-K87 PolarHBondContact O-N 2.64Å; E84-R88 WeakPolarHBondContact O-CG 3.45Å; E84-R88 PolarHBondContact O-N 3.31Å; E84-R88 IonicContact OE2-NH2 3.63Å |
| 85 | K | 94.1 | Very high | 94.1 | Very high | 106 Ų | 106 | 105.2 Ų | 105.2 | 46% | 0.461 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.2 | -40.8 | 175.5 | -76.8 | 168.6 | 176.8 | 166.1 | 0 | 111.6 | D81 S82 R88 K89 | D81-K85 WeakPolarHBondContact O-CB 3.44Å; D81-K85 VanDerWaalsContact O-CG 3.31Å; D81-K85 WeakPolarHBondContact O-CG 3.27Å; D81-K85 PolarHBondContact O-N 2.88Å; D81-K85 WeakPolarHBondContact OD1-CE 3.31Å; D81-K85 IonicContact OD1-NZ 3.49Å; D81-K85 WeakPolarHBondContact OD2-CE 3.45Å; D81-K85 IonicContact OD2-NZ 3.49Å; D81-K85 PolarHBondContact OD2-NZ 3.36Å; S82-K85 WeakPolarHBondContact O-CB 3.46Å; S82-K85 PolarHBondContact O-N 3.1Å; K85-R88 PolarHBondContact O-N 3.14Å; K85-K89 WeakPolarHBondContact O-CG 3.19Å; K85-K89 PolarHBondContact O-N 2.89Å |
| 86 | E | 95.1 | Very high | 93.7 | Very high | 127 Ų | 127 | 102.7 Ų | 102.7 | 59% | 0.593 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -45.5 | 175.2 | -72.8 | -174.5 | 172.3 | 0 | 0 | 112.4 | S82 N83 E84 R88 K89 A90 | S82-E86 WeakPolarHBondContact O-CG 3.45Å; S82-E86 PolarHBondContact O-N 3.44Å; N83-E86 PolarHBondContact O-N 3.03Å; E84-E86 VanDerWaalsContact C-N 3.3Å; E84-E86 PolarHBondContact O-N 3.14Å; E86-R88 VanDerWaalsContact C-N 3.33Å; E86-R88 PolarHBondContact O-N 3Å; E86-K89 WeakPolarHBondContact O-CB 3.46Å; E86-K89 PolarHBondContact O-N 2.85Å; E86-K89 VanDerWaalsContact O-N 3.15Å; E86-A90 PolarHBondContact O-N 3.3Å |
| 87 | K | 94 | Very high | 93.3 | Very high | 146 Ų | 146 | 103.1 Ų | 103.1 | 64% | 0.635 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.5 | -43.4 | 174.8 | -72.6 | 174.8 | -177 | 178.8 | 0 | 112 | N83 E84 K89 A90 L91 | N83-K87 WeakPolarHBondContact O-CG 3.43Å; N83-K87 PolarHBondContact O-N 2.97Å; E84-K87 PolarHBondContact O-N 2.64Å; K87-K89 VanDerWaalsContact C-N 3.35Å; K87-K89 PolarHBondContact O-N 3.34Å; K87-A90 PolarHBondContact O-N 2.98Å; K87-L91 WeakPolarHBondContact O-CG 3.46Å; K87-L91 PolarHBondContact O-N 2.92Å |
| 88 | R | 92.9 | Very high | 92.8 | Very high | 165 Ų | 165 | 103.3 Ų | 103.3 | 62% | 0.623 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.1 | -42.8 | 175.5 | -72 | 178.4 | -168 | -175.3 | 9.6 | 111.6 | E84 K85 E86 Q92 | E84-R88 WeakPolarHBondContact O-CG 3.45Å; E84-R88 PolarHBondContact O-N 3.31Å; E84-R88 IonicContact OE2-NH2 3.63Å; K85-R88 PolarHBondContact O-N 3.14Å; E86-R88 VanDerWaalsContact C-N 3.33Å; E86-R88 PolarHBondContact O-N 3Å; R88-Q92 WeakPolarHBondContact O-CB 3.5Å; R88-Q92 PolarHBondContact O-N 3.43Å |
| 89 | K | 94.3 | Very high | 92 | Very high | 142 Ų | 142 | 104.2 Ų | 104.2 | 62% | 0.617 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64 | -41 | 175.9 | -73.5 | 173.9 | -178.1 | 178.3 | 0 | 112.2 | K85 E86 K87 Q92 K93 | K85-K89 WeakPolarHBondContact O-CG 3.19Å; K85-K89 PolarHBondContact O-N 2.89Å; E86-K89 WeakPolarHBondContact O-CB 3.46Å; E86-K89 PolarHBondContact O-N 2.85Å; E86-K89 VanDerWaalsContact O-N 3.15Å; K87-K89 VanDerWaalsContact C-N 3.35Å; K87-K89 PolarHBondContact O-N 3.34Å; K89-Q92 PolarHBondContact O-N 3.37Å; K89-K93 WeakPolarHBondContact O-CG 3.3Å; K89-K93 PolarHBondContact O-N 3.27Å; K89-K93 VanDerWaalsContact O-N 3.1Å |
| 90 | A | 94.1 | Very high | 91.1 | Very high | 46 Ų | 46 | 104 Ų | 104 | 38% | 0.38 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.3 | -50.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | E86 K87 Q92 K93 D94 | E86-A90 PolarHBondContact O-N 3.3Å; K87-A90 PolarHBondContact O-N 2.98Å; A90-Q92 VanDerWaalsContact C-N 3.27Å; A90-Q92 PolarHBondContact O-N 2.97Å; A90-K93 WeakPolarHBondContact O-CB 3.43Å; A90-K93 PolarHBondContact O-N 3.34Å; A90-D94 PolarHBondContact O-N 3.32Å |
| 91 | L | 93.8 | Very high | 90.2 | Very high | 109 Ų | 109 | 105 Ų | 105 | 57% | 0.571 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -55.6 | -41.2 | 175.7 | -76.2 | 167.4 | 0 | 0 | 0 | 112.5 | K87 D94 L95 | K87-L91 WeakPolarHBondContact O-CG 3.46Å; K87-L91 PolarHBondContact O-N 2.92Å; L91-D94 PolarHBondContact O-N 3.07Å; L91-L95 WeakPolarHBondContact O-CB 3.33Å; L91-L95 WeakPolarHBondContact O-CG 3.45Å; L91-L95 PolarHBondContact O-N 3.39Å |
| 92 | Q | 91.8 | Very high | 88.9 | Confident | 95 Ų | 95 | 107.3 Ų | 107.3 | 44% | 0.444 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.2 | -39.8 | 176.7 | -173.8 | 63.1 | 45.9 | 0 | 0 | 112.2 | R88 K89 A90 N96 | R88-Q92 WeakPolarHBondContact O-CB 3.5Å; R88-Q92 PolarHBondContact O-N 3.43Å; K89-Q92 PolarHBondContact O-N 3.37Å; A90-Q92 VanDerWaalsContact C-N 3.27Å; A90-Q92 PolarHBondContact O-N 2.97Å; Q92-N96 PolarHBondContact NE2-OD1 2.82Å; Q92-N96 PolarHBondContact O-N 2.92Å; Q92-N96 PolarHBondContact O-OD1 2.96Å |
| 93 | K | 93 | Very high | 87.2 | Confident | 140 Ų | 140 | 111.5 Ų | 111.5 | 61% | 0.609 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.3 | -44.3 | 175.6 | -72.7 | 175.9 | 178.2 | -176.3 | 0 | 111.1 | K89 A90 L95 N96 Q97 | K89-K93 WeakPolarHBondContact O-CG 3.3Å; K89-K93 PolarHBondContact O-N 3.27Å; K89-K93 VanDerWaalsContact O-N 3.1Å; A90-K93 WeakPolarHBondContact O-CB 3.43Å; A90-K93 PolarHBondContact O-N 3.34Å; K93-L95 VanDerWaalsContact C-N 3.35Å; K93-L95 PolarHBondContact O-N 2.91Å; K93-N96 PolarHBondContact O-N 3.43Å; K93-Q97 WeakPolarHBondContact O-CG 3.2Å; K93-Q97 PolarHBondContact O-N 3.43Å |
| 94 | D | 91.7 | Very high | 85.4 | Confident | 92 Ų | 92 | 115 Ų | 115 | 49% | 0.492 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 179.4 | -63.8 | -13.6 | 0 | 0 | 0 | 111.4 | A90 L91 Q97 F98 | A90-D94 PolarHBondContact O-N 3.32Å; L91-D94 PolarHBondContact O-N 3.07Å; D94-Q97 PolarHBondContact O-N 3Å; D94-F98 WeakPolarHBondContact O-CB 3.29Å; D94-F98 PolarHBondContact O-N 3.36Å |
| 95 | L | 88.6 | Confident | 83.3 | Confident | 82 Ų | 82 | 118.4 Ų | 118.4 | 43% | 0.429 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.1 | -43.7 | 174.2 | -77.3 | 172.9 | 0 | 0 | 0 | 112.3 | L91 K93 F98 W99 | L91-L95 WeakPolarHBondContact O-CB 3.33Å; L91-L95 WeakPolarHBondContact O-CG 3.45Å; L91-L95 PolarHBondContact O-N 3.39Å; K93-L95 VanDerWaalsContact C-N 3.35Å; K93-L95 PolarHBondContact O-N 2.91Å; L95-F98 PolarHBondContact O-N 2.98Å; L95-W99 PolarHBondContact O-N 3.31Å |
| 96 | N | 86.9 | Confident | 81 | Confident | 69 Ų | 69 | 122.3 Ų | 122.3 | 37% | 0.369 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.5 | -45 | 177.4 | -69.7 | -3 | 0 | 0 | 0 | 111.2 | Q92 K93 F98 W99 D100 | Q92-N96 PolarHBondContact NE2-OD1 2.82Å; Q92-N96 PolarHBondContact O-N 2.92Å; Q92-N96 PolarHBondContact O-OD1 2.96Å; K93-N96 PolarHBondContact O-N 3.43Å; N96-F98 VanDerWaalsContact C-N 3.32Å; N96-F98 PolarHBondContact O-N 3.45Å; N96-W99 PolarHBondContact O-N 3.05Å; N96-D100 PolarHBondContact O-N 2.89Å |
| 97 | Q | 86.6 | Confident | 78.9 | Confident | 116 Ų | 116 | 123 Ų | 123 | 54% | 0.542 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -60.9 | -41.2 | 175.5 | -72.1 | 176.5 | 7.1 | 0 | 0 | 112.1 | K93 D94 W99 D100 L101 | K93-Q97 WeakPolarHBondContact O-CG 3.2Å; K93-Q97 PolarHBondContact O-N 3.43Å; D94-Q97 PolarHBondContact O-N 3Å; Q97-W99 VanDerWaalsContact C-N 3.34Å; Q97-D100 PolarHBondContact O-N 3.33Å; Q97-L101 WeakPolarHBondContact O-CB 3.4Å; Q97-L101 VanDerWaalsContact O-CG 3.3Å; Q97-L101 WeakPolarHBondContact O-CG 3.33Å; Q97-L101 PolarHBondContact O-N 3Å |
| 98 | F | 85 | Confident | 76.6 | Confident | 108 Ų | 108 | 121.2 Ų | 121.2 | 47% | 0.474 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61.5 | -42.5 | 175.1 | 176.3 | -98.3 | 0 | 0 | 0 | 111.8 | D94 L95 N96 Q102 | D94-F98 WeakPolarHBondContact O-CB 3.29Å; D94-F98 PolarHBondContact O-N 3.36Å; L95-F98 PolarHBondContact O-N 2.98Å; N96-F98 VanDerWaalsContact C-N 3.32Å; N96-F98 PolarHBondContact O-N 3.45Å; F98-Q102 HydrophobicContact CD1-CG 4.4Å; F98-Q102 HydrophobicContact CD2-CG 4.32Å; F98-Q102 HydrophobicContact CE1-CG 3.99Å; F98-Q102 HydrophobicContact CE2-CG 3.91Å; F98-Q102 HydrophobicContact CZ-CG 3.72Å; F98-Q102 WeakPolarHBondContact O-CB 3.41Å; F98-Q102 VanDerWaalsContact O-CG 3.29Å; F98-Q102 WeakPolarHBondContact O-CG 3.24Å; F98-Q102 PolarHBondContact O-N 3.47Å |
| 99 | W | 79.9 | Confident | 74.1 | Confident | 133 Ų | 133 | 121.5 Ų | 121.5 | 50% | 0.504 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.5 | -42.9 | 175.6 | -69.9 | -23.3 | 0 | 0 | 0 | 112.5 | L95 N96 Q97 L101 Q102 Q103 | L95-W99 PolarHBondContact O-N 3.31Å; N96-W99 PolarHBondContact O-N 3.05Å; Q97-W99 VanDerWaalsContact C-N 3.34Å; W99-L101 PolarHBondContact O-N 2.9Å; W99-Q102 PolarHBondContact O-N 2.88Å; W99-Q103 VanDerWaalsContact O-CB 3.32Å; W99-Q103 WeakPolarHBondContact O-CB 3.48Å; W99-Q103 VanDerWaalsContact O-CG 3.3Å; W99-Q103 WeakPolarHBondContact O-CG 3.46Å; W99-Q103 PolarHBondContact O-N 2.93Å |
| 100 | D | 77.1 | Confident | 71.6 | Confident | 99 Ų | 99 | 120.9 Ų | 120.9 | 53% | 0.529 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.3 | -43.9 | 177.3 | -70.7 | -24.5 | 0 | 0 | 0 | 111.9 | N96 Q97 Q103 Q104 | N96-D100 PolarHBondContact O-N 2.89Å; Q97-D100 PolarHBondContact O-N 3.33Å; D100-Q103 PolarHBondContact O-N 3.26Å; D100-Q104 WeakPolarHBondContact O-CG 3.42Å; D100-Q104 PolarHBondContact O-N 3.18Å |
| 101 | L | 76.7 | Confident | 69.4 | Low | 123 Ų | 123 | 125.6 Ų | 125.6 | 64% | 0.644 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -64.9 | -41 | 177.6 | -73.1 | 168.9 | 0 | 0 | 0 | 112.6 | Q97 W99 M105 | Q97-L101 WeakPolarHBondContact O-CB 3.4Å; Q97-L101 VanDerWaalsContact O-CG 3.3Å; Q97-L101 WeakPolarHBondContact O-CG 3.33Å; Q97-L101 PolarHBondContact O-N 3Å; W99-L101 PolarHBondContact O-N 2.9Å; L101-M105 WeakPolarHBondContact O-CG 3.1Å |
| 102 | Q | 67.3 | Low | 67 | Low | 116 Ų | 116 | 128.6 Ų | 128.6 | 54% | 0.542 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -75 | -32 | 179.9 | -74.6 | -98 | -26.2 | 0 | 0 | 112.6 | F98 W99 | F98-Q102 HydrophobicContact CD1-CG 4.4Å; F98-Q102 HydrophobicContact CD2-CG 4.32Å; F98-Q102 HydrophobicContact CE1-CG 3.99Å; F98-Q102 HydrophobicContact CE2-CG 3.91Å; F98-Q102 HydrophobicContact CZ-CG 3.72Å; F98-Q102 WeakPolarHBondContact O-CB 3.41Å; F98-Q102 VanDerWaalsContact O-CG 3.29Å; F98-Q102 WeakPolarHBondContact O-CG 3.24Å; F98-Q102 PolarHBondContact O-N 3.47Å; W99-Q102 PolarHBondContact O-N 2.88Å |
| 103 | Q | 60.5 | Low | 65.1 | Low | 147 Ų | 147 | 129.8 Ų | 129.8 | 69% | 0.687 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -75.3 | -28.8 | 178.4 | -75.3 | -173.5 | 1 | 0 | 0 | 112.9 | W99 D100 | W99-Q103 VanDerWaalsContact O-CB 3.32Å; W99-Q103 WeakPolarHBondContact O-CB 3.48Å; W99-Q103 VanDerWaalsContact O-CG 3.3Å; W99-Q103 WeakPolarHBondContact O-CG 3.46Å; W99-Q103 PolarHBondContact O-N 2.93Å; D100-Q103 PolarHBondContact O-N 3.26Å |
| 104 | Q | 55.7 | Low | 62.3 | Low | 158 Ų | 158 | 132 Ų | 132 | 74% | 0.738 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -74.6 | -22 | 174 | -70.7 | -169 | -0.3 | 0 | 0 | 114 | D100 K106 | D100-Q104 WeakPolarHBondContact O-CG 3.42Å; D100-Q104 PolarHBondContact O-N 3.18Å; Q104-K106 VanDerWaalsContact C-N 3.26Å; Q104-K106 PolarHBondContact O-N 3.08Å |
| 105 | M | 49.8 | Very low | 59.9 | Low | 168 Ų | 168 | 130.6 Ų | 130.6 | 83% | 0.828 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | 5.9 | -178.9 | -78 | -82.8 | -108.8 | 0 | 0 | 114.7 | L101 | L101-M105 WeakPolarHBondContact O-CG 3.1Š|
| 106 | K | 46.8 | Very low | 57.4 | Low | 187 Ų | 187 | 135.6 Ų | 135.6 | 81% | 0.813 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.2 | 44.9 | 176.1 | -68.9 | -168 | -179.7 | 179.4 | 0 | 113.6 | Q104 | Q104-K106 VanDerWaalsContact C-N 3.26Å; Q104-K106 PolarHBondContact O-N 3.08Å |
| 107 | I | 51.4 | Low | 55.3 | Low | 141 Ų | 141 | 141.7 Ų | 141.7 | 72% | 0.723 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -124.2 | 115.1 | 155.6 | -57.2 | 179 | 0 | 0 | 0 | 107.2 | ||
| 108 | S | 45.3 | Very low | 53 | Low | 109 Ų | 109 | 143.1 Ų | 143.1 | 76% | 0.762 | 72% | 0.715 | S | S | * | * | trans | 92.6 | 98.9 | 163.4 | -59.9 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 109 | H | 40.3 | Very low | 51.4 | Low | 172 Ų | 172 | 145.1 Ų | 145.1 | 80% | 0.796 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -176.7 | 109.3 | 133.8 | -116 | 62 | 0 | 0 | 0 | 105.5 | ||
| 110 | D | 41.8 | Very low | 50 | Low | 129 Ų | 129 | 144.6 Ų | 144.6 | 69% | 0.69 | 74% | 0.742 | S | S | * | * | cis | -152.8 | 132.2 | 17.4 | -71.6 | -47.6 | 0 | 0 | 0 | 109.3 | ||||
| 111 | V | 47.6 | Very low | 49 | Very low | 144 Ų | 144 | 145 Ų | 145 | 87% | 0.873 | 74% | 0.743 | S | S | * | * | trans | -105.2 | 103.2 | 148.1 | 173.2 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 112 | E | 44.1 | Very low | 48.2 | Very low | 173 Ų | 173 | 142.7 Ų | 142.7 | 81% | 0.808 | 74% | 0.735 | S | S | * | * | trans | -147.6 | 124.3 | 149.4 | -132.1 | -178.6 | -174.7 | 0 | 0 | 111.6 | ||||
| 113 | V | 51.8 | Low | 47.6 | Very low | 119 Ų | 119 | 142.9 Ų | 142.9 | 72% | 0.721 | 74% | 0.736 | S | S | * | * | trans | -68.2 | 136.5 | 179.9 | 172.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 114 | K | 34.3 | Very low | 47.7 | Very low | 188 Ų | 188 | 141.4 Ų | 141.4 | 82% | 0.817 | 74% | 0.741 | S | S | * | * | trans | -167.5 | 126 | 142.8 | -99.3 | 149.8 | -153.8 | -177.8 | 0 | 109.8 | ||||
| 115 | G | 41.2 | Very low | 47.8 | Very low | 62 Ų | 62 | 141.2 Ų | 141.2 | 64% | 0.639 | 74% | 0.741 | S | S | * | * | trans | -52.6 | 141.9 | -167 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y117 | G115-Y117 WeakPolarHBondContact O-CD1 3.34Å; G115-Y117 WeakPolarHBondContact O-CE1 3.29Å; G115-Y117 PolarHBondContact O-N 3.39Å | ||
| 116 | Q | 34.7 | Very low | 48.4 | Very low | 186 Ų | 186 | 136 Ų | 136 | 87% | 0.869 | 72% | 0.716 | S | S | * | * | trans | -76.1 | 106.9 | 168.7 | -86.9 | 163.8 | -46.2 | 0 | 0 | 109.7 | N118 | Q116-N118 PolarHBondContact O-N 3.03Š| ||
| 117 | Y | 43.6 | Very low | 49.3 | Very low | 197 Ų | 197 | 129 Ų | 129 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | -65.3 | 116.7 | 158.5 | 25.7 | -87 | 0 | 0 | 0 | 108.4 | G115 L119 | G115-Y117 WeakPolarHBondContact O-CD1 3.34Å; G115-Y117 WeakPolarHBondContact O-CE1 3.29Å; G115-Y117 PolarHBondContact O-N 3.39Å; Y117-L119 PolarHBondContact O-N 3.31Å; Y117-L119 VanDerWaalsContact O-N 3.12Å | ||
| 118 | N | 37.9 | Very low | 49.9 | Very low | 146 Ų | 146 | 128.7 Ų | 128.7 | 78% | 0.781 | 70% | 0.703 | S | S | * | * | trans | -77.4 | 90.7 | 168.9 | -70.1 | -24.4 | 0 | 0 | 0 | 108.9 | Q116 | Q116-N118 PolarHBondContact O-N 3.03Š| ||
| 119 | L | 51.5 | Low | 50.5 | Low | 150 Ų | 150 | 129.3 Ų | 129.3 | 79% | 0.785 | 71% | 0.708 | S | S | * | * | trans | -109.1 | 72.4 | 157.5 | -91.7 | 141.6 | 0 | 0 | 0 | 107.4 | Y117 I121 | Y117-L119 PolarHBondContact O-N 3.31Å; Y117-L119 VanDerWaalsContact O-N 3.12Å; L119-I121 PolarHBondContact O-N 2.91Å; L119-I121 VanDerWaalsContact O-N 3.16Å | ||
| 120 | T | 50 | Low | 51.5 | Low | 123 Ų | 123 | 122.9 Ų | 122.9 | 76% | 0.755 | 68% | 0.682 | S | S | * | * | trans | -78.8 | 94.8 | 170.8 | -48.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 121 | I | 57.2 | Low | 52.6 | Low | 108 Ų | 108 | 123.3 Ų | 123.3 | 55% | 0.554 | 68% | 0.682 | S | S | * | * | trans | -71 | 125.8 | 161.5 | -56.9 | 171.8 | 0 | 0 | 0 | 106.1 | L119 E123 | L119-I121 PolarHBondContact O-N 2.91Å; L119-I121 VanDerWaalsContact O-N 3.16Å; I121-E123 PolarHBondContact O-N 3.16Å | ||
| 122 | P | 58.8 | Low | 53.4 | Low | 73 Ų | 73 | 122.8 Ų | 122.8 | 47% | 0.474 | 67% | 0.67 | S | S | . | * | trans | -62.4 | 132.8 | -177.7 | 22.8 | -31 | 0 | 0 | 0 | 111.3 | S124 E125 | P122-S124 PolarHBondContact O-N 3.49Å; P122-E125 PolarHBondContact O-N 2.93Å | ||
| 123 | E | 55.8 | Low | 54.3 | Low | 121 Ų | 121 | 118.1 Ų | 118.1 | 57% | 0.565 | 65% | 0.649 | S | S | * | * | G | 310 helix | trans | -57.5 | -6.6 | 178.7 | -78.9 | -172.5 | 143.8 | 0 | 0 | 114.1 | I121 E125 R139 | I121-E123 PolarHBondContact O-N 3.16Å; E123-E125 VanDerWaalsContact C-N 3.31Å; E123-E125 PolarHBondContact O-N 3.36Å; E123-R139 IonicContact OE1-CZ 3.35Å; E123-R139 IonicContact OE1-NH1 2.76Å; E123-R139 PolarHBondContact OE1-NH1 2.87Å; E123-R139 IonicContact OE1-NH2 2.96Å; E123-R139 PolarHBondContact OE1-NH2 2.92Å; E123-R139 IonicContact OE2-NH1 3.87Å |
| 124 | S | 62.5 | Low | 55.2 | Low | 115 Ų | 115 | 117.3 Ų | 117.3 | 80% | 0.804 | 64% | 0.636 | S | S | * | * | G | 310 helix | trans | -71.9 | -16.2 | 177.7 | -179 | 0 | 0 | 0 | 0 | 114.4 | P122 | P122-S124 PolarHBondContact O-N 3.49Š|
| 125 | E | 56.6 | Low | 56.9 | Low | 155 Ų | 155 | 118 Ų | 118 | 72% | 0.724 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -112.5 | -0.1 | -173.6 | -64.6 | -175.5 | -177.8 | 0 | 0 | 114 | P122 E123 G127 | P122-E125 PolarHBondContact O-N 2.93Å; E123-E125 VanDerWaalsContact C-N 3.31Å; E123-E125 PolarHBondContact O-N 3.36Å; E125-G127 PolarHBondContact O-N 3.35Å |
| 126 | L | 62.2 | Low | 58.5 | Low | 59 Ų | 59 | 118.7 Ų | 118.7 | 31% | 0.309 | 65% | 0.65 | S | S | . | * | trans | -96.5 | 96.5 | -176.5 | -70.9 | 163.5 | 0 | 0 | 0 | 111 | I133 | L126-I133 HydrophobicContact CB-CD1 4.39Š| ||
| 127 | G | 66.1 | Low | 60.4 | Low | 38 Ų | 38 | 115.6 Ų | 115.6 | 39% | 0.392 | 64% | 0.635 | S | S | . | * | trans | -80.4 | 172.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | E125 S129 S130 | E125-G127 PolarHBondContact O-N 3.35Å; G127-S129 PolarHBondContact O-N 3Å; G127-S130 WeakPolarHBondContact O-CB 3.46Å; G127-S130 PolarHBondContact O-N 2.87Å; G127-S130 PolarHBondContact O-OG 3.43Å | ||
| 128 | P | 65.6 | Low | 61.6 | Low | 135 Ų | 135 | 108.6 Ų | 108.6 | 88% | 0.877 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -61.5 | -17.6 | -177.1 | 21.1 | -31.2 | 0 | 0 | 0 | 114.6 | S130 | P128-S130 VanDerWaalsContact C-N 3.32Š|
| 129 | S | 57.9 | Low | 63.1 | Low | 122 Ų | 122 | 109.8 Ų | 109.8 | 85% | 0.853 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -72.3 | -22.7 | 174.5 | -163.9 | 0 | 0 | 0 | 0 | 113.4 | G127 M131 | G127-S129 PolarHBondContact O-N 3Å; S129-M131 PolarHBondContact O-N 3.05Å |
| 130 | S | 61.3 | Low | 64.4 | Low | 38 Ų | 38 | 111.2 Ų | 111.2 | 27% | 0.266 | 60% | 0.6 | S | S | . | * | G | 310 helix | trans | -70.5 | -17.5 | -178.1 | 67.7 | 0 | 0 | 0 | 0 | 113.4 | G127 P128 H132 | G127-S130 WeakPolarHBondContact O-CB 3.46Å; G127-S130 PolarHBondContact O-N 2.87Å; G127-S130 PolarHBondContact O-OG 3.43Å; P128-S130 VanDerWaalsContact C-N 3.32Å; S130-H132 PolarHBondContact O-CE1 3.15Å; S130-H132 PolarHBondContact O-N 2.91Å; S130-H132 VanDerWaalsContact O-N 3.15Å; S130-H132 PolarHBondContact O-ND1 3.33Å; S130-H132 PolarHBondContact OG-N 3.19Å |
| 131 | M | 64.9 | Low | 65.9 | Low | 137 Ų | 137 | 113.7 Ų | 113.7 | 68% | 0.675 | 60% | 0.596 | S | S | * | * | S | Bend | trans | 55.7 | 18.7 | -171.8 | -69.2 | -175.1 | 65.9 | 0 | 0 | 115.1 | S129 F134 | S129-M131 PolarHBondContact O-N 3.05Å; M131-F134 HydrophobicContact CB-CZ 4.14Å; M131-F134 HydrophobicContact CE-CZ 3.96Å; M131-F134 HydrophobicContact CG-CZ 4.48Å; M131-F134 WeakPolarHBondContact O-CE2 3.45Å |
| 132 | H | 62.4 | Low | 67.1 | Low | 134 Ų | 134 | 117.4 Ų | 117.4 | 62% | 0.62 | 61% | 0.607 | S | S | * | * | trans | -94.2 | -13.4 | -179.1 | -74.9 | 72.4 | 0 | 0 | 0 | 114.1 | S130 | S130-H132 PolarHBondContact O-CE1 3.15Å; S130-H132 PolarHBondContact O-N 2.91Å; S130-H132 VanDerWaalsContact O-N 3.15Å; S130-H132 PolarHBondContact O-ND1 3.33Å; S130-H132 PolarHBondContact OG-N 3.19Å | ||
| 133 | I | 63.3 | Low | 68.4 | Low | 75 Ų | 75 | 119.7 Ų | 119.7 | 39% | 0.385 | 61% | 0.612 | S | S | . | * | trans | -131.6 | 116.4 | -179.5 | -56.3 | 174.1 | 0 | 0 | 0 | 108.6 | L126 | L126-I133 HydrophobicContact CB-CD1 4.39Š| ||
| 134 | F | 71.1 | Confident | 69.8 | Low | 102 Ų | 102 | 120.2 Ų | 120.2 | 45% | 0.447 | 61% | 0.609 | S | S | . | * | trans | -112.7 | 125.2 | 175.7 | -67.4 | -83.1 | 0 | 0 | 0 | 110.7 | M131 G136 E137 | M131-F134 HydrophobicContact CB-CZ 4.14Å; M131-F134 HydrophobicContact CE-CZ 3.96Å; M131-F134 HydrophobicContact CG-CZ 4.48Å; M131-F134 WeakPolarHBondContact O-CE2 3.45Å; F134-G136 PolarHBondContact O-N 2.91Å; F134-E137 HydrophobicContact CB-CG 3.92Å; F134-E137 WeakPolarHBondContact O-CB 3.34Å; F134-E137 PolarHBondContact O-N 2.67Å; F134-E137 VanDerWaalsContact O-N 3.14Å | ||
| 135 | E | 70.1 | Confident | 71.1 | Confident | 201 Ų | 201 | 117.6 Ų | 117.6 | 94% | 0.939 | 59% | 0.588 | S | S | * | * | G | 310 helix | trans | -63.3 | -23 | 179.7 | -64.3 | -170.6 | 161.8 | 0 | 0 | 113.4 | E137 | E135-E137 VanDerWaalsContact C-N 3.34Š|
| 136 | G | 75.4 | Confident | 72.6 | Confident | 78 Ų | 78 | 116.2 Ų | 116.2 | 80% | 0.804 | 58% | 0.579 | S | S | * | * | G | 310 helix | trans | -76.1 | -12.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | F134 D138 | F134-G136 PolarHBondContact O-N 2.91Å; G136-D138 PolarHBondContact O-N 3.33Å |
| 137 | E | 73.9 | Confident | 73.9 | Confident | 120 Ų | 120 | 119.3 Ų | 119.3 | 56% | 0.561 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -72.9 | -10.7 | -178.1 | -76.7 | 177.5 | 164.1 | 0 | 0 | 113.6 | F134 E135 R139 | F134-E137 HydrophobicContact CB-CG 3.92Å; F134-E137 WeakPolarHBondContact O-CB 3.34Å; F134-E137 PolarHBondContact O-N 2.67Å; F134-E137 VanDerWaalsContact O-N 3.14Å; E135-E137 VanDerWaalsContact C-N 3.34Å; E137-R139 PolarHBondContact O-N 3.49Å |
| 138 | D | 69.9 | Low | 75 | Confident | 51 Ų | 51 | 122.4 Ų | 122.4 | 27% | 0.273 | 60% | 0.596 | S | S | . | * | trans | 39 | 74.8 | 178 | -171.9 | 20.7 | 0 | 0 | 0 | 112.6 | G136 R140 R141 R144 | G136-D138 PolarHBondContact O-N 3.33Å; D138-R140 PolarHBondContact O-N 3.44Å; D138-R140 PolarHBondContact OD1-N 3.44Å; D138-R141 HydrophobicContact CB-CB 4.21Å; D138-R141 WeakPolarHBondContact O-CB 3.45Å; D138-R141 PolarHBondContact O-N 2.94Å; D138-R141 PolarHBondContact OD1-N 3.41Å; D138-R141 WeakPolarHBondContact OD2-CA 3.12Å; D138-R141 PolarHBondContact OD2-N 3.23Å; D138-R144 IonicContact OD1-NH2 3.02Å; D138-R144 PolarHBondContact OD1-NH2 2.97Å; D138-R144 IonicContact OD2-CZ 3.24Å; D138-R144 VanDerWaalsContact OD2-CZ 3.24Å; D138-R144 IonicContact OD2-NE 3.08Å; D138-R144 PolarHBondContact OD2-NE 2.94Å; D138-R144 VanDerWaalsContact OD2-NE 3.08Å; D138-R144 IonicContact OD2-NH2 2.7Å; D138-R144 PolarHBondContact OD2-NH2 3.34Å | ||
| 139 | R | 69 | Low | 76.2 | Confident | 171 Ų | 171 | 121.8 Ų | 121.8 | 65% | 0.645 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.4 | -22.1 | 177.4 | -69.9 | -178.5 | 168.7 | -172.4 | -5.2 | 112.8 | E123 E137 | E123-R139 IonicContact OE1-CZ 3.35Å; E123-R139 IonicContact OE1-NH1 2.76Å; E123-R139 PolarHBondContact OE1-NH1 2.87Å; E123-R139 IonicContact OE1-NH2 2.96Å; E123-R139 PolarHBondContact OE1-NH2 2.92Å; E123-R139 IonicContact OE2-NH1 3.87Å; E137-R139 PolarHBondContact O-N 3.49Å |
| 140 | R | 78.8 | Confident | 77.8 | Confident | 180 Ų | 180 | 123.5 Ų | 123.5 | 68% | 0.679 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | 5.6 | 177 | -61.5 | -174 | -172.6 | 167.8 | 2.8 | 114.6 | D138 K142 E143 R144 | D138-R140 PolarHBondContact O-N 3.44Å; D138-R140 PolarHBondContact OD1-N 3.44Å; R140-K142 PolarHBondContact O-N 3.22Å; R140-E143 WeakPolarHBondContact O-CB 3.34Å; R140-E143 PolarHBondContact O-N 3.48Å; R140-R144 PolarHBondContact O-N 3.34Å |
| 141 | R | 80.7 | Confident | 79.3 | Confident | 175 Ų | 175 | 128.4 Ų | 128.4 | 66% | 0.66 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -51.3 | -42.1 | 178.7 | -177.9 | -179.6 | 178.5 | -163.7 | 1.1 | 112.6 | D138 E143 R144 V145 | D138-R141 HydrophobicContact CB-CB 4.21Å; D138-R141 WeakPolarHBondContact O-CB 3.45Å; D138-R141 PolarHBondContact O-N 2.94Å; D138-R141 PolarHBondContact OD1-N 3.41Å; D138-R141 WeakPolarHBondContact OD2-CA 3.12Å; D138-R141 PolarHBondContact OD2-N 3.23Å; R141-E143 PolarHBondContact O-N 2.86Å; R141-R144 PolarHBondContact O-N 2.99Å; R141-V145 HydrophobicContact CG-CG2 4.45Å; R141-V145 WeakPolarHBondContact O-CB 3.48Å; R141-V145 VanDerWaalsContact O-CG2 3.24Å; R141-V145 WeakPolarHBondContact O-CG2 3.41Å; R141-V145 PolarHBondContact O-N 3.37Å |
| 142 | K | 83.1 | Confident | 80.7 | Confident | 185 Ų | 185 | 128.3 Ų | 128.3 | 80% | 0.804 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63 | -40.8 | 178.4 | -70 | -177.7 | 179.2 | 176 | 0 | 112.1 | R140 K146 | R140-K142 PolarHBondContact O-N 3.22Å; K142-K146 WeakPolarHBondContact O-CB 3.4Å; K142-K146 PolarHBondContact O-N 3.44Å |
| 143 | E | 85.1 | Confident | 82.2 | Confident | 122 Ų | 122 | 126.4 Ų | 126.4 | 57% | 0.57 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.6 | -44.7 | 178 | -62.6 | 178.2 | 161.4 | 0 | 0 | 111.1 | R140 R141 V145 K146 E147 | R140-E143 WeakPolarHBondContact O-CB 3.34Å; R140-E143 PolarHBondContact O-N 3.48Å; R141-E143 PolarHBondContact O-N 2.86Å; E143-V145 PolarHBondContact O-N 2.83Å; E143-K146 WeakPolarHBondContact O-CB 3.47Å; E143-K146 PolarHBondContact O-N 3.45Å; E143-K146 VanDerWaalsContact O-N 3.16Å; E143-E147 PolarHBondContact O-N 3.39Å |
| 144 | R | 86.6 | Confident | 83.7 | Confident | 132 Ų | 132 | 129.7 Ų | 129.7 | 50% | 0.498 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -58.1 | -46.8 | 175.5 | -165.9 | -164.2 | -50.6 | -106.9 | -2.6 | 112.1 | D138 R140 R141 K146 E147 Q148 | D138-R144 IonicContact OD1-NH2 3.02Å; D138-R144 PolarHBondContact OD1-NH2 2.97Å; D138-R144 IonicContact OD2-CZ 3.24Å; D138-R144 VanDerWaalsContact OD2-CZ 3.24Å; D138-R144 IonicContact OD2-NE 3.08Å; D138-R144 PolarHBondContact OD2-NE 2.94Å; D138-R144 VanDerWaalsContact OD2-NE 3.08Å; D138-R144 IonicContact OD2-NH2 2.7Å; D138-R144 PolarHBondContact OD2-NH2 3.34Å; R140-R144 PolarHBondContact O-N 3.34Å; R141-R144 PolarHBondContact O-N 2.99Å; R144-K146 VanDerWaalsContact C-N 3.33Å; R144-K146 PolarHBondContact O-N 3.27Å; R144-E147 PolarHBondContact O-N 3.01Å; R144-Q148 WeakPolarHBondContact O-CB 3.32Å; R144-Q148 VanDerWaalsContact O-CG 3.32Å; R144-Q148 WeakPolarHBondContact O-CG 3.38Å; R144-Q148 PolarHBondContact O-N 3.48Å |
| 145 | V | 88.3 | Confident | 84.9 | Confident | 60 Ų | 60 | 129 Ų | 129 | 36% | 0.364 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -64.6 | -38.6 | 177 | 171 | 0 | 0 | 0 | 0 | 110.9 | R141 E143 Q148 M149 | R141-V145 HydrophobicContact CG-CG2 4.45Å; R141-V145 WeakPolarHBondContact O-CB 3.48Å; R141-V145 VanDerWaalsContact O-CG2 3.24Å; R141-V145 WeakPolarHBondContact O-CG2 3.41Å; R141-V145 PolarHBondContact O-N 3.37Å; E143-V145 PolarHBondContact O-N 2.83Å; V145-Q148 PolarHBondContact O-N 2.93Å; V145-M149 HydrophobicContact CG1-CE 4.49Å; V145-M149 WeakPolarHBondContact O-CB 3.31Å; V145-M149 WeakPolarHBondContact O-CG 3.33Å; V145-M149 PolarHBondContact O-N 3.44Å |
| 146 | K | 89.8 | Confident | 86.1 | Confident | 126 Ų | 126 | 124.1 Ų | 124.1 | 55% | 0.548 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.1 | -41.3 | 176.3 | -170.9 | 178.8 | -175.7 | 178.1 | 0 | 111.9 | K142 E143 R144 R150 | K142-K146 WeakPolarHBondContact O-CB 3.4Å; K142-K146 PolarHBondContact O-N 3.44Å; E143-K146 WeakPolarHBondContact O-CB 3.47Å; E143-K146 PolarHBondContact O-N 3.45Å; E143-K146 VanDerWaalsContact O-N 3.16Å; R144-K146 VanDerWaalsContact C-N 3.33Å; R144-K146 PolarHBondContact O-N 3.27Å; K146-R150 WeakPolarHBondContact O-CB 3.29Å; K146-R150 WeakPolarHBondContact O-CG 3.44Å; K146-R150 PolarHBondContact O-N 3.2Å |
| 147 | E | 88.8 | Confident | 87 | Confident | 124 Ų | 124 | 124.9 Ų | 124.9 | 58% | 0.579 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -68.3 | -41.6 | 174.7 | -73.1 | -172.6 | 169.5 | 0 | 0 | 112.7 | E143 R144 R150 K151 | E143-E147 PolarHBondContact O-N 3.39Å; R144-E147 PolarHBondContact O-N 3.01Å; E147-R150 PolarHBondContact O-N 3.3Å; E147-K151 WeakPolarHBondContact O-CG 3.49Å; E147-K151 PolarHBondContact O-N 3.15Å |
| 148 | Q | 89.6 | Confident | 88 | Confident | 102 Ų | 102 | 125.6 Ų | 125.6 | 48% | 0.477 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.1 | -40.9 | 174.4 | -74.2 | 177.7 | -4.2 | 0 | 0 | 112 | R144 V145 K151 K152 | R144-Q148 WeakPolarHBondContact O-CB 3.32Å; R144-Q148 VanDerWaalsContact O-CG 3.32Å; R144-Q148 WeakPolarHBondContact O-CG 3.38Å; R144-Q148 PolarHBondContact O-N 3.48Å; V145-Q148 PolarHBondContact O-N 2.93Å; Q148-K151 PolarHBondContact O-N 3.47Å; Q148-K152 WeakPolarHBondContact O-CB 3.29Å; Q148-K152 WeakPolarHBondContact O-CG 3.47Å; Q148-K152 PolarHBondContact O-N 2.85Å |
| 149 | M | 90.1 | Very high | 89.2 | Confident | 123 Ų | 123 | 129.2 Ų | 129.2 | 61% | 0.606 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63 | -43.7 | 172.9 | -80.9 | -163 | 175.8 | 0 | 0 | 111.4 | V145 K151 K152 V153 | V145-M149 HydrophobicContact CG1-CE 4.49Å; V145-M149 WeakPolarHBondContact O-CB 3.31Å; V145-M149 WeakPolarHBondContact O-CG 3.33Å; V145-M149 PolarHBondContact O-N 3.44Å; M149-K151 VanDerWaalsContact C-N 3.32Å; M149-K151 PolarHBondContact O-N 3.45Å; M149-K152 PolarHBondContact O-N 3.23Å; M149-V153 WeakPolarHBondContact O-CB 3.45Å; M149-V153 VanDerWaalsContact O-CG2 3.26Å; M149-V153 WeakPolarHBondContact O-CG2 3.34Å; M149-V153 PolarHBondContact O-N 3Å |
| 150 | R | 92.4 | Very high | 90.5 | Very high | 158 Ų | 158 | 125.9 Ų | 125.9 | 60% | 0.596 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -59.3 | -42.1 | 175.3 | -80.3 | 176 | 170.6 | 175.6 | -5 | 112.3 | K146 E147 K154 | K146-R150 WeakPolarHBondContact O-CB 3.29Å; K146-R150 WeakPolarHBondContact O-CG 3.44Å; K146-R150 PolarHBondContact O-N 3.2Å; E147-R150 PolarHBondContact O-N 3.3Å; R150-K154 WeakPolarHBondContact O-CG 3.33Å; R150-K154 PolarHBondContact O-N 3.17Å; R150-K154 VanDerWaalsContact O-N 3.08Å |
| 151 | K | 92.3 | Very high | 91.2 | Very high | 140 Ų | 140 | 120.3 Ų | 120.3 | 61% | 0.609 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.9 | -51.2 | 174.3 | -73.3 | -177.8 | 178.3 | -177.8 | 0 | 111.3 | E147 Q148 M149 V153 K154 D155 | E147-K151 WeakPolarHBondContact O-CG 3.49Å; E147-K151 PolarHBondContact O-N 3.15Å; Q148-K151 PolarHBondContact O-N 3.47Å; M149-K151 VanDerWaalsContact C-N 3.32Å; M149-K151 PolarHBondContact O-N 3.45Å; K151-V153 VanDerWaalsContact C-N 3.31Å; K151-V153 PolarHBondContact O-N 3.4Å; K151-K154 WeakPolarHBondContact O-CB 3.33Å; K151-K154 PolarHBondContact O-N 2.95Å; K151-D155 PolarHBondContact O-N 3.25Å |
| 152 | K | 93.8 | Very high | 91.9 | Very high | 135 Ų | 135 | 116 Ų | 116 | 59% | 0.587 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -56.7 | -41.8 | 177.1 | -75.5 | 179.8 | 178.3 | -177.9 | 0 | 113.1 | Q148 M149 D155 L156 | Q148-K152 WeakPolarHBondContact O-CB 3.29Å; Q148-K152 WeakPolarHBondContact O-CG 3.47Å; Q148-K152 PolarHBondContact O-N 2.85Å; M149-K152 PolarHBondContact O-N 3.23Å; K152-D155 PolarHBondContact O-N 3.02Å; K152-L156 VanDerWaalsContact O-CB 3.3Å; K152-L156 WeakPolarHBondContact O-CB 3.4Å; K152-L156 WeakPolarHBondContact O-CG 3.34Å; K152-L156 PolarHBondContact O-N 3.43Å |
| 153 | V | 94.7 | Very high | 92.5 | Very high | 95 Ų | 95 | 113.6 Ų | 113.6 | 58% | 0.576 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.4 | -42.5 | 177.2 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | M149 K151 Q157 | M149-V153 WeakPolarHBondContact O-CB 3.45Å; M149-V153 VanDerWaalsContact O-CG2 3.26Å; M149-V153 WeakPolarHBondContact O-CG2 3.34Å; M149-V153 PolarHBondContact O-N 3Å; K151-V153 VanDerWaalsContact C-N 3.31Å; K151-V153 PolarHBondContact O-N 3.4Å; V153-Q157 VanDerWaalsContact O-CB 3.27Å; V153-Q157 WeakPolarHBondContact O-CB 3.47Å; V153-Q157 PolarHBondContact O-N 3.42Å |
| 154 | K | 95.2 | Very high | 93 | Very high | 144 Ų | 144 | 112.8 Ų | 112.8 | 63% | 0.626 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.5 | -48.7 | 174.7 | -75.9 | -175.1 | 175.8 | -168.2 | 0 | 111.9 | R150 K151 L156 Q157 E158 | R150-K154 WeakPolarHBondContact O-CG 3.33Å; R150-K154 PolarHBondContact O-N 3.17Å; R150-K154 VanDerWaalsContact O-N 3.08Å; K151-K154 WeakPolarHBondContact O-CB 3.33Å; K151-K154 PolarHBondContact O-N 2.95Å; K154-L156 VanDerWaalsContact C-N 3.34Å; K154-L156 PolarHBondContact O-N 2.89Å; K154-Q157 WeakPolarHBondContact O-CB 3.32Å; K154-Q157 PolarHBondContact O-N 3.33Å; K154-Q157 VanDerWaalsContact O-N 3.17Å; K154-E158 PolarHBondContact O-N 2.83Å |
| 155 | D | 94.8 | Very high | 93.4 | Very high | 86 Ų | 86 | 111.4 Ų | 111.4 | 46% | 0.46 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.7 | -41 | -178.8 | -59 | -15.5 | 0 | 0 | 0 | 111.5 | K151 K152 E158 Q159 | K151-D155 PolarHBondContact O-N 3.25Å; K152-D155 PolarHBondContact O-N 3.02Å; D155-E158 PolarHBondContact O-N 3.28Å; D155-Q159 WeakPolarHBondContact O-CG 3.39Å; D155-Q159 PolarHBondContact O-N 3.45Å |
| 156 | L | 95.2 | Very high | 93.7 | Very high | 100 Ų | 100 | 115.6 Ų | 115.6 | 52% | 0.524 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.4 | -39.4 | 175.4 | -73.9 | 171.2 | 0 | 0 | 0 | 112 | K152 K154 Q159 M160 | K152-L156 VanDerWaalsContact O-CB 3.3Å; K152-L156 WeakPolarHBondContact O-CB 3.4Å; K152-L156 WeakPolarHBondContact O-CG 3.34Å; K152-L156 PolarHBondContact O-N 3.43Å; K154-L156 VanDerWaalsContact C-N 3.34Å; K154-L156 PolarHBondContact O-N 2.89Å; L156-Q159 PolarHBondContact O-N 3.49Å; L156-M160 WeakPolarHBondContact O-CB 3.46Å; L156-M160 VanDerWaalsContact O-CG 3.31Å; L156-M160 WeakPolarHBondContact O-CG 3.43Å; L156-M160 PolarHBondContact O-N 3.35Å |
| 157 | Q | 95.1 | Very high | 94 | Very high | 94 Ų | 94 | 113.3 Ų | 113.3 | 44% | 0.439 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.1 | -45.9 | 176.3 | -173.3 | 64 | 40.1 | 0 | 0 | 110.9 | V153 K154 Q159 M160 D161 | V153-Q157 VanDerWaalsContact O-CB 3.27Å; V153-Q157 WeakPolarHBondContact O-CB 3.47Å; V153-Q157 PolarHBondContact O-N 3.42Å; K154-Q157 WeakPolarHBondContact O-CB 3.32Å; K154-Q157 PolarHBondContact O-N 3.33Å; K154-Q157 VanDerWaalsContact O-N 3.17Å; Q157-Q159 PolarHBondContact O-N 2.95Å; Q157-M160 PolarHBondContact O-N 3.4Å; Q157-D161 PolarHBondContact NE2-OD1 3.31Å; Q157-D161 PolarHBondContact NE2-OD2 2.91Å; Q157-D161 PolarHBondContact O-N 2.91Å |
| 158 | E | 95.2 | Very high | 94.3 | Very high | 134 Ų | 134 | 111 Ų | 111 | 63% | 0.626 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -58.3 | -47.9 | 174.8 | -75.6 | 178.3 | -171.8 | 0 | 0 | 111.2 | K154 D155 M160 D161 D162 | K154-E158 PolarHBondContact O-N 2.83Å; D155-E158 PolarHBondContact O-N 3.28Å; E158-M160 VanDerWaalsContact C-N 3.34Å; E158-M160 PolarHBondContact O-N 3.09Å; E158-D161 PolarHBondContact O-N 3.06Å; E158-D162 VanDerWaalsContact O-CB 3.3Å; E158-D162 WeakPolarHBondContact O-CB 3.32Å; E158-D162 PolarHBondContact O-N 3.1Å |
| 159 | Q | 95.1 | Very high | 94.6 | Very high | 127 Ų | 127 | 113.7 Ų | 113.7 | 59% | 0.593 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.3 | -40.3 | 176.7 | -73.6 | 178.6 | 9.3 | 0 | 0 | 113.2 | D155 L156 Q157 K163 | D155-Q159 WeakPolarHBondContact O-CG 3.39Å; D155-Q159 PolarHBondContact O-N 3.45Å; L156-Q159 PolarHBondContact O-N 3.49Å; Q157-Q159 PolarHBondContact O-N 2.95Å; Q159-K163 WeakPolarHBondContact O-CB 3.35Å; Q159-K163 PolarHBondContact O-N 3.23Å |
| 160 | M | 95.1 | Very high | 94.8 | Very high | 102 Ų | 102 | 110.3 Ų | 110.3 | 50% | 0.502 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.2 | -44.7 | 177 | -78.2 | -177.3 | 63.1 | 0 | 0 | 111.5 | L156 Q157 E158 K163 K164 | L156-M160 WeakPolarHBondContact O-CB 3.46Å; L156-M160 VanDerWaalsContact O-CG 3.31Å; L156-M160 WeakPolarHBondContact O-CG 3.43Å; L156-M160 PolarHBondContact O-N 3.35Å; Q157-M160 PolarHBondContact O-N 3.4Å; E158-M160 VanDerWaalsContact C-N 3.34Å; E158-M160 PolarHBondContact O-N 3.09Å; M160-K163 PolarHBondContact O-N 3.26Å; M160-K164 WeakPolarHBondContact O-CG 3.37Å; M160-K164 PolarHBondContact O-N 3.45Å |
| 161 | D | 95.1 | Very high | 95 | Very high | 62 Ų | 62 | 109.5 Ų | 109.5 | 33% | 0.332 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.8 | -38.3 | -179.2 | -66.4 | -27.6 | 0 | 0 | 0 | 111.1 | Q157 E158 K163 K164 M165 | Q157-D161 PolarHBondContact NE2-OD1 3.31Å; Q157-D161 PolarHBondContact NE2-OD2 2.91Å; Q157-D161 PolarHBondContact O-N 2.91Å; E158-D161 PolarHBondContact O-N 3.06Å; D161-K163 PolarHBondContact O-N 3.33Å; D161-K164 PolarHBondContact O-N 3.07Å; D161-K164 IonicContact OD1-NZ 2.64Å; D161-K164 PolarHBondContact OD1-NZ 3.33Å; D161-M165 VanDerWaalsContact O-CG 3.29Å; D161-M165 WeakPolarHBondContact O-CG 3.36Å; D161-M165 PolarHBondContact O-N 2.87Å |
| 162 | D | 95.5 | Very high | 95.2 | Very high | 85 Ų | 85 | 107.8 Ų | 107.8 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -57.8 | -45.1 | 170.3 | -116.7 | 28.9 | 0 | 0 | 0 | 112.5 | E158 M165 R166 | E158-D162 VanDerWaalsContact O-CB 3.3Å; E158-D162 WeakPolarHBondContact O-CB 3.32Å; E158-D162 PolarHBondContact O-N 3.1Å; D162-M165 PolarHBondContact O-N 2.93Å; D162-R166 WeakPolarHBondContact O-CG 3.44Å; D162-R166 PolarHBondContact O-N 2.9Å; D162-R166 IonicContact OD2-CZ 3.8Å; D162-R166 IonicContact OD2-NH1 2.79Å; D162-R166 PolarHBondContact OD2-NH1 3.34Å; D162-R166 IonicContact OD2-NH2 3.53Å; D162-R166 PolarHBondContact OD2-NH2 2.99Å |
| 163 | K | 95.5 | Very high | 95.3 | Very high | 135 Ų | 135 | 109.8 Ų | 109.8 | 59% | 0.587 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63 | -46.6 | 176.7 | -174.1 | 179.1 | -176.9 | -177.5 | 0 | 111.1 | Q159 M160 D161 M165 R166 D167 | Q159-K163 WeakPolarHBondContact O-CB 3.35Å; Q159-K163 PolarHBondContact O-N 3.23Å; M160-K163 PolarHBondContact O-N 3.26Å; D161-K163 PolarHBondContact O-N 3.33Å; K163-M165 VanDerWaalsContact C-N 3.28Å; K163-M165 PolarHBondContact O-N 3Å; K163-R166 PolarHBondContact O-N 3.24Å; K163-R166 VanDerWaalsContact O-N 3.14Å; K163-D167 PolarHBondContact O-N 3.43Å |
| 164 | K | 95.6 | Very high | 95.4 | Very high | 105 Ų | 105 | 110.9 Ų | 110.9 | 46% | 0.457 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -57.1 | -42.3 | 175.3 | -71.3 | 170.7 | -165.2 | 157.8 | 0 | 111.5 | M160 D161 D167 T168 | M160-K164 WeakPolarHBondContact O-CG 3.37Å; M160-K164 PolarHBondContact O-N 3.45Å; D161-K164 PolarHBondContact O-N 3.07Å; D161-K164 IonicContact OD1-NZ 2.64Å; D161-K164 PolarHBondContact OD1-NZ 3.33Å; K164-D167 PolarHBondContact O-N 3.2Å; K164-T168 WeakPolarHBondContact O-CG2 3.34Å; K164-T168 PolarHBondContact O-N 3.02Å; K164-T168 PolarHBondContact O-OG1 3.32Å |
| 165 | M | 94.4 | Very high | 95.5 | Very high | 102 Ų | 102 | 108.2 Ų | 108.2 | 50% | 0.502 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.5 | -34.2 | 178.7 | -68.3 | -57.4 | -76.5 | 0 | 0 | 112.8 | D161 D162 K163 T168 R169 | D161-M165 VanDerWaalsContact O-CG 3.29Å; D161-M165 WeakPolarHBondContact O-CG 3.36Å; D161-M165 PolarHBondContact O-N 2.87Å; D162-M165 PolarHBondContact O-N 2.93Å; K163-M165 VanDerWaalsContact C-N 3.28Å; K163-M165 PolarHBondContact O-N 3Å; M165-T168 WeakPolarHBondContact CA-OG1 3.24Å; M165-T168 PolarHBondContact O-OG1 2.93Å; M165-T168 VanDerWaalsContact O-OG1 3.05Å; M165-R169 WeakPolarHBondContact O-CB 3.33Å; M165-R169 VanDerWaalsContact O-CG 3.24Å; M165-R169 WeakPolarHBondContact O-CG 3.5Å; M165-R169 PolarHBondContact O-N 3.48Å; M165-R169 VanDerWaalsContact O-N 3.15Å |
| 166 | R | 95 | Very high | 95.6 | Very high | 149 Ų | 149 | 107.9 Ų | 107.9 | 56% | 0.562 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.1 | -44.3 | 171.7 | -70.1 | -177.4 | -167.9 | 94 | 9.3 | 111.2 | D162 K163 R169 A170 | D162-R166 WeakPolarHBondContact O-CG 3.44Å; D162-R166 PolarHBondContact O-N 2.9Å; D162-R166 IonicContact OD2-CZ 3.8Å; D162-R166 IonicContact OD2-NH1 2.79Å; D162-R166 PolarHBondContact OD2-NH1 3.34Å; D162-R166 IonicContact OD2-NH2 3.53Å; D162-R166 PolarHBondContact OD2-NH2 2.99Å; K163-R166 PolarHBondContact O-N 3.24Å; K163-R166 VanDerWaalsContact O-N 3.14Å; R166-R169 PolarHBondContact O-N 2.97Å; R166-A170 WeakPolarHBondContact O-CB 3.32Å; R166-A170 PolarHBondContact O-N 3.41Å |
| 167 | D | 95.1 | Very high | 95.8 | Very high | 77 Ų | 77 | 108.3 Ų | 108.3 | 41% | 0.412 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.1 | -41.7 | -179.9 | -68.2 | -16.2 | 0 | 0 | 0 | 111.8 | K163 K164 A170 K171 | K163-D167 PolarHBondContact O-N 3.43Å; K164-D167 PolarHBondContact O-N 3.2Å; D167-A170 PolarHBondContact O-N 2.97Å; D167-K171 WeakPolarHBondContact O-CB 3.39Å; D167-K171 VanDerWaalsContact O-CG 3.29Å; D167-K171 WeakPolarHBondContact O-CG 3.43Å; D167-K171 PolarHBondContact O-N 3.37Å |
| 168 | T | 95.3 | Very high | 95.8 | Very high | 76 Ų | 76 | 107.8 Ų | 107.8 | 47% | 0.466 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.6 | -40.8 | 175.7 | 55.2 | 0 | 0 | 0 | 0 | 111.9 | K164 M165 K171 H172 | K164-T168 WeakPolarHBondContact O-CG2 3.34Å; K164-T168 PolarHBondContact O-N 3.02Å; K164-T168 PolarHBondContact O-OG1 3.32Å; M165-T168 WeakPolarHBondContact CA-OG1 3.24Å; M165-T168 PolarHBondContact O-OG1 2.93Å; M165-T168 VanDerWaalsContact O-OG1 3.05Å; T168-K171 PolarHBondContact O-N 2.97Å; T168-H172 WeakPolarHBondContact O-CB 3.41Å; T168-H172 PolarHBondContact O-N 3.41Å |
| 169 | R | 95.4 | Very high | 95.9 | Very high | 158 Ų | 158 | 105.3 Ų | 105.3 | 60% | 0.596 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.4 | -41 | 173.6 | -75.3 | 175.1 | -176.9 | -179.1 | 3.3 | 112.1 | M165 R166 H172 R173 | M165-R169 WeakPolarHBondContact O-CB 3.33Å; M165-R169 VanDerWaalsContact O-CG 3.24Å; M165-R169 WeakPolarHBondContact O-CG 3.5Å; M165-R169 PolarHBondContact O-N 3.48Å; M165-R169 VanDerWaalsContact O-N 3.15Å; R166-R169 PolarHBondContact O-N 2.97Å; R169-H172 PolarHBondContact O-N 2.92Å; R169-R173 WeakPolarHBondContact O-CG 3.41Å; R169-R173 PolarHBondContact O-N 3.5Å |
| 170 | A | 95.9 | Very high | 96 | Very high | 53 Ų | 53 | 104.7 Ų | 104.7 | 44% | 0.438 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.5 | -49.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.2 | R166 D167 H172 R173 E174 | R166-A170 WeakPolarHBondContact O-CB 3.32Å; R166-A170 PolarHBondContact O-N 3.41Å; D167-A170 PolarHBondContact O-N 2.97Å; A170-H172 VanDerWaalsContact C-N 3.3Å; A170-H172 PolarHBondContact O-N 3.48Å; A170-R173 WeakPolarHBondContact O-CB 3.44Å; A170-R173 PolarHBondContact O-N 2.98Å; A170-R173 VanDerWaalsContact O-N 3.16Å; A170-E174 PolarHBondContact O-N 2.96Å |
| 171 | K | 96.3 | Very high | 96.1 | Very high | 141 Ų | 141 | 104.4 Ų | 104.4 | 61% | 0.613 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.8 | -40.5 | 175.2 | -72.1 | 174.8 | -177.7 | -177.6 | 0 | 112.4 | D167 T168 E174 M175 | D167-K171 WeakPolarHBondContact O-CB 3.39Å; D167-K171 VanDerWaalsContact O-CG 3.29Å; D167-K171 WeakPolarHBondContact O-CG 3.43Å; D167-K171 PolarHBondContact O-N 3.37Å; T168-K171 PolarHBondContact O-N 2.97Å; K171-E174 PolarHBondContact O-N 3.32Å; K171-M175 WeakPolarHBondContact O-CB 3.25Å; K171-M175 PolarHBondContact O-N 2.94Å |
| 172 | H | 96 | Very high | 96.2 | Very high | 104 Ų | 104 | 105.8 Ų | 105.8 | 48% | 0.481 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -42.2 | 177.1 | -174.9 | 69.1 | 0 | 0 | 0 | 111.9 | T168 R169 A170 M175 L176 | T168-H172 WeakPolarHBondContact O-CB 3.41Å; T168-H172 PolarHBondContact O-N 3.41Å; R169-H172 PolarHBondContact O-N 2.92Å; A170-H172 VanDerWaalsContact C-N 3.3Å; A170-H172 PolarHBondContact O-N 3.48Å; H172-M175 WeakPolarHBondContact ND1-CE 3.43Å; H172-M175 PolarHBondContact O-N 3.3Å; H172-L176 WeakPolarHBondContact O-CG 3.35Å; H172-L176 PolarHBondContact O-N 3.06Å |
| 173 | R | 96.9 | Very high | 96.3 | Very high | 176 Ų | 176 | 106.3 Ų | 106.3 | 66% | 0.664 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.5 | -45.3 | 174.5 | -72.6 | 172.8 | -178.4 | -173 | -0.6 | 111.8 | R169 A170 L176 L177 | R169-R173 WeakPolarHBondContact O-CG 3.41Å; R169-R173 PolarHBondContact O-N 3.5Å; A170-R173 WeakPolarHBondContact O-CB 3.44Å; A170-R173 PolarHBondContact O-N 2.98Å; A170-R173 VanDerWaalsContact O-N 3.16Å; R173-L176 PolarHBondContact O-N 2.91Å; R173-L177 WeakPolarHBondContact O-CG 3.43Å; R173-L177 PolarHBondContact O-N 3.38Å |
| 174 | E | 96.3 | Very high | 96.4 | Very high | 119 Ų | 119 | 105.1 Ų | 105.1 | 56% | 0.556 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.7 | -45 | 177.2 | -170.7 | -174.7 | 167.5 | 0 | 0 | 111.5 | A170 K171 L176 L177 N178 | A170-E174 PolarHBondContact O-N 2.96Å; K171-E174 PolarHBondContact O-N 3.32Å; E174-L176 VanDerWaalsContact C-N 3.33Å; E174-L176 PolarHBondContact O-N 3.42Å; E174-L177 PolarHBondContact O-N 3.14Å; E174-N178 WeakPolarHBondContact O-CB 3.44Å; E174-N178 PolarHBondContact O-N 3.43Å |
| 175 | M | 97.1 | Very high | 96.5 | Very high | 87 Ų | 87 | 104.6 Ų | 104.6 | 43% | 0.429 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.6 | -43 | 174.8 | 178.8 | -166 | 68.8 | 0 | 0 | 112.1 | K171 H172 N178 N179 | K171-M175 WeakPolarHBondContact O-CB 3.25Å; K171-M175 PolarHBondContact O-N 2.94Å; H172-M175 WeakPolarHBondContact ND1-CE 3.43Å; H172-M175 PolarHBondContact O-N 3.3Å; M175-N178 PolarHBondContact O-N 3.46Å; M175-N179 WeakPolarHBondContact O-CB 3.36Å; M175-N179 PolarHBondContact O-N 2.87Å; M175-N179 PolarHBondContact O-ND2 3.42Å |
| 176 | L | 97.5 | Very high | 96.7 | Very high | 80 Ų | 80 | 104.3 Ų | 104.3 | 42% | 0.419 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.8 | -42.8 | 176.9 | -71 | 173.9 | 0 | 0 | 0 | 112 | H172 R173 E174 N179 Q180 | H172-L176 WeakPolarHBondContact O-CG 3.35Å; H172-L176 PolarHBondContact O-N 3.06Å; R173-L176 PolarHBondContact O-N 2.91Å; E174-L176 VanDerWaalsContact C-N 3.33Å; E174-L176 PolarHBondContact O-N 3.42Å; L176-N179 PolarHBondContact O-N 3.5Å; L176-Q180 WeakPolarHBondContact O-CG 3.49Å; L176-Q180 PolarHBondContact O-N 2.91Å |
| 177 | L | 97.6 | Very high | 96.8 | Very high | 108 Ų | 108 | 102 Ų | 102 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.8 | -44.8 | 176.5 | -70.3 | 171.1 | 0 | 0 | 0 | 111.5 | R173 E174 N179 Q180 L181 | R173-L177 WeakPolarHBondContact O-CG 3.43Å; R173-L177 PolarHBondContact O-N 3.38Å; E174-L177 PolarHBondContact O-N 3.14Å; L177-N179 VanDerWaalsContact C-N 3.34Å; L177-N179 PolarHBondContact O-N 3.01Å; L177-Q180 WeakPolarHBondContact O-CB 3.42Å; L177-Q180 PolarHBondContact O-N 3.4Å; L177-L181 PolarHBondContact O-N 3.38Å |
| 178 | N | 97.1 | Very high | 96.9 | Very high | 83 Ų | 83 | 105.6 Ų | 105.6 | 44% | 0.444 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61 | -43.4 | 176.6 | -74.5 | -15.5 | 0 | 0 | 0 | 111.4 | E174 M175 Q180 L181 V182 | E174-N178 WeakPolarHBondContact O-CB 3.44Å; E174-N178 PolarHBondContact O-N 3.43Å; M175-N178 PolarHBondContact O-N 3.46Å; N178-Q180 VanDerWaalsContact C-N 3.32Å; N178-Q180 PolarHBondContact O-N 3.44Å; N178-L181 PolarHBondContact O-N 3.2Å; N178-V182 WeakPolarHBondContact O-CG2 3.49Å; N178-V182 PolarHBondContact O-N 3.23Å |
| 179 | N | 96.8 | Very high | 97 | Very high | 83 Ų | 83 | 104.8 Ų | 104.8 | 44% | 0.444 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 175.6 | -72.1 | -19.1 | 0 | 0 | 0 | 112.1 | M175 L176 L177 N183 | M175-N179 WeakPolarHBondContact O-CB 3.36Å; M175-N179 PolarHBondContact O-N 2.87Å; M175-N179 PolarHBondContact O-ND2 3.42Å; L176-N179 PolarHBondContact O-N 3.5Å; L177-N179 VanDerWaalsContact C-N 3.34Å; L177-N179 PolarHBondContact O-N 3.01Å; N179-N183 WeakPolarHBondContact O-CB 3.42Å; N179-N183 PolarHBondContact O-N 3.31Å; N179-N183 PolarHBondContact O-ND2 2.91Å |
| 180 | Q | 97.4 | Very high | 97.1 | Very high | 114 Ų | 114 | 102 Ų | 102 | 53% | 0.533 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -42.3 | 175.3 | -75 | 176 | -1.5 | 0 | 0 | 111.9 | L176 L177 N178 N183 Q184 | L176-Q180 WeakPolarHBondContact O-CG 3.49Å; L176-Q180 PolarHBondContact O-N 2.91Å; L177-Q180 WeakPolarHBondContact O-CB 3.42Å; L177-Q180 PolarHBondContact O-N 3.4Å; N178-Q180 VanDerWaalsContact C-N 3.32Å; N178-Q180 PolarHBondContact O-N 3.44Å; Q180-N183 PolarHBondContact O-N 2.95Å; Q180-Q184 WeakPolarHBondContact O-CG 3.14Å; Q180-Q184 PolarHBondContact O-N 2.83Å |
| 181 | L | 97.1 | Very high | 97.2 | Very high | 95 Ų | 95 | 104.2 Ų | 104.2 | 50% | 0.497 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.9 | -47.1 | 178.3 | -170.4 | 68.6 | 0 | 0 | 0 | 111.4 | L177 N178 N183 Q184 D185 | L177-L181 PolarHBondContact O-N 3.38Å; N178-L181 PolarHBondContact O-N 3.2Å; L181-N183 VanDerWaalsContact C-N 3.28Å; L181-N183 PolarHBondContact O-N 3.48Å; L181-Q184 WeakPolarHBondContact O-CB 3.48Å; L181-Q184 PolarHBondContact O-N 2.94Å; L181-D185 PolarHBondContact O-N 3.28Å |
| 182 | V | 97.6 | Very high | 97.2 | Very high | 91 Ų | 91 | 101.8 Ų | 101.8 | 55% | 0.552 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59 | -40.9 | 176.2 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | N178 D185 L186 | N178-V182 WeakPolarHBondContact O-CG2 3.49Å; N178-V182 PolarHBondContact O-N 3.23Å; V182-D185 PolarHBondContact O-N 3.41Å; V182-L186 WeakPolarHBondContact O-CB 3.33Å; V182-L186 PolarHBondContact O-N 3.09Å |
| 183 | N | 97 | Very high | 97.3 | Very high | 97 Ų | 97 | 99.5 Ų | 99.5 | 52% | 0.519 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.5 | -40.7 | 175.9 | -71.9 | -22.4 | 0 | 0 | 0 | 111.7 | N179 Q180 L181 L186 M187 | N179-N183 WeakPolarHBondContact O-CB 3.42Å; N179-N183 PolarHBondContact O-N 3.31Å; N179-N183 PolarHBondContact O-ND2 2.91Å; Q180-N183 PolarHBondContact O-N 2.95Å; L181-N183 VanDerWaalsContact C-N 3.28Å; L181-N183 PolarHBondContact O-N 3.48Å; N183-L186 PolarHBondContact O-N 2.92Å; N183-M187 VanDerWaalsContact O-CG 3.25Å; N183-M187 WeakPolarHBondContact O-CG 3.17Å; N183-M187 PolarHBondContact O-N 3.32Å |
| 184 | Q | 97.5 | Very high | 97.4 | Very high | 110 Ų | 110 | 94.6 Ų | 94.6 | 51% | 0.514 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 175.3 | -72.9 | 176.8 | 8.8 | 0 | 0 | 111.2 | Q180 L181 L186 M187 W188 | Q180-Q184 WeakPolarHBondContact O-CG 3.14Å; Q180-Q184 PolarHBondContact O-N 2.83Å; L181-Q184 WeakPolarHBondContact O-CB 3.48Å; L181-Q184 PolarHBondContact O-N 2.94Å; Q184-L186 VanDerWaalsContact C-N 3.3Å; Q184-L186 PolarHBondContact O-N 3.15Å; Q184-M187 PolarHBondContact O-N 3.37Å; Q184-M187 VanDerWaalsContact O-N 3.14Å; Q184-W188 PolarHBondContact O-N 3.02Å |
| 185 | D | 97.6 | Very high | 97.4 | Very high | 94 Ų | 94 | 93.2 Ų | 93.2 | 50% | 0.503 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.1 | -40.8 | 178.1 | -70.5 | -17.5 | 0 | 0 | 0 | 111.8 | L181 V182 W188 A189 | L181-D185 PolarHBondContact O-N 3.28Å; V182-D185 PolarHBondContact O-N 3.41Å; D185-W188 PolarHBondContact O-N 2.85Å; D185-A189 WeakPolarHBondContact O-CB 3.36Å; D185-A189 PolarHBondContact O-N 3.3Å |
| 186 | L | 97.8 | Very high | 97.4 | Very high | 96 Ų | 96 | 93.1 Ų | 93.1 | 50% | 0.503 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -45.3 | 174.7 | -173.8 | 75.4 | 0 | 0 | 0 | 111.6 | V182 N183 Q184 W188 A189 Q190 | V182-L186 WeakPolarHBondContact O-CB 3.33Å; V182-L186 PolarHBondContact O-N 3.09Å; N183-L186 PolarHBondContact O-N 2.92Å; Q184-L186 VanDerWaalsContact C-N 3.3Å; Q184-L186 PolarHBondContact O-N 3.15Å; L186-W188 VanDerWaalsContact C-N 3.34Å; L186-W188 PolarHBondContact O-N 2.9Å; L186-A189 PolarHBondContact O-N 2.93Å; L186-Q190 WeakPolarHBondContact O-CG 3.43Å; L186-Q190 PolarHBondContact O-N 3.37Å |
| 187 | M | 97.5 | Very high | 97.4 | Very high | 99 Ų | 99 | 94.4 Ų | 94.4 | 49% | 0.488 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.9 | -41.9 | 178 | -69.3 | -58.6 | -63.9 | 0 | 0 | 111.4 | N183 Q184 Q190 Q191 | N183-M187 VanDerWaalsContact O-CG 3.25Å; N183-M187 WeakPolarHBondContact O-CG 3.17Å; N183-M187 PolarHBondContact O-N 3.32Å; Q184-M187 PolarHBondContact O-N 3.37Å; Q184-M187 VanDerWaalsContact O-N 3.14Å; M187-Q190 PolarHBondContact O-N 3.2Å; M187-Q191 WeakPolarHBondContact O-CB 3.43Å; M187-Q191 WeakPolarHBondContact O-CG 3.33Å; M187-Q191 PolarHBondContact O-N 2.95Å |
| 188 | W | 97.3 | Very high | 97.4 | Very high | 154 Ų | 154 | 97.5 Ų | 97.5 | 58% | 0.583 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.1 | -44.7 | 174.6 | -80.5 | 114.7 | 0 | 0 | 0 | 112.2 | Q184 D185 L186 Q190 Q191 N192 | Q184-W188 PolarHBondContact O-N 3.02Å; D185-W188 PolarHBondContact O-N 2.85Å; L186-W188 VanDerWaalsContact C-N 3.34Å; L186-W188 PolarHBondContact O-N 2.9Å; W188-Q190 VanDerWaalsContact C-N 3.33Å; W188-Q190 PolarHBondContact O-N 3.22Å; W188-Q191 PolarHBondContact O-N 3.41Å; W188-N192 WeakPolarHBondContact O-CB 3.5Å; W188-N192 PolarHBondContact O-N 3.42Å; W188-N192 PolarHBondContact O-ND2 2.96Å |
| 189 | A | 97.7 | Very high | 97.4 | Very high | 58 Ų | 58 | 100.1 Ų | 100.1 | 48% | 0.479 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.4 | -42.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | D185 L186 N192 A193 | D185-A189 WeakPolarHBondContact O-CB 3.36Å; D185-A189 PolarHBondContact O-N 3.3Å; L186-A189 PolarHBondContact O-N 2.93Å; A189-N192 PolarHBondContact O-N 3.49Å; A189-A193 WeakPolarHBondContact O-CB 3.25Å; A189-A193 PolarHBondContact O-N 3.02Å |
| 190 | Q | 97.4 | Very high | 97.5 | Very high | 99 Ų | 99 | 101.1 Ų | 101.1 | 46% | 0.463 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64 | -44.1 | 175.7 | -72.6 | 175.7 | 3.6 | 0 | 0 | 112.1 | L186 M187 W188 A193 V194 | L186-Q190 WeakPolarHBondContact O-CG 3.43Å; L186-Q190 PolarHBondContact O-N 3.37Å; M187-Q190 PolarHBondContact O-N 3.2Å; W188-Q190 VanDerWaalsContact C-N 3.33Å; W188-Q190 PolarHBondContact O-N 3.22Å; Q190-A193 PolarHBondContact O-N 3.43Å; Q190-V194 WeakPolarHBondContact O-CG2 3.43Å; Q190-V194 PolarHBondContact O-N 2.8Å |
| 191 | Q | 97.4 | Very high | 97.5 | Very high | 100 Ų | 100 | 98.6 Ų | 98.6 | 47% | 0.467 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.5 | -46.6 | 177 | -75.6 | 177.6 | -1.3 | 0 | 0 | 111.4 | M187 W188 A193 V194 E195 | M187-Q191 WeakPolarHBondContact O-CB 3.43Å; M187-Q191 WeakPolarHBondContact O-CG 3.33Å; M187-Q191 PolarHBondContact O-N 2.95Å; W188-Q191 PolarHBondContact O-N 3.41Å; Q191-A193 VanDerWaalsContact C-N 3.33Å; Q191-A193 PolarHBondContact O-N 3.47Å; Q191-V194 PolarHBondContact O-N 3.33Å; Q191-E195 PolarHBondContact O-N 2.96Å |
| 192 | N | 97.3 | Very high | 97.6 | Very high | 90 Ų | 90 | 97 Ų | 97 | 48% | 0.481 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.1 | -41.6 | 176.8 | -74.2 | -20.2 | 0 | 0 | 0 | 111.9 | W188 A189 V194 E195 E196 | W188-N192 WeakPolarHBondContact O-CB 3.5Å; W188-N192 PolarHBondContact O-N 3.42Å; W188-N192 PolarHBondContact O-ND2 2.96Å; A189-N192 PolarHBondContact O-N 3.49Å; N192-V194 PolarHBondContact O-N 3.02Å; N192-E195 PolarHBondContact O-N 3.27Å; N192-E196 WeakPolarHBondContact O-CG 3.47Å; N192-E196 PolarHBondContact O-N 3.46Å |
| 193 | A | 97.9 | Very high | 97.6 | Very high | 56 Ų | 56 | 98.3 Ų | 98.3 | 46% | 0.463 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | A189 Q190 Q191 E196 E197 | A189-A193 WeakPolarHBondContact O-CB 3.25Å; A189-A193 PolarHBondContact O-N 3.02Å; Q190-A193 PolarHBondContact O-N 3.43Å; Q191-A193 VanDerWaalsContact C-N 3.33Å; Q191-A193 PolarHBondContact O-N 3.47Å; A193-E196 PolarHBondContact O-N 3.33Å; A193-E197 WeakPolarHBondContact O-CG 3.33Å; A193-E197 PolarHBondContact O-N 2.98Å |
| 194 | V | 97.8 | Very high | 97.7 | Very high | 73 Ų | 73 | 97.7 Ų | 97.7 | 44% | 0.442 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.3 | -39.4 | 177.2 | 172.5 | 0 | 0 | 0 | 0 | 111.7 | Q190 Q191 N192 E197 R198 | Q190-V194 WeakPolarHBondContact O-CG2 3.43Å; Q190-V194 PolarHBondContact O-N 2.8Å; Q191-V194 PolarHBondContact O-N 3.33Å; N192-V194 PolarHBondContact O-N 3.02Å; V194-E197 PolarHBondContact O-N 3.33Å; V194-R198 WeakPolarHBondContact O-CG 3.36Å; V194-R198 PolarHBondContact O-N 2.92Å |
| 195 | E | 97.7 | Very high | 97.7 | Very high | 90 Ų | 90 | 95.4 Ų | 95.4 | 42% | 0.421 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 175.1 | -76.2 | -159.4 | 175.4 | 0 | 0 | 112.5 | Q191 N192 E197 R198 R199 | Q191-E195 PolarHBondContact O-N 2.96Å; N192-E195 PolarHBondContact O-N 3.27Å; E195-E197 VanDerWaalsContact C-N 3.35Å; E195-E197 PolarHBondContact O-N 3.06Å; E195-R198 WeakPolarHBondContact O-CB 3.38Å; E195-R198 PolarHBondContact O-N 3.4Å; E195-R199 WeakPolarHBondContact O-CG 3.31Å; E195-R199 PolarHBondContact O-N 2.92Å; E195-R199 IonicContact OE2-NH2 3.52Å |
| 196 | E | 97.3 | Very high | 97.7 | Very high | 85 Ų | 85 | 95.6 Ų | 95.6 | 40% | 0.397 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62 | -42.3 | 176.3 | -76.5 | -60.8 | 135.2 | 0 | 0 | 111.7 | N192 A193 R198 R199 K200 | N192-E196 WeakPolarHBondContact O-CG 3.47Å; N192-E196 PolarHBondContact O-N 3.46Å; A193-E196 PolarHBondContact O-N 3.33Å; E196-R198 VanDerWaalsContact C-N 3.35Å; E196-R198 PolarHBondContact O-N 3.25Å; E196-R199 PolarHBondContact O-N 3.46Å; E196-R199 IonicContact OE1-CZ 2.82Å; E196-R199 IonicContact OE1-NH1 2.67Å; E196-R199 PolarHBondContact OE1-NH1 3.49Å; E196-K200 VanDerWaalsContact O-CG 3.31Å; E196-K200 WeakPolarHBondContact O-CG 3.28Å; E196-K200 PolarHBondContact O-N 3.43Å |
| 197 | E | 97.7 | Very high | 97.7 | Very high | 108 Ų | 108 | 98.5 Ų | 98.5 | 51% | 0.505 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.8 | -38.6 | 174.1 | -69 | -53 | 134.3 | 0 | 0 | 112.4 | A193 V194 E195 K200 A201 | A193-E197 WeakPolarHBondContact O-CG 3.33Å; A193-E197 PolarHBondContact O-N 2.98Å; V194-E197 PolarHBondContact O-N 3.33Å; E195-E197 VanDerWaalsContact C-N 3.35Å; E195-E197 PolarHBondContact O-N 3.06Å; E197-K200 PolarHBondContact O-N 3.07Å; E197-K200 IonicContact OE1-NZ 3.52Å; E197-K200 PolarHBondContact OE1-NZ 2.76Å; E197-A201 WeakPolarHBondContact O-CB 3.41Å; E197-A201 PolarHBondContact O-N 3.22Å |
| 198 | R | 97.3 | Very high | 97.7 | Very high | 173 Ų | 173 | 97.5 Ų | 97.5 | 65% | 0.653 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.3 | -41.7 | 173.2 | -73.1 | 172.9 | -179.1 | 174.9 | 1.4 | 112.1 | V194 E195 E196 A201 A202 | V194-R198 WeakPolarHBondContact O-CG 3.36Å; V194-R198 PolarHBondContact O-N 2.92Å; E195-R198 WeakPolarHBondContact O-CB 3.38Å; E195-R198 PolarHBondContact O-N 3.4Å; E196-R198 VanDerWaalsContact C-N 3.35Å; E196-R198 PolarHBondContact O-N 3.25Å; R198-A201 PolarHBondContact O-N 2.87Å; R198-A202 WeakPolarHBondContact O-CB 3.23Å; R198-A202 PolarHBondContact O-N 3.39Å |
| 199 | R | 97.6 | Very high | 97.8 | Very high | 137 Ų | 137 | 94.5 Ų | 94.5 | 52% | 0.517 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 176.2 | -72.7 | 174.3 | -173.5 | 173.1 | 2.9 | 111 | E195 E196 A202 L203 | E195-R199 WeakPolarHBondContact O-CG 3.31Å; E195-R199 PolarHBondContact O-N 2.92Å; E195-R199 IonicContact OE2-NH2 3.52Å; E196-R199 PolarHBondContact O-N 3.46Å; E196-R199 IonicContact OE1-CZ 2.82Å; E196-R199 IonicContact OE1-NH1 2.67Å; E196-R199 PolarHBondContact OE1-NH1 3.49Å; R199-A202 PolarHBondContact O-N 3.21Å; R199-L203 WeakPolarHBondContact O-CG 3.4Å; R199-L203 PolarHBondContact O-N 2.98Å |
| 200 | K | 97.8 | Very high | 97.8 | Very high | 104 Ų | 104 | 96 Ų | 96 | 45% | 0.452 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.8 | -47 | 175.2 | -69.4 | 172.6 | -166.1 | 169.2 | 0 | 111.4 | E196 E197 A202 L203 V204 | E196-K200 VanDerWaalsContact O-CG 3.31Å; E196-K200 WeakPolarHBondContact O-CG 3.28Å; E196-K200 PolarHBondContact O-N 3.43Å; E197-K200 PolarHBondContact O-N 3.07Å; E197-K200 IonicContact OE1-NZ 3.52Å; E197-K200 PolarHBondContact OE1-NZ 2.76Å; K200-A202 VanDerWaalsContact C-N 3.34Å; K200-A202 PolarHBondContact O-N 2.89Å; K200-L203 PolarHBondContact O-N 3.37Å; K200-V204 WeakPolarHBondContact O-CG2 3.45Å; K200-V204 PolarHBondContact O-N 3.28Å |
| 201 | A | 98.2 | Very high | 97.9 | Very high | 62 Ų | 62 | 95.1 Ų | 95.1 | 51% | 0.512 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.7 | -42 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | E197 R198 V204 S205 | E197-A201 WeakPolarHBondContact O-CB 3.41Å; E197-A201 PolarHBondContact O-N 3.22Å; R198-A201 PolarHBondContact O-N 2.87Å; A201-V204 PolarHBondContact O-N 2.95Å; A201-S205 PolarHBondContact O-N 3.4Å |
| 202 | A | 98.1 | Very high | 97.9 | Very high | 60 Ų | 60 | 92.6 Ų | 92.6 | 50% | 0.496 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | R198 R199 K200 S205 L206 | R198-A202 WeakPolarHBondContact O-CB 3.23Å; R198-A202 PolarHBondContact O-N 3.39Å; R199-A202 PolarHBondContact O-N 3.21Å; K200-A202 VanDerWaalsContact C-N 3.34Å; K200-A202 PolarHBondContact O-N 2.89Å; A202-S205 PolarHBondContact O-N 3.5Å; A202-L206 WeakPolarHBondContact O-CB 3.36Å; A202-L206 PolarHBondContact O-N 2.95Å |
| 203 | L | 98.1 | Very high | 97.9 | Very high | 120 Ų | 120 | 92.8 Ų | 92.8 | 63% | 0.628 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.8 | -42.1 | 175.9 | -72.5 | 172.6 | 0 | 0 | 0 | 112.2 | R199 K200 L206 W207 | R199-L203 WeakPolarHBondContact O-CG 3.4Å; R199-L203 PolarHBondContact O-N 2.98Å; K200-L203 PolarHBondContact O-N 3.37Å; L203-L206 PolarHBondContact O-N 3.38Å; L203-W207 WeakPolarHBondContact O-CB 3.31Å; L203-W207 PolarHBondContact O-N 2.96Å |
| 204 | V | 98.1 | Very high | 97.9 | Very high | 84 Ų | 84 | 92.6 Ų | 92.6 | 51% | 0.509 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.3 | -43.3 | 176.2 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | K200 A201 L206 W207 N208 | K200-V204 WeakPolarHBondContact O-CG2 3.45Å; K200-V204 PolarHBondContact O-N 3.28Å; A201-V204 PolarHBondContact O-N 2.95Å; V204-L206 PolarHBondContact O-N 2.94Å; V204-W207 PolarHBondContact O-N 3.22Å; V204-N208 VanDerWaalsContact O-CG 3.26Å; V204-N208 PolarHBondContact O-N 2.88Å; V204-N208 PolarHBondContact O-ND2 2.95Å |
| 205 | S | 97.8 | Very high | 97.9 | Very high | 61 Ų | 61 | 94.3 Ų | 94.3 | 43% | 0.427 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.3 | -49.3 | 174.6 | -169.4 | 0 | 0 | 0 | 0 | 111.5 | A201 A202 W207 N208 D209 | A201-S205 PolarHBondContact O-N 3.4Å; A202-S205 PolarHBondContact O-N 3.5Å; S205-W207 VanDerWaalsContact C-N 3.29Å; S205-W207 PolarHBondContact O-N 3.43Å; S205-N208 WeakPolarHBondContact O-CB 3.38Å; S205-N208 PolarHBondContact O-N 3.42Å; S205-D209 VanDerWaalsContact O-CG 3.25Å; S205-D209 PolarHBondContact O-N 3.46Å |
| 206 | L | 98.3 | Very high | 97.9 | Very high | 99 Ų | 99 | 93.7 Ų | 93.7 | 52% | 0.518 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.6 | -35.6 | 179.3 | -176.7 | 143.3 | 0 | 0 | 0 | 112.2 | A202 L203 V204 N210 | A202-L206 WeakPolarHBondContact O-CB 3.36Å; A202-L206 PolarHBondContact O-N 2.95Å; L203-L206 PolarHBondContact O-N 3.38Å; V204-L206 PolarHBondContact O-N 2.94Å; L206-N210 WeakPolarHBondContact CD2-ND2 3.4Å; L206-N210 VanDerWaalsContact O-CB 3.31Å; L206-N210 WeakPolarHBondContact O-CB 3.32Å; L206-N210 PolarHBondContact O-N 3.36Å; L206-N210 PolarHBondContact O-ND2 3.34Å |
| 207 | W | 98 | Very high | 97.9 | Very high | 156 Ų | 156 | 97.3 Ų | 97.3 | 59% | 0.591 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.2 | -45.3 | 174.1 | -178.7 | 84.8 | 0 | 0 | 0 | 111.7 | L203 V204 S205 D209 N210 Q211 | L203-W207 WeakPolarHBondContact O-CB 3.31Å; L203-W207 PolarHBondContact O-N 2.96Å; V204-W207 PolarHBondContact O-N 3.22Å; S205-W207 VanDerWaalsContact C-N 3.29Å; S205-W207 PolarHBondContact O-N 3.43Å; W207-D209 PolarHBondContact O-N 2.89Å; W207-N210 PolarHBondContact O-N 2.88Å; W207-Q211 VanDerWaalsContact CZ3-OE1 3.24Å; W207-Q211 WeakPolarHBondContact O-CB 3.38Å; W207-Q211 PolarHBondContact O-N 2.92Å |
| 208 | N | 98.3 | Very high | 97.9 | Very high | 78 Ų | 78 | 94.3 Ų | 94.3 | 42% | 0.417 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.3 | -44.4 | 175.3 | -68.6 | -27.8 | 0 | 0 | 0 | 111.5 | V204 S205 Q211 A212 | V204-N208 VanDerWaalsContact O-CG 3.26Å; V204-N208 PolarHBondContact O-N 2.88Å; V204-N208 PolarHBondContact O-ND2 2.95Å; S205-N208 WeakPolarHBondContact O-CB 3.38Å; S205-N208 PolarHBondContact O-N 3.42Å; N208-Q211 PolarHBondContact O-N 3.48Å; N208-A212 WeakPolarHBondContact O-CB 3.36Å; N208-A212 PolarHBondContact O-N 3.07Å |
| 209 | D | 98.3 | Very high | 98 | Very high | 92 Ų | 92 | 91.3 Ų | 91.3 | 49% | 0.492 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.7 | -43.6 | 178.3 | -66.5 | -26 | 0 | 0 | 0 | 111.4 | S205 W207 Q211 A212 L213 | S205-D209 VanDerWaalsContact O-CG 3.25Å; S205-D209 PolarHBondContact O-N 3.46Å; W207-D209 PolarHBondContact O-N 2.89Å; D209-Q211 VanDerWaalsContact C-N 3.31Å; D209-Q211 PolarHBondContact O-N 2.89Å; D209-A212 PolarHBondContact O-N 3.26Å; D209-L213 WeakPolarHBondContact O-CB 3.5Å; D209-L213 WeakPolarHBondContact O-CG 3.47Å; D209-L213 PolarHBondContact O-N 3.34Å |
| 210 | N | 98.1 | Very high | 98 | Very high | 88 Ų | 88 | 88.2 Ų | 88.2 | 47% | 0.471 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.5 | -38.3 | 175.7 | -76.8 | -25.3 | 0 | 0 | 0 | 112.1 | L206 W207 A214 | L206-N210 WeakPolarHBondContact CD2-ND2 3.4Å; L206-N210 VanDerWaalsContact O-CB 3.31Å; L206-N210 WeakPolarHBondContact O-CB 3.32Å; L206-N210 PolarHBondContact O-N 3.36Å; L206-N210 PolarHBondContact O-ND2 3.34Å; W207-N210 PolarHBondContact O-N 2.88Å; N210-A214 WeakPolarHBondContact O-CB 3.27Å; N210-A214 PolarHBondContact O-N 3.31Å |
| 211 | Q | 98.3 | Very high | 98 | Very high | 81 Ų | 81 | 90 Ų | 90 | 38% | 0.379 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.5 | -48.5 | 175 | -175.1 | -179.4 | -19.9 | 0 | 0 | 110.8 | W207 N208 D209 L213 A214 E215 | W207-Q211 VanDerWaalsContact CZ3-OE1 3.24Å; W207-Q211 WeakPolarHBondContact O-CB 3.38Å; W207-Q211 PolarHBondContact O-N 2.92Å; N208-Q211 PolarHBondContact O-N 3.48Å; D209-Q211 VanDerWaalsContact C-N 3.31Å; D209-Q211 PolarHBondContact O-N 2.89Å; Q211-L213 VanDerWaalsContact C-N 3.33Å; Q211-L213 PolarHBondContact O-N 2.93Å; Q211-A214 WeakPolarHBondContact O-CB 3.41Å; Q211-A214 PolarHBondContact O-N 3.32Å; Q211-A214 VanDerWaalsContact O-N 3.07Å; Q211-E215 PolarHBondContact NE2-OE1 3.06Å; Q211-E215 VanDerWaalsContact NE2-OE1 3.08Å; Q211-E215 WeakPolarHBondContact O-CG 3.45Å; Q211-E215 PolarHBondContact O-N 2.94Å |
| 212 | A | 97.9 | Very high | 97.9 | Very high | 48 Ų | 48 | 93.7 Ų | 93.7 | 40% | 0.397 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59 | -43.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | N208 D209 A214 E215 V216 | N208-A212 WeakPolarHBondContact O-CB 3.36Å; N208-A212 PolarHBondContact O-N 3.07Å; D209-A212 PolarHBondContact O-N 3.26Å; A212-A214 VanDerWaalsContact C-N 3.32Å; A212-A214 PolarHBondContact O-N 3.28Å; A212-E215 PolarHBondContact O-N 3.19Å; A212-V216 WeakPolarHBondContact O-CG2 3.45Å; A212-V216 PolarHBondContact O-N 3.16Å |
| 213 | L | 98.1 | Very high | 97.9 | Very high | 93 Ų | 93 | 96.3 Ų | 96.3 | 49% | 0.487 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.4 | -37.6 | 174.5 | -76.3 | 169.7 | 0 | 0 | 0 | 112.5 | D209 Q211 R217 | D209-L213 WeakPolarHBondContact O-CB 3.5Å; D209-L213 WeakPolarHBondContact O-CG 3.47Å; D209-L213 PolarHBondContact O-N 3.34Å; Q211-L213 VanDerWaalsContact C-N 3.33Å; Q211-L213 PolarHBondContact O-N 2.93Å; L213-R217 WeakPolarHBondContact O-CB 3.42Å; L213-R217 VanDerWaalsContact O-CG 3.27Å; L213-R217 WeakPolarHBondContact O-CG 3.37Å; L213-R217 PolarHBondContact O-N 3.39Å |
| 214 | A | 97.9 | Very high | 97.9 | Very high | 53 Ų | 53 | 95.8 Ų | 95.8 | 44% | 0.438 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.7 | -39.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | N210 Q211 A212 A218 | N210-A214 WeakPolarHBondContact O-CB 3.27Å; N210-A214 PolarHBondContact O-N 3.31Å; Q211-A214 WeakPolarHBondContact O-CB 3.41Å; Q211-A214 PolarHBondContact O-N 3.32Å; Q211-A214 VanDerWaalsContact O-N 3.07Å; A212-A214 VanDerWaalsContact C-N 3.32Å; A212-A214 PolarHBondContact O-N 3.28Å; A214-A218 WeakPolarHBondContact O-CB 3.42Å; A214-A218 PolarHBondContact O-N 2.99Å |
| 215 | E | 97.8 | Very high | 97.9 | Very high | 108 Ų | 108 | 99.2 Ų | 99.2 | 51% | 0.505 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65 | -48.1 | 175.9 | -71.3 | 174.1 | -168.3 | 0 | 0 | 111.4 | Q211 A212 R217 A218 L219 | Q211-E215 PolarHBondContact NE2-OE1 3.06Å; Q211-E215 VanDerWaalsContact NE2-OE1 3.08Å; Q211-E215 WeakPolarHBondContact O-CG 3.45Å; Q211-E215 PolarHBondContact O-N 2.94Å; A212-E215 PolarHBondContact O-N 3.19Å; E215-R217 PolarHBondContact O-N 3.26Å; E215-A218 WeakPolarHBondContact O-CA 3.39Å; E215-A218 WeakPolarHBondContact O-CB 3.49Å; E215-A218 PolarHBondContact O-N 2.98Å; E215-L219 WeakPolarHBondContact O-CG 3.41Å; E215-L219 PolarHBondContact O-N 2.92Å |
| 216 | V | 97.8 | Very high | 97.9 | Very high | 77 Ų | 77 | 104 Ų | 104 | 47% | 0.467 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.6 | -49.9 | 174.8 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | A212 A218 L219 D220 | A212-V216 WeakPolarHBondContact O-CG2 3.45Å; A212-V216 PolarHBondContact O-N 3.16Å; V216-A218 PolarHBondContact O-N 3.02Å; V216-A218 VanDerWaalsContact O-N 3.16Å; V216-L219 WeakPolarHBondContact O-CB 3.35Å; V216-L219 PolarHBondContact O-N 3.43Å; V216-D220 PolarHBondContact O-N 2.95Å |
| 217 | R | 97.6 | Very high | 97.8 | Very high | 161 Ų | 161 | 103.3 Ų | 103.3 | 61% | 0.608 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.4 | -27.3 | 176.6 | -73.8 | 177.9 | -176.1 | -177.5 | 4.1 | 113.5 | L213 E215 R221 | L213-R217 WeakPolarHBondContact O-CB 3.42Å; L213-R217 VanDerWaalsContact O-CG 3.27Å; L213-R217 WeakPolarHBondContact O-CG 3.37Å; L213-R217 PolarHBondContact O-N 3.39Å; E215-R217 PolarHBondContact O-N 3.26Å; R217-R221 WeakPolarHBondContact O-CB 3.46Å; R217-R221 WeakPolarHBondContact O-CG 3.31Å; R217-R221 PolarHBondContact O-N 2.8Å; R217-R221 PolarHBondContact O-NE 3.02Å |
| 218 | A | 97.8 | Very high | 97.8 | Very high | 45 Ų | 45 | 101 Ų | 101 | 37% | 0.372 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -75.8 | -37.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | A214 E215 V216 R222 | A214-A218 WeakPolarHBondContact O-CB 3.42Å; A214-A218 PolarHBondContact O-N 2.99Å; E215-A218 WeakPolarHBondContact O-CA 3.39Å; E215-A218 WeakPolarHBondContact O-CB 3.49Å; E215-A218 PolarHBondContact O-N 2.98Å; V216-A218 PolarHBondContact O-N 3.02Å; V216-A218 VanDerWaalsContact O-N 3.16Å; A218-R222 WeakPolarHBondContact O-CB 3.44Å; A218-R222 PolarHBondContact O-N 3.31Å |
| 219 | L | 97.8 | Very high | 97.8 | Very high | 110 Ų | 110 | 99.7 Ų | 99.7 | 58% | 0.576 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.6 | -48.9 | 172.8 | -66.2 | 175.9 | 0 | 0 | 0 | 111.1 | E215 V216 R221 R222 E223 | E215-L219 WeakPolarHBondContact O-CG 3.41Å; E215-L219 PolarHBondContact O-N 2.92Å; V216-L219 WeakPolarHBondContact O-CB 3.35Å; V216-L219 PolarHBondContact O-N 3.43Å; L219-R221 VanDerWaalsContact C-N 3.31Å; L219-R221 PolarHBondContact O-N 3.17Å; L219-R222 CarbonylContact O-C 3.56Å; L219-R222 WeakPolarHBondContact O-CA 3.46Å; L219-R222 WeakPolarHBondContact O-CB 3.31Å; L219-R222 PolarHBondContact O-N 2.95Å; L219-E223 PolarHBondContact O-N 3.23Å |
| 220 | D | 97.4 | Very high | 97.7 | Very high | 73 Ų | 73 | 97.6 Ų | 97.6 | 39% | 0.39 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -56.4 | -45.8 | 177.7 | -64.1 | -18.4 | 0 | 0 | 0 | 111.3 | V216 R222 E223 Q224 | V216-D220 PolarHBondContact O-N 2.95Å; D220-R222 VanDerWaalsContact C-N 3.26Å; D220-R222 PolarHBondContact O-N 3.08Å; D220-E223 PolarHBondContact O-N 2.85Å; D220-Q224 WeakPolarHBondContact O-CB 3.33Å; D220-Q224 VanDerWaalsContact O-CG 3.31Å; D220-Q224 WeakPolarHBondContact O-CG 3.26Å; D220-Q224 PolarHBondContact O-N 3.04Å |
| 221 | R | 97.9 | Very high | 97.7 | Very high | 140 Ų | 140 | 98.5 Ų | 98.5 | 53% | 0.528 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.1 | -28.5 | 175.8 | -78.9 | -178.5 | -75.9 | 164.1 | -6.1 | 113.2 | R217 L219 R225 | R217-R221 WeakPolarHBondContact O-CB 3.46Å; R217-R221 WeakPolarHBondContact O-CG 3.31Å; R217-R221 PolarHBondContact O-N 2.8Å; R217-R221 PolarHBondContact O-NE 3.02Å; L219-R221 VanDerWaalsContact C-N 3.31Å; L219-R221 PolarHBondContact O-N 3.17Å; R221-R225 WeakPolarHBondContact O-CG 3.47Å; R221-R225 PolarHBondContact O-N 3.09Å; R221-R225 PolarHBondContact O-NE 2.74Å |
| 222 | R | 97.7 | Very high | 97.7 | Very high | 140 Ų | 140 | 98.7 Ų | 98.7 | 53% | 0.528 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -75.2 | -39.5 | 175.2 | -172.3 | 179.6 | -175.2 | -178.7 | 1.7 | 110.7 | A218 L219 D220 R226 | A218-R222 WeakPolarHBondContact O-CB 3.44Å; A218-R222 PolarHBondContact O-N 3.31Å; L219-R222 CarbonylContact O-C 3.56Å; L219-R222 WeakPolarHBondContact O-CA 3.46Å; L219-R222 WeakPolarHBondContact O-CB 3.31Å; L219-R222 PolarHBondContact O-N 2.95Å; D220-R222 VanDerWaalsContact C-N 3.26Å; D220-R222 PolarHBondContact O-N 3.08Å; R222-R226 WeakPolarHBondContact O-CG 3.33Å; R222-R226 PolarHBondContact O-N 2.82Å; R222-R226 VanDerWaalsContact O-N 3.09Å |
| 223 | E | 97.5 | Very high | 97.6 | Very high | 115 Ų | 115 | 102 Ų | 102 | 54% | 0.537 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.2 | -47 | 175.2 | -170.3 | 175.4 | 178.9 | 0 | 0 | 111.4 | L219 D220 R225 R226 N227 | L219-E223 PolarHBondContact O-N 3.23Å; D220-E223 PolarHBondContact O-N 2.85Å; E223-R225 VanDerWaalsContact C-N 3.32Å; E223-R225 PolarHBondContact O-N 3.33Å; E223-R226 WeakPolarHBondContact O-CA 3.4Å; E223-R226 WeakPolarHBondContact O-CB 3.48Å; E223-R226 PolarHBondContact O-N 2.91Å; E223-N227 PolarHBondContact O-N 2.83Å |
| 224 | Q | 97.3 | Very high | 97.6 | Very high | 109 Ų | 109 | 101.1 Ų | 101.1 | 51% | 0.509 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -53.5 | -48.2 | 173.2 | -75.2 | 173.1 | -9.1 | 0 | 0 | 111.7 | D220 R226 N227 E228 | D220-Q224 WeakPolarHBondContact O-CB 3.33Å; D220-Q224 VanDerWaalsContact O-CG 3.31Å; D220-Q224 WeakPolarHBondContact O-CG 3.26Å; D220-Q224 PolarHBondContact O-N 3.04Å; Q224-R226 VanDerWaalsContact C-N 3.28Å; Q224-R226 PolarHBondContact O-N 3.26Å; Q224-N227 PolarHBondContact O-N 3.01Å; Q224-N227 VanDerWaalsContact O-N 3.17Å; Q224-E228 WeakPolarHBondContact O-CB 3.48Å; Q224-E228 VanDerWaalsContact O-CG 3.31Å; Q224-E228 WeakPolarHBondContact O-CG 3.3Å; Q224-E228 PolarHBondContact O-N 2.82Å |
| 225 | R | 97.8 | Very high | 97.6 | Very high | 157 Ų | 157 | 104.3 Ų | 104.3 | 59% | 0.592 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.3 | -32.5 | 176.1 | -77.8 | -178.9 | -69.5 | -168.8 | 1.8 | 113.6 | R221 E223 A229 | R221-R225 WeakPolarHBondContact O-CG 3.47Å; R221-R225 PolarHBondContact O-N 3.09Å; R221-R225 PolarHBondContact O-NE 2.74Å; E223-R225 VanDerWaalsContact C-N 3.32Å; E223-R225 PolarHBondContact O-N 3.33Å; R225-A229 VanDerWaalsContact O-CB 3.26Å; R225-A229 WeakPolarHBondContact O-CB 3.45Å; R225-A229 PolarHBondContact O-N 3.06Å |
| 226 | R | 97.6 | Very high | 97.5 | Very high | 161 Ų | 161 | 104.8 Ų | 104.8 | 61% | 0.608 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70 | -43.2 | 174.6 | -78.3 | 176.7 | 168.8 | 176.6 | -4.4 | 111 | R222 E223 Q224 A229 A230 | R222-R226 WeakPolarHBondContact O-CG 3.33Å; R222-R226 PolarHBondContact O-N 2.82Å; R222-R226 VanDerWaalsContact O-N 3.09Å; E223-R226 WeakPolarHBondContact O-CA 3.4Å; E223-R226 WeakPolarHBondContact O-CB 3.48Å; E223-R226 PolarHBondContact O-N 2.91Å; Q224-R226 VanDerWaalsContact C-N 3.28Å; Q224-R226 PolarHBondContact O-N 3.26Å; R226-A229 PolarHBondContact O-N 2.87Å; R226-A230 PolarHBondContact O-N 3.48Å |
| 227 | N | 97.6 | Very high | 97.4 | Very high | 85 Ų | 85 | 109 Ų | 109 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.3 | -48.6 | 178.1 | -65.6 | -8.5 | 0 | 0 | 0 | 110.4 | E223 Q224 A229 A230 D231 | E223-N227 PolarHBondContact O-N 2.83Å; Q224-N227 PolarHBondContact O-N 3.01Å; Q224-N227 VanDerWaalsContact O-N 3.17Å; N227-A229 VanDerWaalsContact C-N 3.28Å; N227-A229 PolarHBondContact O-N 3.39Å; N227-A230 CarbonylContact O-C 3.6Å; N227-A230 WeakPolarHBondContact O-CA 3.36Å; N227-A230 WeakPolarHBondContact O-CB 3.22Å; N227-A230 PolarHBondContact O-N 3.41Å; N227-D231 VanDerWaalsContact O-CG 3.31Å; N227-D231 PolarHBondContact O-N 2.82Å |
| 228 | E | 97.9 | Very high | 97.2 | Very high | 108 Ų | 108 | 106.3 Ų | 106.3 | 51% | 0.505 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -55.4 | -43.3 | 173.4 | -72.9 | 170.9 | -176.8 | 0 | 0 | 111.6 | Q224 A230 D231 N232 | Q224-E228 WeakPolarHBondContact O-CB 3.48Å; Q224-E228 VanDerWaalsContact O-CG 3.31Å; Q224-E228 WeakPolarHBondContact O-CG 3.3Å; Q224-E228 PolarHBondContact O-N 2.82Å; E228-A230 PolarHBondContact O-N 3.44Å; E228-D231 PolarHBondContact O-N 3.49Å; E228-N232 VanDerWaalsContact O-CB 3.3Å; E228-N232 WeakPolarHBondContact O-CB 3.49Å; E228-N232 PolarHBondContact O-N 3.02Å; E228-N232 PolarHBondContact O-ND2 3.17Å; E228-N232 VanDerWaalsContact O-ND2 3.1Å; E228-N232 PolarHBondContact O-OD1 3.36Å |
| 229 | A | 97.1 | Very high | 97.1 | Very high | 49 Ų | 49 | 107.5 Ų | 107.5 | 41% | 0.405 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65 | -38 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | R225 R226 N227 L233 | R225-A229 VanDerWaalsContact O-CB 3.26Å; R225-A229 WeakPolarHBondContact O-CB 3.45Å; R225-A229 PolarHBondContact O-N 3.06Å; R226-A229 PolarHBondContact O-N 2.87Å; N227-A229 VanDerWaalsContact C-N 3.28Å; N227-A229 PolarHBondContact O-N 3.39Å; A229-L233 WeakPolarHBondContact O-CG 3.44Å; A229-L233 PolarHBondContact O-N 2.87Å; A229-L233 VanDerWaalsContact O-N 3.15Å |
| 230 | A | 97.5 | Very high | 96.9 | Very high | 49 Ų | 49 | 104.2 Ų | 104.2 | 41% | 0.405 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67 | -45 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | R226 N227 E228 N232 L233 V234 | R226-A230 PolarHBondContact O-N 3.48Å; N227-A230 CarbonylContact O-C 3.6Å; N227-A230 WeakPolarHBondContact O-CA 3.36Å; N227-A230 WeakPolarHBondContact O-CB 3.22Å; N227-A230 PolarHBondContact O-N 3.41Å; E228-A230 PolarHBondContact O-N 3.44Å; A230-N232 VanDerWaalsContact C-N 3.35Å; A230-N232 PolarHBondContact O-N 3.3Å; A230-L233 WeakPolarHBondContact O-CB 3.45Å; A230-L233 PolarHBondContact O-N 3.42Å; A230-L233 VanDerWaalsContact O-N 3.16Å; A230-V234 WeakPolarHBondContact O-CG2 3.47Å; A230-V234 PolarHBondContact O-N 2.97Å |
| 231 | D | 97.6 | Very high | 96.6 | Very high | 106 Ų | 106 | 104 Ų | 104 | 57% | 0.567 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.8 | -43.3 | 177.1 | -67.5 | -20.6 | 0 | 0 | 0 | 111 | N227 E228 L233 V234 E235 | N227-D231 VanDerWaalsContact O-CG 3.31Å; N227-D231 PolarHBondContact O-N 2.82Å; E228-D231 PolarHBondContact O-N 3.49Å; D231-L233 VanDerWaalsContact C-N 3.3Å; D231-L233 PolarHBondContact O-N 3.1Å; D231-V234 PolarHBondContact O-N 3.41Å; D231-E235 WeakPolarHBondContact O-CB 3.47Å; D231-E235 PolarHBondContact O-N 3.42Å |
| 232 | N | 97.6 | Very high | 96.3 | Very high | 86 Ų | 86 | 99.7 Ų | 99.7 | 46% | 0.46 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.6 | -40 | 175 | -69.8 | -22.2 | 0 | 0 | 0 | 111.9 | E228 A230 E235 I236 | E228-N232 VanDerWaalsContact O-CB 3.3Å; E228-N232 WeakPolarHBondContact O-CB 3.49Å; E228-N232 PolarHBondContact O-N 3.02Å; E228-N232 PolarHBondContact O-ND2 3.17Å; E228-N232 VanDerWaalsContact O-ND2 3.1Å; E228-N232 PolarHBondContact O-OD1 3.36Å; A230-N232 VanDerWaalsContact C-N 3.35Å; A230-N232 PolarHBondContact O-N 3.3Å; N232-E235 PolarHBondContact O-N 2.91Å; N232-I236 WeakPolarHBondContact O-CB 3.2Å; N232-I236 WeakPolarHBondContact O-CD1 3.5Å; N232-I236 WeakPolarHBondContact O-CG1 3.33Å; N232-I236 PolarHBondContact O-N 3.23Å |
| 233 | L | 97.2 | Very high | 95.7 | Very high | 118 Ų | 118 | 96.6 Ų | 96.6 | 62% | 0.618 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.9 | -40.5 | 177 | -73.4 | 171.4 | 0 | 0 | 0 | 111.6 | A229 A230 D231 I236 W237 | A229-L233 WeakPolarHBondContact O-CG 3.44Å; A229-L233 PolarHBondContact O-N 2.87Å; A229-L233 VanDerWaalsContact O-N 3.15Å; A230-L233 WeakPolarHBondContact O-CB 3.45Å; A230-L233 PolarHBondContact O-N 3.42Å; A230-L233 VanDerWaalsContact O-N 3.16Å; D231-L233 VanDerWaalsContact C-N 3.3Å; D231-L233 PolarHBondContact O-N 3.1Å; L233-I236 PolarHBondContact O-N 3.32Å; L233-W237 WeakPolarHBondContact O-CB 3.36Å; L233-W237 PolarHBondContact O-N 3.29Å |
| 234 | V | 97.2 | Very high | 95.1 | Very high | 73 Ų | 73 | 98.2 Ų | 98.2 | 44% | 0.442 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.9 | -42.9 | 175.7 | 170.7 | 0 | 0 | 0 | 0 | 110.4 | A230 D231 W237 H238 | A230-V234 WeakPolarHBondContact O-CG2 3.47Å; A230-V234 PolarHBondContact O-N 2.97Å; D231-V234 PolarHBondContact O-N 3.41Å; V234-W237 PolarHBondContact O-N 3.33Å; V234-H238 WeakPolarHBondContact CG1-CD2 3.41Å; V234-H238 WeakPolarHBondContact CG1-NE2 3.35Å; V234-H238 WeakPolarHBondContact O-CB 3.15Å; V234-H238 PolarHBondContact O-CD2 3.09Å; V234-H238 PolarHBondContact O-N 3.16Å |
| 235 | E | 97.1 | Very high | 94.8 | Very high | 121 Ų | 121 | 98.4 Ų | 98.4 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.7 | -46.6 | 174.9 | -175.1 | -176.9 | 175.9 | 0 | 0 | 111.8 | D231 N232 W237 H238 T239 | D231-E235 WeakPolarHBondContact O-CB 3.47Å; D231-E235 PolarHBondContact O-N 3.42Å; N232-E235 PolarHBondContact O-N 2.91Å; E235-W237 VanDerWaalsContact C-N 3.29Å; E235-W237 PolarHBondContact O-N 3.15Å; E235-H238 PolarHBondContact O-N 2.94Å; E235-T239 WeakPolarHBondContact O-CB 3.45Å; E235-T239 PolarHBondContact O-N 3.35Å; E235-T239 PolarHBondContact O-OG1 3.44Å |
| 236 | I | 96.1 | Very high | 94.2 | Very high | 118 Ų | 118 | 93.9 Ų | 93.9 | 61% | 0.605 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.1 | -44.1 | 176 | -71.1 | 164.5 | 0 | 0 | 0 | 110.2 | N232 L233 G240 | N232-I236 WeakPolarHBondContact O-CB 3.2Å; N232-I236 WeakPolarHBondContact O-CD1 3.5Å; N232-I236 WeakPolarHBondContact O-CG1 3.33Å; N232-I236 PolarHBondContact O-N 3.23Å; L233-I236 PolarHBondContact O-N 3.32Å; I236-G240 PolarHBondContact O-N 3.18Å |
| 237 | W | 95.6 | Very high | 93.6 | Very high | 164 Ų | 164 | 91.8 Ų | 91.8 | 62% | 0.621 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.5 | -47.4 | 179.8 | -173.3 | 83 | 0 | 0 | 0 | 111.8 | L233 V234 E235 T239 G240 T241 | L233-W237 WeakPolarHBondContact O-CB 3.36Å; L233-W237 PolarHBondContact O-N 3.29Å; V234-W237 PolarHBondContact O-N 3.33Å; E235-W237 VanDerWaalsContact C-N 3.29Å; E235-W237 PolarHBondContact O-N 3.15Å; W237-T239 VanDerWaalsContact C-N 3.35Å; W237-T239 PolarHBondContact O-N 3.15Å; W237-G240 PolarHBondContact O-N 3.28Å; W237-T241 HydrophobicContact CD2-CG2 4.23Å; W237-T241 HydrophobicContact CZ2-CG2 4.05Å; W237-T241 WeakPolarHBondContact O-CB 3.37Å; W237-T241 WeakPolarHBondContact O-CG2 3.47Å; W237-T241 PolarHBondContact O-N 2.79Å; W237-T241 PolarHBondContact O-OG1 3.07Å |
| 238 | H | 94.8 | Very high | 92.5 | Very high | 106 Ų | 106 | 90.9 Ų | 90.9 | 49% | 0.491 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 176.9 | -74.8 | -47.2 | 0 | 0 | 0 | 112.6 | V234 E235 T241 S242 | V234-H238 WeakPolarHBondContact CG1-CD2 3.41Å; V234-H238 WeakPolarHBondContact CG1-NE2 3.35Å; V234-H238 WeakPolarHBondContact O-CB 3.15Å; V234-H238 PolarHBondContact O-CD2 3.09Å; V234-H238 PolarHBondContact O-N 3.16Å; E235-H238 PolarHBondContact O-N 2.94Å; H238-T241 PolarHBondContact O-N 2.93Å; H238-T241 PolarHBondContact O-OG1 2.82Å; H238-S242 WeakPolarHBondContact O-CB 3.39Å; H238-S242 PolarHBondContact O-N 2.97Å |
| 239 | T | 94.9 | Very high | 91.1 | Very high | 69 Ų | 69 | 90.4 Ų | 90.4 | 42% | 0.423 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.2 | -48 | 176.8 | -57.4 | 0 | 0 | 0 | 0 | 109.9 | E235 W237 T241 S242 L245 | E235-T239 WeakPolarHBondContact O-CB 3.45Å; E235-T239 PolarHBondContact O-N 3.35Å; E235-T239 PolarHBondContact O-OG1 3.44Å; W237-T239 VanDerWaalsContact C-N 3.35Å; W237-T239 PolarHBondContact O-N 3.15Å; T239-T241 VanDerWaalsContact C-N 3.32Å; T239-T241 PolarHBondContact O-N 3.17Å; T239-S242 WeakPolarHBondContact O-CB 3.48Å; T239-S242 PolarHBondContact O-N 3.39Å; T239-S242 VanDerWaalsContact O-N 3.17Å; T239-L245 HydrophobicContact CG2-CD1 3.68Å; T239-L245 WeakPolarHBondContact O-CD1 3.43Å |
| 240 | G | 93.6 | Very high | 89.5 | Confident | 42 Ų | 42 | 95.9 Ų | 95.9 | 43% | 0.433 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.7 | -29.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | I236 W237 T246 | I236-G240 PolarHBondContact O-N 3.18Å; W237-G240 PolarHBondContact O-N 3.28Å; G240-T246 WeakPolarHBondContact O-CG2 3.39Å |
| 241 | T | 91.5 | Very high | 87.7 | Confident | 68 Ų | 68 | 96.8 Ų | 96.8 | 42% | 0.417 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 1.7 | 175.9 | 54.5 | 0 | 0 | 0 | 0 | 113.4 | W237 H238 T239 | W237-T241 HydrophobicContact CD2-CG2 4.23Å; W237-T241 HydrophobicContact CZ2-CG2 4.05Å; W237-T241 WeakPolarHBondContact O-CB 3.37Å; W237-T241 WeakPolarHBondContact O-CG2 3.47Å; W237-T241 PolarHBondContact O-N 2.79Å; W237-T241 PolarHBondContact O-OG1 3.07Å; H238-T241 PolarHBondContact O-N 2.93Å; H238-T241 PolarHBondContact O-OG1 2.82Å; T239-T241 VanDerWaalsContact C-N 3.32Å; T239-T241 PolarHBondContact O-N 3.17Å |
| 242 | S | 91.3 | Very high | 85.9 | Confident | 50 Ų | 50 | 92.9 Ų | 92.9 | 35% | 0.35 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -65.3 | 142.9 | 178.3 | 179.9 | 0 | 0 | 0 | 0 | 111.2 | H238 T239 M244 L245 T246 | H238-S242 WeakPolarHBondContact O-CB 3.39Å; H238-S242 PolarHBondContact O-N 2.97Å; T239-S242 WeakPolarHBondContact O-CB 3.48Å; T239-S242 PolarHBondContact O-N 3.39Å; T239-S242 VanDerWaalsContact O-N 3.17Å; S242-M244 PolarHBondContact O-N 3.47Å; S242-M244 VanDerWaalsContact O-N 3.15Å; S242-M244 PolarHBondContact OG-N 2.86Å; S242-L245 PolarHBondContact O-N 2.68Å; S242-L245 VanDerWaalsContact O-N 3.09Å; S242-T246 PolarHBondContact O-N 3.49Å; S242-T246 PolarHBondContact O-OG1 2.87Å |
| 243 | D | 85.1 | Confident | 84.2 | Confident | 75 Ų | 75 | 92 Ų | 92 | 40% | 0.401 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -54.1 | -30.6 | 174.2 | -177.1 | 27.9 | 0 | 0 | 0 | 112.1 | E247 T248 | D243-E247 WeakPolarHBondContact O-CA 3.17Å; D243-E247 PolarHBondContact O-N 3.47Å; D243-T248 PolarHBondContact OD1-OG1 3.01Å |
| 244 | M | 85.3 | Confident | 82.7 | Confident | 148 Ų | 148 | 88.8 Ų | 88.8 | 73% | 0.729 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -67.7 | -43.2 | 177.3 | -179 | 179.9 | -94.5 | 0 | 0 | 112.7 | S242 | S242-M244 PolarHBondContact O-N 3.47Å; S242-M244 VanDerWaalsContact O-N 3.15Å; S242-M244 PolarHBondContact OG-N 2.86Å |
| 245 | L | 89.8 | Confident | 81.2 | Confident | 113 Ų | 113 | 93.5 Ų | 93.5 | 59% | 0.592 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -89.2 | -32.5 | -176.2 | -69.8 | -167.5 | 0 | 0 | 0 | 113.3 | T239 S242 E247 | T239-L245 HydrophobicContact CG2-CD1 3.68Å; T239-L245 WeakPolarHBondContact O-CD1 3.43Å; S242-L245 PolarHBondContact O-N 2.68Å; S242-L245 VanDerWaalsContact O-N 3.09Å; L245-E247 VanDerWaalsContact C-N 3.28Å |
| 246 | T | 86.1 | Confident | 79.5 | Confident | 63 Ų | 63 | 92.8 Ų | 92.8 | 39% | 0.387 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -80.2 | -14.8 | 177.9 | 54.2 | 0 | 0 | 0 | 0 | 112.6 | G240 S242 T248 | G240-T246 WeakPolarHBondContact O-CG2 3.39Å; S242-T246 PolarHBondContact O-N 3.49Å; S242-T246 PolarHBondContact O-OG1 2.87Å; T246-T248 PolarHBondContact O-N 3.36Å; T246-T248 VanDerWaalsContact O-N 3.12Å |
| 247 | E | 84.6 | Confident | 77.8 | Confident | 117 Ų | 117 | 90.9 Ų | 90.9 | 55% | 0.547 | 51% | 0.508 | S | S | . | . | trans | 44.3 | 44 | -175.3 | -54.7 | -161.3 | 139.1 | 0 | 0 | 111.5 | D243 L245 A249 R270 | D243-E247 WeakPolarHBondContact O-CA 3.17Å; D243-E247 PolarHBondContact O-N 3.47Å; L245-E247 VanDerWaalsContact C-N 3.28Å; E247-A249 PolarHBondContact O-N 3.16Å; E247-A249 VanDerWaalsContact O-N 3.09Å; E247-R270 IonicContact OE1-CZ 3.71Å; E247-R270 IonicContact OE1-NH1 2.76Å; E247-R270 PolarHBondContact OE1-NH1 2.82Å; E247-R270 IonicContact OE2-NH1 2.8Å | ||
| 248 | T | 75.9 | Confident | 76.6 | Confident | 65 Ų | 65 | 86.7 Ų | 86.7 | 40% | 0.399 | 52% | 0.516 | S | S | . | . | trans | -51.2 | 123.3 | -173.5 | 27.7 | 0 | 0 | 0 | 0 | 110.1 | D243 T246 E250 | D243-T248 PolarHBondContact OD1-OG1 3.01Å; T246-T248 PolarHBondContact O-N 3.36Å; T246-T248 VanDerWaalsContact O-N 3.12Å; T248-E250 PolarHBondContact O-N 3.28Å; T248-E250 VanDerWaalsContact O-N 3.09Å | ||
| 249 | A | 66.6 | Low | 75.5 | Confident | 98 Ų | 98 | 85.8 Ų | 85.8 | 81% | 0.81 | 54% | 0.535 | S | S | * | . | trans | -73.7 | 5.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | E247 P251 | E247-A249 PolarHBondContact O-N 3.16Å; E247-A249 VanDerWaalsContact O-N 3.09Å; A249-P251 WeakPolarHBondContact O-CD 3.21Å; A249-P251 VanDerWaalsContact O-N 3.11Å | ||
| 250 | E | 65.2 | Low | 74.2 | Confident | 165 Ų | 165 | 91 Ų | 91 | 77% | 0.771 | 55% | 0.546 | S | S | * | . | trans | -60.3 | 117.3 | 171.1 | -72 | -161.8 | 163.1 | 0 | 0 | 107.7 | T248 A252 | T248-E250 PolarHBondContact O-N 3.28Å; T248-E250 VanDerWaalsContact O-N 3.09Å; E250-A252 PolarHBondContact O-N 2.84Å | ||
| 251 | P | 58.3 | Low | 73.1 | Confident | 68 Ų | 68 | 93.1 Ų | 93.1 | 44% | 0.442 | 55% | 0.553 | S | S | . | * | trans | -63.5 | 132.2 | 179.4 | 29.6 | -34 | 0 | 0 | 0 | 105.9 | A249 E253 V264 | A249-P251 WeakPolarHBondContact O-CD 3.21Å; A249-P251 VanDerWaalsContact O-N 3.11Å; P251-E253 HydrophobicContact CB-CG 3.77Å; P251-E253 HydrophobicContact CG-CG 3.67Å; P251-E253 WeakPolarHBondContact CG-OE1 3.39Å; P251-E253 PolarHBondContact O-N 3Å; P251-V264 HydrophobicContact CB-CG2 4.48Å | ||
| 252 | A | 59.9 | Low | 72.2 | Confident | 23 Ų | 23 | 93 Ų | 93 | 19% | 0.19 | 55% | 0.553 | C | S | . | * | trans | -70.5 | 62 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | E250 T254 L265 K268 | E250-A252 PolarHBondContact O-N 2.84Å; A252-T254 PolarHBondContact O-N 2.92Å; A252-L265 HydrophobicContact CB-CD1 3.85Å; A252-K268 HydrophobicContact CB-CB 3.82Å; A252-K268 HydrophobicContact CB-CD 3.21Å; A252-K268 HydrophobicContact CB-CG 4.13Å | ||
| 253 | E | 63.3 | Low | 71.5 | Confident | 68 Ų | 68 | 95.2 Ų | 95.2 | 32% | 0.318 | 56% | 0.558 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -65.5 | 101.6 | 172.1 | -73.8 | 179.6 | -177.7 | 0 | 0 | 105.3 | P251 Y255 P262 H263 | P251-E253 HydrophobicContact CB-CG 3.77Å; P251-E253 HydrophobicContact CG-CG 3.67Å; P251-E253 WeakPolarHBondContact CG-OE1 3.39Å; P251-E253 PolarHBondContact O-N 3Å; E253-Y255 HydrophobicContact CB-CE2 4Å; E253-Y255 PolarHBondContact O-N 3.25Å; E253-Y255 VanDerWaalsContact O-N 3.15Å; E253-Y255 PolarHBondContact OE2-OH 3.22Å; E253-P262 HydrophobicContact CB-CB 3.94Å; E253-P262 HydrophobicContact CG-CB 3.88Å; E253-H263 WeakPolarHBondContact CA-O 3.32Å |
| 254 | T | 64.3 | Low | 71.1 | Confident | 50 Ų | 50 | 94.2 Ų | 94.2 | 31% | 0.307 | 55% | 0.554 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -78 | 107.5 | 172.4 | -42.9 | 0 | 0 | 0 | 0 | 105.8 | A252 L256 H263 L265 | A252-T254 PolarHBondContact O-N 2.92Å; T254-L256 HydrophobicContact CG2-CD2 3.92Å; T254-L256 HydrophobicContact CG2-CG 3.88Å; T254-L256 PolarHBondContact O-N 3.09Å; T254-H263 PolarHBondContact N-O 3.45Å; T254-H263 VanDerWaalsContact N-O 3.12Å; T254-L265 WeakPolarHBondContact OG1-CD1 3.5Å; T254-L265 WeakPolarHBondContact OG1-CG 3.49Å |
| 255 | Y | 65.3 | Low | 70.9 | Confident | 173 Ų | 173 | 90.3 Ų | 90.3 | 68% | 0.678 | 54% | 0.536 | S | S | * | . | trans | -73 | 76.3 | 166.5 | -67 | -84.5 | 0 | 0 | 0 | 108.1 | E253 G257 P262 | E253-Y255 HydrophobicContact CB-CE2 4Å; E253-Y255 PolarHBondContact O-N 3.25Å; E253-Y255 VanDerWaalsContact O-N 3.15Å; E253-Y255 PolarHBondContact OE2-OH 3.22Å; Y255-G257 PolarHBondContact O-N 3.12Å; Y255-P262 HydrophobicContact CE1-CB 4.26Å | ||
| 256 | L | 61.5 | Low | 70.6 | Confident | 105 Ų | 105 | 90.1 Ų | 90.1 | 55% | 0.55 | 54% | 0.542 | S | S | . | . | trans | -65.6 | 103.3 | 167.7 | -69 | 170.8 | 0 | 0 | 0 | 106.6 | T254 | T254-L256 HydrophobicContact CG2-CD2 3.92Å; T254-L256 HydrophobicContact CG2-CG 3.88Å; T254-L256 PolarHBondContact O-N 3.09Å | ||
| 257 | G | 61.7 | Low | 70.3 | Confident | 79 Ų | 79 | 94.7 Ų | 94.7 | 81% | 0.814 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.7 | 144.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y255 | Y255-G257 PolarHBondContact O-N 3.12Š|
| 258 | G | 70.5 | Confident | 70 | Confident | 76 Ų | 76 | 94.4 Ų | 94.4 | 78% | 0.784 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 119.6 | 24.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | R260 | G258-R260 VanDerWaalsContact C-N 3.27Å; G258-R260 PolarHBondContact O-N 2.78Å |
| 259 | G | 71.1 | Confident | 70.3 | Confident | 86 Ų | 86 | 97.9 Ų | 97.9 | 89% | 0.887 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.1 | 13.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 260 | R | 67.4 | Low | 71.1 | Confident | 178 Ų | 178 | 100.1 Ų | 100.1 | 67% | 0.672 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 140 | 172.5 | -65.7 | -174.1 | -170.9 | -143.5 | 1.7 | 109.8 | G258 | G258-R260 VanDerWaalsContact C-N 3.27Å; G258-R260 PolarHBondContact O-N 2.78Å |
| 261 | P | 71.5 | Confident | 72 | Confident | 88 Ų | 88 | 94.1 Ų | 94.1 | 57% | 0.571 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -59.4 | 148.9 | 174.1 | 24.9 | -32.1 | 0 | 0 | 0 | 110 | H263 | P261-H263 PolarHBondContact O-CD2 3.16Å; P261-H263 PolarHBondContact O-N 2.99Å; P261-H263 PolarHBondContact O-NE2 3.24Å |
| 262 | P | 72.1 | Confident | 73.2 | Confident | 64 Ų | 64 | 95.6 Ų | 95.6 | 42% | 0.416 | 54% | 0.538 | S | S | . | . | P | Polyproline II helix | trans | -56.2 | 127.6 | 179.9 | 20.4 | -30.2 | 0 | 0 | 0 | 110.2 | E253 Y255 | E253-P262 HydrophobicContact CB-CB 3.94Å; E253-P262 HydrophobicContact CG-CB 3.88Å; Y255-P262 HydrophobicContact CE1-CB 4.26Å |
| 263 | H | 75.1 | Confident | 74.4 | Confident | 97 Ų | 97 | 97.2 Ų | 97.2 | 45% | 0.449 | 55% | 0.548 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 138.4 | 176.5 | -67.1 | -70 | 0 | 0 | 0 | 109.4 | E253 T254 P261 | E253-H263 WeakPolarHBondContact CA-O 3.32Å; T254-H263 PolarHBondContact N-O 3.45Å; T254-H263 VanDerWaalsContact N-O 3.12Å; P261-H263 PolarHBondContact O-CD2 3.16Å; P261-H263 PolarHBondContact O-N 2.99Å; P261-H263 PolarHBondContact O-NE2 3.24Å |
| 264 | V | 78.5 | Confident | 75.6 | Confident | 54 Ų | 54 | 100 Ų | 100 | 33% | 0.327 | 57% | 0.565 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88 | 130.1 | 174.7 | -170.6 | 0 | 0 | 0 | 0 | 109 | P251 W269 | P251-V264 HydrophobicContact CB-CG2 4.48Å; V264-W269 HydrophobicContact CB-CE3 4.09Å; V264-W269 HydrophobicContact CB-CZ3 4.44Å; V264-W269 HydrophobicContact CG1-CE3 3.79Å; V264-W269 HydrophobicContact CG1-CZ3 4.45Å; V264-W269 HydrophobicContact CG2-CE3 4.36Å; V264-W269 HydrophobicContact CG2-CZ3 4.24Å |
| 265 | L | 81 | Confident | 76.7 | Confident | 67 Ų | 67 | 101.1 Ų | 101.1 | 35% | 0.351 | 58% | 0.579 | S | S | . | * | trans | -61.4 | 129.7 | 173.5 | -79.9 | 145.7 | 0 | 0 | 0 | 110.4 | A252 T254 D267 K268 W269 | A252-L265 HydrophobicContact CB-CD1 3.85Å; T254-L265 WeakPolarHBondContact OG1-CD1 3.5Å; T254-L265 WeakPolarHBondContact OG1-CG 3.49Å; L265-D267 VanDerWaalsContact C-N 3.25Å; L265-D267 PolarHBondContact O-N 3.09Å; L265-K268 HydrophobicContact CB-CB 4.2Å; L265-K268 HydrophobicContact CB-CG 4.38Å; L265-K268 HydrophobicContact CD1-CD 4.21Å; L265-K268 PolarHBondContact O-N 2.86Å; L265-W269 PolarHBondContact O-N 3.15Å | ||
| 266 | P | 81.8 | Confident | 77.8 | Confident | 109 Ų | 109 | 97.2 Ų | 97.2 | 71% | 0.708 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -53.6 | -41.9 | 179.7 | -28 | 35.2 | 0 | 0 | 0 | 113.2 | K268 W269 | P266-K268 PolarHBondContact O-N 3.12Å; P266-W269 WeakPolarHBondContact O-CB 3.32Å; P266-W269 PolarHBondContact O-N 2.67Å |
| 267 | D | 79.9 | Confident | 79.2 | Confident | 159 Ų | 159 | 95.5 Ų | 95.5 | 85% | 0.85 | 56% | 0.558 | S | S | * | * | G | 310 helix | trans | -70.8 | -19.3 | -176.5 | -55.4 | -19.1 | 0 | 0 | 0 | 113.3 | L265 | L265-D267 VanDerWaalsContact C-N 3.25Å; L265-D267 PolarHBondContact O-N 3.09Å |
| 268 | K | 79.2 | Confident | 80.7 | Confident | 111 Ų | 111 | 95.4 Ų | 95.4 | 48% | 0.483 | 54% | 0.539 | S | S | . | . | G | 310 helix | trans | -106.7 | 7.2 | -178.9 | -64 | -169.6 | 170.6 | -157.2 | 0 | 112.7 | A252 L265 P266 R270 | A252-K268 HydrophobicContact CB-CB 3.82Å; A252-K268 HydrophobicContact CB-CD 3.21Å; A252-K268 HydrophobicContact CB-CG 4.13Å; L265-K268 HydrophobicContact CB-CB 4.2Å; L265-K268 HydrophobicContact CB-CG 4.38Å; L265-K268 HydrophobicContact CD1-CD 4.21Å; L265-K268 PolarHBondContact O-N 2.86Å; P266-K268 PolarHBondContact O-N 3.12Å; K268-R270 PolarHBondContact O-N 3.3Å |
| 269 | W | 82.9 | Confident | 81.9 | Confident | 137 Ų | 137 | 96.1 Ų | 96.1 | 52% | 0.519 | 52% | 0.522 | S | S | . | . | trans | -72.2 | 112.8 | 177.3 | 179 | -95.1 | 0 | 0 | 0 | 111 | V264 L265 P266 G271 M272 | V264-W269 HydrophobicContact CB-CE3 4.09Å; V264-W269 HydrophobicContact CB-CZ3 4.44Å; V264-W269 HydrophobicContact CG1-CE3 3.79Å; V264-W269 HydrophobicContact CG1-CZ3 4.45Å; V264-W269 HydrophobicContact CG2-CE3 4.36Å; V264-W269 HydrophobicContact CG2-CZ3 4.24Å; L265-W269 PolarHBondContact O-N 3.15Å; P266-W269 WeakPolarHBondContact O-CB 3.32Å; P266-W269 PolarHBondContact O-N 2.67Å; W269-G271 VanDerWaalsContact CZ2-C 3.5Å; W269-M272 HydrophobicContact CH2-CG 4.31Å; W269-M272 HydrophobicContact CZ2-CG 4.14Å | ||
| 270 | R | 83.3 | Confident | 83 | Confident | 146 Ų | 146 | 96.6 Ų | 96.6 | 55% | 0.551 | 50% | 0.499 | S | S | * | . | trans | -110.7 | 16.1 | 178 | -59.9 | -159.6 | -171.3 | -123.5 | 16.9 | 114.4 | E247 K268 | E247-R270 IonicContact OE1-CZ 3.71Å; E247-R270 IonicContact OE1-NH1 2.76Å; E247-R270 PolarHBondContact OE1-NH1 2.82Å; E247-R270 IonicContact OE2-NH1 2.8Å; K268-R270 PolarHBondContact O-N 3.3Å | ||
| 271 | G | 84.2 | Confident | 84.3 | Confident | 38 Ų | 38 | 92.8 Ų | 92.8 | 39% | 0.392 | 49% | 0.489 | S | S | . | . | trans | 109.5 | -177.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | W269 | W269-G271 VanDerWaalsContact CZ2-C 3.5Š| ||
| 272 | M | 83.1 | Confident | 85.4 | Confident | 100 Ų | 100 | 94 Ų | 94 | 49% | 0.493 | 49% | 0.487 | S | S | . | . | trans | -79.3 | 146.5 | -180 | -67.5 | 177.9 | -174.9 | 0 | 0 | 111.3 | W269 Q276 L277 F280 | W269-M272 HydrophobicContact CH2-CG 4.31Å; W269-M272 HydrophobicContact CZ2-CG 4.14Å; M272-Q276 HydrophobicContact CB-CB 4.44Å; M272-L277 HydrophobicContact CB-CD2 4.08Å; M272-L277 HydrophobicContact CB-CG 4.07Å; M272-L277 HydrophobicContact SD-CD2 4.06Å; M272-F280 HydrophobicContact CE-CE2 4.32Å; M272-F280 HydrophobicContact SD-CD2 4.25Å; M272-F280 HydrophobicContact SD-CE2 3.74Å | ||
| 273 | S | 84.7 | Confident | 86.6 | Confident | 57 Ų | 57 | 94.1 Ų | 94.1 | 40% | 0.399 | 48% | 0.482 | S | S | . | . | trans | -69.6 | 153.8 | 175.2 | 74.9 | 0 | 0 | 0 | 0 | 111.3 | A275 Q276 L277 | S273-A275 PolarHBondContact O-N 2.94Å; S273-Q276 WeakPolarHBondContact O-CB 3.47Å; S273-Q276 PolarHBondContact O-N 3.16Å; S273-Q276 WeakPolarHBondContact OG-CG 3.16Å; S273-Q276 PolarHBondContact OG-N 3.41Å; S273-L277 PolarHBondContact O-N 3.3Å | ||
| 274 | L | 87.8 | Confident | 87.5 | Confident | 126 Ų | 126 | 96.5 Ų | 96.5 | 66% | 0.66 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -58 | -35.2 | 177.5 | -173.8 | 64.4 | 0 | 0 | 0 | 111.8 | L277 N278 | L274-L277 PolarHBondContact O-N 2.89Å; L274-N278 WeakPolarHBondContact O-CB 3.34Å; L274-N278 PolarHBondContact O-N 3.48Å; L274-N278 PolarHBondContact O-ND2 3.28Å; L274-N278 PolarHBondContact O-OD1 3.06Å |
| 275 | A | 88.3 | Confident | 88.3 | Confident | 73 Ų | 73 | 98.7 Ų | 98.7 | 60% | 0.603 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.7 | -42.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | S273 N278 H279 | S273-A275 PolarHBondContact O-N 2.94Å; A275-N278 PolarHBondContact O-N 3.39Å; A275-H279 WeakPolarHBondContact O-CB 3.46Å; A275-H279 PolarHBondContact O-N 2.82Å |
| 276 | Q | 87.5 | Confident | 89 | Confident | 92 Ų | 92 | 101 Ų | 101 | 43% | 0.43 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 175.3 | -72.8 | 170.3 | -12.3 | 0 | 0 | 111.6 | M272 S273 H279 F280 | M272-Q276 HydrophobicContact CB-CB 4.44Å; S273-Q276 WeakPolarHBondContact O-CB 3.47Å; S273-Q276 PolarHBondContact O-N 3.16Å; S273-Q276 WeakPolarHBondContact OG-CG 3.16Å; S273-Q276 PolarHBondContact OG-N 3.41Å; Q276-H279 WeakPolarHBondContact O-CB 3.49Å; Q276-H279 PolarHBondContact O-N 3.03Å; Q276-F280 WeakPolarHBondContact O-CD2 3.47Å; Q276-F280 PolarHBondContact O-N 3.07Å |
| 277 | L | 91.9 | Very high | 89.6 | Confident | 69 Ų | 69 | 101.5 Ų | 101.5 | 36% | 0.361 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 176.6 | -69.8 | 174.7 | 0 | 0 | 0 | 111.6 | M272 S273 L274 H279 F280 H281 | M272-L277 HydrophobicContact CB-CD2 4.08Å; M272-L277 HydrophobicContact CB-CG 4.07Å; M272-L277 HydrophobicContact SD-CD2 4.06Å; S273-L277 PolarHBondContact O-N 3.3Å; L274-L277 PolarHBondContact O-N 2.89Å; L277-H279 VanDerWaalsContact C-N 3.31Å; L277-H279 PolarHBondContact O-N 3.47Å; L277-F280 PolarHBondContact O-N 3.39Å; L277-F280 VanDerWaalsContact O-N 3.16Å; L277-H281 PolarHBondContact O-CD2 3.22Å; L277-H281 PolarHBondContact O-N 2.99Å |
| 278 | N | 93.9 | Very high | 90.3 | Very high | 77 Ų | 77 | 99.9 Ų | 99.9 | 41% | 0.412 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.7 | -42.4 | 176.2 | -71.2 | -12.5 | 0 | 0 | 0 | 111.4 | L274 A275 F280 H281 E282 | L274-N278 WeakPolarHBondContact O-CB 3.34Å; L274-N278 PolarHBondContact O-N 3.48Å; L274-N278 PolarHBondContact O-ND2 3.28Å; L274-N278 PolarHBondContact O-OD1 3.06Å; A275-N278 PolarHBondContact O-N 3.39Å; N278-F280 VanDerWaalsContact C-N 3.33Å; N278-F280 PolarHBondContact O-N 3.47Å; N278-H281 WeakPolarHBondContact O-CB 3.36Å; N278-H281 PolarHBondContact O-N 2.94Å; N278-H281 VanDerWaalsContact O-N 3.1Å; N278-E282 WeakPolarHBondContact O-CG 3.34Å; N278-E282 PolarHBondContact O-N 3.19Å |
| 279 | H | 94.8 | Very high | 91.1 | Very high | 91 Ų | 91 | 99.5 Ų | 99.5 | 42% | 0.421 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.2 | -42.8 | 175.3 | -174.4 | 61.4 | 0 | 0 | 0 | 112.4 | A275 Q276 L277 H281 E282 Q283 | A275-H279 WeakPolarHBondContact O-CB 3.46Å; A275-H279 PolarHBondContact O-N 2.82Å; Q276-H279 WeakPolarHBondContact O-CB 3.49Å; Q276-H279 PolarHBondContact O-N 3.03Å; L277-H279 VanDerWaalsContact C-N 3.31Å; L277-H279 PolarHBondContact O-N 3.47Å; H279-H281 VanDerWaalsContact C-N 3.33Å; H279-H281 PolarHBondContact O-N 3.36Å; H279-E282 PolarHBondContact O-N 3.29Å; H279-Q283 PolarHBondContact CD2-NE2 3.1Å; H279-Q283 PolarHBondContact NE2-NE2 3.4Å; H279-Q283 WeakPolarHBondContact O-CB 3.41Å; H279-Q283 WeakPolarHBondContact O-CG 3.41Å; H279-Q283 PolarHBondContact O-N 3.5Å |
| 280 | F | 93.5 | Very high | 91.7 | Very high | 96 Ų | 96 | 98.5 Ų | 98.5 | 42% | 0.421 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.7 | -35.7 | 174.4 | -70.7 | -53.7 | 0 | 0 | 0 | 112.9 | M272 Q276 L277 N278 R284 | M272-F280 HydrophobicContact CE-CE2 4.32Å; M272-F280 HydrophobicContact SD-CD2 4.25Å; M272-F280 HydrophobicContact SD-CE2 3.74Å; Q276-F280 WeakPolarHBondContact O-CD2 3.47Å; Q276-F280 PolarHBondContact O-N 3.07Å; L277-F280 PolarHBondContact O-N 3.39Å; L277-F280 VanDerWaalsContact O-N 3.16Å; N278-F280 VanDerWaalsContact C-N 3.33Å; N278-F280 PolarHBondContact O-N 3.47Å; F280-R284 VanDerWaalsContact O-CB 3.27Å; F280-R284 WeakPolarHBondContact O-CB 3.35Å; F280-R284 PolarHBondContact O-N 2.98Å |
| 281 | H | 94.6 | Very high | 92.2 | Very high | 98 Ų | 98 | 98.1 Ų | 98.1 | 45% | 0.454 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.2 | -49.2 | 173.7 | -71.2 | -57 | 0 | 0 | 0 | 110.7 | L277 N278 H279 Q283 R284 E285 | L277-H281 PolarHBondContact O-CD2 3.22Å; L277-H281 PolarHBondContact O-N 2.99Å; N278-H281 WeakPolarHBondContact O-CB 3.36Å; N278-H281 PolarHBondContact O-N 2.94Å; N278-H281 VanDerWaalsContact O-N 3.1Å; H279-H281 VanDerWaalsContact C-N 3.33Å; H279-H281 PolarHBondContact O-N 3.36Å; H281-Q283 PolarHBondContact O-N 2.9Å; H281-R284 WeakPolarHBondContact O-CB 3.48Å; H281-R284 PolarHBondContact O-N 3.06Å; H281-E285 VanDerWaalsContact O-CG 3.26Å; H281-E285 WeakPolarHBondContact O-CG 3.47Å; H281-E285 PolarHBondContact O-N 2.86Å |
| 282 | E | 96.4 | Very high | 92.7 | Very high | 112 Ų | 112 | 102.2 Ų | 102.2 | 52% | 0.523 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -57.9 | -49.2 | 176 | -70.8 | 172.7 | -178.1 | 0 | 0 | 112.1 | N278 H279 R284 E285 Q286 | N278-E282 WeakPolarHBondContact O-CG 3.34Å; N278-E282 PolarHBondContact O-N 3.19Å; H279-E282 PolarHBondContact O-N 3.29Å; E282-R284 VanDerWaalsContact C-N 3.3Å; E282-R284 PolarHBondContact O-N 2.98Å; E282-E285 WeakPolarHBondContact O-CB 3.27Å; E282-E285 PolarHBondContact O-N 3.42Å; E282-E285 VanDerWaalsContact O-N 3.12Å; E282-Q286 WeakPolarHBondContact O-CG 3.5Å; E282-Q286 PolarHBondContact O-N 2.92Å |
| 283 | Q | 95.4 | Very high | 93.2 | Very high | 67 Ų | 67 | 104.4 Ų | 104.4 | 31% | 0.313 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.9 | -42.7 | 176.3 | -75.7 | -174.3 | -8.7 | 0 | 0 | 111.9 | H279 H281 E285 Q286 Q287 | H279-Q283 PolarHBondContact CD2-NE2 3.1Å; H279-Q283 PolarHBondContact NE2-NE2 3.4Å; H279-Q283 WeakPolarHBondContact O-CB 3.41Å; H279-Q283 WeakPolarHBondContact O-CG 3.41Å; H279-Q283 PolarHBondContact O-N 3.5Å; H281-Q283 PolarHBondContact O-N 2.9Å; Q283-E285 VanDerWaalsContact C-N 3.29Å; Q283-E285 PolarHBondContact O-N 3.36Å; Q283-Q286 PolarHBondContact O-N 2.88Å; Q283-Q287 WeakPolarHBondContact O-CG 3.34Å; Q283-Q287 PolarHBondContact O-N 3.48Å |
| 284 | R | 95.1 | Very high | 93.6 | Very high | 147 Ų | 147 | 107.5 Ų | 107.5 | 56% | 0.555 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64 | -37 | 178 | -171.9 | -175.1 | -60.5 | 176.4 | 2.2 | 111.6 | F280 H281 E282 R288 | F280-R284 VanDerWaalsContact O-CB 3.27Å; F280-R284 WeakPolarHBondContact O-CB 3.35Å; F280-R284 PolarHBondContact O-N 2.98Å; H281-R284 WeakPolarHBondContact O-CB 3.48Å; H281-R284 PolarHBondContact O-N 3.06Å; E282-R284 VanDerWaalsContact C-N 3.3Å; E282-R284 PolarHBondContact O-N 2.98Å; R284-R288 WeakPolarHBondContact O-CB 3.26Å; R284-R288 PolarHBondContact O-N 3.49Å |
| 285 | E | 95.3 | Very high | 94 | Very high | 100 Ų | 100 | 106 Ų | 106 | 47% | 0.467 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.9 | -42.7 | 175.4 | -62.5 | -137.1 | 121 | 0 | 0 | 111.9 | H281 E282 Q283 Q287 R288 L289 | H281-E285 VanDerWaalsContact O-CG 3.26Å; H281-E285 WeakPolarHBondContact O-CG 3.47Å; H281-E285 PolarHBondContact O-N 2.86Å; E282-E285 WeakPolarHBondContact O-CB 3.27Å; E282-E285 PolarHBondContact O-N 3.42Å; E282-E285 VanDerWaalsContact O-N 3.12Å; Q283-E285 VanDerWaalsContact C-N 3.29Å; Q283-E285 PolarHBondContact O-N 3.36Å; E285-Q287 PolarHBondContact O-N 3.3Å; E285-R288 WeakPolarHBondContact O-CB 3.34Å; E285-R288 PolarHBondContact O-N 2.92Å; E285-R288 IonicContact OE1-CZ 3.86Å; E285-R288 IonicContact OE1-NH1 2.82Å; E285-R288 PolarHBondContact OE1-NH1 3.12Å; E285-R288 IonicContact OE1-NH2 3.94Å; E285-R288 PolarHBondContact OE1-NH2 3.36Å; E285-L289 WeakPolarHBondContact O-CG 3.46Å; E285-L289 PolarHBondContact O-N 3.26Å |
| 286 | Q | 95.2 | Very high | 94.2 | Very high | 115 Ų | 115 | 108.3 Ų | 108.3 | 54% | 0.537 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.3 | -48.7 | 174.3 | -69.9 | 173.4 | -0 | 0 | 0 | 111.2 | E282 Q283 R288 L289 E290 | E282-Q286 WeakPolarHBondContact O-CG 3.5Å; E282-Q286 PolarHBondContact O-N 2.92Å; Q283-Q286 PolarHBondContact O-N 2.88Å; Q286-R288 VanDerWaalsContact C-N 3.28Å; Q286-R288 PolarHBondContact O-N 3.49Å; Q286-L289 PolarHBondContact O-N 2.87Å; Q286-L289 VanDerWaalsContact O-N 3.09Å; Q286-E290 WeakPolarHBondContact O-CG 3.38Å; Q286-E290 PolarHBondContact O-N 3.09Å |
| 287 | Q | 95.3 | Very high | 94.5 | Very high | 121 Ų | 121 | 106.6 Ų | 106.6 | 57% | 0.565 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.3 | -39.5 | 175.9 | -72.6 | 176.5 | 3.7 | 0 | 0 | 112.4 | Q283 E285 L289 E290 K291 | Q283-Q287 WeakPolarHBondContact O-CG 3.34Å; Q283-Q287 PolarHBondContact O-N 3.48Å; E285-Q287 PolarHBondContact O-N 3.3Å; Q287-L289 VanDerWaalsContact C-N 3.34Å; Q287-E290 PolarHBondContact O-N 3.12Å; Q287-K291 WeakPolarHBondContact O-CB 3.42Å; Q287-K291 PolarHBondContact O-N 3.03Å |
| 288 | R | 94.7 | Very high | 94.5 | Very high | 124 Ų | 124 | 107 Ų | 107 | 47% | 0.468 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63 | -42.4 | 176.7 | -166.7 | -164.2 | -55.3 | 139.2 | 3.6 | 111.1 | R284 E285 Q286 K292 | R284-R288 WeakPolarHBondContact O-CB 3.26Å; R284-R288 PolarHBondContact O-N 3.49Å; E285-R288 WeakPolarHBondContact O-CB 3.34Å; E285-R288 PolarHBondContact O-N 2.92Å; E285-R288 IonicContact OE1-CZ 3.86Å; E285-R288 IonicContact OE1-NH1 2.82Å; E285-R288 PolarHBondContact OE1-NH1 3.12Å; E285-R288 IonicContact OE1-NH2 3.94Å; E285-R288 PolarHBondContact OE1-NH2 3.36Å; Q286-R288 VanDerWaalsContact C-N 3.28Å; Q286-R288 PolarHBondContact O-N 3.49Å; R288-K292 WeakPolarHBondContact O-CG 3.41Å; R288-K292 PolarHBondContact O-N 3.48Å; R288-K292 VanDerWaalsContact O-N 3.12Å |
| 289 | L | 95.6 | Very high | 94.5 | Very high | 103 Ų | 103 | 110.4 Ų | 110.4 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.6 | -43.8 | 178.1 | -69.3 | 172.7 | 0 | 0 | 0 | 111.8 | E285 Q286 Q287 K292 K293 | E285-L289 WeakPolarHBondContact O-CG 3.46Å; E285-L289 PolarHBondContact O-N 3.26Å; Q286-L289 PolarHBondContact O-N 2.87Å; Q286-L289 VanDerWaalsContact O-N 3.09Å; Q287-L289 VanDerWaalsContact C-N 3.34Å; L289-K292 WeakPolarHBondContact O-CB 3.38Å; L289-K292 PolarHBondContact O-N 2.99Å; L289-K293 WeakPolarHBondContact O-CG 3.47Å; L289-K293 PolarHBondContact O-N 2.8Å |
| 290 | E | 94.9 | Very high | 94.4 | Very high | 116 Ų | 116 | 112 Ų | 112 | 54% | 0.542 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.1 | -46.6 | 175.7 | -74 | -179.5 | 171.2 | 0 | 0 | 111.7 | Q286 Q287 K292 K293 Q294 | Q286-E290 WeakPolarHBondContact O-CG 3.38Å; Q286-E290 PolarHBondContact O-N 3.09Å; Q287-E290 PolarHBondContact O-N 3.12Å; E290-K292 VanDerWaalsContact C-N 3.29Å; E290-K292 PolarHBondContact O-N 3.18Å; E290-K293 WeakPolarHBondContact O-CB 3.44Å; E290-K293 PolarHBondContact O-N 3.1Å; E290-K293 VanDerWaalsContact O-N 3.13Å; E290-Q294 WeakPolarHBondContact O-CG 3.49Å; E290-Q294 PolarHBondContact O-N 2.84Å |
| 291 | K | 95.1 | Very high | 94.4 | Very high | 139 Ų | 139 | 116.3 Ų | 116.3 | 60% | 0.604 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.7 | -37.6 | 177.2 | -169.3 | 171 | -174.4 | 174.2 | 0 | 112.2 | Q287 Q294 L295 | Q287-K291 WeakPolarHBondContact O-CB 3.42Å; Q287-K291 PolarHBondContact O-N 3.03Å; K291-Q294 PolarHBondContact O-N 3.44Å; K291-L295 WeakPolarHBondContact O-CG 3.47Å; K291-L295 PolarHBondContact O-N 2.94Å |
| 292 | K | 94 | Very high | 94.3 | Very high | 123 Ų | 123 | 116.1 Ų | 116.1 | 54% | 0.535 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.3 | -46 | 172.9 | -78.5 | -177.9 | 177.5 | -172.8 | 0 | 111.7 | R288 L289 E290 Q294 L295 E296 | R288-K292 WeakPolarHBondContact O-CG 3.41Å; R288-K292 PolarHBondContact O-N 3.48Å; R288-K292 VanDerWaalsContact O-N 3.12Å; L289-K292 WeakPolarHBondContact O-CB 3.38Å; L289-K292 PolarHBondContact O-N 2.99Å; E290-K292 VanDerWaalsContact C-N 3.29Å; E290-K292 PolarHBondContact O-N 3.18Å; K292-Q294 VanDerWaalsContact C-N 3.33Å; K292-Q294 PolarHBondContact O-N 3.12Å; K292-L295 PolarHBondContact O-N 3.28Å; K292-E296 PolarHBondContact O-N 3.33Å |
| 293 | K | 94.3 | Very high | 94.1 | Very high | 146 Ų | 146 | 113.3 Ų | 113.3 | 64% | 0.635 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.5 | -40.7 | 176.7 | -70.7 | 178.6 | 179.3 | -179.2 | 0 | 112.1 | L289 E290 E296 A297 | L289-K293 WeakPolarHBondContact O-CG 3.47Å; L289-K293 PolarHBondContact O-N 2.8Å; E290-K293 WeakPolarHBondContact O-CB 3.44Å; E290-K293 PolarHBondContact O-N 3.1Å; E290-K293 VanDerWaalsContact O-N 3.13Å; K293-E296 PolarHBondContact O-N 3.33Å; K293-A297 WeakPolarHBondContact O-CB 3.43Å; K293-A297 PolarHBondContact O-N 3.46Å |
| 294 | Q | 93 | Very high | 94 | Very high | 122 Ų | 122 | 113 Ų | 113 | 57% | 0.57 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.8 | -47.8 | 175 | -73.6 | 176.6 | -7.2 | 0 | 0 | 111.4 | E290 K291 K292 E296 A297 D298 | E290-Q294 WeakPolarHBondContact O-CG 3.49Å; E290-Q294 PolarHBondContact O-N 2.84Å; K291-Q294 PolarHBondContact O-N 3.44Å; K292-Q294 VanDerWaalsContact C-N 3.33Å; K292-Q294 PolarHBondContact O-N 3.12Å; Q294-E296 VanDerWaalsContact C-N 3.29Å; Q294-E296 PolarHBondContact O-N 2.93Å; Q294-A297 WeakPolarHBondContact O-CB 3.49Å; Q294-A297 PolarHBondContact O-N 2.88Å; Q294-A297 VanDerWaalsContact O-N 3.12Å; Q294-D298 PolarHBondContact O-N 3.13Å |
| 295 | L | 94.8 | Very high | 93.9 | Very high | 96 Ų | 96 | 113.8 Ų | 113.8 | 50% | 0.503 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.9 | -36.5 | 176.7 | -71.1 | 171.5 | 0 | 0 | 0 | 112.8 | K291 K292 K299 | K291-L295 WeakPolarHBondContact O-CG 3.47Å; K291-L295 PolarHBondContact O-N 2.94Å; K292-L295 PolarHBondContact O-N 3.28Å; L295-K299 VanDerWaalsContact O-CG 3.27Å; L295-K299 WeakPolarHBondContact O-CG 3.27Å; L295-K299 PolarHBondContact O-N 3.04Å |
| 296 | E | 93.1 | Very high | 93.8 | Very high | 120 Ų | 120 | 113.5 Ų | 113.5 | 56% | 0.561 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.3 | -41.9 | 174 | -73.5 | 176.7 | -179.8 | 0 | 0 | 112 | K292 K293 Q294 K299 I300 | K292-E296 PolarHBondContact O-N 3.33Å; K293-E296 PolarHBondContact O-N 3.33Å; Q294-E296 VanDerWaalsContact C-N 3.29Å; Q294-E296 PolarHBondContact O-N 2.93Å; E296-K299 PolarHBondContact O-N 3.01Å; E296-I300 WeakPolarHBondContact O-CG1 3.41Å; E296-I300 PolarHBondContact O-N 3.07Å; E296-I300 VanDerWaalsContact O-N 3.08Å |
| 297 | A | 92.9 | Very high | 93.7 | Very high | 56 Ų | 56 | 113.1 Ų | 113.1 | 46% | 0.463 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | K293 Q294 I300 R301 | K293-A297 WeakPolarHBondContact O-CB 3.43Å; K293-A297 PolarHBondContact O-N 3.46Å; Q294-A297 WeakPolarHBondContact O-CB 3.49Å; Q294-A297 PolarHBondContact O-N 2.88Å; Q294-A297 VanDerWaalsContact O-N 3.12Å; A297-I300 PolarHBondContact O-N 3.32Å; A297-R301 PolarHBondContact O-N 3.03Å |
| 298 | D | 93.2 | Very high | 93.6 | Very high | 78 Ų | 78 | 112.2 Ų | 112.2 | 42% | 0.417 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.9 | -43.9 | 175.9 | -70.8 | -23.1 | 0 | 0 | 0 | 110.9 | Q294 I300 R301 D302 | Q294-D298 PolarHBondContact O-N 3.13Å; D298-I300 VanDerWaalsContact C-N 3.3Å; D298-I300 PolarHBondContact O-N 3Å; D298-R301 CarbonylContact O-C 3.6Å; D298-R301 WeakPolarHBondContact O-CB 3.48Å; D298-R301 PolarHBondContact O-N 3.38Å; D298-R301 VanDerWaalsContact O-N 3.1Å; D298-D302 WeakPolarHBondContact O-CB 3.48Å; D298-D302 VanDerWaalsContact O-CG 3.32Å; D298-D302 PolarHBondContact O-N 2.9Å |
| 299 | K | 93.9 | Very high | 93.5 | Very high | 149 Ų | 149 | 111 Ų | 111 | 65% | 0.648 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -57.6 | -41.1 | 173.6 | -76.1 | 173.6 | -177.8 | -177.7 | 0 | 112.9 | L295 E296 A303 | L295-K299 VanDerWaalsContact O-CG 3.27Å; L295-K299 WeakPolarHBondContact O-CG 3.27Å; L295-K299 PolarHBondContact O-N 3.04Å; E296-K299 PolarHBondContact O-N 3.01Å; K299-A303 VanDerWaalsContact O-CB 3.31Å; K299-A303 WeakPolarHBondContact O-CB 3.41Å; K299-A303 PolarHBondContact O-N 3.1Å |
| 300 | I | 92.6 | Very high | 93.4 | Very high | 125 Ų | 125 | 110.3 Ų | 110.3 | 64% | 0.641 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.9 | -42.1 | 177 | -67.5 | 165 | 0 | 0 | 0 | 110.1 | E296 A297 D298 A303 A304 | E296-I300 WeakPolarHBondContact O-CG1 3.41Å; E296-I300 PolarHBondContact O-N 3.07Å; E296-I300 VanDerWaalsContact O-N 3.08Å; A297-I300 PolarHBondContact O-N 3.32Å; D298-I300 VanDerWaalsContact C-N 3.3Å; D298-I300 PolarHBondContact O-N 3Å; I300-A303 PolarHBondContact O-N 3.34Å; I300-A304 WeakPolarHBondContact O-CB 3.5Å; I300-A304 PolarHBondContact O-N 2.86Å |
| 301 | R | 92.3 | Very high | 93.3 | Very high | 185 Ų | 185 | 112.2 Ų | 112.2 | 70% | 0.698 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.9 | -45.7 | 177.5 | -178.3 | -178.2 | 174.1 | 179.1 | -1.9 | 111.9 | A297 D298 A304 W305 | A297-R301 PolarHBondContact O-N 3.03Å; D298-R301 CarbonylContact O-C 3.6Å; D298-R301 WeakPolarHBondContact O-CB 3.48Å; D298-R301 PolarHBondContact O-N 3.38Å; D298-R301 VanDerWaalsContact O-N 3.1Å; R301-A304 WeakPolarHBondContact O-CB 3.41Å; R301-A304 PolarHBondContact O-N 3.42Å; R301-W305 PolarHBondContact O-N 3.5Å |
| 302 | D | 92.8 | Very high | 93.2 | Very high | 95 Ų | 95 | 110.6 Ų | 110.6 | 51% | 0.508 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 177.7 | -70.3 | -16.2 | 0 | 0 | 0 | 110.5 | D298 A304 W305 D306 | D298-D302 WeakPolarHBondContact O-CB 3.48Å; D298-D302 VanDerWaalsContact O-CG 3.32Å; D298-D302 PolarHBondContact O-N 2.9Å; D302-A304 VanDerWaalsContact C-N 3.3Å; D302-A304 PolarHBondContact O-N 3.24Å; D302-W305 WeakPolarHBondContact O-CB 3.29Å; D302-W305 PolarHBondContact O-N 3.25Å; D302-W305 VanDerWaalsContact O-N 3.1Å; D302-D306 PolarHBondContact O-N 2.84Å |
| 303 | A | 93.3 | Very high | 93.1 | Very high | 53 Ų | 53 | 107.6 Ų | 107.6 | 44% | 0.438 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.1 | -37.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | K299 I300 M307 | K299-A303 VanDerWaalsContact O-CB 3.31Å; K299-A303 WeakPolarHBondContact O-CB 3.41Å; K299-A303 PolarHBondContact O-N 3.1Å; I300-A303 PolarHBondContact O-N 3.34Å; A303-M307 WeakPolarHBondContact O-CB 3.48Å; A303-M307 VanDerWaalsContact O-CG 3.29Å; A303-M307 WeakPolarHBondContact O-CG 3.39Å; A303-M307 PolarHBondContact O-N 3.03Å |
| 304 | A | 93.3 | Very high | 93 | Very high | 61 Ų | 61 | 107.2 Ų | 107.2 | 50% | 0.504 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.5 | -38.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | I300 R301 D302 M307 Q308 | I300-A304 WeakPolarHBondContact O-CB 3.5Å; I300-A304 PolarHBondContact O-N 2.86Å; R301-A304 WeakPolarHBondContact O-CB 3.41Å; R301-A304 PolarHBondContact O-N 3.42Å; D302-A304 VanDerWaalsContact C-N 3.3Å; D302-A304 PolarHBondContact O-N 3.24Å; A304-M307 PolarHBondContact O-N 2.94Å; A304-Q308 PolarHBondContact O-N 2.95Å |
| 305 | W | 92.8 | Very high | 92.9 | Very high | 163 Ų | 163 | 103.4 Ų | 103.4 | 62% | 0.617 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.3 | -45.8 | 175.7 | -175.2 | -104 | 0 | 0 | 0 | 112.1 | R301 D302 M307 Q308 L309 | R301-W305 PolarHBondContact O-N 3.5Å; D302-W305 WeakPolarHBondContact O-CB 3.29Å; D302-W305 PolarHBondContact O-N 3.25Å; D302-W305 VanDerWaalsContact O-N 3.1Å; W305-M307 VanDerWaalsContact C-N 3.25Å; W305-M307 PolarHBondContact O-N 2.92Å; W305-Q308 WeakPolarHBondContact O-CB 3.45Å; W305-Q308 PolarHBondContact O-N 3.18Å; W305-L309 PolarHBondContact O-N 3.42Å |
| 306 | D | 93.1 | Very high | 92.8 | Very high | 93 Ų | 93 | 100.2 Ų | 100.2 | 50% | 0.497 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.5 | -40.2 | 174.6 | -73.1 | -18.8 | 0 | 0 | 0 | 111.2 | D302 Q308 L309 L310 | D302-D306 PolarHBondContact O-N 2.84Å; D306-Q308 PolarHBondContact O-N 3.3Å; D306-L309 PolarHBondContact O-N 2.98Å; D306-L310 WeakPolarHBondContact O-CB 3.31Å; D306-L310 WeakPolarHBondContact O-CG 3.34Å; D306-L310 PolarHBondContact O-N 3.48Å |
| 307 | M | 92.8 | Very high | 92.6 | Very high | 107 Ų | 107 | 98.3 Ų | 98.3 | 53% | 0.527 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.9 | -38.4 | 175.1 | -77.6 | -85 | 69.6 | 0 | 0 | 113.2 | A303 A304 W305 L310 K311 | A303-M307 WeakPolarHBondContact O-CB 3.48Å; A303-M307 VanDerWaalsContact O-CG 3.29Å; A303-M307 WeakPolarHBondContact O-CG 3.39Å; A303-M307 PolarHBondContact O-N 3.03Å; A304-M307 PolarHBondContact O-N 2.94Å; W305-M307 VanDerWaalsContact C-N 3.25Å; W305-M307 PolarHBondContact O-N 2.92Å; M307-L310 HydrophobicContact CE-CB 4.08Å; M307-L310 HydrophobicContact CE-CD1 3.39Å; M307-L310 HydrophobicContact CE-CG 4.36Å; M307-K311 WeakPolarHBondContact O-CG 3.29Å; M307-K311 PolarHBondContact O-N 3.48Å; M307-K311 VanDerWaalsContact O-N 3.14Å |
| 308 | Q | 92.4 | Very high | 92.6 | Very high | 102 Ų | 102 | 101 Ų | 101 | 48% | 0.477 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.2 | -41.9 | 174.2 | -175.3 | 172.9 | -10.9 | 0 | 0 | 111.3 | A304 W305 D306 L310 K311 I312 | A304-Q308 PolarHBondContact O-N 2.95Å; W305-Q308 WeakPolarHBondContact O-CB 3.45Å; W305-Q308 PolarHBondContact O-N 3.18Å; D306-Q308 PolarHBondContact O-N 3.3Å; Q308-L310 PolarHBondContact O-N 3.49Å; Q308-K311 WeakPolarHBondContact O-CB 3.43Å; Q308-K311 PolarHBondContact O-N 2.83Å; Q308-I312 HydrophobicContact CG-CD1 4.23Å; Q308-I312 WeakPolarHBondContact O-CG1 3.46Å; Q308-I312 PolarHBondContact O-N 3.35Å |
| 309 | L | 93.3 | Very high | 92.5 | Very high | 99 Ų | 99 | 104.1 Ų | 104.1 | 52% | 0.518 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.7 | -43.6 | 176.9 | -173.1 | 63.8 | 0 | 0 | 0 | 111.5 | W305 D306 K311 I312 S313 | W305-L309 PolarHBondContact O-N 3.42Å; D306-L309 PolarHBondContact O-N 2.98Å; L309-K311 VanDerWaalsContact C-N 3.33Å; L309-K311 PolarHBondContact O-N 3.08Å; L309-I312 PolarHBondContact O-N 3.03Å; L309-S313 PolarHBondContact O-N 3.22Å |
| 310 | L | 93.8 | Very high | 92.2 | Very high | 89 Ų | 89 | 102.3 Ų | 102.3 | 47% | 0.466 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.2 | -37.4 | 175.6 | -77.1 | 167.8 | 0 | 0 | 0 | 112.6 | D306 M307 Q308 S313 K314 | D306-L310 WeakPolarHBondContact O-CB 3.31Å; D306-L310 WeakPolarHBondContact O-CG 3.34Å; D306-L310 PolarHBondContact O-N 3.48Å; M307-L310 HydrophobicContact CE-CB 4.08Å; M307-L310 HydrophobicContact CE-CD1 3.39Å; M307-L310 HydrophobicContact CE-CG 4.36Å; Q308-L310 PolarHBondContact O-N 3.49Å; L310-S313 PolarHBondContact O-N 2.93Å; L310-K314 WeakPolarHBondContact O-CB 3.48Å; L310-K314 WeakPolarHBondContact O-CG 3.34Å; L310-K314 PolarHBondContact O-N 3.29Å |
| 311 | K | 92.7 | Very high | 92 | Very high | 156 Ų | 156 | 102.4 Ų | 102.4 | 68% | 0.678 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.1 | -42.8 | 173.3 | -72.9 | 175.7 | -176.6 | 178.3 | 0 | 111.7 | M307 Q308 L309 A315 | M307-K311 WeakPolarHBondContact O-CG 3.29Å; M307-K311 PolarHBondContact O-N 3.48Å; M307-K311 VanDerWaalsContact O-N 3.14Å; Q308-K311 WeakPolarHBondContact O-CB 3.43Å; Q308-K311 PolarHBondContact O-N 2.83Å; L309-K311 VanDerWaalsContact C-N 3.33Å; L309-K311 PolarHBondContact O-N 3.08Å; K311-A315 WeakPolarHBondContact O-CB 3.33Å; K311-A315 PolarHBondContact O-N 3.27Å |
| 312 | I | 92.7 | Very high | 92 | Very high | 104 Ų | 104 | 99.8 Ų | 99.8 | 53% | 0.533 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.4 | -45.2 | 177.1 | -67 | 163.6 | 0 | 0 | 0 | 110.5 | Q308 L309 A315 G316 | Q308-I312 HydrophobicContact CG-CD1 4.23Å; Q308-I312 WeakPolarHBondContact O-CG1 3.46Å; Q308-I312 PolarHBondContact O-N 3.35Å; L309-I312 PolarHBondContact O-N 3.03Å; I312-A315 PolarHBondContact O-N 3.49Å; I312-G316 PolarHBondContact O-N 2.83Å |
| 313 | S | 91.6 | Very high | 91.7 | Very high | 61 Ų | 61 | 99.7 Ų | 99.7 | 43% | 0.427 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.1 | -50.9 | 176.7 | -169.7 | 0 | 0 | 0 | 0 | 111.2 | L309 L310 A315 G316 D317 | L309-S313 PolarHBondContact O-N 3.22Å; L310-S313 PolarHBondContact O-N 2.93Å; S313-A315 VanDerWaalsContact C-N 3.34Å; S313-A315 PolarHBondContact O-N 2.9Å; S313-G316 CarbonylContact O-C 3.56Å; S313-G316 WeakPolarHBondContact O-CA 3.48Å; S313-G316 PolarHBondContact O-N 3.05Å; S313-D317 VanDerWaalsContact O-CG 3.31Å; S313-D317 PolarHBondContact O-N 2.87Å |
| 314 | K | 92.3 | Very high | 91.5 | Very high | 137 Ų | 137 | 99.8 Ų | 99.8 | 60% | 0.596 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -58.2 | -43.9 | 177.4 | -74.7 | -179.5 | 179 | -173.6 | 0 | 112.4 | L310 G316 D317 E318 | L310-K314 WeakPolarHBondContact O-CB 3.48Å; L310-K314 WeakPolarHBondContact O-CG 3.34Å; L310-K314 PolarHBondContact O-N 3.29Å; K314-G316 VanDerWaalsContact C-N 3.27Å; K314-G316 PolarHBondContact O-N 3.36Å; K314-D317 PolarHBondContact O-N 3.21Å; K314-E318 WeakPolarHBondContact O-CB 3.42Å; K314-E318 WeakPolarHBondContact O-CG 3.37Å; K314-E318 PolarHBondContact O-N 2.89Å |
| 315 | A | 91.9 | Very high | 91.3 | Very high | 42 Ų | 42 | 102.6 Ų | 102.6 | 35% | 0.347 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.7 | -31.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | K311 I312 S313 K319 | K311-A315 WeakPolarHBondContact O-CB 3.33Å; K311-A315 PolarHBondContact O-N 3.27Å; I312-A315 PolarHBondContact O-N 3.49Å; S313-A315 VanDerWaalsContact C-N 3.34Å; S313-A315 PolarHBondContact O-N 2.9Å; A315-K319 WeakPolarHBondContact O-CG 3.4Å; A315-K319 PolarHBondContact O-N 3.31Å |
| 316 | G | 91.2 | Very high | 91.2 | Very high | 29 Ų | 29 | 99 Ų | 99 | 30% | 0.299 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.8 | -52.1 | 170 | 0 | 0 | 0 | 0 | 0 | 111.7 | I312 S313 K314 E318 K319 D320 | I312-G316 PolarHBondContact O-N 2.83Å; S313-G316 CarbonylContact O-C 3.56Å; S313-G316 WeakPolarHBondContact O-CA 3.48Å; S313-G316 PolarHBondContact O-N 3.05Å; K314-G316 VanDerWaalsContact C-N 3.27Å; K314-G316 PolarHBondContact O-N 3.36Å; G316-E318 VanDerWaalsContact C-N 3.32Å; G316-E318 PolarHBondContact O-N 3.42Å; G316-K319 WeakPolarHBondContact O-CB 3.32Å; G316-K319 PolarHBondContact O-N 3.02Å; G316-D320 PolarHBondContact O-N 3.5Å |
| 317 | D | 90.6 | Very high | 91 | Very high | 81 Ų | 81 | 101.8 Ų | 101.8 | 43% | 0.433 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.7 | -43.2 | 178.2 | -63.2 | -33.9 | 0 | 0 | 0 | 111.7 | S313 K314 K319 D320 Q321 | S313-D317 VanDerWaalsContact O-CG 3.31Å; S313-D317 PolarHBondContact O-N 2.87Å; K314-D317 PolarHBondContact O-N 3.21Å; D317-K319 VanDerWaalsContact C-N 3.34Å; D317-K319 PolarHBondContact O-N 3.31Å; D317-D320 PolarHBondContact O-N 3.14Å; D317-Q321 WeakPolarHBondContact O-CB 3.33Å; D317-Q321 VanDerWaalsContact O-CG 3.28Å; D317-Q321 WeakPolarHBondContact O-CG 3.42Å; D317-Q321 PolarHBondContact O-N 3.34Å |
| 318 | E | 91.9 | Very high | 90.8 | Very high | 111 Ų | 111 | 105.5 Ų | 105.5 | 52% | 0.519 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62 | -38.8 | 175.4 | -75.8 | 175.1 | -168.2 | 0 | 0 | 112.6 | K314 G316 K322 | K314-E318 WeakPolarHBondContact O-CB 3.42Å; K314-E318 WeakPolarHBondContact O-CG 3.37Å; K314-E318 PolarHBondContact O-N 2.89Å; G316-E318 VanDerWaalsContact C-N 3.32Å; G316-E318 PolarHBondContact O-N 3.42Å; E318-K322 WeakPolarHBondContact O-CG 3.46Å; E318-K322 PolarHBondContact O-N 3.37Å; E318-K322 VanDerWaalsContact O-N 3.1Å |
| 319 | K | 90.4 | Very high | 90.7 | Very high | 144 Ų | 144 | 106 Ų | 106 | 63% | 0.626 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -67.9 | -43.2 | 175 | -77.4 | 176.9 | -179.3 | 178 | 0 | 111.2 | A315 G316 D317 Q321 K322 M323 | A315-K319 WeakPolarHBondContact O-CG 3.4Å; A315-K319 PolarHBondContact O-N 3.31Å; G316-K319 WeakPolarHBondContact O-CB 3.32Å; G316-K319 PolarHBondContact O-N 3.02Å; D317-K319 VanDerWaalsContact C-N 3.34Å; D317-K319 PolarHBondContact O-N 3.31Å; K319-Q321 VanDerWaalsContact C-N 3.33Å; K319-Q321 PolarHBondContact O-N 3.01Å; K319-K322 PolarHBondContact O-N 2.91Å; K319-M323 WeakPolarHBondContact O-CG 3.36Å; K319-M323 PolarHBondContact O-N 2.97Å |
| 320 | D | 89.3 | Confident | 90.4 | Very high | 111 Ų | 111 | 107.3 Ų | 107.3 | 59% | 0.594 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.9 | -39.6 | 178.3 | -76.8 | -16 | 0 | 0 | 0 | 111.6 | G316 D317 M323 A324 | G316-D320 PolarHBondContact O-N 3.5Å; D317-D320 PolarHBondContact O-N 3.14Å; D320-M323 PolarHBondContact O-N 2.87Å; D320-A324 WeakPolarHBondContact O-CB 3.28Å; D320-A324 PolarHBondContact O-N 3.33Å |
| 321 | Q | 88.4 | Confident | 90.1 | Very high | 127 Ų | 127 | 111.2 Ų | 111.2 | 59% | 0.593 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59.3 | -50 | 171.9 | -75.2 | 175.9 | 10.5 | 0 | 0 | 111.6 | D317 K319 M323 A324 E325 | D317-Q321 WeakPolarHBondContact O-CB 3.33Å; D317-Q321 VanDerWaalsContact O-CG 3.28Å; D317-Q321 WeakPolarHBondContact O-CG 3.42Å; D317-Q321 PolarHBondContact O-N 3.34Å; K319-Q321 VanDerWaalsContact C-N 3.33Å; K319-Q321 PolarHBondContact O-N 3.01Å; Q321-M323 VanDerWaalsContact C-N 3.31Å; Q321-M323 PolarHBondContact O-N 3.35Å; Q321-A324 WeakPolarHBondContact O-CB 3.46Å; Q321-A324 PolarHBondContact O-N 3Å; Q321-A324 VanDerWaalsContact O-N 3.14Å; Q321-E325 WeakPolarHBondContact O-CG 3.34Å; Q321-E325 PolarHBondContact O-N 3.41Å |
| 322 | K | 90.4 | Very high | 90 | Very high | 130 Ų | 130 | 107.5 Ų | 107.5 | 57% | 0.565 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.1 | -41.4 | 176.3 | -73.4 | 173.8 | -177.4 | 174.2 | 0 | 112.3 | E318 K319 E325 L326 | E318-K322 WeakPolarHBondContact O-CG 3.46Å; E318-K322 PolarHBondContact O-N 3.37Å; E318-K322 VanDerWaalsContact O-N 3.1Å; K319-K322 PolarHBondContact O-N 2.91Å; K322-E325 PolarHBondContact O-N 3.14Å; K322-L326 WeakPolarHBondContact O-CG 3.48Å; K322-L326 PolarHBondContact O-N 2.84Å |
| 323 | M | 87.8 | Confident | 90 | Very high | 94 Ų | 94 | 107.1 Ų | 107.1 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 176.1 | -73.1 | -62.4 | -66.2 | 0 | 0 | 112 | K319 D320 Q321 L326 R327 | K319-M323 WeakPolarHBondContact O-CG 3.36Å; K319-M323 PolarHBondContact O-N 2.97Å; D320-M323 PolarHBondContact O-N 2.87Å; Q321-M323 VanDerWaalsContact C-N 3.31Å; Q321-M323 PolarHBondContact O-N 3.35Å; M323-L326 PolarHBondContact O-N 3.28Å; M323-L326 HydrophobicContact SD-CD1 4.43Å; M323-R327 WeakPolarHBondContact O-CB 3.35Å; M323-R327 VanDerWaalsContact O-CG 3.29Å; M323-R327 WeakPolarHBondContact O-CG 3.48Å; M323-R327 PolarHBondContact O-N 3.37Å |
| 324 | A | 88.5 | Confident | 89.8 | Confident | 55 Ų | 55 | 109.6 Ų | 109.6 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.8 | -40.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | D320 Q321 R327 R328 | D320-A324 WeakPolarHBondContact O-CB 3.28Å; D320-A324 PolarHBondContact O-N 3.33Å; Q321-A324 WeakPolarHBondContact O-CB 3.46Å; Q321-A324 PolarHBondContact O-N 3Å; Q321-A324 VanDerWaalsContact O-N 3.14Å; A324-R327 PolarHBondContact O-N 3.1Å; A324-R328 WeakPolarHBondContact O-CB 3.37Å; A324-R328 PolarHBondContact O-N 3.44Å |
| 325 | E | 89.7 | Confident | 89.6 | Confident | 120 Ų | 120 | 107.4 Ų | 107.4 | 56% | 0.561 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.7 | -47.1 | 173.6 | -72.6 | 178.9 | 170.9 | 0 | 0 | 111.9 | Q321 K322 R327 R328 Q329 | Q321-E325 WeakPolarHBondContact O-CG 3.34Å; Q321-E325 PolarHBondContact O-N 3.41Å; K322-E325 PolarHBondContact O-N 3.14Å; E325-R327 PolarHBondContact O-N 3.45Å; E325-R328 WeakPolarHBondContact O-CB 3.4Å; E325-R328 PolarHBondContact O-N 2.89Å; E325-R328 VanDerWaalsContact O-N 3.13Å; E325-Q329 WeakPolarHBondContact O-CG 3.45Å; E325-Q329 PolarHBondContact O-N 3.36Å |
| 326 | L | 90.1 | Very high | 89.4 | Confident | 86 Ų | 86 | 110.3 Ų | 110.3 | 45% | 0.45 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 174.9 | -77.3 | 168.1 | 0 | 0 | 0 | 111.9 | K322 M323 R328 Q329 Q330 | K322-L326 WeakPolarHBondContact O-CG 3.48Å; K322-L326 PolarHBondContact O-N 2.84Å; M323-L326 PolarHBondContact O-N 3.28Å; M323-L326 HydrophobicContact SD-CD1 4.43Å; L326-R328 VanDerWaalsContact C-N 3.28Å; L326-R328 PolarHBondContact O-N 2.85Å; L326-Q329 PolarHBondContact O-N 3.45Å; L326-Q330 WeakPolarHBondContact O-CG 3.31Å; L326-Q330 PolarHBondContact O-N 3.34Å |
| 327 | R | 89.4 | Confident | 89.3 | Confident | 153 Ų | 153 | 114.6 Ų | 114.6 | 58% | 0.577 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.1 | -38.8 | 174.6 | -75.8 | 176 | -174.3 | 171 | 4.2 | 111.7 | M323 A324 E325 Q330 R331 | M323-R327 WeakPolarHBondContact O-CB 3.35Å; M323-R327 VanDerWaalsContact O-CG 3.29Å; M323-R327 WeakPolarHBondContact O-CG 3.48Å; M323-R327 PolarHBondContact O-N 3.37Å; A324-R327 PolarHBondContact O-N 3.1Å; E325-R327 PolarHBondContact O-N 3.45Å; R327-Q330 PolarHBondContact O-N 2.93Å; R327-R331 WeakPolarHBondContact O-CG 3.42Å; R327-R331 PolarHBondContact O-N 3.34Å |
| 328 | R | 88.7 | Confident | 89.1 | Confident | 184 Ų | 184 | 115.2 Ų | 115.2 | 69% | 0.694 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65 | -44.1 | 176.2 | -174.1 | -177 | 177.8 | -170.8 | 0.1 | 111.1 | A324 E325 L326 R331 I332 | A324-R328 WeakPolarHBondContact O-CB 3.37Å; A324-R328 PolarHBondContact O-N 3.44Å; E325-R328 WeakPolarHBondContact O-CB 3.4Å; E325-R328 PolarHBondContact O-N 2.89Å; E325-R328 VanDerWaalsContact O-N 3.13Å; L326-R328 VanDerWaalsContact C-N 3.28Å; L326-R328 PolarHBondContact O-N 2.85Å; R328-R331 PolarHBondContact O-N 2.96Å; R328-I332 HydrophobicContact CG-CD1 4.25Å; R328-I332 WeakPolarHBondContact O-CG1 3.47Å; R328-I332 PolarHBondContact O-N 3.08Å |
| 329 | Q | 89.5 | Confident | 88.9 | Confident | 114 Ų | 114 | 116.8 Ų | 116.8 | 53% | 0.533 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61 | -45.7 | 175.5 | -70.2 | 175.8 | 0.8 | 0 | 0 | 111.6 | E325 L326 R331 I332 L333 | E325-Q329 WeakPolarHBondContact O-CG 3.45Å; E325-Q329 PolarHBondContact O-N 3.36Å; L326-Q329 PolarHBondContact O-N 3.45Å; Q329-R331 VanDerWaalsContact C-N 3.34Å; Q329-R331 PolarHBondContact O-N 3.32Å; Q329-I332 PolarHBondContact O-N 3.37Å; Q329-L333 WeakPolarHBondContact O-CG 3.49Å; Q329-L333 PolarHBondContact O-N 3Å |
| 330 | Q | 87.6 | Confident | 88.8 | Confident | 125 Ų | 125 | 116.1 Ų | 116.1 | 58% | 0.584 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.6 | -42.4 | 175.5 | -73 | 176.4 | -11.5 | 0 | 0 | 112.3 | L326 R327 I332 L333 M334 | L326-Q330 WeakPolarHBondContact O-CG 3.31Å; L326-Q330 PolarHBondContact O-N 3.34Å; R327-Q330 PolarHBondContact O-N 2.93Å; Q330-I332 PolarHBondContact O-N 3.08Å; Q330-L333 PolarHBondContact O-N 3.45Å; Q330-M334 WeakPolarHBondContact O-CG 3.43Å; Q330-M334 PolarHBondContact O-N 3.49Å |
| 331 | R | 88.4 | Confident | 88.6 | Confident | 171 Ų | 171 | 115.9 Ų | 115.9 | 65% | 0.645 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.9 | -43.7 | 174.9 | -74.9 | 178.5 | -167.5 | -130.2 | 3.7 | 112 | R327 R328 Q329 L333 M334 D335 | R327-R331 WeakPolarHBondContact O-CG 3.42Å; R327-R331 PolarHBondContact O-N 3.34Å; R328-R331 PolarHBondContact O-N 2.96Å; Q329-R331 VanDerWaalsContact C-N 3.34Å; Q329-R331 PolarHBondContact O-N 3.32Å; R331-L333 VanDerWaalsContact C-N 3.33Å; R331-L333 PolarHBondContact O-N 3.43Å; R331-M334 PolarHBondContact O-N 2.91Å; R331-D335 WeakPolarHBondContact O-CB 3.39Å; R331-D335 VanDerWaalsContact O-CG 3.22Å; R331-D335 PolarHBondContact O-N 2.9Å |
| 332 | I | 89.8 | Confident | 88.5 | Confident | 78 Ų | 78 | 112 Ų | 112 | 40% | 0.4 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 177.6 | -67.8 | 164.2 | 0 | 0 | 0 | 110.9 | R328 Q329 Q330 D335 Q336 | R328-I332 HydrophobicContact CG-CD1 4.25Å; R328-I332 WeakPolarHBondContact O-CG1 3.47Å; R328-I332 PolarHBondContact O-N 3.08Å; Q329-I332 PolarHBondContact O-N 3.37Å; Q330-I332 PolarHBondContact O-N 3.08Å; I332-D335 PolarHBondContact O-N 3.02Å; I332-Q336 WeakPolarHBondContact O-CG 3.43Å; I332-Q336 PolarHBondContact O-N 3.38Å |
| 333 | L | 91.6 | Very high | 88.3 | Confident | 97 Ų | 97 | 114.5 Ų | 114.5 | 51% | 0.508 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.7 | -48.5 | 176.7 | -70.2 | 172.8 | 0 | 0 | 0 | 111.3 | Q329 Q330 R331 D335 Q336 E337 | Q329-L333 WeakPolarHBondContact O-CG 3.49Å; Q329-L333 PolarHBondContact O-N 3Å; Q330-L333 PolarHBondContact O-N 3.45Å; R331-L333 VanDerWaalsContact C-N 3.33Å; R331-L333 PolarHBondContact O-N 3.43Å; L333-D335 VanDerWaalsContact C-N 3.29Å; L333-D335 PolarHBondContact O-N 3.31Å; L333-Q336 WeakPolarHBondContact O-CB 3.48Å; L333-Q336 PolarHBondContact O-N 2.98Å; L333-Q336 VanDerWaalsContact O-N 3.08Å; L333-E337 PolarHBondContact O-N 3.49Å |
| 334 | M | 88 | Confident | 88.2 | Confident | 112 Ų | 112 | 115.7 Ų | 115.7 | 55% | 0.552 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -59.4 | -39.1 | 175.5 | -72.9 | -146.5 | -58.5 | 0 | 0 | 112.3 | Q330 R331 Q336 E337 N338 | Q330-M334 WeakPolarHBondContact O-CG 3.43Å; Q330-M334 PolarHBondContact O-N 3.49Å; R331-M334 PolarHBondContact O-N 2.91Å; M334-Q336 VanDerWaalsContact C-N 3.31Å; M334-Q336 PolarHBondContact O-N 3.2Å; M334-E337 PolarHBondContact O-N 3.22Å; M334-N338 VanDerWaalsContact O-CB 3.31Å; M334-N338 WeakPolarHBondContact O-CB 3.33Å; M334-N338 VanDerWaalsContact O-CG 3.27Å; M334-N338 PolarHBondContact O-N 3.47Å; M334-N338 PolarHBondContact O-ND2 3.39Å |
| 335 | D | 87.6 | Confident | 88 | Confident | 91 Ų | 91 | 119 Ų | 119 | 49% | 0.487 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.8 | -35.5 | 176.2 | -73.2 | -20.4 | 0 | 0 | 0 | 112 | R331 I332 L333 K339 | R331-D335 WeakPolarHBondContact O-CB 3.39Å; R331-D335 VanDerWaalsContact O-CG 3.22Å; R331-D335 PolarHBondContact O-N 2.9Å; I332-D335 PolarHBondContact O-N 3.02Å; L333-D335 VanDerWaalsContact C-N 3.29Å; L333-D335 PolarHBondContact O-N 3.31Å; D335-K339 WeakPolarHBondContact O-CB 3.44Å; D335-K339 VanDerWaalsContact O-CG 3.27Å; D335-K339 WeakPolarHBondContact O-CG 3.43Å; D335-K339 PolarHBondContact O-N 2.91Å |
| 336 | Q | 89.3 | Confident | 87.7 | Confident | 103 Ų | 103 | 119.7 Ų | 119.7 | 48% | 0.481 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67.9 | -45.7 | 174.4 | -71.7 | 174 | 5.8 | 0 | 0 | 111.6 | I332 L333 M334 K339 Q340 | I332-Q336 WeakPolarHBondContact O-CG 3.43Å; I332-Q336 PolarHBondContact O-N 3.38Å; L333-Q336 WeakPolarHBondContact O-CB 3.48Å; L333-Q336 PolarHBondContact O-N 2.98Å; L333-Q336 VanDerWaalsContact O-N 3.08Å; M334-Q336 VanDerWaalsContact C-N 3.31Å; M334-Q336 PolarHBondContact O-N 3.2Å; Q336-K339 WeakPolarHBondContact O-CB 3.43Å; Q336-K339 PolarHBondContact O-N 3.39Å; Q336-Q340 PolarHBondContact O-N 3.04Å |
| 337 | E | 88 | Confident | 87.3 | Confident | 120 Ų | 120 | 118.5 Ų | 118.5 | 56% | 0.561 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.6 | -46.1 | 175.5 | -70.4 | 178.7 | 168.6 | 0 | 0 | 111.2 | L333 M334 K339 Q340 L341 | L333-E337 PolarHBondContact O-N 3.49Å; M334-E337 PolarHBondContact O-N 3.22Å; E337-K339 VanDerWaalsContact C-N 3.32Å; E337-K339 PolarHBondContact O-N 3.13Å; E337-Q340 WeakPolarHBondContact O-CB 3.47Å; E337-Q340 PolarHBondContact O-N 2.9Å; E337-Q340 VanDerWaalsContact O-N 3.08Å; E337-L341 WeakPolarHBondContact O-CG 3.5Å; E337-L341 PolarHBondContact O-N 3.01Å |
| 338 | N | 87.4 | Confident | 87 | Confident | 93 Ų | 93 | 116.7 Ų | 116.7 | 50% | 0.497 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60 | -39.4 | 175.6 | -77.9 | -24.8 | 0 | 0 | 0 | 112.3 | M334 L341 A342 | M334-N338 VanDerWaalsContact O-CB 3.31Å; M334-N338 WeakPolarHBondContact O-CB 3.33Å; M334-N338 VanDerWaalsContact O-CG 3.27Å; M334-N338 PolarHBondContact O-N 3.47Å; M334-N338 PolarHBondContact O-ND2 3.39Å; N338-L341 PolarHBondContact O-N 3.49Å; N338-A342 VanDerWaalsContact O-CB 3.31Å; N338-A342 WeakPolarHBondContact O-CB 3.45Å; N338-A342 PolarHBondContact O-N 2.97Å |
| 339 | K | 87.7 | Confident | 86.6 | Confident | 145 Ų | 145 | 112.8 Ų | 112.8 | 63% | 0.63 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.4 | -40 | 173.6 | -78.5 | 173.1 | -174.4 | 176.7 | 0 | 112.2 | D335 Q336 E337 R343 | D335-K339 WeakPolarHBondContact O-CB 3.44Å; D335-K339 VanDerWaalsContact O-CG 3.27Å; D335-K339 WeakPolarHBondContact O-CG 3.43Å; D335-K339 PolarHBondContact O-N 2.91Å; Q336-K339 WeakPolarHBondContact O-CB 3.43Å; Q336-K339 PolarHBondContact O-N 3.39Å; E337-K339 VanDerWaalsContact C-N 3.32Å; E337-K339 PolarHBondContact O-N 3.13Å; K339-R343 WeakPolarHBondContact O-CG 3.4Å; K339-R343 PolarHBondContact O-N 2.9Å; K339-R343 VanDerWaalsContact O-N 3.09Å |
| 340 | Q | 86.6 | Confident | 86 | Confident | 129 Ų | 129 | 112.4 Ų | 112.4 | 60% | 0.603 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.7 | -46.4 | 176.2 | -70 | -174.3 | 0.5 | 0 | 0 | 111.2 | Q336 E337 A342 R343 L344 | Q336-Q340 PolarHBondContact O-N 3.04Å; E337-Q340 WeakPolarHBondContact O-CB 3.47Å; E337-Q340 PolarHBondContact O-N 2.9Å; E337-Q340 VanDerWaalsContact O-N 3.08Å; Q340-A342 VanDerWaalsContact C-N 3.34Å; Q340-A342 PolarHBondContact O-N 3.4Å; Q340-R343 PolarHBondContact O-N 3.45Å; Q340-L344 WeakPolarHBondContact O-CG 3.31Å; Q340-L344 PolarHBondContact O-N 3.5Å |
| 341 | L | 86.6 | Confident | 85.7 | Confident | 107 Ų | 107 | 111.7 Ų | 111.7 | 56% | 0.56 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.1 | -43.6 | 175.5 | -72.2 | 171 | 0 | 0 | 0 | 111.9 | E337 N338 R343 L344 Q345 | E337-L341 WeakPolarHBondContact O-CG 3.5Å; E337-L341 PolarHBondContact O-N 3.01Å; N338-L341 PolarHBondContact O-N 3.49Å; L341-R343 PolarHBondContact O-N 3.34Å; L341-L344 PolarHBondContact O-N 3.43Å; L341-Q345 WeakPolarHBondContact O-CB 3.48Å; L341-Q345 PolarHBondContact O-N 2.92Å |
| 342 | A | 85.7 | Confident | 85.2 | Confident | 44 Ų | 44 | 105.7 Ų | 105.7 | 36% | 0.364 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -40.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | N338 Q340 Q345 Q346 | N338-A342 VanDerWaalsContact O-CB 3.31Å; N338-A342 WeakPolarHBondContact O-CB 3.45Å; N338-A342 PolarHBondContact O-N 2.97Å; Q340-A342 VanDerWaalsContact C-N 3.34Å; Q340-A342 PolarHBondContact O-N 3.4Å; A342-Q345 PolarHBondContact O-N 3.34Å; A342-Q346 WeakPolarHBondContact O-CG 3.38Å; A342-Q346 PolarHBondContact O-N 3.48Å |
| 343 | R | 85.9 | Confident | 84.5 | Confident | 184 Ų | 184 | 106.7 Ų | 106.7 | 69% | 0.694 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.7 | -44.8 | 174.3 | -75.7 | 178.1 | -178 | 174.4 | 0.8 | 112 | K339 Q340 L341 Q345 Q346 A347 | K339-R343 WeakPolarHBondContact O-CG 3.4Å; K339-R343 PolarHBondContact O-N 2.9Å; K339-R343 VanDerWaalsContact O-N 3.09Å; Q340-R343 PolarHBondContact O-N 3.45Å; L341-R343 PolarHBondContact O-N 3.34Å; R343-Q345 VanDerWaalsContact C-N 3.31Å; R343-Q345 PolarHBondContact O-N 2.94Å; R343-Q346 PolarHBondContact O-N 3.41Å; R343-A347 WeakPolarHBondContact O-CB 3.19Å; R343-A347 PolarHBondContact O-N 2.9Å |
| 344 | L | 85.9 | Confident | 83.5 | Confident | 119 Ų | 119 | 108.2 Ų | 108.2 | 62% | 0.623 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.9 | -42.8 | 176.6 | -71 | 172.4 | 0 | 0 | 0 | 111.1 | Q340 L341 A347 H348 | Q340-L344 WeakPolarHBondContact O-CG 3.31Å; Q340-L344 PolarHBondContact O-N 3.5Å; L341-L344 PolarHBondContact O-N 3.43Å; L344-A347 PolarHBondContact O-N 3.34Å; L344-H348 WeakPolarHBondContact O-CB 3.36Å; L344-H348 PolarHBondContact O-N 3.21Å |
| 345 | Q | 84.1 | Confident | 82.6 | Confident | 125 Ų | 125 | 109.4 Ų | 109.4 | 58% | 0.584 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.9 | -43.4 | 177.1 | -167.9 | 175.6 | 21.2 | 0 | 0 | 112 | L341 A342 R343 H348 Q349 | L341-Q345 WeakPolarHBondContact O-CB 3.48Å; L341-Q345 PolarHBondContact O-N 2.92Å; A342-Q345 PolarHBondContact O-N 3.34Å; R343-Q345 VanDerWaalsContact C-N 3.31Å; R343-Q345 PolarHBondContact O-N 2.94Å; Q345-H348 PolarHBondContact O-N 3.09Å; Q345-Q349 WeakPolarHBondContact O-CB 3.27Å; Q345-Q349 WeakPolarHBondContact O-CG 3.37Å; Q345-Q349 PolarHBondContact O-N 3.26Å |
| 346 | Q | 83.9 | Confident | 81.6 | Confident | 133 Ų | 133 | 109.7 Ų | 109.7 | 62% | 0.621 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.6 | -42.9 | 174.8 | -76.4 | -179.8 | -6.3 | 0 | 0 | 112.4 | A342 R343 H348 Q349 H350 | A342-Q346 WeakPolarHBondContact O-CG 3.38Å; A342-Q346 PolarHBondContact O-N 3.48Å; R343-Q346 PolarHBondContact O-N 3.41Å; Q346-H348 VanDerWaalsContact C-N 3.33Å; Q346-H348 PolarHBondContact O-N 3.44Å; Q346-Q349 PolarHBondContact O-N 3.02Å; Q346-H350 WeakPolarHBondContact O-CB 3.42Å; Q346-H350 PolarHBondContact O-N 3.01Å |
| 347 | A | 82.1 | Confident | 80.8 | Confident | 61 Ų | 61 | 112.2 Ų | 112.2 | 50% | 0.504 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | R343 L344 H350 Y351 | R343-A347 WeakPolarHBondContact O-CB 3.19Å; R343-A347 PolarHBondContact O-N 2.9Å; L344-A347 PolarHBondContact O-N 3.34Å; A347-H350 PolarHBondContact O-N 3.36Å; A347-Y351 PolarHBondContact O-N 3.44Å |
| 348 | H | 82.4 | Confident | 79.6 | Confident | 115 Ų | 115 | 110.2 Ų | 110.2 | 53% | 0.532 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.8 | -42.8 | 176.7 | -172.5 | 51.6 | 0 | 0 | 0 | 112.6 | L344 Q345 Q346 H350 Y351 L352 | L344-H348 WeakPolarHBondContact O-CB 3.36Å; L344-H348 PolarHBondContact O-N 3.21Å; Q345-H348 PolarHBondContact O-N 3.09Å; Q346-H348 VanDerWaalsContact C-N 3.33Å; Q346-H348 PolarHBondContact O-N 3.44Å; H348-H350 VanDerWaalsContact C-N 3.31Å; H348-H350 PolarHBondContact O-N 2.87Å; H348-Y351 PolarHBondContact O-N 3.27Å; H348-L352 WeakPolarHBondContact O-CG 3.44Å; H348-L352 PolarHBondContact O-N 2.86Å |
| 349 | Q | 80.6 | Confident | 78.7 | Confident | 102 Ų | 102 | 113.2 Ų | 113.2 | 48% | 0.477 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.3 | -38.2 | 173.9 | -75.3 | 179.9 | -2 | 0 | 0 | 112.3 | Q345 Q346 N353 | Q345-Q349 WeakPolarHBondContact O-CB 3.27Å; Q345-Q349 WeakPolarHBondContact O-CG 3.37Å; Q345-Q349 PolarHBondContact O-N 3.26Å; Q346-Q349 PolarHBondContact O-N 3.02Å; Q349-N353 WeakPolarHBondContact O-CB 3.45Å; Q349-N353 VanDerWaalsContact O-CG 3.28Å; Q349-N353 PolarHBondContact O-N 3.42Å; Q349-N353 PolarHBondContact O-ND2 3.27Å |
| 350 | H | 77.5 | Confident | 77.7 | Confident | 107 Ų | 107 | 115 Ų | 115 | 50% | 0.495 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.2 | -43.5 | 176.2 | -174.2 | -81 | 0 | 0 | 0 | 112 | Q346 A347 H348 N353 K354 | Q346-H350 WeakPolarHBondContact O-CB 3.42Å; Q346-H350 PolarHBondContact O-N 3.01Å; A347-H350 PolarHBondContact O-N 3.36Å; H348-H350 VanDerWaalsContact C-N 3.31Å; H348-H350 PolarHBondContact O-N 2.87Å; H350-N353 PolarHBondContact O-N 2.97Å; H350-K354 VanDerWaalsContact CE1-CD 3.43Å; H350-K354 WeakPolarHBondContact CE1-CD 3.46Å; H350-K354 PolarHBondContact CE1-NZ 3.35Å; H350-K354 VanDerWaalsContact NE2-CE 3.29Å; H350-K354 WeakPolarHBondContact NE2-CE 3.48Å; H350-K354 PolarHBondContact NE2-NZ 2.7Å; H350-K354 VanDerWaalsContact NE2-NZ 3.15Å; H350-K354 WeakPolarHBondContact O-CB 3.39Å; H350-K354 PolarHBondContact O-N 3.19Å |
| 351 | Y | 79.9 | Confident | 76.6 | Confident | 110 Ų | 110 | 112.7 Ų | 112.7 | 43% | 0.431 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -58.1 | -50.7 | 173.6 | 175.7 | -97.6 | 0 | 0 | 0 | 112 | A347 H348 N353 K354 E355 L356 | A347-Y351 PolarHBondContact O-N 3.44Å; H348-Y351 PolarHBondContact O-N 3.27Å; Y351-N353 PolarHBondContact O-N 2.85Å; Y351-K354 PolarHBondContact O-N 3.42Å; Y351-E355 HydrophobicContact CD2-CB 4.36Å; Y351-E355 HydrophobicContact CD2-CG 4.32Å; Y351-E355 WeakPolarHBondContact CD2-OE2 3.34Å; Y351-E355 HydrophobicContact CE2-CB 4.29Å; Y351-E355 HydrophobicContact CE2-CG 4.48Å; Y351-E355 WeakPolarHBondContact CE2-OE2 3.38Å; Y351-E355 PolarHBondContact O-N 3.44Å; Y351-L356 HydrophobicContact CE1-CD1 3.81Å |
| 352 | L | 77.9 | Confident | 75.8 | Confident | 44 Ų | 44 | 112.4 Ų | 112.4 | 23% | 0.23 | 56% | 0.555 | C | S | . | * | I | π-helix | trans | -57.4 | -48.9 | 178.3 | -74 | 168.7 | 0 | 0 | 0 | 111.9 | H348 L356 Y357 | H348-L352 WeakPolarHBondContact O-CG 3.44Å; H348-L352 PolarHBondContact O-N 2.86Å; L352-L356 HydrophobicContact CD2-CD1 4.46Å; L352-L356 WeakPolarHBondContact O-CB 3.43Å; L352-L356 PolarHBondContact O-N 2.96Å; L352-Y357 HydrophobicContact CB-CE2 4.3Å; L352-Y357 WeakPolarHBondContact O-CD2 2.99Å; L352-Y357 PolarHBondContact O-N 3.25Å |
| 353 | N | 76.4 | Confident | 74.7 | Confident | 100 Ų | 100 | 120.8 Ų | 120.8 | 54% | 0.535 | 58% | 0.578 | S | S | . | * | I | π-helix | trans | -73.9 | -31 | -174.4 | -70.7 | -19.2 | 0 | 0 | 0 | 113.7 | Q349 H350 Y351 | Q349-N353 WeakPolarHBondContact O-CB 3.45Å; Q349-N353 VanDerWaalsContact O-CG 3.28Å; Q349-N353 PolarHBondContact O-N 3.42Å; Q349-N353 PolarHBondContact O-ND2 3.27Å; H350-N353 PolarHBondContact O-N 2.97Å; Y351-N353 PolarHBondContact O-N 2.85Å |
| 354 | K | 71 | Confident | 73.8 | Confident | 128 Ų | 128 | 117.8 Ų | 117.8 | 56% | 0.557 | 58% | 0.575 | S | S | * | * | I | π-helix | trans | -94.4 | -42.9 | -176.8 | -73.6 | -162.8 | -175.8 | -176.2 | 0 | 114.3 | H350 Y351 T358 | H350-K354 VanDerWaalsContact CE1-CD 3.43Å; H350-K354 WeakPolarHBondContact CE1-CD 3.46Å; H350-K354 PolarHBondContact CE1-NZ 3.35Å; H350-K354 VanDerWaalsContact NE2-CE 3.29Å; H350-K354 WeakPolarHBondContact NE2-CE 3.48Å; H350-K354 PolarHBondContact NE2-NZ 2.7Å; H350-K354 VanDerWaalsContact NE2-NZ 3.15Å; H350-K354 WeakPolarHBondContact O-CB 3.39Å; H350-K354 PolarHBondContact O-N 3.19Å; Y351-K354 PolarHBondContact O-N 3.42Å; K354-T358 WeakPolarHBondContact O-CG2 3.41Å; K354-T358 PolarHBondContact O-OG1 3.44Å |
| 355 | E | 67.5 | Low | 73 | Confident | 138 Ų | 138 | 118.1 Ų | 118.1 | 65% | 0.645 | 57% | 0.569 | S | S | * | * | I | π-helix | trans | -96.3 | -35.1 | -172 | -63.7 | -169.2 | -171.8 | 0 | 0 | 112.7 | Y351 | Y351-E355 HydrophobicContact CD2-CB 4.36Å; Y351-E355 HydrophobicContact CD2-CG 4.32Å; Y351-E355 WeakPolarHBondContact CD2-OE2 3.34Å; Y351-E355 HydrophobicContact CE2-CB 4.29Å; Y351-E355 HydrophobicContact CE2-CG 4.48Å; Y351-E355 WeakPolarHBondContact CE2-OE2 3.38Å; Y351-E355 PolarHBondContact O-N 3.44Å |
| 356 | L | 66.4 | Low | 72.2 | Confident | 96 Ų | 96 | 118.3 Ų | 118.3 | 50% | 0.503 | 57% | 0.568 | S | S | . | * | I | π-helix | trans | -95.9 | -37.9 | -173.2 | -126.1 | 135.5 | 0 | 0 | 0 | 112.9 | Y351 L352 | Y351-L356 HydrophobicContact CE1-CD1 3.81Å; L352-L356 HydrophobicContact CD2-CD1 4.46Å; L352-L356 WeakPolarHBondContact O-CB 3.43Å; L352-L356 PolarHBondContact O-N 2.96Å |
| 357 | Y | 74.1 | Confident | 71.2 | Confident | 156 Ų | 156 | 115.2 Ų | 115.2 | 61% | 0.612 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -92.7 | 9.7 | -177.5 | -62.4 | -25 | 0 | 0 | 0 | 115.1 | L352 | L352-Y357 HydrophobicContact CB-CE2 4.3Å; L352-Y357 WeakPolarHBondContact O-CD2 2.99Å; L352-Y357 PolarHBondContact O-N 3.25Å |
| 358 | T | 61.5 | Low | 70.5 | Confident | 79 Ų | 79 | 119.2 Ų | 119.2 | 49% | 0.485 | 57% | 0.573 | S | S | . | * | trans | -101.3 | 89.1 | 173.9 | 53.8 | 0 | 0 | 0 | 0 | 111.8 | K354 K360 | K354-T358 WeakPolarHBondContact O-CG2 3.41Å; K354-T358 PolarHBondContact O-OG1 3.44Å; T358-K360 PolarHBondContact O-N 3.02Å | ||
| 359 | N | 68.3 | Low | 69.6 | Low | 156 Ų | 156 | 119.7 Ų | 119.7 | 83% | 0.834 | 57% | 0.574 | S | S | * | * | trans | -73.2 | 107.4 | 173.5 | -75.2 | -28.4 | 0 | 0 | 0 | 110.6 | ||||
| 360 | K | 66.8 | Low | 68.6 | Low | 181 Ų | 181 | 122.8 Ų | 122.8 | 79% | 0.787 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 121.5 | 166.6 | -68.5 | -179.4 | -178.5 | 175 | 0 | 108.8 | T358 T362 | T358-K360 PolarHBondContact O-N 3.02Å; K360-T362 PolarHBondContact O-N 2.93Å |
| 361 | P | 64.9 | Low | 67.9 | Low | 81 Ų | 81 | 123.6 Ų | 123.6 | 53% | 0.526 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 125.7 | -179.4 | 20.9 | -28.8 | 0 | 0 | 0 | 110.9 | Y365 F366 | P361-Y365 HydrophobicContact CB-CD1 3.93Å; P361-Y365 HydrophobicContact CB-CG 4.25Å; P361-F366 HydrophobicContact CB-CE2 4.33Å; P361-F366 HydrophobicContact CG-CE2 4.29Å; P361-F366 HydrophobicContact CG-CZ 4.26Å |
| 362 | T | 69.1 | Low | 66.5 | Low | 101 Ų | 101 | 121.6 Ų | 121.6 | 62% | 0.62 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 150.1 | -176.4 | -35.9 | 0 | 0 | 0 | 0 | 110.5 | K360 D364 Y365 | K360-T362 PolarHBondContact O-N 2.93Å; T362-D364 PolarHBondContact O-N 3.33Å; T362-Y365 WeakPolarHBondContact O-CB 3.29Å; T362-Y365 PolarHBondContact O-N 3.03Å |
| 363 | R | 63.1 | Low | 65.1 | Low | 221 Ų | 221 | 126.2 Ų | 126.2 | 83% | 0.834 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -53.8 | -27.2 | -172.6 | -165.5 | 176.3 | 171.5 | -175.3 | -3.6 | 114 | Y365 F366 | R363-Y365 VanDerWaalsContact C-N 3.32Å; R363-Y365 PolarHBondContact O-N 3.35Å; R363-F366 PolarHBondContact O-N 3Å |
| 364 | D | 65.9 | Low | 63.5 | Low | 120 Ų | 120 | 136.6 Ų | 136.6 | 64% | 0.642 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -66.5 | -27.1 | 175.6 | -59.7 | -24.4 | 0 | 0 | 0 | 113.8 | T362 F366 A367 | T362-D364 PolarHBondContact O-N 3.33Å; D364-F366 VanDerWaalsContact C-N 3.3Å; D364-F366 PolarHBondContact O-N 2.93Å; D364-A367 PolarHBondContact O-N 3Å |
| 365 | Y | 70 | Confident | 63.1 | Low | 127 Ų | 127 | 137.1 Ų | 137.1 | 50% | 0.498 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -61.9 | -36.7 | 175.2 | 176.6 | -100.6 | 0 | 0 | 0 | 112 | P361 T362 R363 F369 | P361-Y365 HydrophobicContact CB-CD1 3.93Å; P361-Y365 HydrophobicContact CB-CG 4.25Å; T362-Y365 WeakPolarHBondContact O-CB 3.29Å; T362-Y365 PolarHBondContact O-N 3.03Å; R363-Y365 VanDerWaalsContact C-N 3.32Å; R363-Y365 PolarHBondContact O-N 3.35Å; Y365-F369 HydrophobicContact CE1-CE2 4.44Å |
| 366 | F | 65.9 | Low | 62.9 | Low | 129 Ų | 129 | 137 Ų | 137 | 57% | 0.566 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -80.2 | -20.5 | 179 | -64.7 | -75 | 0 | 0 | 0 | 113.1 | P361 R363 D364 Q368 | P361-F366 HydrophobicContact CB-CE2 4.33Å; P361-F366 HydrophobicContact CG-CE2 4.29Å; P361-F366 HydrophobicContact CG-CZ 4.26Å; R363-F366 PolarHBondContact O-N 3Å; D364-F366 VanDerWaalsContact C-N 3.3Å; D364-F366 PolarHBondContact O-N 2.93Å; F366-Q368 VanDerWaalsContact C-N 3.26Å; F366-Q368 PolarHBondContact O-N 3.48Å |
| 367 | A | 64 | Low | 62.7 | Low | 68 Ų | 68 | 139.3 Ų | 139.3 | 56% | 0.562 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -7.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D364 | D364-A367 PolarHBondContact O-N 3Š|
| 368 | Q | 67.7 | Low | 62 | Low | 144 Ų | 144 | 138.3 Ų | 138.3 | 67% | 0.673 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -12.6 | 178.2 | -69.6 | -179.8 | -4.3 | 0 | 0 | 114 | F366 | F366-Q368 VanDerWaalsContact C-N 3.26Å; F366-Q368 PolarHBondContact O-N 3.48Å |
| 369 | F | 63 | Low | 62 | Low | 126 Ų | 126 | 142 Ų | 142 | 55% | 0.553 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -93.2 | 134 | -179.7 | -69.1 | -88.6 | 0 | 0 | 0 | 111 | Y365 | Y365-F369 HydrophobicContact CE1-CE2 4.44Š|
| 370 | N | 60.3 | Low | 61.6 | Low | 167 Ų | 167 | 141.1 Ų | 141.1 | 89% | 0.893 | 72% | 0.718 | S | S | * | * | S | Bend | trans | 74.1 | 29 | 175 | -55.6 | -23.8 | 0 | 0 | 0 | 118.3 | ||
| 371 | T | 61.8 | Low | 61.2 | Low | 124 Ų | 124 | 138.2 Ų | 138.2 | 76% | 0.761 | 71% | 0.713 | S | S | * | * | trans | -95.8 | 12.2 | 178.1 | 50.8 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 372 | G | 50.8 | Low | 61 | Low | 68 Ų | 68 | 142.6 Ų | 142.6 | 70% | 0.701 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -147 | 133.8 | 177 | 0 | 0 | 0 | 0 | 0 | 114 | R374 | G372-R374 PolarHBondContact O-N 3.15Š|
| 373 | C | 48.7 | Very low | 60.3 | Low | 140 Ų | 140 | 146.1 Ų | 146.1 | 95% | 0.946 | 74% | 0.736 | S | S | * | * | trans | -70.1 | 109.7 | 179.6 | -72.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 374 | R | 42.2 | Very low | 60 | Low | 319 Ų | 319 | 139.3 Ų | 139.3 | 100% | 1.204 | 73% | 0.727 | S | S | * | * | trans | -142.7 | 0 | 145.9 | -98 | -169.4 | 178.8 | -168.1 | 0.1 | 109.1 | G372 | G372-R374 PolarHBondContact O-N 3.15Š|
Retrieved 374 of 374 residues in 701.4 ms
(Link to these results)