| 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 | 49.6 | Very low | 47.3 | Very low | 242 Ų | 242 | 158.2 Ų | 158.2 | 100% | 1.192 | 81% | 0.809 | S | S | * | * | 0 | 91.5 | 0 | -66.5 | -162 | -66.9 | 0 | 0 | 107.4 | |||||
| 2 | L | 42 | Very low | 47.3 | Very low | 179 Ų | 179 | 158.6 Ų | 158.6 | 94% | 0.937 | 81% | 0.805 | S | S | * | * | trans | -142.2 | 92.7 | 172.9 | -77 | 170.8 | 0 | 0 | 0 | 105.6 | ||||
| 3 | A | 44.3 | Very low | 47.7 | Very low | 82 Ų | 82 | 157.8 Ų | 157.8 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | trans | -73.1 | 160.8 | 152.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 4 | D | 50.2 | Low | 47.9 | Very low | 159 Ų | 159 | 159.6 Ų | 159.6 | 85% | 0.85 | 80% | 0.801 | S | S | * | * | trans | 87.5 | 77.3 | 174 | -53.5 | -16.1 | 0 | 0 | 0 | 116.2 | ||||
| 5 | M | 50.7 | Low | 48.5 | Very low | 171 Ų | 171 | 160.7 Ų | 160.7 | 84% | 0.842 | 80% | 0.803 | S | S | * | * | trans | -165.2 | 60 | 136.1 | -124.8 | 173.5 | 64.1 | 0 | 0 | 109.9 | V7 | M5-V7 VanDerWaalsContact C-N 3.3Å; M5-V7 HydrophobicContact CG-CG2 4.47Å; M5-V7 PolarHBondContact O-N 3.5Å | ||
| 6 | I | 49.8 | Very low | 48.9 | Very low | 161 Ų | 161 | 159.6 Ų | 159.6 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | trans | -82.6 | 95.2 | 154.2 | -60.3 | 174.4 | 0 | 0 | 0 | 103.3 | E8 | I6-E8 VanDerWaalsContact C-N 3.3Å; I6-E8 PolarHBondContact O-N 3.42Å | ||
| 7 | V | 49.7 | Very low | 49.2 | Very low | 98 Ų | 98 | 160.4 Ų | 160.4 | 59% | 0.594 | 80% | 0.795 | S | S | * | * | trans | -61.3 | 104.1 | 163.4 | 176.2 | 0 | 0 | 0 | 0 | 104.4 | M5 E9 | M5-V7 VanDerWaalsContact C-N 3.3Å; M5-V7 HydrophobicContact CG-CG2 4.47Å; M5-V7 PolarHBondContact O-N 3.5Å; V7-E9 HydrophobicContact CG1-CG 4.11Å; V7-E9 PolarHBondContact O-N 2.83Å | ||
| 8 | E | 47.4 | Very low | 49.8 | Very low | 160 Ų | 160 | 157.2 Ų | 157.2 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -60.4 | 85.6 | 158 | -69.7 | 174.4 | 164.4 | 0 | 0 | 105.3 | I6 E10 | I6-E8 VanDerWaalsContact C-N 3.3Å; I6-E8 PolarHBondContact O-N 3.42Å; E8-E10 PolarHBondContact O-N 3.29Å | ||
| 9 | E | 48.2 | Very low | 50.2 | Low | 150 Ų | 150 | 159.8 Ų | 159.8 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -62.3 | 88.3 | 152.4 | -83.4 | 179.6 | 165.8 | 0 | 0 | 104.1 | V7 F11 | V7-E9 HydrophobicContact CG1-CG 4.11Å; V7-E9 PolarHBondContact O-N 2.83Å; E9-F11 PolarHBondContact O-N 2.85Å | ||
| 10 | E | 44.3 | Very low | 50.7 | Low | 165 Ų | 165 | 159.8 Ų | 159.8 | 77% | 0.771 | 78% | 0.78 | S | S | * | * | trans | -50.7 | 92 | 158.7 | -68.3 | 172.9 | 164 | 0 | 0 | 105.3 | E8 E12 | E8-E10 PolarHBondContact O-N 3.29Å; E10-E12 PolarHBondContact O-N 2.67Å | ||
| 11 | F | 44.1 | Very low | 52.1 | Low | 173 Ų | 173 | 157.6 Ų | 157.6 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | -58.4 | 96.5 | 158.6 | -85.5 | -94.7 | 0 | 0 | 0 | 104 | E9 I13 | E9-F11 PolarHBondContact O-N 2.85Å; F11-I13 PolarHBondContact O-N 3.25Å | ||
| 12 | E | 47.8 | Very low | 53.6 | Low | 163 Ų | 163 | 153.2 Ų | 153.2 | 76% | 0.762 | 75% | 0.746 | S | S | * | * | trans | -50.6 | 92.3 | 156.3 | -76.2 | 179.8 | 167.2 | 0 | 0 | 105.2 | E10 K14 | E10-E12 PolarHBondContact O-N 2.67Å; E12-K14 PolarHBondContact O-N 3.44Å | ||
| 13 | I | 52.1 | Low | 55.6 | Low | 148 Ų | 148 | 151 Ų | 151 | 76% | 0.759 | 73% | 0.73 | S | S | * | * | trans | -62.2 | 92.5 | 160.3 | -61.2 | 169.3 | 0 | 0 | 0 | 101.9 | F11 E15 | F11-I13 PolarHBondContact O-N 3.25Å; I13-E15 VanDerWaalsContact C-N 3.26Å; I13-E15 PolarHBondContact O-N 2.99Å | ||
| 14 | K | 50.7 | Low | 57.7 | Low | 183 Ų | 183 | 150.8 Ų | 150.8 | 80% | 0.796 | 72% | 0.718 | S | S | * | * | trans | -52.6 | 103.3 | 168.6 | -76.3 | 178.3 | 177.9 | 175.1 | 0 | 105.1 | E12 E16 | E12-K14 PolarHBondContact O-N 3.44Å; K14-E16 PolarHBondContact O-N 3.49Å; K14-E16 VanDerWaalsContact O-N 3.15Å | ||
| 15 | E | 56.2 | Low | 59.5 | Low | 177 Ų | 177 | 148.4 Ų | 148.4 | 83% | 0.827 | 71% | 0.705 | S | S | * | * | trans | -55.5 | 121.5 | 172.7 | -73 | -179.3 | 155.4 | 0 | 0 | 106.9 | I13 | I13-E15 VanDerWaalsContact C-N 3.26Å; I13-E15 PolarHBondContact O-N 2.99Å | ||
| 16 | E | 54.7 | Low | 61.3 | Low | 142 Ų | 142 | 145.6 Ų | 145.6 | 66% | 0.664 | 69% | 0.689 | S | S | * | * | trans | 68 | 94.9 | 160.1 | -58 | -177.8 | 153.7 | 0 | 0 | 115.6 | K14 P18 K22 | K14-E16 PolarHBondContact O-N 3.49Å; K14-E16 VanDerWaalsContact O-N 3.15Å; E16-P18 WeakPolarHBondContact O-CD 3.27Å; E16-K22 IonicContact OE1-NZ 3.81Å | ||
| 17 | E | 54.9 | Low | 63.3 | Low | 173 Ų | 173 | 143.1 Ų | 143.1 | 81% | 0.808 | 67% | 0.674 | S | S | * | * | trans | -61.8 | 109.3 | 141.4 | -89.7 | -175.7 | 174.1 | 0 | 0 | 107.6 | W19 | E17-W19 PolarHBondContact O-N 3.44Š| ||
| 18 | P | 60 | Low | 65.4 | Low | 103 Ų | 103 | 142.6 Ų | 142.6 | 67% | 0.669 | 67% | 0.668 | S | S | * | * | trans | -76.5 | 24.1 | -173.9 | -15.5 | 33.5 | 0 | 0 | 0 | 113.6 | E16 Y20 | E16-P18 WeakPolarHBondContact O-CD 3.27Å; P18-Y20 PolarHBondContact O-N 2.78Å; P18-Y20 VanDerWaalsContact O-N 3.14Å | ||
| 19 | W | 57.1 | Low | 67.6 | Low | 208 Ų | 208 | 140.9 Ų | 140.9 | 79% | 0.788 | 66% | 0.663 | S | S | * | * | trans | -80.5 | 7 | -164.4 | -73.1 | 85 | 0 | 0 | 0 | 114.7 | E17 | E17-W19 PolarHBondContact O-N 3.44Š| ||
| 20 | Y | 59.5 | Low | 69.8 | Low | 159 Ų | 159 | 138.7 Ų | 138.7 | 62% | 0.624 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -139.7 | 123.6 | 164.3 | -79.7 | -87.9 | 0 | 0 | 0 | 109 | P18 K22 D24 | P18-Y20 PolarHBondContact O-N 2.78Å; P18-Y20 VanDerWaalsContact O-N 3.14Å; Y20-K22 PolarHBondContact O-N 3.47Å; Y20-D24 HydrophobicContact CD1-CB 4.29Å |
| 21 | D | 80.8 | Confident | 72.3 | Confident | 113 Ų | 113 | 135 Ų | 135 | 60% | 0.604 | 64% | 0.639 | S | S | * | * | trans | -57.6 | 136 | 166.5 | -75.3 | -37.4 | 0 | 0 | 0 | 107.7 | Q23 D24 L25 | D21-Q23 PolarHBondContact O-N 2.83Å; D21-D24 WeakPolarHBondContact O-CB 3.44Å; D21-D24 PolarHBondContact O-N 2.91Å; D21-L25 PolarHBondContact O-N 3.16Å | ||
| 22 | K | 81.3 | Confident | 74.7 | Confident | 150 Ų | 150 | 129.8 Ų | 129.8 | 65% | 0.652 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -53 | -30.5 | -178 | -71.8 | 177.3 | 179.5 | 172.7 | 0 | 112.1 | E16 Y20 E26 | E16-K22 IonicContact OE1-NZ 3.81Å; Y20-K22 PolarHBondContact O-N 3.47Å; K22-E26 VanDerWaalsContact O-CG 3.27Å; K22-E26 WeakPolarHBondContact O-CG 3.22Å; K22-E26 PolarHBondContact O-N 2.93Å |
| 23 | Q | 84.3 | Confident | 77 | Confident | 132 Ų | 132 | 125 Ų | 125 | 62% | 0.617 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.4 | -45.7 | 173.6 | -67.2 | 175.2 | 2.1 | 0 | 0 | 111.8 | D21 L25 E26 H27 | D21-Q23 PolarHBondContact O-N 2.83Å; Q23-L25 VanDerWaalsContact C-N 3.32Å; Q23-L25 PolarHBondContact O-N 3.08Å; Q23-E26 WeakPolarHBondContact O-CB 3.36Å; Q23-E26 PolarHBondContact O-N 3.47Å; Q23-E26 VanDerWaalsContact O-N 3.12Å; Q23-H27 PolarHBondContact O-N 3.15Å; Q23-H27 PolarHBondContact O-ND1 2.86Å |
| 24 | D | 87.6 | Confident | 79.1 | Confident | 79 Ų | 79 | 123.9 Ų | 123.9 | 42% | 0.422 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -63.1 | -40 | -179.1 | -66.9 | -19.4 | 0 | 0 | 0 | 111.8 | Y20 D21 E26 H27 D28 | Y20-D24 HydrophobicContact CD1-CB 4.29Å; D21-D24 WeakPolarHBondContact O-CB 3.44Å; D21-D24 PolarHBondContact O-N 2.91Å; D24-E26 VanDerWaalsContact C-N 3.33Å; D24-E26 PolarHBondContact O-N 3.46Å; D24-H27 PolarHBondContact O-N 3.39Å; D24-D28 PolarHBondContact O-N 3.01Å |
| 25 | L | 87.8 | Confident | 81.4 | Confident | 109 Ų | 109 | 120 Ų | 120 | 57% | 0.571 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -62.6 | -39.7 | 173.8 | -177.5 | 64.5 | 0 | 0 | 0 | 112.2 | D21 Q23 L29 | D21-L25 PolarHBondContact O-N 3.16Å; Q23-L25 VanDerWaalsContact C-N 3.32Å; Q23-L25 PolarHBondContact O-N 3.08Å; L25-L29 VanDerWaalsContact O-CB 3.32Å; L25-L29 WeakPolarHBondContact O-CB 3.43Å; L25-L29 PolarHBondContact O-N 3.21Å |
| 26 | E | 88.9 | Confident | 83.3 | Confident | 111 Ų | 111 | 112.9 Ų | 112.9 | 52% | 0.519 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.1 | -40.1 | 175.3 | -73.6 | 168.5 | -173.4 | 0 | 0 | 111.8 | K22 Q23 D24 Q30 | K22-E26 VanDerWaalsContact O-CG 3.27Å; K22-E26 WeakPolarHBondContact O-CG 3.22Å; K22-E26 PolarHBondContact O-N 2.93Å; Q23-E26 WeakPolarHBondContact O-CB 3.36Å; Q23-E26 PolarHBondContact O-N 3.47Å; Q23-E26 VanDerWaalsContact O-N 3.12Å; D24-E26 VanDerWaalsContact C-N 3.33Å; D24-E26 PolarHBondContact O-N 3.46Å; E26-Q30 WeakPolarHBondContact O-CB 3.41Å; E26-Q30 WeakPolarHBondContact O-CG 3.49Å; E26-Q30 PolarHBondContact O-N 3.37Å |
| 27 | H | 91.9 | Very high | 85.4 | Confident | 110 Ų | 110 | 112.3 Ų | 112.3 | 51% | 0.509 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.3 | -43.6 | 176.5 | -70.5 | 89.8 | 0 | 0 | 0 | 111.9 | Q23 D24 L29 Q30 L31 | Q23-H27 PolarHBondContact O-N 3.15Å; Q23-H27 PolarHBondContact O-ND1 2.86Å; D24-H27 PolarHBondContact O-N 3.39Å; H27-L29 VanDerWaalsContact C-N 3.32Å; H27-L29 PolarHBondContact O-N 3.28Å; H27-Q30 WeakPolarHBondContact O-CB 3.5Å; H27-Q30 PolarHBondContact O-N 3.46Å; H27-L31 WeakPolarHBondContact O-CB 3.3Å; H27-L31 PolarHBondContact O-N 2.9Å |
| 28 | D | 94.2 | Very high | 87.4 | Confident | 86 Ų | 86 | 107.2 Ų | 107.2 | 46% | 0.46 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.3 | -37.7 | 177.1 | -77.9 | -19.1 | 0 | 0 | 0 | 111.8 | D24 L31 A32 | D24-D28 PolarHBondContact O-N 3.01Å; D28-L31 PolarHBondContact O-N 3.47Å; D28-A32 WeakPolarHBondContact O-CB 3.21Å; D28-A32 PolarHBondContact O-N 3.27Å |
| 29 | L | 93.6 | Very high | 89.3 | Confident | 124 Ų | 124 | 108 Ų | 108 | 65% | 0.649 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.7 | -40.4 | 174.9 | -170.3 | 120.1 | 0 | 0 | 0 | 111.8 | L25 H27 A32 A33 | L25-L29 VanDerWaalsContact O-CB 3.32Å; L25-L29 WeakPolarHBondContact O-CB 3.43Å; L25-L29 PolarHBondContact O-N 3.21Å; H27-L29 VanDerWaalsContact C-N 3.32Å; H27-L29 PolarHBondContact O-N 3.28Å; L29-A32 PolarHBondContact O-N 2.84Å; L29-A33 WeakPolarHBondContact O-CB 3.47Å; L29-A33 PolarHBondContact O-N 3Å |
| 30 | Q | 94.4 | Very high | 91.2 | Very high | 104 Ų | 104 | 104.1 Ų | 104.1 | 49% | 0.486 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.3 | -46.5 | 173.1 | -73.3 | 167.1 | 16.5 | 0 | 0 | 111.2 | E26 H27 A32 A33 E34 | E26-Q30 WeakPolarHBondContact O-CB 3.41Å; E26-Q30 WeakPolarHBondContact O-CG 3.49Å; E26-Q30 PolarHBondContact O-N 3.37Å; H27-Q30 WeakPolarHBondContact O-CB 3.5Å; H27-Q30 PolarHBondContact O-N 3.46Å; Q30-A32 PolarHBondContact O-N 3.4Å; Q30-A33 WeakPolarHBondContact O-CB 3.27Å; Q30-A33 PolarHBondContact O-N 3.39Å; Q30-A33 VanDerWaalsContact O-N 3.17Å; Q30-E34 WeakPolarHBondContact O-CG 3.31Å; Q30-E34 PolarHBondContact O-N 3.09Å |
| 31 | L | 95.9 | Very high | 93 | Very high | 89 Ų | 89 | 101.1 Ų | 101.1 | 47% | 0.466 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.9 | -43.7 | 177.7 | -177 | 66 | 0 | 0 | 0 | 111.8 | H27 D28 A33 E34 L35 | H27-L31 WeakPolarHBondContact O-CB 3.3Å; H27-L31 PolarHBondContact O-N 2.9Å; D28-L31 PolarHBondContact O-N 3.47Å; L31-A33 VanDerWaalsContact C-N 3.3Å; L31-A33 PolarHBondContact O-N 3.18Å; L31-E34 PolarHBondContact O-N 2.84Å; L31-L35 HydrophobicContact CG-CD1 4.28Å; L31-L35 WeakPolarHBondContact O-CB 3.37Å; L31-L35 WeakPolarHBondContact O-CG 3.41Å; L31-L35 PolarHBondContact O-N 3.39Å |
| 32 | A | 96.1 | Very high | 93.8 | Very high | 63 Ų | 63 | 103.1 Ų | 103.1 | 52% | 0.521 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.8 | -38.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | D28 L29 Q30 G36 | D28-A32 WeakPolarHBondContact O-CB 3.21Å; D28-A32 PolarHBondContact O-N 3.27Å; L29-A32 PolarHBondContact O-N 2.84Å; Q30-A32 PolarHBondContact O-N 3.4Å; A32-G36 PolarHBondContact O-N 2.95Å |
| 33 | A | 95.9 | Very high | 94.6 | Very high | 63 Ų | 63 | 99.9 Ų | 99.9 | 52% | 0.521 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.8 | -40.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L29 Q30 L31 G36 K37 | L29-A33 WeakPolarHBondContact O-CB 3.47Å; L29-A33 PolarHBondContact O-N 3Å; Q30-A33 WeakPolarHBondContact O-CB 3.27Å; Q30-A33 PolarHBondContact O-N 3.39Å; Q30-A33 VanDerWaalsContact O-N 3.17Å; L31-A33 VanDerWaalsContact C-N 3.3Å; L31-A33 PolarHBondContact O-N 3.18Å; A33-G36 PolarHBondContact O-N 2.83Å; A33-K37 VanDerWaalsContact O-CB 3.31Å; A33-K37 WeakPolarHBondContact O-CB 3.39Å; A33-K37 PolarHBondContact O-N 2.94Å |
| 34 | E | 96.6 | Very high | 95.3 | Very high | 123 Ų | 123 | 101.2 Ų | 101.2 | 58% | 0.575 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.5 | -42 | 175.5 | -73.8 | -178.8 | 176.7 | 0 | 0 | 112.2 | Q30 L31 K37 S38 | Q30-E34 WeakPolarHBondContact O-CG 3.31Å; Q30-E34 PolarHBondContact O-N 3.09Å; L31-E34 PolarHBondContact O-N 2.84Å; E34-K37 PolarHBondContact O-N 3.23Å; E34-S38 WeakPolarHBondContact O-CB 3.43Å; E34-S38 PolarHBondContact O-N 2.92Å; E34-S38 PolarHBondContact O-OG 3Å |
| 35 | L | 97.3 | Very high | 95.8 | Very high | 101 Ų | 101 | 103.3 Ų | 103.3 | 53% | 0.529 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.7 | -43.9 | 173.7 | -72.5 | 173 | 0 | 0 | 0 | 111.5 | L31 K37 S38 L39 | L31-L35 HydrophobicContact CG-CD1 4.28Å; L31-L35 WeakPolarHBondContact O-CB 3.37Å; L31-L35 WeakPolarHBondContact O-CG 3.41Å; L31-L35 PolarHBondContact O-N 3.39Å; L35-K37 VanDerWaalsContact C-N 3.33Å; L35-K37 PolarHBondContact O-N 3.12Å; L35-S38 PolarHBondContact O-N 2.81Å; L35-L39 WeakPolarHBondContact O-CB 3.33Å; L35-L39 WeakPolarHBondContact O-CG 3.35Å; L35-L39 PolarHBondContact O-N 3.5Å |
| 36 | G | 97.6 | Very high | 96.3 | Very high | 29 Ų | 29 | 103.2 Ų | 103.2 | 30% | 0.299 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | A32 A33 L39 L40 | A32-G36 PolarHBondContact O-N 2.95Å; A33-G36 PolarHBondContact O-N 2.83Å; G36-L39 PolarHBondContact O-N 3.48Å; G36-L40 WeakPolarHBondContact O-CB 3.45Å; G36-L40 VanDerWaalsContact O-CG 3.28Å; G36-L40 WeakPolarHBondContact O-CG 3.5Å; G36-L40 PolarHBondContact O-N 3.44Å |
| 37 | K | 98 | Very high | 96.7 | Very high | 129 Ų | 129 | 103 Ų | 103 | 56% | 0.561 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.3 | -47.3 | 174.1 | -178.9 | 179.2 | 171.6 | -175 | 0 | 111.7 | A33 E34 L35 L39 L40 E41 | A33-K37 VanDerWaalsContact O-CB 3.31Å; A33-K37 WeakPolarHBondContact O-CB 3.39Å; A33-K37 PolarHBondContact O-N 2.94Å; E34-K37 PolarHBondContact O-N 3.23Å; L35-K37 VanDerWaalsContact C-N 3.33Å; L35-K37 PolarHBondContact O-N 3.12Å; K37-L39 VanDerWaalsContact C-N 3.34Å; K37-L39 PolarHBondContact O-N 3.4Å; K37-L40 PolarHBondContact O-N 3.5Å; K37-E41 WeakPolarHBondContact CE-OE1 3.27Å; K37-E41 HydrophobicContact CG-CG 4.5Å; K37-E41 WeakPolarHBondContact CG-OE1 3.48Å; K37-E41 WeakPolarHBondContact O-CB 3.47Å; K37-E41 VanDerWaalsContact O-CG 3.32Å; K37-E41 WeakPolarHBondContact O-CG 3.29Å; K37-E41 PolarHBondContact O-N 3.39Å |
| 38 | S | 97.4 | Very high | 97 | Very high | 66 Ų | 66 | 100.9 Ų | 100.9 | 46% | 0.462 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.6 | -39.7 | 178.9 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | E34 L35 E41 R42 | E34-S38 WeakPolarHBondContact O-CB 3.43Å; E34-S38 PolarHBondContact O-N 2.92Å; E34-S38 PolarHBondContact O-OG 3Å; L35-S38 PolarHBondContact O-N 2.81Å; S38-E41 PolarHBondContact O-N 3.2Å; S38-R42 WeakPolarHBondContact O-CB 3.28Å; S38-R42 PolarHBondContact O-N 3.32Å |
| 39 | L | 98.3 | Very high | 97.2 | Very high | 120 Ų | 120 | 98.1 Ų | 98.1 | 63% | 0.628 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.5 | -40.9 | 176 | -73.8 | 173.9 | 0 | 0 | 0 | 111.9 | L35 G36 K37 R42 N43 | L35-L39 WeakPolarHBondContact O-CB 3.33Å; L35-L39 WeakPolarHBondContact O-CG 3.35Å; L35-L39 PolarHBondContact O-N 3.5Å; G36-L39 PolarHBondContact O-N 3.48Å; K37-L39 VanDerWaalsContact C-N 3.34Å; K37-L39 PolarHBondContact O-N 3.4Å; L39-R42 PolarHBondContact O-N 3.03Å; L39-N43 VanDerWaalsContact O-CB 3.27Å; L39-N43 WeakPolarHBondContact O-CB 3.5Å; L39-N43 PolarHBondContact O-N 3.47Å |
| 40 | L | 98.3 | Very high | 97.4 | Very high | 127 Ų | 127 | 96.8 Ų | 96.8 | 67% | 0.665 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.4 | -41.7 | 175 | -73 | 172.1 | 0 | 0 | 0 | 111.7 | G36 K37 N43 R44 | G36-L40 WeakPolarHBondContact O-CB 3.45Å; G36-L40 VanDerWaalsContact O-CG 3.28Å; G36-L40 WeakPolarHBondContact O-CG 3.5Å; G36-L40 PolarHBondContact O-N 3.44Å; K37-L40 PolarHBondContact O-N 3.5Å; L40-N43 PolarHBondContact O-N 3.4Å; L40-R44 VanDerWaalsContact O-CB 3.27Å; L40-R44 WeakPolarHBondContact O-CB 3.31Å; L40-R44 PolarHBondContact O-N 2.91Å |
| 41 | E | 97.7 | Very high | 97.6 | Very high | 95 Ų | 95 | 97.7 Ų | 97.7 | 44% | 0.444 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 174.6 | -75.4 | 171.6 | -179.7 | 0 | 0 | 110.9 | K37 S38 N43 R44 E45 | K37-E41 WeakPolarHBondContact CE-OE1 3.27Å; K37-E41 HydrophobicContact CG-CG 4.5Å; K37-E41 WeakPolarHBondContact CG-OE1 3.48Å; K37-E41 WeakPolarHBondContact O-CB 3.47Å; K37-E41 VanDerWaalsContact O-CG 3.32Å; K37-E41 WeakPolarHBondContact O-CG 3.29Å; K37-E41 PolarHBondContact O-N 3.39Å; S38-E41 PolarHBondContact O-N 3.2Å; E41-N43 VanDerWaalsContact C-N 3.34Å; E41-N43 PolarHBondContact O-N 3.46Å; E41-R44 PolarHBondContact O-N 3.04Å; E41-E45 WeakPolarHBondContact O-CG 3.49Å; E41-E45 PolarHBondContact O-N 2.98Å |
| 42 | R | 97.7 | Very high | 97.7 | Very high | 156 Ų | 156 | 99.3 Ų | 99.3 | 59% | 0.589 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.2 | -40.8 | 175.5 | -175.7 | 177 | -179.4 | 78.3 | 1 | 112.4 | S38 L39 E45 L46 | S38-R42 WeakPolarHBondContact O-CB 3.28Å; S38-R42 PolarHBondContact O-N 3.32Å; L39-R42 PolarHBondContact O-N 3.03Å; R42-E45 PolarHBondContact O-N 2.9Å; R42-L46 HydrophobicContact CG-CD1 4.45Å; R42-L46 VanDerWaalsContact O-CG 3.31Å; R42-L46 WeakPolarHBondContact O-CG 3.28Å; R42-L46 PolarHBondContact O-N 3.25Å |
| 43 | N | 98 | Very high | 97.8 | Very high | 82 Ų | 82 | 102.4 Ų | 102.4 | 44% | 0.439 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.5 | -45.5 | 177.8 | -167.3 | -81.3 | 0 | 0 | 0 | 110.7 | L39 L40 E41 E45 L46 E47 | L39-N43 VanDerWaalsContact O-CB 3.27Å; L39-N43 WeakPolarHBondContact O-CB 3.5Å; L39-N43 PolarHBondContact O-N 3.47Å; L40-N43 PolarHBondContact O-N 3.4Å; E41-N43 VanDerWaalsContact C-N 3.34Å; E41-N43 PolarHBondContact O-N 3.46Å; N43-E45 VanDerWaalsContact C-N 3.33Å; N43-E45 PolarHBondContact O-N 3.07Å; N43-L46 WeakPolarHBondContact O-CB 3.4Å; N43-L46 PolarHBondContact O-N 2.68Å; N43-L46 VanDerWaalsContact O-N 3.12Å; N43-E47 WeakPolarHBondContact O-CG 3.46Å; N43-E47 PolarHBondContact O-N 2.97Å; N43-E47 PolarHBondContact OD1-OE1 3.23Å |
| 44 | R | 98.1 | Very high | 97.9 | Very high | 159 Ų | 159 | 107 Ų | 107 | 60% | 0.6 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.7 | -37.6 | 174.8 | 170.9 | 177 | 160.8 | 80.7 | 5.1 | 112.7 | L40 E41 Q48 | L40-R44 VanDerWaalsContact O-CB 3.27Å; L40-R44 WeakPolarHBondContact O-CB 3.31Å; L40-R44 PolarHBondContact O-N 2.91Å; E41-R44 PolarHBondContact O-N 3.04Å; R44-Q48 WeakPolarHBondContact O-CB 3.46Å; R44-Q48 VanDerWaalsContact O-CG 3.27Å; R44-Q48 WeakPolarHBondContact O-CG 3.37Å; R44-Q48 PolarHBondContact O-N 3.24Å; R44-Q48 PolarHBondContact O-NE2 2.96Å |
| 45 | E | 98.2 | Very high | 98 | Very high | 124 Ų | 124 | 103.6 Ų | 103.6 | 58% | 0.579 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -42.1 | 173.5 | -74.6 | 173.8 | 177.6 | 0 | 0 | 111.9 | E41 R42 N43 Q48 G49 | E41-E45 WeakPolarHBondContact O-CG 3.49Å; E41-E45 PolarHBondContact O-N 2.98Å; R42-E45 PolarHBondContact O-N 2.9Å; N43-E45 VanDerWaalsContact C-N 3.33Å; N43-E45 PolarHBondContact O-N 3.07Å; E45-Q48 PolarHBondContact O-N 3.31Å; E45-G49 PolarHBondContact O-N 2.83Å |
| 46 | L | 98.2 | Very high | 98 | Very high | 107 Ų | 107 | 101.2 Ų | 101.2 | 56% | 0.56 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.6 | -42.7 | 176.2 | -70.2 | 171.6 | 0 | 0 | 0 | 111.7 | R42 N43 G49 L50 | R42-L46 HydrophobicContact CG-CD1 4.45Å; R42-L46 VanDerWaalsContact O-CG 3.31Å; R42-L46 WeakPolarHBondContact O-CG 3.28Å; R42-L46 PolarHBondContact O-N 3.25Å; N43-L46 WeakPolarHBondContact O-CB 3.4Å; N43-L46 PolarHBondContact O-N 2.68Å; N43-L46 VanDerWaalsContact O-N 3.12Å; L46-G49 PolarHBondContact O-N 3.24Å; L46-L50 VanDerWaalsContact O-CB 3.32Å; L46-L50 WeakPolarHBondContact O-CB 3.49Å; L46-L50 PolarHBondContact O-N 2.98Å |
| 47 | E | 97.8 | Very high | 98.1 | Very high | 105 Ų | 105 | 103.6 Ų | 103.6 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.6 | -44.5 | 174.6 | -72.2 | 177 | 160.2 | 0 | 0 | 111.6 | N43 L50 Q51 | N43-E47 WeakPolarHBondContact O-CG 3.46Å; N43-E47 PolarHBondContact O-N 2.97Å; N43-E47 PolarHBondContact OD1-OE1 3.23Å; E47-L50 PolarHBondContact O-N 3.29Å; E47-Q51 WeakPolarHBondContact O-CB 3.39Å; E47-Q51 VanDerWaalsContact O-CG 3.3Å; E47-Q51 WeakPolarHBondContact O-CG 3.4Å; E47-Q51 PolarHBondContact O-N 3.43Å |
| 48 | Q | 98.1 | Very high | 98.1 | Very high | 66 Ų | 66 | 103.1 Ų | 103.1 | 31% | 0.308 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 175.2 | -75.7 | 170.1 | 38.2 | 0 | 0 | 112 | R44 E45 L50 Q51 Q52 | R44-Q48 WeakPolarHBondContact O-CB 3.46Å; R44-Q48 VanDerWaalsContact O-CG 3.27Å; R44-Q48 WeakPolarHBondContact O-CG 3.37Å; R44-Q48 PolarHBondContact O-N 3.24Å; R44-Q48 PolarHBondContact O-NE2 2.96Å; E45-Q48 PolarHBondContact O-N 3.31Å; Q48-L50 VanDerWaalsContact C-N 3.3Å; Q48-L50 PolarHBondContact O-N 3.05Å; Q48-Q51 PolarHBondContact O-N 3.03Å; Q48-Q52 WeakPolarHBondContact O-CB 3.44Å; Q48-Q52 VanDerWaalsContact O-CG 3.27Å; Q48-Q52 WeakPolarHBondContact O-CG 3.33Å; Q48-Q52 PolarHBondContact O-N 3.42Å |
| 49 | G | 98.1 | Very high | 98.1 | Very high | 29 Ų | 29 | 105.9 Ų | 105.9 | 30% | 0.299 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.7 | -40.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | E45 L46 Q52 M53 | E45-G49 PolarHBondContact O-N 2.83Å; L46-G49 PolarHBondContact O-N 3.24Å; G49-Q52 PolarHBondContact O-N 3.26Å; G49-M53 WeakPolarHBondContact O-CB 3.36Å; G49-M53 WeakPolarHBondContact O-CG 3.49Å; G49-M53 PolarHBondContact O-N 3.23Å |
| 50 | L | 98.1 | Very high | 98.1 | Very high | 95 Ų | 95 | 105.3 Ų | 105.3 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.9 | -43.4 | 175.6 | 173.7 | 141.2 | 0 | 0 | 0 | 111.8 | L46 E47 Q48 Q52 M53 Y54 | L46-L50 VanDerWaalsContact O-CB 3.32Å; L46-L50 WeakPolarHBondContact O-CB 3.49Å; L46-L50 PolarHBondContact O-N 2.98Å; E47-L50 PolarHBondContact O-N 3.29Å; Q48-L50 VanDerWaalsContact C-N 3.3Å; Q48-L50 PolarHBondContact O-N 3.05Å; L50-Q52 VanDerWaalsContact C-N 3.35Å; L50-Q52 PolarHBondContact O-N 2.94Å; L50-M53 WeakPolarHBondContact O-CB 3.23Å; L50-M53 PolarHBondContact O-N 3.5Å; L50-Y54 HydrophobicContact CD1-CE2 4.14Å; L50-Y54 HydrophobicContact CD2-CD2 3.64Å; L50-Y54 HydrophobicContact CD2-CE2 3.41Å; L50-Y54 VanDerWaalsContact CD2-CE2 3.41Å; L50-Y54 HydrophobicContact CG-CD2 3.86Å; L50-Y54 HydrophobicContact CG-CE2 3.55Å; L50-Y54 WeakPolarHBondContact O-CD2 3.21Å; L50-Y54 PolarHBondContact O-N 2.89Å |
| 51 | Q | 98.1 | Very high | 98.1 | Very high | 123 Ų | 123 | 103.5 Ų | 103.5 | 58% | 0.575 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.9 | -42.7 | 173.7 | -74.2 | 171.7 | 0.2 | 0 | 0 | 112 | E47 Q48 Y54 S55 | E47-Q51 WeakPolarHBondContact O-CB 3.39Å; E47-Q51 VanDerWaalsContact O-CG 3.3Å; E47-Q51 WeakPolarHBondContact O-CG 3.4Å; E47-Q51 PolarHBondContact O-N 3.43Å; Q48-Q51 PolarHBondContact O-N 3.03Å; Q51-Y54 PolarHBondContact O-N 3.1Å; Q51-S55 PolarHBondContact O-N 3.4Å; Q51-S55 PolarHBondContact O-OG 2.97Å |
| 52 | Q | 98.3 | Very high | 98.1 | Very high | 123 Ų | 123 | 104.3 Ų | 104.3 | 58% | 0.575 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.6 | -46.6 | 174 | -73.1 | 170.2 | 16.6 | 0 | 0 | 111 | Q48 G49 L50 Y54 S55 T56 | Q48-Q52 WeakPolarHBondContact O-CB 3.44Å; Q48-Q52 VanDerWaalsContact O-CG 3.27Å; Q48-Q52 WeakPolarHBondContact O-CG 3.33Å; Q48-Q52 PolarHBondContact O-N 3.42Å; G49-Q52 PolarHBondContact O-N 3.26Å; L50-Q52 VanDerWaalsContact C-N 3.35Å; L50-Q52 PolarHBondContact O-N 2.94Å; Q52-Y54 VanDerWaalsContact C-N 3.33Å; Q52-Y54 PolarHBondContact O-N 2.94Å; Q52-S55 WeakPolarHBondContact CA-OG 3.34Å; Q52-S55 PolarHBondContact O-N 2.73Å; Q52-S55 PolarHBondContact O-OG 2.82Å; Q52-T56 WeakPolarHBondContact O-CG2 3.47Å; Q52-T56 PolarHBondContact O-N 2.91Å; Q52-T56 PolarHBondContact O-OG1 3.38Å |
| 53 | M | 97.6 | Very high | 98.1 | Very high | 128 Ų | 128 | 102.5 Ų | 102.5 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.3 | -42.2 | 174.9 | -76.9 | -61.8 | -54.6 | 0 | 0 | 112.3 | G49 L50 T56 N57 | G49-M53 WeakPolarHBondContact O-CB 3.36Å; G49-M53 WeakPolarHBondContact O-CG 3.49Å; G49-M53 PolarHBondContact O-N 3.23Å; L50-M53 WeakPolarHBondContact O-CB 3.23Å; L50-M53 PolarHBondContact O-N 3.5Å; M53-T56 WeakPolarHBondContact CA-OG1 3.29Å; M53-T56 PolarHBondContact O-OG1 3.47Å; M53-N57 VanDerWaalsContact O-CB 3.25Å; M53-N57 WeakPolarHBondContact O-CB 3.41Å; M53-N57 PolarHBondContact O-N 3.49Å |
| 54 | Y | 98.3 | Very high | 98.2 | Very high | 160 Ų | 160 | 103.3 Ų | 103.3 | 63% | 0.627 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -43.3 | 174.7 | -81.3 | -65.2 | 0 | 0 | 0 | 112.6 | L50 Q51 Q52 N57 Q58 | L50-Y54 HydrophobicContact CD1-CE2 4.14Å; L50-Y54 HydrophobicContact CD2-CD2 3.64Å; L50-Y54 HydrophobicContact CD2-CE2 3.41Å; L50-Y54 VanDerWaalsContact CD2-CE2 3.41Å; L50-Y54 HydrophobicContact CG-CD2 3.86Å; L50-Y54 HydrophobicContact CG-CE2 3.55Å; L50-Y54 WeakPolarHBondContact O-CD2 3.21Å; L50-Y54 PolarHBondContact O-N 2.89Å; Q51-Y54 PolarHBondContact O-N 3.1Å; Q52-Y54 VanDerWaalsContact C-N 3.33Å; Q52-Y54 PolarHBondContact O-N 2.94Å; Y54-N57 PolarHBondContact O-N 3.32Å; Y54-Q58 WeakPolarHBondContact O-CB 3.47Å; Y54-Q58 PolarHBondContact O-N 3.16Å |
| 55 | S | 98.2 | Very high | 98.2 | Very high | 52 Ų | 52 | 101 Ų | 101 | 36% | 0.364 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.1 | -47.1 | 177.9 | 64 | 0 | 0 | 0 | 0 | 112.2 | Q51 Q52 N57 Q58 E59 | Q51-S55 PolarHBondContact O-N 3.4Å; Q51-S55 PolarHBondContact O-OG 2.97Å; Q52-S55 WeakPolarHBondContact CA-OG 3.34Å; Q52-S55 PolarHBondContact O-N 2.73Å; Q52-S55 PolarHBondContact O-OG 2.82Å; S55-N57 VanDerWaalsContact C-N 3.33Å; S55-N57 PolarHBondContact O-N 3.42Å; S55-Q58 WeakPolarHBondContact O-CB 3.48Å; S55-Q58 PolarHBondContact O-N 3.31Å; S55-E59 WeakPolarHBondContact O-CG 3.43Å; S55-E59 PolarHBondContact O-N 3.12Å |
| 56 | T | 98.3 | Very high | 98.2 | Very high | 51 Ų | 51 | 102.4 Ų | 102.4 | 31% | 0.313 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65 | -37 | 177.7 | 57.9 | 0 | 0 | 0 | 0 | 112.1 | Q52 M53 E59 Q60 | Q52-T56 WeakPolarHBondContact O-CG2 3.47Å; Q52-T56 PolarHBondContact O-N 2.91Å; Q52-T56 PolarHBondContact O-OG1 3.38Å; M53-T56 WeakPolarHBondContact CA-OG1 3.29Å; M53-T56 PolarHBondContact O-OG1 3.47Å; T56-E59 PolarHBondContact O-N 3.41Å; T56-Q60 VanDerWaalsContact O-CG 3.27Å; T56-Q60 WeakPolarHBondContact O-CG 3.36Å; T56-Q60 PolarHBondContact O-N 3.18Å |
| 57 | N | 98.4 | Very high | 98.2 | Very high | 78 Ų | 78 | 101.1 Ų | 101.1 | 42% | 0.417 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.5 | -41.2 | 174.8 | -172.3 | -93.5 | 0 | 0 | 0 | 111.5 | M53 Y54 S55 Q60 L61 | M53-N57 VanDerWaalsContact O-CB 3.25Å; M53-N57 WeakPolarHBondContact O-CB 3.41Å; M53-N57 PolarHBondContact O-N 3.49Å; Y54-N57 PolarHBondContact O-N 3.32Å; S55-N57 VanDerWaalsContact C-N 3.33Å; S55-N57 PolarHBondContact O-N 3.42Å; N57-Q60 PolarHBondContact O-N 2.86Å; N57-L61 WeakPolarHBondContact O-CG 3.46Å; N57-L61 PolarHBondContact O-N 2.86Å |
| 58 | Q | 98.4 | Very high | 98.2 | Very high | 120 Ų | 120 | 99.4 Ų | 99.4 | 56% | 0.561 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.4 | -42 | 176.1 | -172.4 | 176.7 | 11.2 | 0 | 0 | 112.1 | Y54 S55 L61 Q62 | Y54-Q58 WeakPolarHBondContact O-CB 3.47Å; Y54-Q58 PolarHBondContact O-N 3.16Å; S55-Q58 WeakPolarHBondContact O-CB 3.48Å; S55-Q58 PolarHBondContact O-N 3.31Å; Q58-L61 PolarHBondContact O-N 3.49Å; Q58-Q62 WeakPolarHBondContact O-CG 3.31Å; Q58-Q62 PolarHBondContact O-N 2.69Å; Q58-Q62 VanDerWaalsContact O-N 3.09Å |
| 59 | E | 97.9 | Very high | 98.2 | Very high | 123 Ų | 123 | 102.7 Ų | 102.7 | 58% | 0.575 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.5 | -44.1 | 174.3 | -70.2 | 170.8 | -179.7 | 0 | 0 | 111.6 | S55 T56 L61 Q62 E63 | S55-E59 WeakPolarHBondContact O-CG 3.43Å; S55-E59 PolarHBondContact O-N 3.12Å; T56-E59 PolarHBondContact O-N 3.41Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 3.33Å; E59-Q62 WeakPolarHBondContact O-CB 3.37Å; E59-Q62 PolarHBondContact O-N 3.15Å; E59-E63 PolarHBondContact O-N 3.24Å |
| 60 | Q | 98.1 | Very high | 98.3 | Very high | 108 Ų | 108 | 105.7 Ų | 105.7 | 51% | 0.505 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.5 | -39.6 | 175.9 | -73.9 | 172.4 | -2.2 | 0 | 0 | 112.4 | T56 N57 Q62 E63 I64 | T56-Q60 VanDerWaalsContact O-CG 3.27Å; T56-Q60 WeakPolarHBondContact O-CG 3.36Å; T56-Q60 PolarHBondContact O-N 3.18Å; N57-Q60 PolarHBondContact O-N 2.86Å; Q60-Q62 VanDerWaalsContact C-N 3.34Å; Q60-E63 PolarHBondContact O-N 3.33Å; Q60-I64 VanDerWaalsContact O-CG1 3.25Å; Q60-I64 WeakPolarHBondContact O-CG1 3.27Å; Q60-I64 PolarHBondContact O-N 3.05Å |
| 61 | L | 98.4 | Very high | 98.3 | Very high | 90 Ų | 90 | 104.7 Ų | 104.7 | 47% | 0.471 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.9 | -42.2 | 175.3 | -71.8 | 172.1 | 0 | 0 | 0 | 111.4 | N57 Q58 E59 E63 I64 E65 | N57-L61 WeakPolarHBondContact O-CG 3.46Å; N57-L61 PolarHBondContact O-N 2.86Å; Q58-L61 PolarHBondContact O-N 3.49Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 3.33Å; L61-E63 VanDerWaalsContact C-N 3.34Å; L61-E63 PolarHBondContact O-N 3.07Å; L61-I64 PolarHBondContact O-N 3.48Å; L61-E65 WeakPolarHBondContact O-CG 3.48Å; L61-E65 PolarHBondContact O-N 2.92Å |
| 62 | Q | 98.2 | Very high | 98.3 | Very high | 111 Ų | 111 | 102.9 Ų | 102.9 | 52% | 0.519 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.5 | -39.3 | 175.8 | -68.1 | 171.8 | 5 | 0 | 0 | 112.1 | Q58 E59 Q60 E65 Y66 | Q58-Q62 WeakPolarHBondContact O-CG 3.31Å; Q58-Q62 PolarHBondContact O-N 2.69Å; Q58-Q62 VanDerWaalsContact O-N 3.09Å; E59-Q62 WeakPolarHBondContact O-CB 3.37Å; E59-Q62 PolarHBondContact O-N 3.15Å; Q60-Q62 VanDerWaalsContact C-N 3.34Å; Q62-E65 PolarHBondContact O-N 3.49Å; Q62-Y66 PolarHBondContact O-N 3.39Å |
| 63 | E | 98.3 | Very high | 98.3 | Very high | 118 Ų | 118 | 101.7 Ų | 101.7 | 55% | 0.551 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.6 | -45.9 | 174.7 | -175.1 | 179.3 | -175 | 0 | 0 | 111.4 | E59 Q60 L61 E65 Y66 L67 | E59-E63 PolarHBondContact O-N 3.24Å; Q60-E63 PolarHBondContact O-N 3.33Å; L61-E63 VanDerWaalsContact C-N 3.34Å; L61-E63 PolarHBondContact O-N 3.07Å; E63-E65 VanDerWaalsContact C-N 3.29Å; E63-E65 PolarHBondContact O-N 2.98Å; E63-Y66 PolarHBondContact O-N 3.41Å; E63-L67 HydrophobicContact CG-CD1 3.99Å; E63-L67 HydrophobicContact CG-CG 4.36Å; E63-L67 WeakPolarHBondContact O-CB 3.5Å; E63-L67 WeakPolarHBondContact O-CG 3.31Å; E63-L67 PolarHBondContact O-N 3.17Å |
| 64 | I | 98.1 | Very high | 98.3 | Very high | 99 Ų | 99 | 100.9 Ų | 100.9 | 51% | 0.508 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.3 | -44.2 | 176.3 | -69.6 | 164.3 | 0 | 0 | 0 | 110.4 | Q60 L61 L67 T68 | Q60-I64 VanDerWaalsContact O-CG1 3.25Å; Q60-I64 WeakPolarHBondContact O-CG1 3.27Å; Q60-I64 PolarHBondContact O-N 3.05Å; L61-I64 PolarHBondContact O-N 3.48Å; I64-L67 PolarHBondContact O-N 3.29Å; I64-T68 VanDerWaalsContact O-CB 3.29Å; I64-T68 WeakPolarHBondContact O-CB 3.41Å; I64-T68 PolarHBondContact O-N 3.49Å; I64-T68 PolarHBondContact O-OG1 3.37Å |
| 65 | E | 98.4 | Very high | 98.3 | Very high | 110 Ų | 110 | 101.1 Ų | 101.1 | 51% | 0.514 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.8 | -42.5 | 176.8 | -74.8 | 179.7 | -164.3 | 0 | 0 | 112.5 | L61 Q62 E63 T68 K69 | L61-E65 WeakPolarHBondContact O-CG 3.48Å; L61-E65 PolarHBondContact O-N 2.92Å; Q62-E65 PolarHBondContact O-N 3.49Å; E63-E65 VanDerWaalsContact C-N 3.29Å; E63-E65 PolarHBondContact O-N 2.98Å; E65-T68 PolarHBondContact O-N 2.85Å; E65-K69 VanDerWaalsContact O-CG 3.3Å; E65-K69 WeakPolarHBondContact O-CG 3.49Å; E65-K69 PolarHBondContact O-N 3.07Å |
| 66 | Y | 98.4 | Very high | 98.3 | Very high | 154 Ų | 154 | 103.7 Ų | 103.7 | 60% | 0.604 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63 | -48.2 | 177.3 | 177.5 | -95.1 | 0 | 0 | 0 | 111.5 | Q62 E63 T68 K69 Q70 | Q62-Y66 PolarHBondContact O-N 3.39Å; E63-Y66 PolarHBondContact O-N 3.41Å; Y66-T68 VanDerWaalsContact C-N 3.3Å; Y66-T68 PolarHBondContact O-N 3.46Å; Y66-K69 PolarHBondContact O-N 2.84Å; Y66-Q70 PolarHBondContact O-N 3.27Å |
| 67 | L | 98.6 | Very high | 98.3 | Very high | 80 Ų | 80 | 103.6 Ų | 103.6 | 42% | 0.419 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.1 | -38.4 | 177.7 | -68.9 | 174.9 | 0 | 0 | 0 | 111.5 | E63 I64 Q70 V71 | E63-L67 HydrophobicContact CG-CD1 3.99Å; E63-L67 HydrophobicContact CG-CG 4.36Å; E63-L67 WeakPolarHBondContact O-CB 3.5Å; E63-L67 WeakPolarHBondContact O-CG 3.31Å; E63-L67 PolarHBondContact O-N 3.17Å; I64-L67 PolarHBondContact O-N 3.29Å; L67-Q70 PolarHBondContact O-N 3.42Å; L67-V71 WeakPolarHBondContact O-CG2 3.25Å; L67-V71 PolarHBondContact O-N 2.93Å |
| 68 | T | 98.4 | Very high | 98.3 | Very high | 69 Ų | 69 | 105 Ų | 105 | 42% | 0.423 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61 | -48.9 | 175.2 | -58 | 0 | 0 | 0 | 0 | 110.7 | I64 E65 Y66 Q70 V71 D72 | I64-T68 VanDerWaalsContact O-CB 3.29Å; I64-T68 WeakPolarHBondContact O-CB 3.41Å; I64-T68 PolarHBondContact O-N 3.49Å; I64-T68 PolarHBondContact O-OG1 3.37Å; E65-T68 PolarHBondContact O-N 2.85Å; Y66-T68 VanDerWaalsContact C-N 3.3Å; Y66-T68 PolarHBondContact O-N 3.46Å; T68-Q70 VanDerWaalsContact C-N 3.29Å; T68-Q70 PolarHBondContact O-N 2.89Å; T68-V71 PolarHBondContact O-N 3.37Å; T68-V71 VanDerWaalsContact O-N 3.14Å; T68-D72 PolarHBondContact O-N 2.81Å |
| 69 | K | 98.5 | Very high | 98.3 | Very high | 136 Ų | 136 | 104 Ų | 104 | 59% | 0.591 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.4 | -39.2 | 175.9 | -71.1 | 166.4 | -175.1 | 163.5 | 0 | 112.1 | E65 Y66 D72 L73 | E65-K69 VanDerWaalsContact O-CG 3.3Å; E65-K69 WeakPolarHBondContact O-CG 3.49Å; E65-K69 PolarHBondContact O-N 3.07Å; Y66-K69 PolarHBondContact O-N 2.84Å; K69-D72 PolarHBondContact O-N 2.86Å; K69-L73 PolarHBondContact O-N 3.3Å |
| 70 | Q | 98.4 | Very high | 98.3 | Very high | 91 Ų | 91 | 102.6 Ų | 102.6 | 43% | 0.425 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.8 | -41.9 | 176.6 | -171.8 | 178.4 | 7.4 | 0 | 0 | 111.7 | Y66 L67 T68 L73 L74 | Y66-Q70 PolarHBondContact O-N 3.27Å; L67-Q70 PolarHBondContact O-N 3.42Å; T68-Q70 VanDerWaalsContact C-N 3.29Å; T68-Q70 PolarHBondContact O-N 2.89Å; Q70-L73 PolarHBondContact O-N 3.39Å; Q70-L74 WeakPolarHBondContact O-CG 3.43Å; Q70-L74 PolarHBondContact O-N 2.85Å |
| 71 | V | 98.4 | Very high | 98.3 | Very high | 75 Ų | 75 | 102.1 Ų | 102.1 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 176 | 170 | 0 | 0 | 0 | 0 | 111.4 | L67 T68 L74 R75 | L67-V71 WeakPolarHBondContact O-CG2 3.25Å; L67-V71 PolarHBondContact O-N 2.93Å; T68-V71 PolarHBondContact O-N 3.37Å; T68-V71 VanDerWaalsContact O-N 3.14Å; V71-L74 PolarHBondContact O-N 3.22Å; V71-R75 WeakPolarHBondContact O-CG 3.33Å; V71-R75 PolarHBondContact O-N 3.25Å |
| 72 | D | 98.3 | Very high | 98.3 | Very high | 84 Ų | 84 | 99.7 Ų | 99.7 | 45% | 0.449 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -40.1 | 177 | -70.6 | -27.7 | 0 | 0 | 0 | 111.9 | T68 K69 R75 Q76 | T68-D72 PolarHBondContact O-N 2.81Å; K69-D72 PolarHBondContact O-N 2.86Å; D72-R75 WeakPolarHBondContact O-CB 3.46Å; D72-R75 PolarHBondContact O-N 2.84Å; D72-Q76 PolarHBondContact O-N 2.94Å |
| 73 | L | 98.4 | Very high | 98.3 | Very high | 99 Ų | 99 | 101 Ų | 101 | 52% | 0.518 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 173.3 | -178.8 | 62.5 | 0 | 0 | 0 | 111.6 | K69 Q70 R75 Q76 V77 | K69-L73 PolarHBondContact O-N 3.3Å; Q70-L73 PolarHBondContact O-N 3.39Å; L73-R75 VanDerWaalsContact C-N 3.29Å; L73-R75 PolarHBondContact O-N 3.36Å; L73-Q76 PolarHBondContact O-N 3.48Å; L73-V77 WeakPolarHBondContact O-CG2 3.16Å; L73-V77 PolarHBondContact O-N 3.49Å |
| 74 | L | 98.4 | Very high | 98.4 | Very high | 110 Ų | 110 | 99.4 Ų | 99.4 | 58% | 0.576 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.2 | -38 | 175.7 | -72.7 | 172.7 | 0 | 0 | 0 | 111.9 | Q70 V71 V77 N78 | Q70-L74 WeakPolarHBondContact O-CG 3.43Å; Q70-L74 PolarHBondContact O-N 2.85Å; V71-L74 PolarHBondContact O-N 3.22Å; L74-V77 PolarHBondContact O-N 2.86Å; L74-N78 WeakPolarHBondContact O-CB 3.1Å; L74-N78 PolarHBondContact O-N 2.9Å |
| 75 | R | 98.5 | Very high | 98.4 | Very high | 165 Ų | 165 | 102 Ų | 102 | 62% | 0.623 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.1 | -47.4 | 172.3 | -76.4 | 176.1 | 161.2 | -159.4 | -6.1 | 111.5 | V71 D72 L73 V77 N78 D79 | V71-R75 WeakPolarHBondContact O-CG 3.33Å; V71-R75 PolarHBondContact O-N 3.25Å; D72-R75 WeakPolarHBondContact O-CB 3.46Å; D72-R75 PolarHBondContact O-N 2.84Å; L73-R75 VanDerWaalsContact C-N 3.29Å; L73-R75 PolarHBondContact O-N 3.36Å; R75-V77 VanDerWaalsContact C-N 3.34Å; R75-V77 PolarHBondContact O-N 2.88Å; R75-N78 WeakPolarHBondContact O-CB 3.49Å; R75-N78 PolarHBondContact O-N 3.46Å; R75-N78 VanDerWaalsContact O-N 3.14Å; R75-D79 VanDerWaalsContact O-CG 3.32Å; R75-D79 PolarHBondContact O-N 2.99Å |
| 76 | Q | 98.2 | Very high | 98.4 | Very high | 106 Ų | 106 | 103 Ų | 103 | 50% | 0.495 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.5 | -43.2 | 177.8 | -174.2 | -176.9 | 14.5 | 0 | 0 | 112.4 | D72 L73 N78 D79 Q80 | D72-Q76 PolarHBondContact O-N 2.94Å; L73-Q76 PolarHBondContact O-N 3.48Å; Q76-N78 VanDerWaalsContact C-N 3.34Å; Q76-D79 PolarHBondContact O-N 3.03Å; Q76-Q80 VanDerWaalsContact O-CG 3.29Å; Q76-Q80 WeakPolarHBondContact O-CG 3.36Å; Q76-Q80 PolarHBondContact O-N 3.06Å |
| 77 | V | 98.3 | Very high | 98.4 | Very high | 50 Ų | 50 | 101.9 Ų | 101.9 | 30% | 0.303 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 176.2 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | L73 L74 R75 Q80 H81 | L73-V77 WeakPolarHBondContact O-CG2 3.16Å; L73-V77 PolarHBondContact O-N 3.49Å; L74-V77 PolarHBondContact O-N 2.86Å; R75-V77 VanDerWaalsContact C-N 3.34Å; R75-V77 PolarHBondContact O-N 2.88Å; V77-Q80 WeakPolarHBondContact O-CB 3.37Å; V77-Q80 PolarHBondContact O-N 3.36Å; V77-H81 WeakPolarHBondContact CG1-NE2 3.31Å; V77-H81 PolarHBondContact O-CD2 2.92Å; V77-H81 VanDerWaalsContact O-CD2 3.3Å; V77-H81 VanDerWaalsContact O-CG 3.29Å; V77-H81 PolarHBondContact O-N 3.36Å |
| 78 | N | 98.1 | Very high | 98.4 | Very high | 107 Ų | 107 | 102.8 Ų | 102.8 | 57% | 0.572 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.6 | -43.1 | 176 | -165.7 | 3.9 | 0 | 0 | 0 | 111.9 | L74 R75 Q76 Q80 H81 A82 | L74-N78 WeakPolarHBondContact O-CB 3.1Å; L74-N78 PolarHBondContact O-N 2.9Å; R75-N78 WeakPolarHBondContact O-CB 3.49Å; R75-N78 PolarHBondContact O-N 3.46Å; R75-N78 VanDerWaalsContact O-N 3.14Å; Q76-N78 VanDerWaalsContact C-N 3.34Å; N78-Q80 VanDerWaalsContact C-N 3.29Å; N78-Q80 PolarHBondContact O-N 2.88Å; N78-H81 WeakPolarHBondContact O-CB 3.19Å; N78-H81 PolarHBondContact O-N 3.42Å; N78-H81 VanDerWaalsContact O-N 3.14Å; N78-A82 PolarHBondContact O-N 3.45Å |
| 79 | D | 98.3 | Very high | 98.4 | Very high | 99 Ų | 99 | 103.4 Ų | 103.4 | 53% | 0.529 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -37.1 | 175 | -66.4 | -19.5 | 0 | 0 | 0 | 111.8 | R75 Q76 K83 | R75-D79 VanDerWaalsContact O-CG 3.32Å; R75-D79 PolarHBondContact O-N 2.99Å; Q76-D79 PolarHBondContact O-N 3.03Å; D79-K83 WeakPolarHBondContact O-CG 3.45Å; D79-K83 PolarHBondContact O-N 2.9Å; D79-K83 VanDerWaalsContact O-N 3.13Å |
| 80 | Q | 98.1 | Very high | 98.4 | Very high | 94 Ų | 94 | 99.9 Ų | 99.9 | 44% | 0.439 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.6 | -44 | 172.5 | -72.5 | 171.3 | -0.5 | 0 | 0 | 111.7 | Q76 V77 N78 A82 K83 V84 | Q76-Q80 VanDerWaalsContact O-CG 3.29Å; Q76-Q80 WeakPolarHBondContact O-CG 3.36Å; Q76-Q80 PolarHBondContact O-N 3.06Å; V77-Q80 WeakPolarHBondContact O-CB 3.37Å; V77-Q80 PolarHBondContact O-N 3.36Å; N78-Q80 VanDerWaalsContact C-N 3.29Å; N78-Q80 PolarHBondContact O-N 2.88Å; Q80-A82 VanDerWaalsContact C-N 3.35Å; Q80-A82 PolarHBondContact O-N 2.88Å; Q80-K83 PolarHBondContact O-N 2.83Å; Q80-V84 WeakPolarHBondContact O-CG2 3.36Å; Q80-V84 PolarHBondContact O-N 3.42Å |
| 81 | H | 98.3 | Very high | 98.3 | Very high | 97 Ų | 97 | 97.3 Ų | 97.3 | 45% | 0.449 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 175.5 | -69.4 | -177.9 | 0 | 0 | 0 | 111.3 | V77 N78 K83 V84 Y85 | V77-H81 WeakPolarHBondContact CG1-NE2 3.31Å; V77-H81 PolarHBondContact O-CD2 2.92Å; V77-H81 VanDerWaalsContact O-CD2 3.3Å; V77-H81 VanDerWaalsContact O-CG 3.29Å; V77-H81 PolarHBondContact O-N 3.36Å; N78-H81 WeakPolarHBondContact O-CB 3.19Å; N78-H81 PolarHBondContact O-N 3.42Å; N78-H81 VanDerWaalsContact O-N 3.14Å; H81-K83 PolarHBondContact O-N 2.95Å; H81-V84 PolarHBondContact O-N 2.85Å; H81-Y85 HydrophobicContact CB-CD2 4.45Å; H81-Y85 HydrophobicContact CB-CE2 4.11Å; H81-Y85 WeakPolarHBondContact O-CD2 3.33Å; H81-Y85 PolarHBondContact O-N 3.14Å |
| 82 | A | 98.3 | Very high | 98.3 | Very high | 40 Ų | 40 | 95.7 Ų | 95.7 | 33% | 0.331 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.9 | -46.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | N78 Q80 V84 Y85 E86 | N78-A82 PolarHBondContact O-N 3.45Å; Q80-A82 VanDerWaalsContact C-N 3.35Å; Q80-A82 PolarHBondContact O-N 2.88Å; A82-V84 PolarHBondContact O-N 3.42Å; A82-Y85 PolarHBondContact O-N 2.84Å; A82-E86 WeakPolarHBondContact O-CG 3.4Å; A82-E86 PolarHBondContact O-N 2.95Å |
| 83 | K | 98.5 | Very high | 98.3 | Very high | 139 Ų | 139 | 97.7 Ų | 97.7 | 60% | 0.604 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.1 | -41.5 | 176.1 | -71 | 171.4 | -176.7 | -179.9 | 0 | 113 | D79 Q80 H81 E86 Q87 | D79-K83 WeakPolarHBondContact O-CG 3.45Å; D79-K83 PolarHBondContact O-N 2.9Å; D79-K83 VanDerWaalsContact O-N 3.13Å; Q80-K83 PolarHBondContact O-N 2.83Å; H81-K83 PolarHBondContact O-N 2.95Å; K83-E86 PolarHBondContact O-N 3.43Å; K83-Q87 WeakPolarHBondContact O-CB 3.46Å; K83-Q87 PolarHBondContact O-N 2.82Å |
| 84 | V | 98.6 | Very high | 98.3 | Very high | 84 Ų | 84 | 98.5 Ų | 98.5 | 51% | 0.509 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.7 | -41.8 | 177.1 | 171.8 | 0 | 0 | 0 | 0 | 110.5 | Q80 H81 A82 Q87 L88 | Q80-V84 WeakPolarHBondContact O-CG2 3.36Å; Q80-V84 PolarHBondContact O-N 3.42Å; H81-V84 PolarHBondContact O-N 2.85Å; A82-V84 PolarHBondContact O-N 3.42Å; V84-Q87 PolarHBondContact O-N 3.38Å; V84-L88 HydrophobicContact CG1-CD1 4.08Å; V84-L88 HydrophobicContact CG1-CG 4.41Å; V84-L88 WeakPolarHBondContact O-CB 3.43Å; V84-L88 WeakPolarHBondContact O-CG 3.4Å; V84-L88 PolarHBondContact O-N 3.26Å |
| 85 | Y | 98.5 | Very high | 98.3 | Very high | 154 Ų | 154 | 99.1 Ų | 99.1 | 60% | 0.604 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.8 | -46.3 | 175.2 | -70.5 | -51.4 | 0 | 0 | 0 | 111.7 | H81 A82 Q87 L88 D89 | H81-Y85 HydrophobicContact CB-CD2 4.45Å; H81-Y85 HydrophobicContact CB-CE2 4.11Å; H81-Y85 WeakPolarHBondContact O-CD2 3.33Å; H81-Y85 PolarHBondContact O-N 3.14Å; A82-Y85 PolarHBondContact O-N 2.84Å; Y85-Q87 VanDerWaalsContact C-N 3.32Å; Y85-Q87 PolarHBondContact O-N 3.35Å; Y85-L88 PolarHBondContact O-N 3.48Å; Y85-D89 VanDerWaalsContact O-CB 3.3Å; Y85-D89 WeakPolarHBondContact O-CB 3.47Å; Y85-D89 PolarHBondContact O-N 3.31Å |
| 86 | E | 98.1 | Very high | 98.3 | Very high | 129 Ų | 129 | 96.9 Ų | 96.9 | 60% | 0.603 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -57.3 | -44.3 | 175.1 | -73.1 | 173.8 | -179.8 | 0 | 0 | 112 | A82 K83 D89 V90 | A82-E86 WeakPolarHBondContact O-CG 3.4Å; A82-E86 PolarHBondContact O-N 2.95Å; K83-E86 PolarHBondContact O-N 3.43Å; E86-D89 VanDerWaalsContact O-CB 3.3Å; E86-D89 WeakPolarHBondContact O-CB 3.29Å; E86-D89 PolarHBondContact O-N 3.24Å; E86-V90 WeakPolarHBondContact O-CG2 3.39Å; E86-V90 PolarHBondContact O-N 3.15Å |
| 87 | Q | 98.6 | Very high | 98.3 | Very high | 132 Ų | 132 | 97.9 Ų | 97.9 | 62% | 0.617 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.9 | -42.3 | 177.8 | -175.3 | 62.5 | 20.7 | 0 | 0 | 112.4 | K83 V84 Y85 D89 V90 S91 | K83-Q87 WeakPolarHBondContact O-CB 3.46Å; K83-Q87 PolarHBondContact O-N 2.82Å; V84-Q87 PolarHBondContact O-N 3.38Å; Y85-Q87 VanDerWaalsContact C-N 3.32Å; Y85-Q87 PolarHBondContact O-N 3.35Å; Q87-D89 VanDerWaalsContact C-N 3.3Å; Q87-D89 PolarHBondContact O-N 2.93Å; Q87-V90 PolarHBondContact O-N 2.94Å; Q87-S91 PolarHBondContact O-N 3.46Å; Q87-S91 PolarHBondContact O-OG 3.37Å |
| 88 | L | 98.6 | Very high | 98.3 | Very high | 98 Ų | 98 | 98.4 Ų | 98.4 | 51% | 0.513 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 175.2 | -75.3 | 173.1 | 0 | 0 | 0 | 110.7 | V84 Y85 V90 S91 A92 | V84-L88 HydrophobicContact CG1-CD1 4.08Å; V84-L88 HydrophobicContact CG1-CG 4.41Å; V84-L88 WeakPolarHBondContact O-CB 3.43Å; V84-L88 WeakPolarHBondContact O-CG 3.4Å; V84-L88 PolarHBondContact O-N 3.26Å; Y85-L88 PolarHBondContact O-N 3.48Å; L88-V90 PolarHBondContact O-N 2.88Å; L88-S91 WeakPolarHBondContact CA-OG 3.21Å; L88-S91 PolarHBondContact O-N 2.8Å; L88-S91 PolarHBondContact O-OG 3.46Å; L88-A92 WeakPolarHBondContact O-CB 3.42Å; L88-A92 PolarHBondContact O-N 3.46Å |
| 89 | D | 98.4 | Very high | 98.3 | Very high | 83 Ų | 83 | 98.1 Ų | 98.1 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 177 | -112.6 | 33.7 | 0 | 0 | 0 | 112.6 | Y85 E86 Q87 R93 | Y85-D89 VanDerWaalsContact O-CB 3.3Å; Y85-D89 WeakPolarHBondContact O-CB 3.47Å; Y85-D89 PolarHBondContact O-N 3.31Å; E86-D89 VanDerWaalsContact O-CB 3.3Å; E86-D89 WeakPolarHBondContact O-CB 3.29Å; E86-D89 PolarHBondContact O-N 3.24Å; Q87-D89 VanDerWaalsContact C-N 3.3Å; Q87-D89 PolarHBondContact O-N 2.93Å; D89-R93 VanDerWaalsContact O-CG 3.3Å; D89-R93 WeakPolarHBondContact O-CG 3.34Å; D89-R93 PolarHBondContact O-N 3.38Å; D89-R93 PolarHBondContact O-NH1 3.46Å; D89-R93 IonicContact OD2-CZ 2.79Å; D89-R93 IonicContact OD2-NH1 2.74Å; D89-R93 PolarHBondContact OD2-NH1 3.49Å; D89-R93 IonicContact OD2-NH2 2.83Å; D89-R93 PolarHBondContact OD2-NH2 2.81Å |
| 90 | V | 98.4 | Very high | 98.3 | Very high | 62 Ų | 62 | 99.2 Ų | 99.2 | 38% | 0.376 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.7 | -49.2 | 173.9 | 172.7 | 0 | 0 | 0 | 0 | 110.3 | E86 Q87 L88 A92 R93 E94 | E86-V90 WeakPolarHBondContact O-CG2 3.39Å; E86-V90 PolarHBondContact O-N 3.15Å; Q87-V90 PolarHBondContact O-N 2.94Å; L88-V90 PolarHBondContact O-N 2.88Å; V90-A92 VanDerWaalsContact C-N 3.31Å; V90-A92 PolarHBondContact O-N 2.9Å; V90-R93 PolarHBondContact O-N 3.02Å; V90-E94 HydrophobicContact CG1-CG 4.41Å; V90-E94 WeakPolarHBondContact CG1-OE1 3.34Å; V90-E94 WeakPolarHBondContact O-CG 3.27Å; V90-E94 PolarHBondContact O-N 2.9Å |
| 91 | S | 97.9 | Very high | 98.4 | Very high | 37 Ų | 37 | 101.2 Ų | 101.2 | 26% | 0.259 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.7 | -37.7 | -179.5 | 74.4 | 0 | 0 | 0 | 0 | 113 | Q87 L88 E94 L95 | Q87-S91 PolarHBondContact O-N 3.46Å; Q87-S91 PolarHBondContact O-OG 3.37Å; L88-S91 WeakPolarHBondContact CA-OG 3.21Å; L88-S91 PolarHBondContact O-N 2.8Å; L88-S91 PolarHBondContact O-OG 3.46Å; S91-E94 PolarHBondContact O-N 3.21Å; S91-L95 WeakPolarHBondContact O-CB 3.36Å; S91-L95 VanDerWaalsContact O-CG 3.26Å; S91-L95 WeakPolarHBondContact O-CG 3.42Å; S91-L95 PolarHBondContact O-N 2.86Å |
| 92 | A | 97.9 | Very high | 98.4 | Very high | 41 Ų | 41 | 101.8 Ų | 101.8 | 34% | 0.339 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -46 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | L88 V90 E94 L95 E96 | L88-A92 WeakPolarHBondContact O-CB 3.42Å; L88-A92 PolarHBondContact O-N 3.46Å; V90-A92 VanDerWaalsContact C-N 3.31Å; V90-A92 PolarHBondContact O-N 2.9Å; A92-E94 PolarHBondContact O-N 3.36Å; A92-L95 PolarHBondContact O-N 3.17Å; A92-E96 WeakPolarHBondContact O-CG 3.37Å; A92-E96 PolarHBondContact O-N 2.9Å |
| 93 | R | 98.3 | Very high | 98.4 | Very high | 125 Ų | 125 | 102.6 Ų | 102.6 | 47% | 0.472 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.3 | -40.9 | 176.7 | -70 | 178.1 | -167.7 | 102.4 | 6.5 | 112.3 | D89 V90 E96 Q97 | D89-R93 VanDerWaalsContact O-CG 3.3Å; D89-R93 WeakPolarHBondContact O-CG 3.34Å; D89-R93 PolarHBondContact O-N 3.38Å; D89-R93 PolarHBondContact O-NH1 3.46Å; D89-R93 IonicContact OD2-CZ 2.79Å; D89-R93 IonicContact OD2-NH1 2.74Å; D89-R93 PolarHBondContact OD2-NH1 3.49Å; D89-R93 IonicContact OD2-NH2 2.83Å; D89-R93 PolarHBondContact OD2-NH2 2.81Å; V90-R93 PolarHBondContact O-N 3.02Å; R93-E96 PolarHBondContact O-N 3.16Å; R93-Q97 WeakPolarHBondContact O-CB 3.43Å; R93-Q97 VanDerWaalsContact O-CG 3.26Å; R93-Q97 WeakPolarHBondContact O-CG 3.32Å; R93-Q97 PolarHBondContact O-N 2.98Å |
| 94 | E | 98.5 | Very high | 98.4 | Very high | 116 Ų | 116 | 100.5 Ų | 100.5 | 54% | 0.542 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.1 | -43 | 175.8 | -71.8 | 174.1 | 179 | 0 | 0 | 111.9 | V90 S91 A92 Q97 S98 | V90-E94 HydrophobicContact CG1-CG 4.41Å; V90-E94 WeakPolarHBondContact CG1-OE1 3.34Å; V90-E94 WeakPolarHBondContact O-CG 3.27Å; V90-E94 PolarHBondContact O-N 2.9Å; S91-E94 PolarHBondContact O-N 3.21Å; A92-E94 PolarHBondContact O-N 3.36Å; E94-Q97 PolarHBondContact O-N 3.37Å; E94-S98 WeakPolarHBondContact O-CB 3.33Å; E94-S98 PolarHBondContact O-N 3.47Å |
| 95 | L | 98.2 | Very high | 98.4 | Very high | 124 Ų | 124 | 100.3 Ų | 100.3 | 65% | 0.649 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.4 | -41.6 | 175.7 | -72.6 | 173.8 | 0 | 0 | 0 | 111.8 | S91 A92 S98 N99 | S91-L95 WeakPolarHBondContact O-CB 3.36Å; S91-L95 VanDerWaalsContact O-CG 3.26Å; S91-L95 WeakPolarHBondContact O-CG 3.42Å; S91-L95 PolarHBondContact O-N 2.86Å; A92-L95 PolarHBondContact O-N 3.17Å; L95-S98 PolarHBondContact O-N 3.18Å; L95-N99 VanDerWaalsContact O-CB 3.27Å; L95-N99 WeakPolarHBondContact O-CB 3.27Å; L95-N99 PolarHBondContact O-N 3.32Å |
| 96 | E | 98.3 | Very high | 98.4 | Very high | 117 Ų | 117 | 97.3 Ų | 97.3 | 55% | 0.547 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 174.6 | -75.6 | 174.7 | -178.9 | 0 | 0 | 111.9 | A92 R93 N99 Q100 | A92-E96 WeakPolarHBondContact O-CG 3.37Å; A92-E96 PolarHBondContact O-N 2.9Å; R93-E96 PolarHBondContact O-N 3.16Å; E96-N99 PolarHBondContact O-N 2.83Å; E96-Q100 VanDerWaalsContact O-CG 3.27Å; E96-Q100 WeakPolarHBondContact O-CG 3.46Å; E96-Q100 PolarHBondContact O-N 3.15Å |
| 97 | Q | 98.6 | Very high | 98.4 | Very high | 127 Ų | 127 | 98.1 Ų | 98.1 | 59% | 0.593 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.3 | -44.3 | 176.8 | -72.1 | 173.2 | 26.1 | 0 | 0 | 111.8 | R93 E94 N99 Q100 K101 | R93-Q97 WeakPolarHBondContact O-CB 3.43Å; R93-Q97 VanDerWaalsContact O-CG 3.26Å; R93-Q97 WeakPolarHBondContact O-CG 3.32Å; R93-Q97 PolarHBondContact O-N 2.98Å; E94-Q97 PolarHBondContact O-N 3.37Å; Q97-N99 VanDerWaalsContact C-N 3.33Å; Q97-N99 PolarHBondContact O-N 3.19Å; Q97-Q100 PolarHBondContact O-N 2.88Å; Q97-K101 WeakPolarHBondContact O-CB 3.48Å; Q97-K101 PolarHBondContact O-N 3.3Å |
| 98 | S | 98.4 | Very high | 98.4 | Very high | 62 Ų | 62 | 95.1 Ų | 95.1 | 43% | 0.434 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61 | -43.3 | 175.6 | -177.1 | 0 | 0 | 0 | 0 | 111.3 | E94 L95 K101 L102 | E94-S98 WeakPolarHBondContact O-CB 3.33Å; E94-S98 PolarHBondContact O-N 3.47Å; L95-S98 PolarHBondContact O-N 3.18Å; S98-K101 PolarHBondContact O-N 2.86Å; S98-L102 WeakPolarHBondContact O-CG 3.34Å; S98-L102 PolarHBondContact O-N 3.3Å |
| 99 | N | 98.2 | Very high | 98.3 | Very high | 100 Ų | 100 | 92.5 Ų | 92.5 | 54% | 0.535 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.2 | -48.1 | 176.5 | -167.4 | -59.7 | 0 | 0 | 0 | 111.4 | L95 E96 Q97 K101 L102 V103 | L95-N99 VanDerWaalsContact O-CB 3.27Å; L95-N99 WeakPolarHBondContact O-CB 3.27Å; L95-N99 PolarHBondContact O-N 3.32Å; E96-N99 PolarHBondContact O-N 2.83Å; Q97-N99 VanDerWaalsContact C-N 3.33Å; Q97-N99 PolarHBondContact O-N 3.19Å; N99-K101 VanDerWaalsContact C-N 3.31Å; N99-K101 PolarHBondContact O-N 3.39Å; N99-L102 PolarHBondContact O-N 3.35Å; N99-V103 WeakPolarHBondContact O-CG2 3.26Å; N99-V103 PolarHBondContact O-N 2.89Å |
| 100 | Q | 98.5 | Very high | 98.3 | Very high | 122 Ų | 122 | 92.9 Ų | 92.9 | 57% | 0.57 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -57.1 | -44.5 | 175.9 | -72.2 | 171.5 | 20.7 | 0 | 0 | 111.7 | E96 Q97 V103 L104 | E96-Q100 VanDerWaalsContact O-CG 3.27Å; E96-Q100 WeakPolarHBondContact O-CG 3.46Å; E96-Q100 PolarHBondContact O-N 3.15Å; Q97-Q100 PolarHBondContact O-N 2.88Å; Q100-V103 PolarHBondContact O-N 3.43Å; Q100-L104 WeakPolarHBondContact O-CG 3.43Å; Q100-L104 PolarHBondContact O-N 3.39Å |
| 101 | K | 98.6 | Very high | 98.3 | Very high | 136 Ų | 136 | 96.1 Ų | 96.1 | 59% | 0.591 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.7 | -48.1 | 175.8 | -176 | -179.7 | 177.3 | -177.9 | 0 | 111.8 | Q97 S98 N99 V103 L104 D105 | Q97-K101 WeakPolarHBondContact O-CB 3.48Å; Q97-K101 PolarHBondContact O-N 3.3Å; S98-K101 PolarHBondContact O-N 2.86Å; N99-K101 VanDerWaalsContact C-N 3.31Å; N99-K101 PolarHBondContact O-N 3.39Å; K101-V103 VanDerWaalsContact C-N 3.29Å; K101-V103 PolarHBondContact O-N 3.36Å; K101-L104 PolarHBondContact O-N 2.89Å; K101-L104 VanDerWaalsContact O-N 3.16Å; K101-D105 PolarHBondContact O-N 3.42Å |
| 102 | L | 98.4 | Very high | 98.3 | Very high | 109 Ų | 109 | 101.4 Ų | 101.4 | 57% | 0.571 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.8 | -37.6 | 177.1 | -72.9 | 173.9 | 0 | 0 | 0 | 112.1 | S98 N99 D105 N106 | S98-L102 WeakPolarHBondContact O-CG 3.34Å; S98-L102 PolarHBondContact O-N 3.3Å; N99-L102 PolarHBondContact O-N 3.35Å; L102-D105 PolarHBondContact O-N 2.84Å; L102-N106 WeakPolarHBondContact O-CB 3.43Å; L102-N106 PolarHBondContact O-N 2.85Å |
| 103 | V | 98.7 | Very high | 98.3 | Very high | 57 Ų | 57 | 104.5 Ų | 104.5 | 35% | 0.345 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 175.1 | 168.6 | 0 | 0 | 0 | 0 | 111.1 | N99 Q100 K101 N106 R107 | N99-V103 WeakPolarHBondContact O-CG2 3.26Å; N99-V103 PolarHBondContact O-N 2.89Å; Q100-V103 PolarHBondContact O-N 3.43Å; K101-V103 VanDerWaalsContact C-N 3.29Å; K101-V103 PolarHBondContact O-N 3.36Å; V103-N106 PolarHBondContact O-N 3.43Å; V103-R107 WeakPolarHBondContact O-CG 3.31Å; V103-R107 PolarHBondContact O-N 2.89Å |
| 104 | L | 98.5 | Very high | 98.3 | Very high | 96 Ų | 96 | 103.3 Ų | 103.3 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.5 | -47.8 | 175.5 | -67.8 | 174.9 | 0 | 0 | 0 | 111.1 | Q100 K101 N106 R107 T108 | Q100-L104 WeakPolarHBondContact O-CG 3.43Å; Q100-L104 PolarHBondContact O-N 3.39Å; K101-L104 PolarHBondContact O-N 2.89Å; K101-L104 VanDerWaalsContact O-N 3.16Å; L104-N106 VanDerWaalsContact C-N 3.3Å; L104-N106 PolarHBondContact O-N 3.37Å; L104-R107 WeakPolarHBondContact O-CB 3.33Å; L104-R107 PolarHBondContact O-N 3.49Å; L104-R107 VanDerWaalsContact O-N 3.15Å; L104-T108 WeakPolarHBondContact O-CG2 3.34Å; L104-T108 PolarHBondContact O-N 3.39Å |
| 105 | D | 98.4 | Very high | 98.3 | Very high | 80 Ų | 80 | 99.5 Ų | 99.5 | 43% | 0.428 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.8 | -42.3 | 177.4 | -70.8 | -17 | 0 | 0 | 0 | 110.8 | K101 L102 R107 T108 A109 | K101-D105 PolarHBondContact O-N 3.42Å; L102-D105 PolarHBondContact O-N 2.84Å; D105-R107 PolarHBondContact O-N 3.32Å; D105-T108 PolarHBondContact O-N 2.95Å; D105-T108 PolarHBondContact O-OG1 3.1Å; D105-A109 WeakPolarHBondContact O-CB 3.34Å; D105-A109 PolarHBondContact O-N 3.12Å |
| 106 | N | 98.1 | Very high | 98.3 | Very high | 90 Ų | 90 | 99 Ų | 99 | 48% | 0.481 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 175.2 | -167 | -86.6 | 0 | 0 | 0 | 111.8 | L102 V103 L104 T108 A109 Q110 | L102-N106 WeakPolarHBondContact O-CB 3.43Å; L102-N106 PolarHBondContact O-N 2.85Å; V103-N106 PolarHBondContact O-N 3.43Å; L104-N106 VanDerWaalsContact C-N 3.3Å; L104-N106 PolarHBondContact O-N 3.37Å; N106-T108 PolarHBondContact O-N 3.5Å; N106-A109 PolarHBondContact O-N 3.34Å; N106-Q110 WeakPolarHBondContact O-CB 3.48Å; N106-Q110 VanDerWaalsContact O-CG 3.29Å; N106-Q110 WeakPolarHBondContact O-CG 3.37Å; N106-Q110 PolarHBondContact O-N 2.99Å; N106-Q110 PolarHBondContact OD1-NE2 3.36Å |
| 107 | R | 98.5 | Very high | 98.3 | Very high | 146 Ų | 146 | 97.5 Ų | 97.5 | 55% | 0.551 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.8 | -44.2 | 174.2 | -73.3 | 173.1 | -176.4 | 169.4 | 2.5 | 111.7 | V103 L104 D105 A109 Q110 L111 | V103-R107 WeakPolarHBondContact O-CG 3.31Å; V103-R107 PolarHBondContact O-N 2.89Å; L104-R107 WeakPolarHBondContact O-CB 3.33Å; L104-R107 PolarHBondContact O-N 3.49Å; L104-R107 VanDerWaalsContact O-N 3.15Å; D105-R107 PolarHBondContact O-N 3.32Å; R107-A109 VanDerWaalsContact C-N 3.34Å; R107-A109 PolarHBondContact O-N 2.89Å; R107-Q110 WeakPolarHBondContact O-CB 3.48Å; R107-Q110 PolarHBondContact O-N 2.94Å; R107-L111 WeakPolarHBondContact O-CG 3.29Å; R107-L111 PolarHBondContact O-N 2.94Å |
| 108 | T | 98.3 | Very high | 98.2 | Very high | 69 Ų | 69 | 96 Ų | 96 | 42% | 0.423 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.1 | -37.4 | 177.8 | 68.3 | 0 | 0 | 0 | 0 | 112.2 | L104 D105 N106 L111 K112 | L104-T108 WeakPolarHBondContact O-CG2 3.34Å; L104-T108 PolarHBondContact O-N 3.39Å; D105-T108 PolarHBondContact O-N 2.95Å; D105-T108 PolarHBondContact O-OG1 3.1Å; N106-T108 PolarHBondContact O-N 3.5Å; T108-L111 PolarHBondContact O-N 2.81Å; T108-K112 WeakPolarHBondContact O-CG 3.49Å; T108-K112 PolarHBondContact O-N 3.42Å; T108-K112 VanDerWaalsContact O-N 3.12Å |
| 109 | A | 97.7 | Very high | 98.2 | Very high | 43 Ų | 43 | 96.4 Ų | 96.4 | 36% | 0.355 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | D105 N106 R107 L111 K112 I113 | D105-A109 WeakPolarHBondContact O-CB 3.34Å; D105-A109 PolarHBondContact O-N 3.12Å; N106-A109 PolarHBondContact O-N 3.34Å; R107-A109 VanDerWaalsContact C-N 3.34Å; R107-A109 PolarHBondContact O-N 2.89Å; A109-L111 PolarHBondContact O-N 3.22Å; A109-K112 PolarHBondContact O-N 3.28Å; A109-I113 VanDerWaalsContact O-CG1 3.31Å; A109-I113 WeakPolarHBondContact O-CG1 3.43Å; A109-I113 PolarHBondContact O-N 2.88Å |
| 110 | Q | 98.3 | Very high | 98.2 | Very high | 91 Ų | 91 | 95.1 Ų | 95.1 | 43% | 0.425 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.5 | -49 | 172.9 | -74.9 | 174.7 | -6.1 | 0 | 0 | 110.9 | N106 R107 K112 I113 H114 | N106-Q110 WeakPolarHBondContact O-CB 3.48Å; N106-Q110 VanDerWaalsContact O-CG 3.29Å; N106-Q110 WeakPolarHBondContact O-CG 3.37Å; N106-Q110 PolarHBondContact O-N 2.99Å; N106-Q110 PolarHBondContact OD1-NE2 3.36Å; R107-Q110 WeakPolarHBondContact O-CB 3.48Å; R107-Q110 PolarHBondContact O-N 2.94Å; Q110-K112 VanDerWaalsContact C-N 3.28Å; Q110-K112 PolarHBondContact O-N 2.83Å; Q110-I113 PolarHBondContact O-N 3.46Å; Q110-I113 VanDerWaalsContact O-N 3.1Å; Q110-H114 PolarHBondContact O-N 3.48Å; Q110-H114 PolarHBondContact O-ND1 3.21Å |
| 111 | L | 98.2 | Very high | 98.1 | Very high | 130 Ų | 130 | 93.9 Ų | 93.9 | 68% | 0.681 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -58.3 | -39.3 | 178 | -69.4 | 173.3 | 0 | 0 | 0 | 112.4 | R107 T108 A109 H114 G115 | R107-L111 WeakPolarHBondContact O-CG 3.29Å; R107-L111 PolarHBondContact O-N 2.94Å; T108-L111 PolarHBondContact O-N 2.81Å; A109-L111 PolarHBondContact O-N 3.22Å; L111-H114 PolarHBondContact O-N 3.4Å; L111-G115 PolarHBondContact O-N 3.5Å |
| 112 | K | 98.3 | Very high | 98.1 | Very high | 148 Ų | 148 | 92.2 Ų | 92.2 | 64% | 0.643 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -65.7 | -41.5 | 174.5 | -69.7 | 172.7 | -176.6 | 175.3 | 0 | 112.4 | T108 A109 Q110 G115 L116 | T108-K112 WeakPolarHBondContact O-CG 3.49Å; T108-K112 PolarHBondContact O-N 3.42Å; T108-K112 VanDerWaalsContact O-N 3.12Å; A109-K112 PolarHBondContact O-N 3.28Å; Q110-K112 VanDerWaalsContact C-N 3.28Å; Q110-K112 PolarHBondContact O-N 2.83Å; K112-G115 PolarHBondContact O-N 3.34Å; K112-L116 WeakPolarHBondContact O-CG 3.26Å; K112-L116 PolarHBondContact O-N 3.3Å |
| 113 | I | 97.9 | Very high | 98 | Very high | 107 Ų | 107 | 91.8 Ų | 91.8 | 55% | 0.549 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.6 | -45.8 | 176.7 | -69.5 | 164.4 | 0 | 0 | 0 | 110.2 | A109 Q110 L116 M117 | A109-I113 VanDerWaalsContact O-CG1 3.31Å; A109-I113 WeakPolarHBondContact O-CG1 3.43Å; A109-I113 PolarHBondContact O-N 2.88Å; Q110-I113 PolarHBondContact O-N 3.46Å; Q110-I113 VanDerWaalsContact O-N 3.1Å; I113-L116 PolarHBondContact O-N 2.76Å; I113-M117 WeakPolarHBondContact O-CB 3.39Å; I113-M117 PolarHBondContact O-N 3.24Å |
| 114 | H | 98.2 | Very high | 98 | Very high | 99 Ų | 99 | 94 Ų | 94 | 46% | 0.458 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 176.5 | -69.8 | 86 | 0 | 0 | 0 | 111.1 | Q110 L111 L116 M117 D118 | Q110-H114 PolarHBondContact O-N 3.48Å; Q110-H114 PolarHBondContact O-ND1 3.21Å; L111-H114 PolarHBondContact O-N 3.4Å; H114-L116 VanDerWaalsContact C-N 3.3Å; H114-L116 PolarHBondContact O-N 2.95Å; H114-M117 WeakPolarHBondContact O-CB 3.36Å; H114-M117 PolarHBondContact O-N 3.17Å; H114-M117 VanDerWaalsContact O-N 3.07Å; H114-D118 VanDerWaalsContact O-CG 3.24Å; H114-D118 PolarHBondContact O-N 2.97Å |
| 115 | G | 98.3 | Very high | 97.9 | Very high | 36 Ų | 36 | 92.9 Ų | 92.9 | 37% | 0.371 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.9 | -38 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L111 K112 T119 | L111-G115 PolarHBondContact O-N 3.5Å; K112-G115 PolarHBondContact O-N 3.34Å; G115-T119 WeakPolarHBondContact O-CG2 3.42Å; G115-T119 PolarHBondContact O-N 3.04Å |
| 116 | L | 97.6 | Very high | 97.8 | Very high | 114 Ų | 114 | 93.4 Ų | 93.4 | 60% | 0.597 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -69.4 | -39 | 173.4 | -71.3 | 172.6 | 0 | 0 | 0 | 112.1 | K112 I113 H114 T119 V120 | K112-L116 WeakPolarHBondContact O-CG 3.26Å; K112-L116 PolarHBondContact O-N 3.3Å; I113-L116 PolarHBondContact O-N 2.76Å; H114-L116 VanDerWaalsContact C-N 3.3Å; H114-L116 PolarHBondContact O-N 2.95Å; L116-T119 WeakPolarHBondContact CA-OG1 3.43Å; L116-T119 PolarHBondContact O-N 3.4Å; L116-T119 PolarHBondContact O-OG1 2.82Å; L116-V120 WeakPolarHBondContact O-CG2 3.24Å; L116-V120 PolarHBondContact O-N 2.97Å |
| 117 | M | 97.7 | Very high | 97.7 | Very high | 86 Ų | 86 | 92.6 Ų | 92.6 | 42% | 0.424 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.5 | -47.2 | 175.9 | -171.1 | 171.9 | 70 | 0 | 0 | 110.7 | I113 H114 T119 V120 E121 | I113-M117 WeakPolarHBondContact O-CB 3.39Å; I113-M117 PolarHBondContact O-N 3.24Å; H114-M117 WeakPolarHBondContact O-CB 3.36Å; H114-M117 PolarHBondContact O-N 3.17Å; H114-M117 VanDerWaalsContact O-N 3.07Å; M117-T119 VanDerWaalsContact C-N 3.29Å; M117-T119 PolarHBondContact O-N 3.48Å; M117-V120 WeakPolarHBondContact O-CB 3.03Å; M117-V120 PolarHBondContact O-N 2.94Å; M117-E121 WeakPolarHBondContact O-CG 3.29Å; M117-E121 PolarHBondContact O-N 3.14Å |
| 118 | D | 98 | Very high | 97.7 | Very high | 95 Ų | 95 | 91.2 Ų | 91.2 | 51% | 0.508 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.5 | -40.2 | 176.1 | -60.7 | -16.5 | 0 | 0 | 0 | 111.6 | H114 E121 L122 | H114-D118 VanDerWaalsContact O-CG 3.24Å; H114-D118 PolarHBondContact O-N 2.97Å; D118-E121 PolarHBondContact O-N 3.01Å; D118-L122 WeakPolarHBondContact O-CB 3.29Å; D118-L122 PolarHBondContact O-N 2.99Å |
| 119 | T | 97.5 | Very high | 97.6 | Very high | 71 Ų | 71 | 93.9 Ų | 93.9 | 44% | 0.436 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.5 | -35.6 | 175.7 | 62.3 | 0 | 0 | 0 | 0 | 112.9 | G115 L116 M117 L123 | G115-T119 WeakPolarHBondContact O-CG2 3.42Å; G115-T119 PolarHBondContact O-N 3.04Å; L116-T119 WeakPolarHBondContact CA-OG1 3.43Å; L116-T119 PolarHBondContact O-N 3.4Å; L116-T119 PolarHBondContact O-OG1 2.82Å; M117-T119 VanDerWaalsContact C-N 3.29Å; M117-T119 PolarHBondContact O-N 3.48Å; T119-L123 VanDerWaalsContact O-CG 3.28Å; T119-L123 WeakPolarHBondContact O-CG 3.28Å; T119-L123 PolarHBondContact O-N 3.38Å |
| 120 | V | 97.9 | Very high | 97.5 | Very high | 73 Ų | 73 | 96.7 Ų | 96.7 | 44% | 0.442 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.5 | -43.2 | 176.5 | 169.9 | 0 | 0 | 0 | 0 | 110.3 | L116 M117 L122 L123 Q124 | L116-V120 WeakPolarHBondContact O-CG2 3.24Å; L116-V120 PolarHBondContact O-N 2.97Å; M117-V120 WeakPolarHBondContact O-CB 3.03Å; M117-V120 PolarHBondContact O-N 2.94Å; V120-L122 PolarHBondContact O-N 3.23Å; V120-L123 PolarHBondContact O-N 3.45Å; V120-Q124 HydrophobicContact CG1-CG 4.32Å; V120-Q124 WeakPolarHBondContact O-CB 3.38Å; V120-Q124 VanDerWaalsContact O-CG 3.29Å; V120-Q124 WeakPolarHBondContact O-CG 3.3Å; V120-Q124 PolarHBondContact O-N 3.48Å |
| 121 | E | 97.9 | Very high | 97.3 | Very high | 96 Ų | 96 | 97.4 Ų | 97.4 | 45% | 0.449 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 175.6 | -70.5 | 177.2 | -171.2 | 0 | 0 | 111.6 | M117 D118 L123 Q124 T125 | M117-E121 WeakPolarHBondContact O-CG 3.29Å; M117-E121 PolarHBondContact O-N 3.14Å; D118-E121 PolarHBondContact O-N 3.01Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-L123 PolarHBondContact O-N 3.36Å; E121-Q124 PolarHBondContact O-N 3.19Å; E121-T125 WeakPolarHBondContact O-CG2 3.23Å; E121-T125 PolarHBondContact O-N 3.45Å; E121-T125 PolarHBondContact O-OG1 2.98Å |
| 122 | L | 98.1 | Very high | 97.1 | Very high | 100 Ų | 100 | 96.1 Ų | 96.1 | 52% | 0.524 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.5 | -41.5 | 173.9 | -179.1 | 64 | 0 | 0 | 0 | 112 | D118 V120 T125 Q126 | D118-L122 WeakPolarHBondContact O-CB 3.29Å; D118-L122 PolarHBondContact O-N 2.99Å; V120-L122 PolarHBondContact O-N 3.23Å; L122-T125 WeakPolarHBondContact CA-OG1 3.23Å; L122-T125 PolarHBondContact O-OG1 2.73Å; L122-Q126 VanDerWaalsContact O-CG 3.31Å; L122-Q126 WeakPolarHBondContact O-CG 3.41Å; L122-Q126 PolarHBondContact O-N 2.87Å; L122-Q126 VanDerWaalsContact O-N 3.12Å |
| 123 | L | 97 | Very high | 96.9 | Very high | 101 Ų | 101 | 93.5 Ų | 93.5 | 53% | 0.529 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.8 | -36.1 | 176 | -71 | 172.2 | 0 | 0 | 0 | 112.1 | T119 V120 E121 Q126 V127 | T119-L123 VanDerWaalsContact O-CG 3.28Å; T119-L123 WeakPolarHBondContact O-CG 3.28Å; T119-L123 PolarHBondContact O-N 3.38Å; V120-L123 PolarHBondContact O-N 3.45Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-L123 PolarHBondContact O-N 3.36Å; L123-Q126 PolarHBondContact O-N 2.84Å; L123-V127 WeakPolarHBondContact O-CB 3.22Å; L123-V127 VanDerWaalsContact O-CG2 3.28Å; L123-V127 WeakPolarHBondContact O-CG2 3.24Å; L123-V127 PolarHBondContact O-N 3.46Å |
| 124 | Q | 97.3 | Very high | 96.6 | Very high | 102 Ų | 102 | 91.9 Ų | 91.9 | 48% | 0.477 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.6 | -48.3 | 175.7 | -77.2 | 170.7 | -8.7 | 0 | 0 | 111.2 | V120 E121 Q126 V127 E128 | V120-Q124 HydrophobicContact CG1-CG 4.32Å; V120-Q124 WeakPolarHBondContact O-CB 3.38Å; V120-Q124 VanDerWaalsContact O-CG 3.29Å; V120-Q124 WeakPolarHBondContact O-CG 3.3Å; V120-Q124 PolarHBondContact O-N 3.48Å; E121-Q124 PolarHBondContact O-N 3.19Å; Q124-Q126 VanDerWaalsContact C-N 3.32Å; Q124-Q126 PolarHBondContact O-N 2.87Å; Q124-V127 PolarHBondContact O-N 3.42Å; Q124-V127 VanDerWaalsContact O-N 3.09Å; Q124-E128 WeakPolarHBondContact O-CG 3.42Å; Q124-E128 PolarHBondContact O-N 3Å |
| 125 | T | 96.9 | Very high | 96.3 | Very high | 73 Ų | 73 | 92.2 Ų | 92.2 | 45% | 0.448 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.4 | -40.1 | 176.2 | 52.7 | 0 | 0 | 0 | 0 | 112.2 | E121 L122 V127 E128 E129 | E121-T125 WeakPolarHBondContact O-CG2 3.23Å; E121-T125 PolarHBondContact O-N 3.45Å; E121-T125 PolarHBondContact O-OG1 2.98Å; L122-T125 WeakPolarHBondContact CA-OG1 3.23Å; L122-T125 PolarHBondContact O-OG1 2.73Å; T125-V127 PolarHBondContact O-N 2.95Å; T125-E128 PolarHBondContact O-N 3.19Å; T125-E129 WeakPolarHBondContact O-CB 3.42Å; T125-E129 PolarHBondContact O-N 3.18Å |
| 126 | Q | 96.4 | Very high | 95.9 | Very high | 91 Ų | 91 | 95.3 Ų | 95.3 | 43% | 0.425 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.6 | -41 | 172.7 | -72.5 | 173.4 | 22.2 | 0 | 0 | 112.7 | L122 L123 Q124 E129 L130 | L122-Q126 VanDerWaalsContact O-CG 3.31Å; L122-Q126 WeakPolarHBondContact O-CG 3.41Å; L122-Q126 PolarHBondContact O-N 2.87Å; L122-Q126 VanDerWaalsContact O-N 3.12Å; L123-Q126 PolarHBondContact O-N 2.84Å; Q124-Q126 VanDerWaalsContact C-N 3.32Å; Q124-Q126 PolarHBondContact O-N 2.87Å; Q126-E129 PolarHBondContact O-N 2.87Å; Q126-L130 WeakPolarHBondContact O-CB 3.25Å; Q126-L130 VanDerWaalsContact O-CG 3.27Å; Q126-L130 WeakPolarHBondContact O-CG 3.35Å; Q126-L130 PolarHBondContact O-N 3.48Å |
| 127 | V | 96.8 | Very high | 95.4 | Very high | 74 Ų | 74 | 96.3 Ų | 96.3 | 45% | 0.448 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.3 | -42.7 | 177 | 167.3 | 0 | 0 | 0 | 0 | 111 | L123 Q124 T125 L130 Q131 | L123-V127 WeakPolarHBondContact O-CB 3.22Å; L123-V127 VanDerWaalsContact O-CG2 3.28Å; L123-V127 WeakPolarHBondContact O-CG2 3.24Å; L123-V127 PolarHBondContact O-N 3.46Å; Q124-V127 PolarHBondContact O-N 3.42Å; Q124-V127 VanDerWaalsContact O-N 3.09Å; T125-V127 PolarHBondContact O-N 2.95Å; V127-L130 PolarHBondContact O-N 3.37Å; V127-Q131 HydrophobicContact CG1-CG 4.4Å; V127-Q131 WeakPolarHBondContact O-CB 3.48Å; V127-Q131 WeakPolarHBondContact O-CG 3.46Å; V127-Q131 PolarHBondContact O-N 2.8Å |
| 128 | E | 97.4 | Very high | 94.7 | Very high | 116 Ų | 116 | 99.6 Ų | 99.6 | 54% | 0.542 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62 | -42.6 | 175.5 | -72.1 | 168.7 | -172.2 | 0 | 0 | 111.4 | Q124 T125 Q131 H132 | Q124-E128 WeakPolarHBondContact O-CG 3.42Å; Q124-E128 PolarHBondContact O-N 3Å; T125-E128 PolarHBondContact O-N 3.19Å; E128-Q131 WeakPolarHBondContact O-CB 3.47Å; E128-Q131 PolarHBondContact O-N 2.81Å; E128-H132 PolarHBondContact O-N 3.43Å |
| 129 | E | 96.3 | Very high | 93.4 | Very high | 125 Ų | 125 | 101.9 Ų | 101.9 | 58% | 0.584 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.8 | -42.9 | 176.5 | -175.5 | 160.4 | -153.9 | 0 | 0 | 112 | T125 Q126 Q131 H132 Q133 | T125-E129 WeakPolarHBondContact O-CB 3.42Å; T125-E129 PolarHBondContact O-N 3.18Å; Q126-E129 PolarHBondContact O-N 2.87Å; E129-Q131 VanDerWaalsContact C-N 3.32Å; E129-Q131 PolarHBondContact O-N 2.97Å; E129-H132 PolarHBondContact O-N 3.21Å; E129-Q133 WeakPolarHBondContact O-CG 3.47Å; E129-Q133 PolarHBondContact O-N 3.24Å |
| 130 | L | 95.2 | Very high | 91.5 | Very high | 103 Ų | 103 | 102.9 Ų | 102.9 | 54% | 0.539 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.2 | -37.9 | 172.9 | -72.7 | 172.7 | 0 | 0 | 0 | 112.1 | Q126 V127 Q133 V134 | Q126-L130 WeakPolarHBondContact O-CB 3.25Å; Q126-L130 VanDerWaalsContact O-CG 3.27Å; Q126-L130 WeakPolarHBondContact O-CG 3.35Å; Q126-L130 PolarHBondContact O-N 3.48Å; V127-L130 PolarHBondContact O-N 3.37Å; L130-Q133 PolarHBondContact O-N 3.4Å; L130-V134 VanDerWaalsContact O-CG2 3.31Å; L130-V134 WeakPolarHBondContact O-CG2 3.06Å; L130-V134 PolarHBondContact O-N 2.79Å |
| 131 | Q | 94.6 | Very high | 89.1 | Confident | 105 Ų | 105 | 104.3 Ų | 104.3 | 49% | 0.491 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.9 | -45.6 | 173.9 | -76.8 | 171.4 | 5.7 | 0 | 0 | 111 | V127 E128 E129 Q133 V134 E135 | V127-Q131 HydrophobicContact CG1-CG 4.4Å; V127-Q131 WeakPolarHBondContact O-CB 3.48Å; V127-Q131 WeakPolarHBondContact O-CG 3.46Å; V127-Q131 PolarHBondContact O-N 2.8Å; E128-Q131 WeakPolarHBondContact O-CB 3.47Å; E128-Q131 PolarHBondContact O-N 2.81Å; E129-Q131 VanDerWaalsContact C-N 3.32Å; E129-Q131 PolarHBondContact O-N 2.97Å; Q131-Q133 PolarHBondContact O-N 2.89Å; Q131-V134 PolarHBondContact O-N 3.4Å; Q131-E135 WeakPolarHBondContact O-CG 3.3Å; Q131-E135 PolarHBondContact O-N 3.23Å |
| 132 | H | 94.6 | Very high | 86.6 | Confident | 104 Ų | 104 | 111.9 Ų | 111.9 | 48% | 0.481 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -59.1 | -46.6 | 175.8 | -169.8 | -78.4 | 0 | 0 | 0 | 111.5 | E128 E129 V134 E135 E136 | E128-H132 PolarHBondContact O-N 3.43Å; E129-H132 PolarHBondContact O-N 3.21Å; H132-V134 VanDerWaalsContact C-N 3.33Å; H132-V134 PolarHBondContact O-N 2.89Å; H132-E135 PolarHBondContact O-N 2.91Å; H132-E135 VanDerWaalsContact O-N 3.15Å; H132-E136 VanDerWaalsContact CE1-CD 3.43Å; H132-E136 IonicContact CE1-OE1 3.16Å; H132-E136 PolarHBondContact CE1-OE1 3.45Å; H132-E136 IonicContact ND1-OE1 3.6Å; H132-E136 IonicContact ND1-OE2 3.81Å; H132-E136 WeakPolarHBondContact O-CG 3.41Å; H132-E136 PolarHBondContact O-N 2.96Å |
| 133 | Q | 94.1 | Very high | 84 | Confident | 92 Ų | 92 | 116 Ų | 116 | 43% | 0.43 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.4 | -40.4 | 176.2 | -70.4 | 175.3 | 27.7 | 0 | 0 | 112.4 | E129 L130 Q131 E135 E136 L137 | E129-Q133 WeakPolarHBondContact O-CG 3.47Å; E129-Q133 PolarHBondContact O-N 3.24Å; L130-Q133 PolarHBondContact O-N 3.4Å; Q131-Q133 PolarHBondContact O-N 2.89Å; Q133-E135 VanDerWaalsContact C-N 3.34Å; Q133-E136 PolarHBondContact O-N 3.37Å; Q133-L137 WeakPolarHBondContact O-CB 3.46Å; Q133-L137 VanDerWaalsContact O-CG 3.3Å; Q133-L137 WeakPolarHBondContact O-CG 3.39Å; Q133-L137 PolarHBondContact O-N 3.3Å |
| 134 | V | 91.1 | Very high | 81.3 | Confident | 73 Ų | 73 | 115.5 Ų | 115.5 | 44% | 0.442 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.5 | -38.9 | 175.5 | 167.6 | 0 | 0 | 0 | 0 | 111.4 | L130 Q131 H132 L137 K138 | L130-V134 VanDerWaalsContact O-CG2 3.31Å; L130-V134 WeakPolarHBondContact O-CG2 3.06Å; L130-V134 PolarHBondContact O-N 2.79Å; Q131-V134 PolarHBondContact O-N 3.4Å; H132-V134 VanDerWaalsContact C-N 3.33Å; H132-V134 PolarHBondContact O-N 2.89Å; V134-L137 PolarHBondContact O-N 3.02Å; V134-K138 HydrophobicContact CG1-CD 4.28Å; V134-K138 VanDerWaalsContact O-CG 3.27Å; V134-K138 WeakPolarHBondContact O-CG 3.38Å; V134-K138 PolarHBondContact O-N 2.91Å |
| 135 | E | 91.8 | Very high | 78.5 | Confident | 106 Ų | 106 | 118.4 Ų | 118.4 | 50% | 0.495 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68.4 | -41.9 | 176.3 | -72.2 | 176.9 | -177.6 | 0 | 0 | 112 | Q131 H132 Q133 L137 K138 L139 | Q131-E135 WeakPolarHBondContact O-CG 3.3Å; Q131-E135 PolarHBondContact O-N 3.23Å; H132-E135 PolarHBondContact O-N 2.91Å; H132-E135 VanDerWaalsContact O-N 3.15Å; Q133-E135 VanDerWaalsContact C-N 3.34Å; E135-L137 VanDerWaalsContact C-N 3.34Å; E135-L137 PolarHBondContact O-N 3.32Å; E135-K138 CarbonylContact O-C 3.58Å; E135-K138 WeakPolarHBondContact O-CA 3.3Å; E135-K138 WeakPolarHBondContact O-CB 3.3Å; E135-K138 PolarHBondContact O-N 3.22Å; E135-K138 VanDerWaalsContact O-N 3.08Å; E135-L139 WeakPolarHBondContact O-CB 3.24Å; E135-L139 VanDerWaalsContact O-CG 3.27Å; E135-L139 WeakPolarHBondContact O-CG 3.48Å; E135-L139 PolarHBondContact O-N 3.34Å |
| 136 | E | 90.8 | Very high | 76 | Confident | 101 Ų | 101 | 127 Ų | 127 | 47% | 0.472 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -59.6 | -42.4 | 172.1 | -75.8 | -173.4 | 146.8 | 0 | 0 | 112.3 | H132 Q133 K138 L139 T140 | H132-E136 VanDerWaalsContact CE1-CD 3.43Å; H132-E136 IonicContact CE1-OE1 3.16Å; H132-E136 PolarHBondContact CE1-OE1 3.45Å; H132-E136 IonicContact ND1-OE1 3.6Å; H132-E136 IonicContact ND1-OE2 3.81Å; H132-E136 WeakPolarHBondContact O-CG 3.41Å; H132-E136 PolarHBondContact O-N 2.96Å; Q133-E136 PolarHBondContact O-N 3.37Å; E136-K138 VanDerWaalsContact C-N 3.3Å; E136-K138 PolarHBondContact O-N 3.3Å; E136-L139 PolarHBondContact O-N 2.98Å; E136-T140 WeakPolarHBondContact O-CB 3.48Å; E136-T140 PolarHBondContact O-N 3.34Å; E136-T140 PolarHBondContact O-OG1 3.49Å |
| 137 | L | 85.3 | Confident | 73.2 | Confident | 135 Ų | 135 | 127.4 Ų | 127.4 | 71% | 0.707 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.2 | -30.1 | 174.2 | -72 | 173.4 | 0 | 0 | 0 | 112.7 | Q133 V134 E135 | Q133-L137 WeakPolarHBondContact O-CB 3.46Å; Q133-L137 VanDerWaalsContact O-CG 3.3Å; Q133-L137 WeakPolarHBondContact O-CG 3.39Å; Q133-L137 PolarHBondContact O-N 3.3Å; V134-L137 PolarHBondContact O-N 3.02Å; E135-L137 VanDerWaalsContact C-N 3.34Å; E135-L137 PolarHBondContact O-N 3.32Å |
| 138 | K | 84.6 | Confident | 71.1 | Confident | 156 Ų | 156 | 129.6 Ų | 129.6 | 68% | 0.678 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -74.5 | -35.1 | 173.2 | -75.2 | 170.2 | -177.9 | 171.4 | 0 | 112.5 | V134 E135 E136 | V134-K138 HydrophobicContact CG1-CD 4.28Å; V134-K138 VanDerWaalsContact O-CG 3.27Å; V134-K138 WeakPolarHBondContact O-CG 3.38Å; V134-K138 PolarHBondContact O-N 2.91Å; E135-K138 CarbonylContact O-C 3.58Å; E135-K138 WeakPolarHBondContact O-CA 3.3Å; E135-K138 WeakPolarHBondContact O-CB 3.3Å; E135-K138 PolarHBondContact O-N 3.22Å; E135-K138 VanDerWaalsContact O-N 3.08Å; E136-K138 VanDerWaalsContact C-N 3.3Å; E136-K138 PolarHBondContact O-N 3.3Å |
| 139 | L | 70 | Confident | 68 | Low | 143 Ų | 143 | 129.9 Ų | 129.9 | 75% | 0.749 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -82.5 | -25 | -179.2 | -68.5 | 172.4 | 0 | 0 | 0 | 112.7 | E135 E136 P141 | E135-L139 WeakPolarHBondContact O-CB 3.24Å; E135-L139 VanDerWaalsContact O-CG 3.27Å; E135-L139 WeakPolarHBondContact O-CG 3.48Å; E135-L139 PolarHBondContact O-N 3.34Å; E136-L139 PolarHBondContact O-N 2.98Å; L139-P141 VanDerWaalsContact O-CD 3.22Å; L139-P141 WeakPolarHBondContact O-CD 3.45Å |
| 140 | T | 57.1 | Low | 65.6 | Low | 91 Ų | 91 | 127 Ų | 127 | 56% | 0.558 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -63.8 | 112.6 | 167.3 | -57.5 | 0 | 0 | 0 | 0 | 108.4 | E136 R142 | E136-T140 WeakPolarHBondContact O-CB 3.48Å; E136-T140 PolarHBondContact O-N 3.34Å; E136-T140 PolarHBondContact O-OG1 3.49Å; T140-R142 PolarHBondContact O-N 2.86Å |
| 141 | P | 48.1 | Very low | 62.9 | Low | 103 Ų | 103 | 130.9 Ų | 130.9 | 67% | 0.669 | 68% | 0.675 | S | S | * | * | trans | -60.7 | 131 | -178.4 | -18.3 | 30.6 | 0 | 0 | 0 | 109 | L139 Q143 | L139-P141 VanDerWaalsContact O-CD 3.22Å; L139-P141 WeakPolarHBondContact O-CD 3.45Å; P141-Q143 PolarHBondContact O-N 3.28Å | ||
| 142 | R | 45.4 | Very low | 60 | Low | 255 Ų | 255 | 136.7 Ų | 136.7 | 96% | 0.962 | 69% | 0.693 | S | S | * | * | trans | -58.9 | 72.4 | 178.3 | -153 | 178.9 | -174.9 | -176.2 | 2.5 | 111.6 | T140 S144 | T140-R142 PolarHBondContact O-N 2.86Å; R142-S144 PolarHBondContact O-N 3.46Å | ||
| 143 | Q | 42.5 | Very low | 57.1 | Low | 188 Ų | 188 | 143.9 Ų | 143.9 | 88% | 0.879 | 72% | 0.716 | S | S | * | * | trans | -96.5 | 69.7 | 169.1 | -79.1 | -169.3 | 8 | 0 | 0 | 109.5 | P141 | P141-Q143 PolarHBondContact O-N 3.28Š| ||
| 144 | S | 40.9 | Very low | 54.9 | Low | 89 Ų | 89 | 144 Ų | 144 | 62% | 0.622 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -163.1 | 108 | 143.2 | -159.2 | 0 | 0 | 0 | 0 | 110.4 | R142 | R142-S144 PolarHBondContact O-N 3.46Š|
| 145 | Q | 38.6 | Very low | 53.1 | Low | 164 Ų | 164 | 146.5 Ų | 146.5 | 77% | 0.766 | 74% | 0.742 | S | S | * | * | trans | 64.5 | 102.4 | 147.3 | -62.1 | -176.9 | 36.6 | 0 | 0 | 119.3 | S147 | Q145-S147 PolarHBondContact O-N 2.83Š| ||
| 146 | R | 44.4 | Very low | 50.8 | Low | 253 Ų | 253 | 153 Ų | 153 | 96% | 0.955 | 76% | 0.762 | S | S | * | * | -51.6 | 120.5 | 127.5 | -86.2 | 177 | 170.3 | 158.4 | -2.7 | 108.7 | |||||
| 147 | S | 37.7 | Very low | 49 | Very low | 99 Ų | 99 | 150.7 Ų | 150.7 | 69% | 0.692 | 77% | 0.766 | S | S | * | * | trans | -149.2 | 140.1 | 142.4 | -145.5 | 0 | 0 | 0 | 0 | 110.2 | Q145 | Q145-S147 PolarHBondContact O-N 2.83Š| ||
| 148 | P | 53.4 | Low | 47.4 | Very low | 121 Ų | 121 | 151 Ų | 151 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | trans | -85.7 | 128.1 | -176.7 | 33.3 | -28.1 | 0 | 0 | 0 | 109.7 | ||||
| 149 | C | 30.8 | Very low | 45.6 | Very low | 121 Ų | 121 | 152 Ų | 152 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -155.2 | 107.1 | 160.5 | -149.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 150 | G | 47.1 | Very low | 44.8 | Very low | 64 Ų | 64 | 149.8 Ų | 149.8 | 66% | 0.66 | 78% | 0.777 | S | S | * | * | trans | -67.2 | 139.8 | 155.6 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 151 | E | 37.5 | Very low | 44.5 | Very low | 186 Ų | 186 | 150.3 Ų | 150.3 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | trans | 173.6 | 122.6 | 132.4 | -96.1 | 172.7 | 170.3 | 0 | 0 | 110.2 | ||||
| 152 | R | 34 | Very low | 44.6 | Very low | 226 Ų | 226 | 149 Ų | 149 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | trans | 68.3 | 92.6 | 138 | -144.6 | 169.1 | -160.3 | -116 | 1.9 | 117.5 | P154 | R152-P154 WeakPolarHBondContact O-CD 3.28Š| ||
| 153 | W | 33.9 | Very low | 44.9 | Very low | 255 Ų | 255 | 141.7 Ų | 141.7 | 97% | 0.966 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 128.9 | 148.1 | -65.6 | 98.1 | 0 | 0 | 0 | 110.2 | ||
| 154 | P | 48 | Very low | 45.5 | Very low | 94 Ų | 94 | 137.8 Ų | 137.8 | 61% | 0.61 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -95.8 | 145.8 | 146.8 | 4.7 | 15.7 | 0 | 0 | 0 | 109.4 | R152 R156 | R152-P154 WeakPolarHBondContact O-CD 3.28Å; P154-R156 PolarHBondContact O-N 2.86Å |
| 155 | P | 52.8 | Low | 45.9 | Very low | 127 Ų | 127 | 139.1 Ų | 139.1 | 83% | 0.825 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 119.1 | -176.2 | 32 | -30.5 | 0 | 0 | 0 | 109.5 | G157 | P155-G157 PolarHBondContact O-N 2.85Š|
| 156 | R | 43.3 | Very low | 46.8 | Very low | 241 Ų | 241 | 138.2 Ų | 138.2 | 91% | 0.909 | 74% | 0.736 | S | S | * | * | trans | -93 | 77.8 | 161.8 | -83.5 | -159.6 | -85.7 | -95.6 | 4.2 | 109.2 | P154 | P154-R156 PolarHBondContact O-N 2.86Š| ||
| 157 | G | 53.1 | Low | 47.4 | Very low | 54 Ų | 54 | 131.6 Ų | 131.6 | 56% | 0.557 | 72% | 0.719 | S | S | * | * | trans | -69.9 | 154.9 | 147 | 0 | 0 | 0 | 0 | 0 | 109.1 | P155 | P155-G157 PolarHBondContact O-N 2.85Š| ||
| 158 | T | 52 | Low | 48.1 | Very low | 141 Ų | 141 | 133 Ų | 133 | 87% | 0.865 | 71% | 0.714 | S | S | * | * | trans | 68.2 | 77.3 | 172.7 | 25.3 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 159 | Q | 48 | Very low | 48 | Very low | 177 Ų | 177 | 131.2 Ų | 131.2 | 83% | 0.827 | 70% | 0.698 | S | S | * | * | trans | -119.1 | 53 | 149.9 | -144.6 | 176.2 | 47.2 | 0 | 0 | 108.6 | ||||
| 160 | S | 51.9 | Low | 49.2 | Very low | 97 Ų | 97 | 129 Ų | 129 | 68% | 0.678 | 69% | 0.689 | S | S | * | * | trans | -105.3 | 141.9 | 154.6 | -178.3 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 161 | V | 52.1 | Low | 49.4 | Very low | 102 Ų | 102 | 134.3 Ų | 134.3 | 62% | 0.618 | 70% | 0.696 | S | S | * | * | trans | 84.5 | 55.3 | -175.8 | -151.5 | 0 | 0 | 0 | 0 | 115.8 | L164 | V161-L164 HydrophobicContact CG1-CB 4.27Å; V161-L164 HydrophobicContact CG1-CD1 4.37Å | ||
| 162 | C | 48.5 | Very low | 49.8 | Very low | 74 Ų | 74 | 135.9 Ų | 135.9 | 50% | 0.5 | 69% | 0.694 | S | S | . | * | S | Bend | trans | -101.1 | -19.3 | 153.8 | -74.5 | 0 | 0 | 0 | 0 | 112.8 | L164 | C162-L164 VanDerWaalsContact C-N 3.28Å; C162-L164 PolarHBondContact O-N 3.29Å |
| 163 | C | 53.1 | Low | 50.3 | Low | 102 Ų | 102 | 134.8 Ų | 134.8 | 69% | 0.689 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -9.9 | -174.9 | -47.6 | 0 | 0 | 0 | 0 | 114.8 | ||
| 164 | L | 54.5 | Low | 50.9 | Low | 106 Ų | 106 | 131.8 Ų | 131.8 | 56% | 0.555 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.5 | -21.9 | 179.5 | -65 | -178.4 | 0 | 0 | 0 | 113.6 | V161 C162 Q168 | V161-L164 HydrophobicContact CG1-CB 4.27Å; V161-L164 HydrophobicContact CG1-CD1 4.37Å; C162-L164 VanDerWaalsContact C-N 3.28Å; C162-L164 PolarHBondContact O-N 3.29Å; L164-Q168 PolarHBondContact O-N 3.31Å |
| 165 | Q | 49.1 | Very low | 50.8 | Low | 117 Ų | 117 | 133.6 Ų | 133.6 | 55% | 0.547 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -74.4 | -32.9 | 178.6 | -164.2 | 78.4 | 27 | 0 | 0 | 111.2 | Q168 N169 | Q165-Q168 PolarHBondContact O-N 3.42Å; Q165-N169 PolarHBondContact O-N 2.96Å; Q165-N169 VanDerWaalsContact O-N 3.16Å; Q165-N169 PolarHBondContact O-ND2 2.93Å |
| 166 | E | 57.9 | Low | 50.5 | Low | 145 Ų | 145 | 134.6 Ų | 134.6 | 68% | 0.678 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -72.3 | -35.3 | 179.1 | -68.7 | 177.4 | 176.1 | 0 | 0 | 112.4 | N169 A170 | E166-N169 PolarHBondContact O-N 2.82Å; E166-A170 PolarHBondContact O-N 3.01Å |
| 167 | L | 56.2 | Low | 50.9 | Low | 114 Ų | 114 | 127.8 Ų | 127.8 | 60% | 0.597 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -69.5 | -32.6 | 175 | -66.8 | 174.9 | 0 | 0 | 0 | 112.6 | H171 | L167-H171 PolarHBondContact O-CD2 3.32Å |
| 168 | Q | 53.4 | Low | 50.9 | Low | 128 Ų | 128 | 132.1 Ų | 132.1 | 60% | 0.598 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -76.7 | -26.8 | 175.8 | -72.9 | 178.8 | 16.1 | 0 | 0 | 113 | L164 Q165 | L164-Q168 PolarHBondContact O-N 3.31Å; Q165-Q168 PolarHBondContact O-N 3.42Å |
| 169 | N | 50.8 | Low | 51 | Low | 84 Ų | 84 | 134.7 Ų | 134.7 | 45% | 0.449 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -77.7 | -28.8 | 176.1 | -69.1 | -17.6 | 0 | 0 | 0 | 112.4 | Q165 E166 H171 R172 | Q165-N169 PolarHBondContact O-N 2.96Å; Q165-N169 VanDerWaalsContact O-N 3.16Å; Q165-N169 PolarHBondContact O-ND2 2.93Å; E166-N169 PolarHBondContact O-N 2.82Å; N169-H171 VanDerWaalsContact C-N 3.31Å; N169-H171 PolarHBondContact O-N 3.19Å; N169-R172 PolarHBondContact O-N 3.25Å |
| 170 | A | 56.4 | Low | 51.3 | Low | 75 Ų | 75 | 128.8 Ų | 128.8 | 62% | 0.62 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -66.5 | -31.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | E166 R172 | E166-A170 PolarHBondContact O-N 3.01Å; A170-R172 VanDerWaalsContact C-N 3.31Å; A170-R172 PolarHBondContact O-N 2.87Å |
| 171 | H | 50.3 | Low | 51.3 | Low | 176 Ų | 176 | 129.5 Ų | 129.5 | 82% | 0.815 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.1 | 2.6 | 177.5 | -80.5 | -65.8 | 0 | 0 | 0 | 114.6 | L167 N169 | L167-H171 PolarHBondContact O-CD2 3.32Å; N169-H171 VanDerWaalsContact C-N 3.31Å; N169-H171 PolarHBondContact O-N 3.19Å |
| 172 | R | 45.9 | Very low | 51.4 | Low | 218 Ų | 218 | 131 Ų | 131 | 82% | 0.823 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.2 | 7.9 | -175.7 | -107.7 | -171.4 | -179.4 | -168.9 | 1.2 | 115.4 | N169 A170 E174 | N169-R172 PolarHBondContact O-N 3.25Å; A170-R172 VanDerWaalsContact C-N 3.31Å; A170-R172 PolarHBondContact O-N 2.87Å; R172-E174 PolarHBondContact O-N 3.4Å |
| 173 | Y | 45.8 | Very low | 51.8 | Low | 203 Ų | 203 | 133.9 Ų | 133.9 | 80% | 0.796 | 69% | 0.692 | S | S | * | * | trans | -85.8 | 97.7 | 163.4 | -85.7 | -88.1 | 0 | 0 | 0 | 108.4 | V175 | Y173-V175 PolarHBondContact O-N 2.87Š| ||
| 174 | E | 46 | Very low | 52 | Low | 193 Ų | 193 | 134.8 Ų | 134.8 | 90% | 0.902 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 121.3 | 161.3 | -70.9 | -161.3 | 163.1 | 0 | 0 | 108.5 | R172 | R172-E174 PolarHBondContact O-N 3.4Š|
| 175 | V | 46.5 | Very low | 52.2 | Low | 132 Ų | 132 | 136.2 Ų | 136.2 | 80% | 0.8 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 125.6 | 169.5 | 171.4 | 0 | 0 | 0 | 0 | 107 | Y173 | Y173-V175 PolarHBondContact O-N 2.87Š|
| 176 | D | 44.9 | Very low | 52.7 | Low | 147 Ų | 147 | 135 Ų | 135 | 79% | 0.786 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 132.2 | 168.9 | -106.9 | -37.7 | 0 | 0 | 0 | 109.9 | D178 | D176-D178 PolarHBondContact O-N 3.45Å; D176-D178 VanDerWaalsContact O-N 3.1Å |
| 177 | P | 53.1 | Low | 53.3 | Low | 99 Ų | 99 | 130.5 Ų | 130.5 | 64% | 0.643 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -88.2 | 79.4 | -177.9 | 35.6 | -30.6 | 0 | 0 | 0 | 109.2 | L181 | P177-L181 HydrophobicContact CB-CD1 4.35Š|
| 178 | D | 52.5 | Low | 53.9 | Low | 145 Ų | 145 | 128.9 Ų | 128.9 | 78% | 0.775 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -156.7 | 126.3 | 156.8 | -136.6 | 1 | 0 | 0 | 0 | 110.6 | D176 | D176-D178 PolarHBondContact O-N 3.45Å; D176-D178 VanDerWaalsContact O-N 3.1Å |
| 179 | E | 55.1 | Low | 54.8 | Low | 195 Ų | 195 | 124.7 Ų | 124.7 | 91% | 0.911 | 66% | 0.661 | S | S | * | * | S | Bend | trans | 81.5 | 8.8 | 169.9 | -50.9 | -142.3 | 136.3 | 0 | 0 | 121.4 | ||
| 180 | G | 53.8 | Low | 55.9 | Low | 52 Ų | 52 | 123.1 Ų | 123.1 | 54% | 0.536 | 66% | 0.656 | S | S | . | * | trans | -132.8 | 2.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | D182 | G180-D182 PolarHBondContact O-N 2.71Š| ||
| 181 | L | 51 | Low | 57 | Low | 113 Ų | 113 | 127.9 Ų | 127.9 | 59% | 0.592 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -73.5 | -27 | -170.4 | -80 | 154 | 0 | 0 | 0 | 114.1 | P177 E185 | P177-L181 HydrophobicContact CB-CD1 4.35Å; L181-E185 PolarHBondContact O-N 3.49Å |
| 182 | D | 55 | Low | 58.5 | Low | 133 Ų | 133 | 127.6 Ų | 127.6 | 71% | 0.711 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -68.8 | -38.4 | -177.8 | -112.4 | -1.2 | 0 | 0 | 0 | 112.3 | G180 V186 | G180-D182 PolarHBondContact O-N 2.71Å; D182-V186 VanDerWaalsContact O-CB 3.24Å; D182-V186 WeakPolarHBondContact O-CB 3.4Å; D182-V186 WeakPolarHBondContact O-CG2 3.45Å; D182-V186 PolarHBondContact O-N 3.23Å |
| 183 | D | 56 | Low | 60.4 | Low | 134 Ų | 134 | 123.1 Ų | 123.1 | 72% | 0.717 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -75.8 | -33.7 | -174.8 | -162.8 | 48.3 | 0 | 0 | 0 | 112.5 | S187 | D183-S187 WeakPolarHBondContact O-CB 3.4Å; D183-S187 PolarHBondContact O-N 2.89Å |
| 184 | L | 57.1 | Low | 62.5 | Low | 122 Ų | 122 | 118.3 Ų | 118.3 | 64% | 0.639 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -78.8 | -37 | 178 | -168.6 | 63.6 | 0 | 0 | 0 | 112.3 | S187 V188 | L184-S187 PolarHBondContact O-N 2.87Å; L184-V188 VanDerWaalsContact O-CG2 3.3Å; L184-V188 WeakPolarHBondContact O-CG2 3.21Å; L184-V188 PolarHBondContact O-N 2.88Å |
| 185 | E | 59.1 | Low | 64.6 | Low | 136 Ų | 136 | 111.8 Ų | 111.8 | 64% | 0.636 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -65.7 | -39.9 | 171 | -86.4 | -166.5 | 144 | 0 | 0 | 111.7 | L181 V188 A189 | L181-E185 PolarHBondContact O-N 3.49Å; E185-V188 PolarHBondContact O-N 3.35Å; E185-A189 VanDerWaalsContact O-CB 3.23Å; E185-A189 WeakPolarHBondContact O-CB 3.37Å; E185-A189 PolarHBondContact O-N 3.32Å |
| 186 | V | 60.3 | Low | 66.7 | Low | 91 Ų | 91 | 110.6 Ų | 110.6 | 55% | 0.552 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -64 | -40.5 | 175.1 | 168.7 | 0 | 0 | 0 | 0 | 111.4 | D182 A189 S190 | D182-V186 VanDerWaalsContact O-CB 3.24Å; D182-V186 WeakPolarHBondContact O-CB 3.4Å; D182-V186 WeakPolarHBondContact O-CG2 3.45Å; D182-V186 PolarHBondContact O-N 3.23Å; V186-A189 PolarHBondContact O-N 3.22Å; V186-S190 WeakPolarHBondContact O-CB 3.3Å; V186-S190 PolarHBondContact O-N 2.95Å |
| 187 | S | 69.6 | Low | 69 | Low | 51 Ų | 51 | 106.7 Ų | 106.7 | 36% | 0.357 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.1 | -48.6 | 175 | -167.1 | 0 | 0 | 0 | 0 | 111.8 | D183 L184 A189 S190 W191 | D183-S187 WeakPolarHBondContact O-CB 3.4Å; D183-S187 PolarHBondContact O-N 2.89Å; L184-S187 PolarHBondContact O-N 2.87Å; S187-A189 VanDerWaalsContact C-N 3.31Å; S187-A189 PolarHBondContact O-N 3.49Å; S187-S190 PolarHBondContact O-N 2.84Å; S187-W191 PolarHBondContact O-N 3.5Å |
| 188 | V | 69.9 | Low | 71 | Confident | 79 Ų | 79 | 105.7 Ų | 105.7 | 48% | 0.479 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.7 | -34.6 | 178.9 | 172.9 | 0 | 0 | 0 | 0 | 112.1 | L184 E185 R192 | L184-V188 VanDerWaalsContact O-CG2 3.3Å; L184-V188 WeakPolarHBondContact O-CG2 3.21Å; L184-V188 PolarHBondContact O-N 2.88Å; E185-V188 PolarHBondContact O-N 3.35Å; V188-R192 WeakPolarHBondContact O-CB 3.19Å; V188-R192 PolarHBondContact O-N 3.48Å; V188-R192 VanDerWaalsContact O-N 3.14Å |
| 189 | A | 72.3 | Confident | 73.1 | Confident | 41 Ų | 41 | 103.8 Ų | 103.8 | 34% | 0.339 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.5 | -45.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | E185 V186 S187 R192 E193 | E185-A189 VanDerWaalsContact O-CB 3.23Å; E185-A189 WeakPolarHBondContact O-CB 3.37Å; E185-A189 PolarHBondContact O-N 3.32Å; V186-A189 PolarHBondContact O-N 3.22Å; S187-A189 VanDerWaalsContact C-N 3.31Å; S187-A189 PolarHBondContact O-N 3.49Å; A189-R192 WeakPolarHBondContact O-CB 3.4Å; A189-R192 PolarHBondContact O-N 3.14Å; A189-E193 WeakPolarHBondContact O-CG 3.48Å; A189-E193 PolarHBondContact O-N 2.85Å |
| 190 | S | 74.4 | Confident | 75.1 | Confident | 51 Ų | 51 | 98.3 Ų | 98.3 | 36% | 0.357 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.5 | -46.2 | 176.7 | 171 | 0 | 0 | 0 | 0 | 112.4 | V186 S187 R192 E193 E194 | V186-S190 WeakPolarHBondContact O-CB 3.3Å; V186-S190 PolarHBondContact O-N 2.95Å; S187-S190 PolarHBondContact O-N 2.84Å; S190-R192 VanDerWaalsContact C-N 3.3Å; S190-R192 PolarHBondContact O-N 2.99Å; S190-E193 PolarHBondContact O-N 3.49Å; S190-E194 WeakPolarHBondContact O-CG 3.42Å; S190-E194 PolarHBondContact O-N 3.38Å |
| 191 | W | 77.5 | Confident | 77.2 | Confident | 174 Ų | 174 | 100.9 Ų | 100.9 | 66% | 0.659 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.2 | -36 | 175.1 | -77 | 106.1 | 0 | 0 | 0 | 112.8 | S187 A195 | S187-W191 PolarHBondContact O-N 3.5Å; W191-A195 VanDerWaalsContact O-CB 3.28Å; W191-A195 WeakPolarHBondContact O-CB 3.27Å; W191-A195 PolarHBondContact O-N 3.22Å |
| 192 | R | 81.9 | Confident | 79.3 | Confident | 171 Ų | 171 | 98.6 Ų | 98.6 | 65% | 0.645 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.4 | -40.7 | 176.7 | -178.4 | -176 | -61.5 | -81.2 | -1.6 | 111.6 | V188 A189 S190 A195 Q196 | V188-R192 WeakPolarHBondContact O-CB 3.19Å; V188-R192 PolarHBondContact O-N 3.48Å; V188-R192 VanDerWaalsContact O-N 3.14Å; A189-R192 WeakPolarHBondContact O-CB 3.4Å; A189-R192 PolarHBondContact O-N 3.14Å; S190-R192 VanDerWaalsContact C-N 3.3Å; S190-R192 PolarHBondContact O-N 2.99Å; R192-A195 PolarHBondContact O-N 2.93Å; R192-Q196 VanDerWaalsContact O-CB 3.3Å; R192-Q196 WeakPolarHBondContact O-CB 3.4Å; R192-Q196 PolarHBondContact O-N 3.26Å |
| 193 | E | 87.4 | Confident | 81.4 | Confident | 124 Ų | 124 | 96.4 Ų | 96.4 | 58% | 0.579 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.1 | -43.7 | 176.2 | -73.5 | 177.1 | -178.1 | 0 | 0 | 111.2 | A189 S190 Q196 V197 | A189-E193 WeakPolarHBondContact O-CG 3.48Å; A189-E193 PolarHBondContact O-N 2.85Å; S190-E193 PolarHBondContact O-N 3.49Å; E193-Q196 PolarHBondContact O-N 3.14Å; E193-V197 WeakPolarHBondContact O-CB 3.29Å; E193-V197 VanDerWaalsContact O-CG2 3.28Å; E193-V197 WeakPolarHBondContact O-CG2 3.33Å; E193-V197 PolarHBondContact O-N 2.95Å |
| 194 | E | 88.7 | Confident | 83.4 | Confident | 101 Ų | 101 | 96 Ų | 96 | 47% | 0.472 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 174.4 | -71.4 | 177.6 | -174.9 | 0 | 0 | 112.2 | S190 Q196 V197 T198 | S190-E194 WeakPolarHBondContact O-CG 3.42Å; S190-E194 PolarHBondContact O-N 3.38Å; E194-Q196 VanDerWaalsContact C-N 3.29Å; E194-Q196 PolarHBondContact O-N 3.44Å; E194-V197 PolarHBondContact O-N 3.38Å; E194-T198 WeakPolarHBondContact O-CB 3.33Å; E194-T198 VanDerWaalsContact O-CG2 3.29Å; E194-T198 WeakPolarHBondContact O-CG2 3.24Å; E194-T198 PolarHBondContact O-N 2.86Å; E194-T198 PolarHBondContact O-OG1 3.13Å |
| 195 | A | 90.2 | Very high | 85.3 | Confident | 57 Ų | 57 | 92.3 Ų | 92.3 | 47% | 0.471 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.9 | -37.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | W191 R192 T198 L199 | W191-A195 VanDerWaalsContact O-CB 3.28Å; W191-A195 WeakPolarHBondContact O-CB 3.27Å; W191-A195 PolarHBondContact O-N 3.22Å; R192-A195 PolarHBondContact O-N 2.93Å; A195-T198 VanDerWaalsContact CA-OG1 3.29Å; A195-T198 WeakPolarHBondContact CA-OG1 3.45Å; A195-T198 PolarHBondContact O-OG1 2.7Å; A195-L199 WeakPolarHBondContact O-CB 3.35Å; A195-L199 PolarHBondContact O-N 3.44Å |
| 196 | Q | 90.6 | Very high | 87.1 | Confident | 107 Ų | 107 | 91 Ų | 91 | 50% | 0.5 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -70.4 | -41 | 176.6 | -172.8 | 178.4 | -0.5 | 0 | 0 | 111.6 | R192 E193 E194 L199 Q200 | R192-Q196 VanDerWaalsContact O-CB 3.3Å; R192-Q196 WeakPolarHBondContact O-CB 3.4Å; R192-Q196 PolarHBondContact O-N 3.26Å; E193-Q196 PolarHBondContact O-N 3.14Å; E194-Q196 VanDerWaalsContact C-N 3.29Å; E194-Q196 PolarHBondContact O-N 3.44Å; Q196-L199 PolarHBondContact O-N 2.99Å; Q196-Q200 WeakPolarHBondContact O-CB 3.41Å; Q196-Q200 WeakPolarHBondContact O-CG 3.45Å; Q196-Q200 PolarHBondContact O-N 3.45Å |
| 197 | V | 94.3 | Very high | 88.9 | Confident | 65 Ų | 65 | 92.8 Ų | 92.8 | 39% | 0.394 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.5 | -44.4 | 177.7 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | E193 E194 Q200 Q201 | E193-V197 WeakPolarHBondContact O-CB 3.29Å; E193-V197 VanDerWaalsContact O-CG2 3.28Å; E193-V197 WeakPolarHBondContact O-CG2 3.33Å; E193-V197 PolarHBondContact O-N 2.95Å; E194-V197 PolarHBondContact O-N 3.38Å; V197-Q200 PolarHBondContact O-N 2.87Å; V197-Q201 HydrophobicContact CG1-CG 4.45Å; V197-Q201 WeakPolarHBondContact O-CB 3.41Å; V197-Q201 VanDerWaalsContact O-CG 3.24Å; V197-Q201 WeakPolarHBondContact O-CG 3.24Å; V197-Q201 PolarHBondContact O-N 3.38Å |
| 198 | T | 94.6 | Very high | 90.2 | Very high | 78 Ų | 78 | 94.4 Ų | 94.4 | 48% | 0.479 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.9 | -41.4 | 175.6 | 51 | 0 | 0 | 0 | 0 | 111.5 | E194 A195 Q201 S202 | E194-T198 WeakPolarHBondContact O-CB 3.33Å; E194-T198 VanDerWaalsContact O-CG2 3.29Å; E194-T198 WeakPolarHBondContact O-CG2 3.24Å; E194-T198 PolarHBondContact O-N 2.86Å; E194-T198 PolarHBondContact O-OG1 3.13Å; A195-T198 VanDerWaalsContact CA-OG1 3.29Å; A195-T198 WeakPolarHBondContact CA-OG1 3.45Å; A195-T198 PolarHBondContact O-OG1 2.7Å; T198-Q201 PolarHBondContact O-N 3.48Å; T198-S202 WeakPolarHBondContact O-CB 3.39Å; T198-S202 PolarHBondContact O-N 3.4Å |
| 199 | L | 96.6 | Very high | 91.6 | Very high | 105 Ų | 105 | 96.1 Ų | 96.1 | 55% | 0.55 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.9 | -44.8 | 173.3 | -175.6 | 67.9 | 0 | 0 | 0 | 111.4 | A195 Q196 Q201 S202 L203 | A195-L199 WeakPolarHBondContact O-CB 3.35Å; A195-L199 PolarHBondContact O-N 3.44Å; Q196-L199 PolarHBondContact O-N 2.99Å; L199-Q201 VanDerWaalsContact C-N 3.34Å; L199-Q201 PolarHBondContact O-N 2.85Å; L199-S202 PolarHBondContact O-N 2.75Å; L199-S202 PolarHBondContact O-OG 3.24Å; L199-L203 HydrophobicContact CG-CD1 4.5Å; L199-L203 PolarHBondContact O-N 2.92Å |
| 200 | Q | 96.9 | Very high | 92.8 | Very high | 80 Ų | 80 | 100.9 Ų | 100.9 | 37% | 0.374 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -38.2 | 175.9 | -74.3 | 175.4 | 14.9 | 0 | 0 | 112.6 | Q196 V197 L203 R204 | Q196-Q200 WeakPolarHBondContact O-CB 3.41Å; Q196-Q200 WeakPolarHBondContact O-CG 3.45Å; Q196-Q200 PolarHBondContact O-N 3.45Å; V197-Q200 PolarHBondContact O-N 2.87Å; Q200-L203 PolarHBondContact O-N 3.4Å; Q200-R204 WeakPolarHBondContact O-CB 3.43Å; Q200-R204 WeakPolarHBondContact O-CG 3.41Å; Q200-R204 PolarHBondContact O-N 3.23Å |
| 201 | Q | 97.2 | Very high | 93.9 | Very high | 106 Ų | 106 | 101.1 Ų | 101.1 | 50% | 0.495 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64 | -42.3 | 173.6 | -73.4 | 171.5 | 6.7 | 0 | 0 | 111 | V197 T198 L199 R204 A205 | V197-Q201 HydrophobicContact CG1-CG 4.45Å; V197-Q201 WeakPolarHBondContact O-CB 3.41Å; V197-Q201 VanDerWaalsContact O-CG 3.24Å; V197-Q201 WeakPolarHBondContact O-CG 3.24Å; V197-Q201 PolarHBondContact O-N 3.38Å; T198-Q201 PolarHBondContact O-N 3.48Å; L199-Q201 VanDerWaalsContact C-N 3.34Å; L199-Q201 PolarHBondContact O-N 2.85Å; Q201-R204 PolarHBondContact O-N 3.5Å; Q201-A205 WeakPolarHBondContact O-CB 3.26Å; Q201-A205 PolarHBondContact O-N 3.41Å |
| 202 | S | 96.8 | Very high | 94.9 | Very high | 64 Ų | 64 | 96.2 Ų | 96.2 | 45% | 0.448 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.1 | -38.9 | 176.2 | 78.3 | 0 | 0 | 0 | 0 | 112.5 | T198 L199 A205 L206 | T198-S202 WeakPolarHBondContact O-CB 3.39Å; T198-S202 PolarHBondContact O-N 3.4Å; L199-S202 PolarHBondContact O-N 2.75Å; L199-S202 PolarHBondContact O-OG 3.24Å; S202-A205 PolarHBondContact O-N 3.33Å; S202-L206 WeakPolarHBondContact O-CB 3.33Å; S202-L206 PolarHBondContact O-N 3.48Å |
| 203 | L | 97.9 | Very high | 95.6 | Very high | 88 Ų | 88 | 91.4 Ų | 91.4 | 46% | 0.461 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.6 | -45.2 | 174 | -84.7 | 169.2 | 0 | 0 | 0 | 111.4 | L199 Q200 A205 L206 Q207 | L199-L203 HydrophobicContact CG-CD1 4.5Å; L199-L203 PolarHBondContact O-N 2.92Å; Q200-L203 PolarHBondContact O-N 3.4Å; L203-A205 VanDerWaalsContact C-N 3.35Å; L203-L206 PolarHBondContact O-N 3.41Å; L203-Q207 WeakPolarHBondContact O-CB 3.3Å; L203-Q207 VanDerWaalsContact O-CG 3.26Å; L203-Q207 WeakPolarHBondContact O-CG 3.4Å; L203-Q207 PolarHBondContact O-N 2.86Å |
| 204 | R | 97.6 | Very high | 96.1 | Very high | 126 Ų | 126 | 92.2 Ų | 92.2 | 48% | 0.475 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 175.6 | -75.5 | -177.7 | -114.2 | 124.4 | -5.4 | 111.2 | Q200 Q201 Q207 T208 | Q200-R204 WeakPolarHBondContact O-CB 3.43Å; Q200-R204 WeakPolarHBondContact O-CG 3.41Å; Q200-R204 PolarHBondContact O-N 3.23Å; Q201-R204 PolarHBondContact O-N 3.5Å; R204-Q207 PolarHBondContact O-N 3.35Å; R204-T208 VanDerWaalsContact O-CG2 3.24Å; R204-T208 WeakPolarHBondContact O-CG2 3.34Å; R204-T208 PolarHBondContact O-N 2.86Å; R204-T208 PolarHBondContact O-OG1 2.92Å |
| 205 | A | 97.3 | Very high | 96.6 | Very high | 43 Ų | 43 | 89.3 Ų | 89.3 | 36% | 0.355 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.2 | -47.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q201 S202 L203 Q207 T208 Q209 | Q201-A205 WeakPolarHBondContact O-CB 3.26Å; Q201-A205 PolarHBondContact O-N 3.41Å; S202-A205 PolarHBondContact O-N 3.33Å; L203-A205 VanDerWaalsContact C-N 3.35Å; A205-Q207 VanDerWaalsContact C-N 3.35Å; A205-Q207 PolarHBondContact O-N 2.99Å; A205-T208 PolarHBondContact O-N 3.22Å; A205-T208 PolarHBondContact O-OG1 3.43Å; A205-Q209 WeakPolarHBondContact O-CG 3.37Å; A205-Q209 PolarHBondContact O-N 3.33Å |
| 206 | L | 97.4 | Very high | 96.9 | Very high | 108 Ų | 108 | 93.7 Ų | 93.7 | 57% | 0.565 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -64 | -38.6 | 177.8 | -169.9 | 68.8 | 0 | 0 | 0 | 112.3 | S202 L203 Q209 F210 | S202-L206 WeakPolarHBondContact O-CB 3.33Å; S202-L206 PolarHBondContact O-N 3.48Å; L203-L206 PolarHBondContact O-N 3.41Å; L206-Q209 PolarHBondContact O-N 2.85Å; L206-F210 WeakPolarHBondContact O-CB 3.39Å; L206-F210 PolarHBondContact O-N 2.9Å |
| 207 | Q | 98.1 | Very high | 97.3 | Very high | 129 Ų | 129 | 95.3 Ų | 95.3 | 60% | 0.603 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62.4 | -44 | 173.7 | -76.4 | 172.4 | -8.6 | 0 | 0 | 111.7 | L203 R204 A205 F210 A211 | L203-Q207 WeakPolarHBondContact O-CB 3.3Å; L203-Q207 VanDerWaalsContact O-CG 3.26Å; L203-Q207 WeakPolarHBondContact O-CG 3.4Å; L203-Q207 PolarHBondContact O-N 2.86Å; R204-Q207 PolarHBondContact O-N 3.35Å; A205-Q207 VanDerWaalsContact C-N 3.35Å; A205-Q207 PolarHBondContact O-N 2.99Å; Q207-F210 PolarHBondContact O-N 3.34Å; Q207-A211 PolarHBondContact O-N 2.84Å |
| 208 | T | 97.5 | Very high | 97.5 | Very high | 85 Ų | 85 | 96.6 Ų | 96.6 | 52% | 0.521 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.6 | -41.7 | 175.2 | 64.1 | 0 | 0 | 0 | 0 | 111.7 | R204 A205 F210 A211 T212 | R204-T208 VanDerWaalsContact O-CG2 3.24Å; R204-T208 WeakPolarHBondContact O-CG2 3.34Å; R204-T208 PolarHBondContact O-N 2.86Å; R204-T208 PolarHBondContact O-OG1 2.92Å; A205-T208 PolarHBondContact O-N 3.22Å; A205-T208 PolarHBondContact O-OG1 3.43Å; T208-F210 PolarHBondContact O-N 2.97Å; T208-A211 PolarHBondContact O-N 2.85Å; T208-T212 WeakPolarHBondContact O-CG2 3.33Å; T208-T212 PolarHBondContact O-N 2.88Å; T208-T212 PolarHBondContact O-OG1 2.73Å |
| 209 | Q | 97.6 | Very high | 97.7 | Very high | 115 Ų | 115 | 98.4 Ų | 98.4 | 54% | 0.537 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 175.8 | -75.1 | 179.4 | -4.1 | 0 | 0 | 111.1 | A205 L206 A211 T212 E213 | A205-Q209 WeakPolarHBondContact O-CG 3.37Å; A205-Q209 PolarHBondContact O-N 3.33Å; L206-Q209 PolarHBondContact O-N 2.85Å; Q209-A211 VanDerWaalsContact C-N 3.33Å; Q209-A211 PolarHBondContact O-N 2.94Å; Q209-T212 WeakPolarHBondContact CA-OG1 3.4Å; Q209-T212 PolarHBondContact O-N 3.31Å; Q209-T212 PolarHBondContact O-OG1 3.06Å; Q209-E213 VanDerWaalsContact O-CB 3.24Å; Q209-E213 WeakPolarHBondContact O-CB 3.29Å; Q209-E213 WeakPolarHBondContact O-CG 3.38Å; Q209-E213 PolarHBondContact O-N 2.98Å |
| 210 | F | 98 | Very high | 97.6 | Very high | 141 Ų | 141 | 95.9 Ų | 95.9 | 62% | 0.618 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59.5 | -42 | 175.8 | -177.9 | -96 | 0 | 0 | 0 | 112.2 | L206 Q207 T208 E213 R214 | L206-F210 WeakPolarHBondContact O-CB 3.39Å; L206-F210 PolarHBondContact O-N 2.9Å; Q207-F210 PolarHBondContact O-N 3.34Å; T208-F210 PolarHBondContact O-N 2.97Å; F210-E213 PolarHBondContact O-N 3.47Å; F210-R214 WeakPolarHBondContact O-CB 3.49Å; F210-R214 PolarHBondContact O-N 3.46Å |
| 211 | A | 98.2 | Very high | 97.7 | Very high | 57 Ų | 57 | 97.6 Ų | 97.6 | 47% | 0.471 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q207 T208 Q209 E213 R214 A215 | Q207-A211 PolarHBondContact O-N 2.84Å; T208-A211 PolarHBondContact O-N 2.85Å; Q209-A211 VanDerWaalsContact C-N 3.33Å; Q209-A211 PolarHBondContact O-N 2.94Å; A211-E213 PolarHBondContact O-N 3.35Å; A211-R214 PolarHBondContact O-N 3.19Å; A211-A215 PolarHBondContact O-N 3.16Å |
| 212 | T | 97.5 | Very high | 97.8 | Very high | 71 Ų | 71 | 96.1 Ų | 96.1 | 44% | 0.436 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65 | -39.5 | 176.8 | 57.4 | 0 | 0 | 0 | 0 | 112.4 | T208 Q209 R214 A215 R216 | T208-T212 WeakPolarHBondContact O-CG2 3.33Å; T208-T212 PolarHBondContact O-N 2.88Å; T208-T212 PolarHBondContact O-OG1 2.73Å; Q209-T212 WeakPolarHBondContact CA-OG1 3.4Å; Q209-T212 PolarHBondContact O-N 3.31Å; Q209-T212 PolarHBondContact O-OG1 3.06Å; T212-R214 VanDerWaalsContact C-N 3.3Å; T212-R214 PolarHBondContact O-N 2.74Å; T212-A215 PolarHBondContact O-N 2.79Å; T212-R216 WeakPolarHBondContact O-CG 3.34Å; T212-R216 PolarHBondContact O-N 3.38Å |
| 213 | E | 97.9 | Very high | 97.8 | Very high | 70 Ų | 70 | 99 Ų | 99 | 33% | 0.327 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68 | -32 | 176.9 | -85.8 | -61.1 | 127.9 | 0 | 0 | 112.2 | Q209 F210 A211 R216 R217 | Q209-E213 VanDerWaalsContact O-CB 3.24Å; Q209-E213 WeakPolarHBondContact O-CB 3.29Å; Q209-E213 WeakPolarHBondContact O-CG 3.38Å; Q209-E213 PolarHBondContact O-N 2.98Å; F210-E213 PolarHBondContact O-N 3.47Å; A211-E213 PolarHBondContact O-N 3.35Å; E213-R216 IonicContact OE1-NH1 2.8Å; E213-R216 PolarHBondContact OE1-NH1 2.92Å; E213-R217 WeakPolarHBondContact O-CG 3.48Å; E213-R217 PolarHBondContact O-N 3.5Å; E213-R217 PolarHBondContact O-NH1 3.07Å; E213-R217 IonicContact OE2-CZ 3.4Å; E213-R217 IonicContact OE2-NH1 3.79Å; E213-R217 PolarHBondContact OE2-NH1 2.94Å; E213-R217 IonicContact OE2-NH2 3.79Å |
| 214 | R | 98.1 | Very high | 97.8 | Very high | 140 Ų | 140 | 97.6 Ų | 97.6 | 53% | 0.528 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70.7 | -45.9 | 172.9 | -170.3 | 179.9 | -178.8 | 97 | 4.8 | 111.5 | F210 A211 T212 R216 R217 E218 | F210-R214 WeakPolarHBondContact O-CB 3.49Å; F210-R214 PolarHBondContact O-N 3.46Å; A211-R214 PolarHBondContact O-N 3.19Å; T212-R214 VanDerWaalsContact C-N 3.3Å; T212-R214 PolarHBondContact O-N 2.74Å; R214-R216 VanDerWaalsContact C-N 3.35Å; R214-R216 PolarHBondContact O-N 3.09Å; R214-R217 WeakPolarHBondContact O-CB 3.37Å; R214-R217 PolarHBondContact O-N 3.35Å; R214-R217 VanDerWaalsContact O-N 3.16Å; R214-E218 WeakPolarHBondContact CG-OE1 3.25Å; R214-E218 IonicContact CZ-OE1 3.01Å; R214-E218 IonicContact NE-OE1 2.94Å; R214-E218 PolarHBondContact NE-OE1 3.49Å; R214-E218 IonicContact NH2-OE1 3.94Å; R214-E218 WeakPolarHBondContact O-CG 3.39Å; R214-E218 PolarHBondContact O-N 3.11Å |
| 215 | A | 97.8 | Very high | 97.8 | Very high | 41 Ų | 41 | 96.2 Ų | 96.2 | 34% | 0.339 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.6 | -45.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A211 T212 R217 E218 E219 | A211-A215 PolarHBondContact O-N 3.16Å; T212-A215 PolarHBondContact O-N 2.79Å; A215-R217 VanDerWaalsContact C-N 3.31Å; A215-R217 PolarHBondContact O-N 3.08Å; A215-E218 PolarHBondContact O-N 3.29Å; A215-E219 WeakPolarHBondContact O-CG 3.49Å; A215-E219 PolarHBondContact O-N 2.89Å |
| 216 | R | 97.9 | Very high | 97.9 | Very high | 149 Ų | 149 | 98.4 Ų | 98.4 | 56% | 0.562 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.9 | -37.9 | 175.2 | -73.7 | 174.8 | -179.4 | 167 | -2.7 | 113.4 | T212 E213 R214 A220 | T212-R216 WeakPolarHBondContact O-CG 3.34Å; T212-R216 PolarHBondContact O-N 3.38Å; E213-R216 IonicContact OE1-NH1 2.8Å; E213-R216 PolarHBondContact OE1-NH1 2.92Å; R214-R216 VanDerWaalsContact C-N 3.35Å; R214-R216 PolarHBondContact O-N 3.09Å; R216-A220 WeakPolarHBondContact O-CB 3.25Å; R216-A220 PolarHBondContact O-N 2.71Å |
| 217 | R | 98.1 | Very high | 97.9 | Very high | 140 Ų | 140 | 98 Ų | 98 | 53% | 0.528 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.2 | -45.2 | 175.1 | -79.4 | 175.8 | -177.2 | 70.9 | 0.2 | 111.2 | E213 R214 A215 E219 A220 E221 | E213-R217 WeakPolarHBondContact O-CG 3.48Å; E213-R217 PolarHBondContact O-N 3.5Å; E213-R217 PolarHBondContact O-NH1 3.07Å; E213-R217 IonicContact OE2-CZ 3.4Å; E213-R217 IonicContact OE2-NH1 3.79Å; E213-R217 PolarHBondContact OE2-NH1 2.94Å; E213-R217 IonicContact OE2-NH2 3.79Å; R214-R217 WeakPolarHBondContact O-CB 3.37Å; R214-R217 PolarHBondContact O-N 3.35Å; R214-R217 VanDerWaalsContact O-N 3.16Å; A215-R217 VanDerWaalsContact C-N 3.31Å; A215-R217 PolarHBondContact O-N 3.08Å; R217-E219 VanDerWaalsContact C-N 3.35Å; R217-A220 PolarHBondContact O-N 3.39Å; R217-E221 WeakPolarHBondContact O-CB 3.36Å; R217-E221 VanDerWaalsContact O-CG 3.29Å; R217-E221 WeakPolarHBondContact O-CG 3.34Å; R217-E221 PolarHBondContact O-N 3.34Å |
| 218 | E | 98.4 | Very high | 97.9 | Very high | 93 Ų | 93 | 94.6 Ų | 94.6 | 44% | 0.435 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 178.3 | -70 | 171.1 | -172.7 | 0 | 0 | 110.9 | R214 A215 E221 T222 | R214-E218 WeakPolarHBondContact CG-OE1 3.25Å; R214-E218 IonicContact CZ-OE1 3.01Å; R214-E218 IonicContact NE-OE1 2.94Å; R214-E218 PolarHBondContact NE-OE1 3.49Å; R214-E218 IonicContact NH2-OE1 3.94Å; R214-E218 WeakPolarHBondContact O-CG 3.39Å; R214-E218 PolarHBondContact O-N 3.11Å; A215-E218 PolarHBondContact O-N 3.29Å; E218-E221 PolarHBondContact O-N 2.98Å; E218-T222 WeakPolarHBondContact O-CG2 3.4Å; E218-T222 PolarHBondContact O-N 2.81Å; E218-T222 PolarHBondContact O-OG1 2.87Å |
| 219 | E | 98.2 | Very high | 98 | Very high | 115 Ų | 115 | 98.2 Ų | 98.2 | 54% | 0.537 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.9 | -53.4 | 172.5 | -72.9 | 167.7 | -176.7 | 0 | 0 | 111.1 | A215 R217 E221 T222 E223 | A215-E219 WeakPolarHBondContact O-CG 3.49Å; A215-E219 PolarHBondContact O-N 2.89Å; R217-E219 VanDerWaalsContact C-N 3.35Å; E219-E221 VanDerWaalsContact C-N 3.28Å; E219-E221 PolarHBondContact O-N 2.88Å; E219-T222 PolarHBondContact O-N 2.94Å; E219-T222 VanDerWaalsContact O-N 3.07Å; E219-T222 PolarHBondContact O-OG1 2.82Å; E219-E223 PolarHBondContact O-N 3.01Å |
| 220 | A | 96.1 | Very high | 98 | Very high | 53 Ų | 53 | 98.2 Ų | 98.2 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.9 | -36.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | R216 R217 A224 | R216-A220 WeakPolarHBondContact O-CB 3.25Å; R216-A220 PolarHBondContact O-N 2.71Å; R217-A220 PolarHBondContact O-N 3.39Å; A220-A224 VanDerWaalsContact O-CB 3.3Å; A220-A224 WeakPolarHBondContact O-CB 3.49Å; A220-A224 PolarHBondContact O-N 3.05Å |
| 221 | E | 98.3 | Very high | 97.9 | Very high | 116 Ų | 116 | 95.9 Ų | 95.9 | 54% | 0.542 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.9 | -40.5 | 174.9 | -78.9 | 175.2 | -164.4 | 0 | 0 | 111.8 | R217 E218 E219 A224 Q225 | R217-E221 WeakPolarHBondContact O-CB 3.36Å; R217-E221 VanDerWaalsContact O-CG 3.29Å; R217-E221 WeakPolarHBondContact O-CG 3.34Å; R217-E221 PolarHBondContact O-N 3.34Å; E218-E221 PolarHBondContact O-N 2.98Å; E219-E221 VanDerWaalsContact C-N 3.28Å; E219-E221 PolarHBondContact O-N 2.88Å; E221-A224 PolarHBondContact O-N 3.44Å; E221-Q225 VanDerWaalsContact O-CG 3.23Å; E221-Q225 WeakPolarHBondContact O-CG 3.49Å; E221-Q225 PolarHBondContact O-N 2.89Å |
| 222 | T | 98.4 | Very high | 97.9 | Very high | 75 Ų | 75 | 95.6 Ų | 95.6 | 46% | 0.46 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.1 | -41.9 | 175.8 | 58 | 0 | 0 | 0 | 0 | 112.4 | E218 E219 Q225 L226 | E218-T222 WeakPolarHBondContact O-CG2 3.4Å; E218-T222 PolarHBondContact O-N 2.81Å; E218-T222 PolarHBondContact O-OG1 2.87Å; E219-T222 PolarHBondContact O-N 2.94Å; E219-T222 VanDerWaalsContact O-N 3.07Å; E219-T222 PolarHBondContact O-OG1 2.82Å; T222-Q225 PolarHBondContact O-N 3.19Å; T222-L226 WeakPolarHBondContact O-CG 3.31Å; T222-L226 PolarHBondContact O-N 3.28Å |
| 223 | E | 98.3 | Very high | 98 | Very high | 124 Ų | 124 | 94.5 Ų | 94.5 | 58% | 0.579 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.5 | -46.5 | 173 | -71.7 | 177.9 | -178.9 | 0 | 0 | 111.4 | E219 Q225 L226 L227 | E219-E223 PolarHBondContact O-N 3.01Å; E223-Q225 VanDerWaalsContact C-N 3.28Å; E223-Q225 PolarHBondContact O-N 3.08Å; E223-L226 PolarHBondContact O-N 3.43Å; E223-L226 VanDerWaalsContact O-N 3.12Å; E223-L227 WeakPolarHBondContact O-CG 3.31Å; E223-L227 PolarHBondContact O-N 3Å |
| 224 | A | 96.9 | Very high | 98 | Very high | 58 Ų | 58 | 95.5 Ų | 95.5 | 48% | 0.479 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.1 | -38.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A220 E221 A228 | A220-A224 VanDerWaalsContact O-CB 3.3Å; A220-A224 WeakPolarHBondContact O-CB 3.49Å; A220-A224 PolarHBondContact O-N 3.05Å; E221-A224 PolarHBondContact O-N 3.44Å; A224-A228 WeakPolarHBondContact O-CB 3.43Å; A224-A228 PolarHBondContact O-N 3.34Å |
| 225 | Q | 98.4 | Very high | 98 | Very high | 97 Ų | 97 | 95.1 Ų | 95.1 | 45% | 0.453 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.1 | -38.5 | 175.1 | -73.1 | 170.8 | 29.1 | 0 | 0 | 112.6 | E221 T222 E223 A228 R229 | E221-Q225 VanDerWaalsContact O-CG 3.23Å; E221-Q225 WeakPolarHBondContact O-CG 3.49Å; E221-Q225 PolarHBondContact O-N 2.89Å; T222-Q225 PolarHBondContact O-N 3.19Å; E223-Q225 VanDerWaalsContact C-N 3.28Å; E223-Q225 PolarHBondContact O-N 3.08Å; Q225-A228 PolarHBondContact O-N 2.93Å; Q225-R229 WeakPolarHBondContact O-CG 3.46Å; Q225-R229 PolarHBondContact O-N 3.43Å; Q225-R229 VanDerWaalsContact O-N 3.14Å |
| 226 | L | 98.3 | Very high | 98 | Very high | 89 Ų | 89 | 98.4 Ų | 98.4 | 47% | 0.466 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -49.2 | 175.6 | -71.1 | 170.8 | 0 | 0 | 0 | 110.7 | T222 E223 A228 R229 E230 | T222-L226 WeakPolarHBondContact O-CG 3.31Å; T222-L226 PolarHBondContact O-N 3.28Å; E223-L226 PolarHBondContact O-N 3.43Å; E223-L226 VanDerWaalsContact O-N 3.12Å; L226-A228 VanDerWaalsContact C-N 3.27Å; L226-A228 PolarHBondContact O-N 3.5Å; L226-R229 WeakPolarHBondContact O-CB 3.42Å; L226-R229 PolarHBondContact O-N 3.25Å; L226-E230 PolarHBondContact O-N 3.14Å |
| 227 | L | 98 | Very high | 98 | Very high | 99 Ų | 99 | 96.6 Ų | 96.6 | 52% | 0.518 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.3 | -37.9 | 176.1 | -68.1 | 174.7 | 0 | 0 | 0 | 112.1 | E223 R229 E230 N231 | E223-L227 WeakPolarHBondContact O-CG 3.31Å; E223-L227 PolarHBondContact O-N 3Å; L227-R229 VanDerWaalsContact C-N 3.34Å; L227-R229 PolarHBondContact O-N 3.42Å; L227-E230 PolarHBondContact O-N 3.02Å; L227-N231 WeakPolarHBondContact O-CB 3.45Å; L227-N231 PolarHBondContact O-N 3.18Å; L227-N231 PolarHBondContact O-ND2 3.35Å |
| 228 | A | 98.3 | Very high | 98 | Very high | 58 Ų | 58 | 94.9 Ų | 94.9 | 48% | 0.479 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.7 | -38.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A224 Q225 L226 A232 | A224-A228 WeakPolarHBondContact O-CB 3.43Å; A224-A228 PolarHBondContact O-N 3.34Å; Q225-A228 PolarHBondContact O-N 2.93Å; L226-A228 VanDerWaalsContact C-N 3.27Å; L226-A228 PolarHBondContact O-N 3.5Å; A228-A232 WeakPolarHBondContact O-CB 3.23Å; A228-A232 PolarHBondContact O-N 2.87Å |
| 229 | R | 98.4 | Very high | 98 | Very high | 161 Ų | 161 | 93.1 Ų | 93.1 | 61% | 0.608 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -68.4 | -42 | 175.7 | -68.8 | 168.9 | -170.8 | 157.9 | 7.6 | 111.6 | Q225 L226 L227 A232 A233 | Q225-R229 WeakPolarHBondContact O-CG 3.46Å; Q225-R229 PolarHBondContact O-N 3.43Å; Q225-R229 VanDerWaalsContact O-N 3.14Å; L226-R229 WeakPolarHBondContact O-CB 3.42Å; L226-R229 PolarHBondContact O-N 3.25Å; L227-R229 VanDerWaalsContact C-N 3.34Å; L227-R229 PolarHBondContact O-N 3.42Å; R229-A232 PolarHBondContact O-N 3.28Å; R229-A233 PolarHBondContact O-N 2.96Å |
| 230 | E | 98.4 | Very high | 98 | Very high | 115 Ų | 115 | 94.8 Ų | 94.8 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -46.1 | 176.5 | -70.2 | 176 | 179.8 | 0 | 0 | 111.2 | L226 L227 A232 A233 L234 | L226-E230 PolarHBondContact O-N 3.14Å; L227-E230 PolarHBondContact O-N 3.02Å; E230-A232 PolarHBondContact O-N 2.93Å; E230-A233 WeakPolarHBondContact O-CB 3.44Å; E230-A233 PolarHBondContact O-N 2.91Å; E230-A233 VanDerWaalsContact O-N 3.13Å; E230-L234 WeakPolarHBondContact O-CG 3.44Å; E230-L234 PolarHBondContact O-N 2.96Å |
| 231 | N | 96.8 | Very high | 98 | Very high | 92 Ų | 92 | 97.5 Ų | 97.5 | 49% | 0.492 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.9 | -46.1 | 174.6 | -79.8 | -30.1 | 0 | 0 | 0 | 111.8 | L227 A233 L234 E235 | L227-N231 WeakPolarHBondContact O-CB 3.45Å; L227-N231 PolarHBondContact O-N 3.18Å; L227-N231 PolarHBondContact O-ND2 3.35Å; N231-A233 VanDerWaalsContact C-N 3.3Å; N231-A233 PolarHBondContact O-N 3.03Å; N231-L234 PolarHBondContact O-N 3.12Å; N231-E235 WeakPolarHBondContact O-CG 3.45Å; N231-E235 PolarHBondContact O-N 3.33Å |
| 232 | A | 98.3 | Very high | 98 | Very high | 52 Ų | 52 | 97.8 Ų | 97.8 | 43% | 0.43 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.9 | -36.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A228 R229 E230 Q236 | A228-A232 WeakPolarHBondContact O-CB 3.23Å; A228-A232 PolarHBondContact O-N 2.87Å; R229-A232 PolarHBondContact O-N 3.28Å; E230-A232 PolarHBondContact O-N 2.93Å; A232-Q236 PolarHBondContact O-N 3.47Å |
| 233 | A | 98.4 | Very high | 98 | Very high | 48 Ų | 48 | 96.2 Ų | 96.2 | 40% | 0.397 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.1 | -41.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | R229 E230 N231 Q236 Q237 | R229-A233 PolarHBondContact O-N 2.96Å; E230-A233 WeakPolarHBondContact O-CB 3.44Å; E230-A233 PolarHBondContact O-N 2.91Å; E230-A233 VanDerWaalsContact O-N 3.13Å; N231-A233 VanDerWaalsContact C-N 3.3Å; N231-A233 PolarHBondContact O-N 3.03Å; A233-Q236 WeakPolarHBondContact O-CB 3.38Å; A233-Q236 PolarHBondContact O-N 3.31Å; A233-Q237 WeakPolarHBondContact O-CG 3.48Å; A233-Q237 PolarHBondContact O-N 2.95Å |
| 234 | L | 97.9 | Very high | 98 | Very high | 90 Ų | 90 | 93.9 Ų | 93.9 | 47% | 0.471 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.9 | -43.8 | 175.4 | -69.2 | 173.4 | 0 | 0 | 0 | 111.4 | E230 N231 Q236 Q237 L238 | E230-L234 WeakPolarHBondContact O-CG 3.44Å; E230-L234 PolarHBondContact O-N 2.96Å; N231-L234 PolarHBondContact O-N 3.12Å; L234-Q236 VanDerWaalsContact C-N 3.28Å; L234-Q236 PolarHBondContact O-N 2.98Å; L234-Q237 WeakPolarHBondContact O-CB 3.44Å; L234-Q237 PolarHBondContact O-N 3.28Å; L234-Q237 VanDerWaalsContact O-N 3.11Å; L234-L238 WeakPolarHBondContact O-CG 3.36Å; L234-L238 PolarHBondContact O-N 3.37Å |
| 235 | E | 97.9 | Very high | 98 | Very high | 133 Ų | 133 | 97.3 Ų | 97.3 | 62% | 0.621 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -57.8 | -42.1 | 173.3 | -74.6 | 175.4 | 179.2 | 0 | 0 | 111.4 | N231 Q237 L238 A239 | N231-E235 WeakPolarHBondContact O-CG 3.45Å; N231-E235 PolarHBondContact O-N 3.33Å; E235-Q237 PolarHBondContact O-N 3.07Å; E235-L238 PolarHBondContact O-N 3.28Å; E235-A239 WeakPolarHBondContact O-CB 3.43Å; E235-A239 PolarHBondContact O-N 3.35Å |
| 236 | Q | 98.3 | Very high | 98 | Very high | 110 Ų | 110 | 94.7 Ų | 94.7 | 51% | 0.514 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 175.4 | -168.9 | -175.7 | 22.8 | 0 | 0 | 112.2 | A232 A233 L234 R240 | A232-Q236 PolarHBondContact O-N 3.47Å; A233-Q236 WeakPolarHBondContact O-CB 3.38Å; A233-Q236 PolarHBondContact O-N 3.31Å; L234-Q236 VanDerWaalsContact C-N 3.28Å; L234-Q236 PolarHBondContact O-N 2.98Å; Q236-R240 VanDerWaalsContact CD-NH2 3.28Å; Q236-R240 WeakPolarHBondContact O-CG 3.38Å; Q236-R240 PolarHBondContact O-N 3.01Å; Q236-R240 VanDerWaalsContact O-N 3.14Å |
| 237 | Q | 98.2 | Very high | 97.9 | Very high | 111 Ų | 111 | 96 Ų | 96 | 52% | 0.519 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.8 | -42.9 | 175.9 | -73.7 | 179.5 | -18.3 | 0 | 0 | 111.6 | A233 L234 E235 R240 M241 | A233-Q237 WeakPolarHBondContact O-CG 3.48Å; A233-Q237 PolarHBondContact O-N 2.95Å; L234-Q237 WeakPolarHBondContact O-CB 3.44Å; L234-Q237 PolarHBondContact O-N 3.28Å; L234-Q237 VanDerWaalsContact O-N 3.11Å; E235-Q237 PolarHBondContact O-N 3.07Å; Q237-R240 WeakPolarHBondContact O-CB 3.37Å; Q237-R240 PolarHBondContact O-N 2.97Å; Q237-M241 WeakPolarHBondContact O-CG 3.48Å; Q237-M241 PolarHBondContact O-N 2.68Å |
| 238 | L | 98.1 | Very high | 97.9 | Very high | 104 Ų | 104 | 95 Ų | 95 | 55% | 0.545 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -48 | 174.9 | -72.8 | 173.7 | 0 | 0 | 0 | 111 | L234 E235 R240 M241 E242 | L234-L238 WeakPolarHBondContact O-CG 3.36Å; L234-L238 PolarHBondContact O-N 3.37Å; E235-L238 PolarHBondContact O-N 3.28Å; L238-R240 VanDerWaalsContact C-N 3.26Å; L238-R240 PolarHBondContact O-N 2.96Å; L238-M241 CarbonylContact O-C 3.6Å; L238-M241 WeakPolarHBondContact O-CB 3.39Å; L238-M241 PolarHBondContact O-N 3.24Å; L238-E242 WeakPolarHBondContact O-CB 3.43Å; L238-E242 WeakPolarHBondContact O-CG 3.49Å; L238-E242 PolarHBondContact O-N 3.36Å |
| 239 | A | 98.1 | Very high | 97.9 | Very high | 55 Ų | 55 | 94.5 Ų | 94.5 | 46% | 0.455 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.5 | -36.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | E235 G243 | E235-A239 WeakPolarHBondContact O-CB 3.43Å; E235-A239 PolarHBondContact O-N 3.35Å; A239-G243 PolarHBondContact O-N 3.11Å |
| 240 | R | 98.2 | Very high | 97.9 | Very high | 151 Ų | 151 | 91 Ų | 91 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.5 | -44.4 | 173.8 | -69.5 | 172 | -171.4 | 176.9 | 5.8 | 111.6 | Q236 Q237 L238 G243 C244 | Q236-R240 VanDerWaalsContact CD-NH2 3.28Å; Q236-R240 WeakPolarHBondContact O-CG 3.38Å; Q236-R240 PolarHBondContact O-N 3.01Å; Q236-R240 VanDerWaalsContact O-N 3.14Å; Q237-R240 WeakPolarHBondContact O-CB 3.37Å; Q237-R240 PolarHBondContact O-N 2.97Å; L238-R240 VanDerWaalsContact C-N 3.26Å; L238-R240 PolarHBondContact O-N 2.96Å; R240-G243 PolarHBondContact O-N 3.48Å; R240-C244 PolarHBondContact O-N 3.38Å; R240-C244 PolarHBondContact O-SG 2.97Å; R240-C244 VanDerWaalsContact O-SG 3.39Å |
| 241 | M | 97.1 | Very high | 97.8 | Very high | 109 Ų | 109 | 89.3 Ų | 89.3 | 54% | 0.537 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 178.2 | -71.9 | -60.6 | -61.9 | 0 | 0 | 111.8 | Q237 L238 G243 C244 Q245 | Q237-M241 WeakPolarHBondContact O-CG 3.48Å; Q237-M241 PolarHBondContact O-N 2.68Å; L238-M241 CarbonylContact O-C 3.6Å; L238-M241 WeakPolarHBondContact O-CB 3.39Å; L238-M241 PolarHBondContact O-N 3.24Å; M241-G243 VanDerWaalsContact C-N 3.32Å; M241-G243 PolarHBondContact O-N 2.84Å; M241-C244 WeakPolarHBondContact O-CB 3.49Å; M241-C244 PolarHBondContact O-N 2.85Å; M241-Q245 WeakPolarHBondContact O-CG 3.48Å; M241-Q245 PolarHBondContact O-N 3.31Å |
| 242 | E | 98.1 | Very high | 97.9 | Very high | 122 Ų | 122 | 90.6 Ų | 90.6 | 57% | 0.57 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60 | -42 | 173.4 | -71.5 | 172.7 | 174.2 | 0 | 0 | 111.1 | L238 C244 Q245 A246 | L238-E242 WeakPolarHBondContact O-CB 3.43Å; L238-E242 WeakPolarHBondContact O-CG 3.49Å; L238-E242 PolarHBondContact O-N 3.36Å; E242-C244 PolarHBondContact O-N 3.21Å; E242-Q245 PolarHBondContact O-N 3.36Å; E242-A246 WeakPolarHBondContact O-CB 3.41Å; E242-A246 PolarHBondContact O-N 3Å |
| 243 | G | 97.8 | Very high | 97.8 | Very high | 42 Ų | 42 | 94 Ų | 94 | 43% | 0.433 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.1 | -42.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | A239 R240 M241 A246 R247 | A239-G243 PolarHBondContact O-N 3.11Å; R240-G243 PolarHBondContact O-N 3.48Å; M241-G243 VanDerWaalsContact C-N 3.32Å; M241-G243 PolarHBondContact O-N 2.84Å; G243-A246 PolarHBondContact O-N 3.42Å; G243-R247 PolarHBondContact O-N 2.97Å; G243-R247 VanDerWaalsContact O-N 3.07Å |
| 244 | C | 97.5 | Very high | 97.8 | Very high | 76 Ų | 76 | 95.9 Ų | 95.9 | 51% | 0.514 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 173.6 | -68.6 | 0 | 0 | 0 | 0 | 112 | R240 M241 E242 R247 V248 | R240-C244 PolarHBondContact O-N 3.38Å; R240-C244 PolarHBondContact O-SG 2.97Å; R240-C244 VanDerWaalsContact O-SG 3.39Å; M241-C244 WeakPolarHBondContact O-CB 3.49Å; M241-C244 PolarHBondContact O-N 2.85Å; E242-C244 PolarHBondContact O-N 3.21Å; C244-R247 PolarHBondContact O-N 2.89Å; C244-V248 WeakPolarHBondContact O-CG2 3.41Å; C244-V248 PolarHBondContact O-N 3.03Å |
| 245 | Q | 98.1 | Very high | 97.7 | Very high | 129 Ų | 129 | 93.1 Ų | 93.1 | 60% | 0.603 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.9 | -43.5 | 176.8 | -73.9 | 177.5 | 10.9 | 0 | 0 | 111.7 | M241 E242 R247 V248 S249 | M241-Q245 WeakPolarHBondContact O-CG 3.48Å; M241-Q245 PolarHBondContact O-N 3.31Å; E242-Q245 PolarHBondContact O-N 3.36Å; Q245-R247 VanDerWaalsContact C-N 3.35Å; Q245-R247 PolarHBondContact O-N 3.13Å; Q245-V248 PolarHBondContact O-N 3.41Å; Q245-S249 PolarHBondContact O-N 3.48Å |
| 246 | A | 97.3 | Very high | 97.7 | Very high | 43 Ų | 43 | 90.7 Ų | 90.7 | 36% | 0.355 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -57.2 | -48 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | E242 G243 V248 S249 E250 | E242-A246 WeakPolarHBondContact O-CB 3.41Å; E242-A246 PolarHBondContact O-N 3Å; G243-A246 PolarHBondContact O-N 3.42Å; A246-V248 VanDerWaalsContact C-N 3.32Å; A246-V248 PolarHBondContact O-N 2.86Å; A246-S249 PolarHBondContact O-N 2.93Å; A246-S249 VanDerWaalsContact O-N 3.14Å; A246-S249 PolarHBondContact O-OG 2.87Å; A246-E250 WeakPolarHBondContact O-CG 3.48Å; A246-E250 PolarHBondContact O-N 3.2Å |
| 247 | R | 97.8 | Very high | 97.6 | Very high | 116 Ų | 116 | 91.1 Ų | 91.1 | 44% | 0.438 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.4 | -38.8 | 177.3 | -175.5 | 57.5 | -179.7 | 156.4 | 7.1 | 113 | G243 C244 Q245 E250 L251 E254 | G243-R247 PolarHBondContact O-N 2.97Å; G243-R247 VanDerWaalsContact O-N 3.07Å; C244-R247 PolarHBondContact O-N 2.89Å; Q245-R247 VanDerWaalsContact C-N 3.35Å; Q245-R247 PolarHBondContact O-N 3.13Å; R247-E250 WeakPolarHBondContact CD-OE2 3.43Å; R247-E250 IonicContact CZ-OE2 3.52Å; R247-E250 IonicContact NH1-OE2 3.73Å; R247-E250 PolarHBondContact NH1-OE2 2.93Å; R247-E250 PolarHBondContact O-N 3.39Å; R247-L251 HydrophobicContact CG-CD1 4.28Å; R247-L251 VanDerWaalsContact O-CG 3.3Å; R247-L251 WeakPolarHBondContact O-CG 3.5Å; R247-L251 PolarHBondContact O-N 3.14Å; R247-E254 IonicContact NH1-OE1 3.7Å |
| 248 | V | 97.8 | Very high | 97.5 | Very high | 77 Ų | 77 | 90.8 Ų | 90.8 | 47% | 0.467 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.9 | -46.4 | 174.9 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | C244 Q245 A246 E250 L251 E252 | C244-V248 WeakPolarHBondContact O-CG2 3.41Å; C244-V248 PolarHBondContact O-N 3.03Å; Q245-V248 PolarHBondContact O-N 3.41Å; A246-V248 VanDerWaalsContact C-N 3.32Å; A246-V248 PolarHBondContact O-N 2.86Å; V248-E250 VanDerWaalsContact C-N 3.32Å; V248-E250 PolarHBondContact O-N 3.39Å; V248-L251 PolarHBondContact O-N 3.48Å; V248-E252 HydrophobicContact CG1-CG 4.41Å; V248-E252 WeakPolarHBondContact O-CG 3.32Å; V248-E252 PolarHBondContact O-N 3.14Å |
| 249 | S | 97.4 | Very high | 97.3 | Very high | 48 Ų | 48 | 91.8 Ų | 91.8 | 34% | 0.336 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.7 | -34.6 | 178.2 | 69.2 | 0 | 0 | 0 | 0 | 113.7 | Q245 A246 E252 Q253 | Q245-S249 PolarHBondContact O-N 3.48Å; A246-S249 PolarHBondContact O-N 2.93Å; A246-S249 VanDerWaalsContact O-N 3.14Å; A246-S249 PolarHBondContact O-OG 2.87Å; S249-E252 PolarHBondContact O-N 2.99Å; S249-Q253 VanDerWaalsContact O-CG 3.31Å; S249-Q253 WeakPolarHBondContact O-CG 3.29Å; S249-Q253 PolarHBondContact O-N 3.37Å |
| 250 | E | 98 | Very high | 97.2 | Very high | 89 Ų | 89 | 94.9 Ų | 94.9 | 42% | 0.416 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.6 | -49 | 172 | -72.7 | 173.5 | -178.4 | 0 | 0 | 110.9 | A246 R247 V248 E252 Q253 E254 | A246-E250 WeakPolarHBondContact O-CG 3.48Å; A246-E250 PolarHBondContact O-N 3.2Å; R247-E250 WeakPolarHBondContact CD-OE2 3.43Å; R247-E250 IonicContact CZ-OE2 3.52Å; R247-E250 IonicContact NH1-OE2 3.73Å; R247-E250 PolarHBondContact NH1-OE2 2.93Å; R247-E250 PolarHBondContact O-N 3.39Å; V248-E250 VanDerWaalsContact C-N 3.32Å; V248-E250 PolarHBondContact O-N 3.39Å; E250-E252 VanDerWaalsContact C-N 3.27Å; E250-E252 PolarHBondContact O-N 3.23Å; E250-Q253 WeakPolarHBondContact O-CB 3.33Å; E250-Q253 PolarHBondContact O-N 3.46Å; E250-Q253 VanDerWaalsContact O-N 3.11Å; E250-E254 WeakPolarHBondContact O-CG 3.36Å; E250-E254 PolarHBondContact O-N 3.47Å |
| 251 | L | 97.9 | Very high | 97 | Very high | 78 Ų | 78 | 93 Ų | 93 | 41% | 0.408 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.7 | -35 | 178.5 | -72 | 172.8 | 0 | 0 | 0 | 112.2 | R247 V248 A255 | R247-L251 HydrophobicContact CG-CD1 4.28Å; R247-L251 VanDerWaalsContact O-CG 3.3Å; R247-L251 WeakPolarHBondContact O-CG 3.5Å; R247-L251 PolarHBondContact O-N 3.14Å; V248-L251 PolarHBondContact O-N 3.48Å; L251-A255 VanDerWaalsContact O-CB 3.29Å; L251-A255 WeakPolarHBondContact O-CB 3.37Å; L251-A255 PolarHBondContact O-N 2.88Å |
| 252 | E | 97.8 | Very high | 96.6 | Very high | 120 Ų | 120 | 96.6 Ų | 96.6 | 56% | 0.561 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 172.8 | -75.5 | 176.8 | 168.5 | 0 | 0 | 111.5 | V248 S249 E250 A255 E256 | V248-E252 HydrophobicContact CG1-CG 4.41Å; V248-E252 WeakPolarHBondContact O-CG 3.32Å; V248-E252 PolarHBondContact O-N 3.14Å; S249-E252 PolarHBondContact O-N 2.99Å; E250-E252 VanDerWaalsContact C-N 3.27Å; E250-E252 PolarHBondContact O-N 3.23Å; E252-A255 PolarHBondContact O-N 2.95Å; E252-E256 WeakPolarHBondContact O-CB 3.49Å; E252-E256 PolarHBondContact O-N 3.27Å |
| 253 | Q | 97 | Very high | 96.3 | Very high | 123 Ų | 123 | 97.5 Ų | 97.5 | 58% | 0.575 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.4 | -48.2 | 174.7 | -70.1 | 169.6 | 30.1 | 0 | 0 | 111.3 | S249 E250 A255 E256 E257 | S249-Q253 VanDerWaalsContact O-CG 3.31Å; S249-Q253 WeakPolarHBondContact O-CG 3.29Å; S249-Q253 PolarHBondContact O-N 3.37Å; E250-Q253 WeakPolarHBondContact O-CB 3.33Å; E250-Q253 PolarHBondContact O-N 3.46Å; E250-Q253 VanDerWaalsContact O-N 3.11Å; Q253-A255 VanDerWaalsContact C-N 3.29Å; Q253-A255 PolarHBondContact O-N 3.27Å; Q253-E256 WeakPolarHBondContact O-CB 3.48Å; Q253-E256 PolarHBondContact O-N 2.86Å; Q253-E256 VanDerWaalsContact O-N 3.09Å; Q253-E257 WeakPolarHBondContact O-CG 3.23Å; Q253-E257 PolarHBondContact O-N 2.95Å |
| 254 | E | 97.4 | Very high | 95.8 | Very high | 88 Ų | 88 | 99 Ų | 99 | 41% | 0.411 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -56.7 | -43 | 175.5 | -70.4 | 175.6 | -164.9 | 0 | 0 | 111.3 | R247 E250 E256 E257 L258 | R247-E254 IonicContact NH1-OE1 3.7Å; E250-E254 WeakPolarHBondContact O-CG 3.36Å; E250-E254 PolarHBondContact O-N 3.47Å; E254-E256 PolarHBondContact O-N 3.5Å; E254-E257 PolarHBondContact O-N 3.07Å; E254-L258 WeakPolarHBondContact O-CG 3.42Å; E254-L258 PolarHBondContact O-N 3.48Å |
| 255 | A | 96.4 | Very high | 95.1 | Very high | 31 Ų | 31 | 100.7 Ų | 100.7 | 26% | 0.256 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.3 | -38.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L251 E252 Q253 L258 R259 | L251-A255 VanDerWaalsContact O-CB 3.29Å; L251-A255 WeakPolarHBondContact O-CB 3.37Å; L251-A255 PolarHBondContact O-N 2.88Å; E252-A255 PolarHBondContact O-N 2.95Å; Q253-A255 VanDerWaalsContact C-N 3.29Å; Q253-A255 PolarHBondContact O-N 3.27Å; A255-L258 PolarHBondContact O-N 3.28Å; A255-R259 VanDerWaalsContact O-CG 3.25Å; A255-R259 WeakPolarHBondContact O-CG 3.44Å; A255-R259 PolarHBondContact O-N 3.04Å |
| 256 | E | 96.8 | Very high | 93.7 | Very high | 83 Ų | 83 | 98 Ų | 98 | 39% | 0.388 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66 | -41.2 | 176.1 | -134 | 63.3 | -123.3 | 0 | 0 | 111.4 | E252 Q253 E254 R259 Q260 | E252-E256 WeakPolarHBondContact O-CB 3.49Å; E252-E256 PolarHBondContact O-N 3.27Å; Q253-E256 WeakPolarHBondContact O-CB 3.48Å; Q253-E256 PolarHBondContact O-N 2.86Å; Q253-E256 VanDerWaalsContact O-N 3.09Å; E254-E256 PolarHBondContact O-N 3.5Å; E256-R259 WeakPolarHBondContact O-CB 3.33Å; E256-R259 PolarHBondContact O-N 3.21Å; E256-R259 IonicContact OE1-CZ 3.52Å; E256-R259 IonicContact OE1-NH1 2.84Å; E256-R259 PolarHBondContact OE1-NH1 3.25Å; E256-R259 IonicContact OE2-CZ 3.01Å; E256-R259 IonicContact OE2-NH1 3.68Å; E256-R259 PolarHBondContact OE2-NH1 3.14Å; E256-Q260 VanDerWaalsContact O-CG 3.31Å; E256-Q260 WeakPolarHBondContact O-CG 3.47Å; E256-Q260 PolarHBondContact O-N 2.92Å |
| 257 | E | 96.6 | Very high | 92.4 | Very high | 119 Ų | 119 | 101.1 Ų | 101.1 | 56% | 0.556 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.5 | -48 | 173.2 | -71.1 | 179.2 | -179.8 | 0 | 0 | 111.2 | Q253 E254 R259 Q260 L261 | Q253-E257 WeakPolarHBondContact O-CG 3.23Å; Q253-E257 PolarHBondContact O-N 2.95Å; E254-E257 PolarHBondContact O-N 3.07Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.39Å; E257-Q260 WeakPolarHBondContact O-CB 3.42Å; E257-Q260 PolarHBondContact O-N 3.04Å; E257-Q260 VanDerWaalsContact O-N 3.08Å; E257-L261 WeakPolarHBondContact O-CG 3.46Å; E257-L261 PolarHBondContact O-N 2.91Å |
| 258 | L | 95.6 | Very high | 90.7 | Very high | 104 Ų | 104 | 100 Ų | 100 | 55% | 0.545 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.7 | -41.1 | 175.8 | -71.2 | 175.1 | 0 | 0 | 0 | 111.8 | E254 A255 Q260 L261 W262 | E254-L258 WeakPolarHBondContact O-CG 3.42Å; E254-L258 PolarHBondContact O-N 3.48Å; A255-L258 PolarHBondContact O-N 3.28Å; L258-Q260 VanDerWaalsContact C-N 3.33Å; L258-Q260 PolarHBondContact O-N 2.72Å; L258-L261 PolarHBondContact O-N 3Å; L258-W262 WeakPolarHBondContact O-CB 3.3Å; L258-W262 VanDerWaalsContact O-CD1 3.3Å; L258-W262 PolarHBondContact O-N 2.8Å |
| 259 | R | 95.3 | Very high | 88.8 | Confident | 124 Ų | 124 | 102.5 Ų | 102.5 | 47% | 0.468 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.2 | -39.8 | 174.2 | -72.7 | 171.4 | -163.5 | 152.8 | 10.4 | 111.7 | A255 E256 E257 K263 | A255-R259 VanDerWaalsContact O-CG 3.25Å; A255-R259 WeakPolarHBondContact O-CG 3.44Å; A255-R259 PolarHBondContact O-N 3.04Å; E256-R259 WeakPolarHBondContact O-CB 3.33Å; E256-R259 PolarHBondContact O-N 3.21Å; E256-R259 IonicContact OE1-CZ 3.52Å; E256-R259 IonicContact OE1-NH1 2.84Å; E256-R259 PolarHBondContact OE1-NH1 3.25Å; E256-R259 IonicContact OE2-CZ 3.01Å; E256-R259 IonicContact OE2-NH1 3.68Å; E256-R259 PolarHBondContact OE2-NH1 3.14Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.39Å; R259-K263 WeakPolarHBondContact O-CB 3.36Å; R259-K263 VanDerWaalsContact O-CG 3.25Å; R259-K263 WeakPolarHBondContact O-CG 3.35Å; R259-K263 PolarHBondContact O-N 3.37Å |
| 260 | Q | 94.5 | Very high | 86.6 | Confident | 120 Ų | 120 | 104.3 Ų | 104.3 | 56% | 0.561 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -67.1 | -41.2 | 176.8 | -70.7 | 176.3 | 25.4 | 0 | 0 | 112 | E256 E257 L258 K263 S264 | E256-Q260 VanDerWaalsContact O-CG 3.31Å; E256-Q260 WeakPolarHBondContact O-CG 3.47Å; E256-Q260 PolarHBondContact O-N 2.92Å; E257-Q260 WeakPolarHBondContact O-CB 3.42Å; E257-Q260 PolarHBondContact O-N 3.04Å; E257-Q260 VanDerWaalsContact O-N 3.08Å; L258-Q260 VanDerWaalsContact C-N 3.33Å; L258-Q260 PolarHBondContact O-N 2.72Å; Q260-K263 PolarHBondContact O-N 2.89Å; Q260-S264 WeakPolarHBondContact O-CB 3.39Å; Q260-S264 PolarHBondContact O-N 3.45Å; Q260-S264 PolarHBondContact O-OG 2.89Å |
| 261 | L | 94.1 | Very high | 84.5 | Confident | 112 Ų | 112 | 105.8 Ų | 105.8 | 59% | 0.586 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.1 | -44.3 | 174.5 | -68.8 | 175.4 | 0 | 0 | 0 | 111.4 | E257 L258 K263 S264 Q265 | E257-L261 WeakPolarHBondContact O-CG 3.46Å; E257-L261 PolarHBondContact O-N 2.91Å; L258-L261 PolarHBondContact O-N 3Å; L261-K263 PolarHBondContact O-N 3.35Å; L261-S264 PolarHBondContact O-N 2.95Å; L261-Q265 WeakPolarHBondContact O-CB 3.47Å; L261-Q265 PolarHBondContact O-N 3.36Å |
| 262 | W | 89.9 | Confident | 82 | Confident | 184 Ų | 184 | 113.3 Ų | 113.3 | 70% | 0.697 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -59.9 | -43.3 | 174.3 | -95.2 | 89.5 | 0 | 0 | 0 | 112.7 | L258 S264 Q265 S266 | L258-W262 WeakPolarHBondContact O-CB 3.3Å; L258-W262 VanDerWaalsContact O-CD1 3.3Å; L258-W262 PolarHBondContact O-N 2.8Å; W262-S264 VanDerWaalsContact C-N 3.32Å; W262-S264 PolarHBondContact O-N 3.4Å; W262-Q265 PolarHBondContact O-N 3.48Å; W262-S266 WeakPolarHBondContact O-CB 3.35Å; W262-S266 PolarHBondContact O-N 2.94Å; W262-S266 PolarHBondContact O-OG 2.94Å |
| 263 | K | 91.7 | Very high | 79.8 | Confident | 141 Ų | 141 | 110.8 Ų | 110.8 | 61% | 0.613 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.8 | -39 | 174.9 | -73.9 | 170.3 | -176.9 | 175.9 | 0 | 111.9 | R259 Q260 L261 S266 S267 | R259-K263 WeakPolarHBondContact O-CB 3.36Å; R259-K263 VanDerWaalsContact O-CG 3.25Å; R259-K263 WeakPolarHBondContact O-CG 3.35Å; R259-K263 PolarHBondContact O-N 3.37Å; Q260-K263 PolarHBondContact O-N 2.89Å; L261-K263 PolarHBondContact O-N 3.35Å; K263-S266 WeakPolarHBondContact CA-OG 3.3Å; K263-S266 PolarHBondContact O-OG 3.44Å; K263-S266 VanDerWaalsContact O-OG 3.06Å; K263-S267 VanDerWaalsContact O-CB 3.23Å; K263-S267 WeakPolarHBondContact O-CB 3.29Å; K263-S267 PolarHBondContact O-N 2.94Å |
| 264 | S | 86.7 | Confident | 77.6 | Confident | 75 Ų | 75 | 111.3 Ų | 111.3 | 52% | 0.524 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -71.9 | -36.6 | 178.1 | -54.2 | 0 | 0 | 0 | 0 | 112.4 | Q260 L261 W262 S268 | Q260-S264 WeakPolarHBondContact O-CB 3.39Å; Q260-S264 PolarHBondContact O-N 3.45Å; Q260-S264 PolarHBondContact O-OG 2.89Å; L261-S264 PolarHBondContact O-N 2.95Å; W262-S264 VanDerWaalsContact C-N 3.32Å; W262-S264 PolarHBondContact O-N 3.4Å; S264-S268 WeakPolarHBondContact O-CB 3.07Å; S264-S268 PolarHBondContact O-N 3.26Å; S264-S268 PolarHBondContact O-OG 2.89Å |
| 265 | Q | 82.7 | Confident | 75.5 | Confident | 110 Ų | 110 | 113.4 Ų | 113.4 | 51% | 0.514 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -73.1 | -39.5 | 177.7 | -166.8 | 173.6 | 47.4 | 0 | 0 | 112.4 | L261 W262 S268 R269 | L261-Q265 WeakPolarHBondContact O-CB 3.47Å; L261-Q265 PolarHBondContact O-N 3.36Å; W262-Q265 PolarHBondContact O-N 3.48Å; Q265-S268 WeakPolarHBondContact CA-OG 3.33Å; Q265-S268 PolarHBondContact O-N 3.04Å; Q265-S268 PolarHBondContact O-OG 3.03Å; Q265-S268 VanDerWaalsContact O-OG 3.04Å; Q265-R269 PolarHBondContact O-N 3.04Å |
| 266 | S | 68.7 | Low | 73.4 | Confident | 74 Ų | 74 | 117.8 Ų | 117.8 | 52% | 0.517 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -68.9 | -34.2 | 172 | 51.5 | 0 | 0 | 0 | 0 | 112.3 | W262 K263 S268 | W262-S266 WeakPolarHBondContact O-CB 3.35Å; W262-S266 PolarHBondContact O-N 2.94Å; W262-S266 PolarHBondContact O-OG 2.94Å; K263-S266 WeakPolarHBondContact CA-OG 3.3Å; K263-S266 PolarHBondContact O-OG 3.44Å; K263-S266 VanDerWaalsContact O-OG 3.06Å; S266-S268 VanDerWaalsContact C-N 3.34Å |
| 267 | S | 70.4 | Confident | 71.1 | Confident | 107 Ų | 107 | 120.3 Ų | 120.3 | 75% | 0.748 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -72.3 | -23.7 | 173.9 | -172.6 | 0 | 0 | 0 | 0 | 113.7 | K263 | K263-S267 VanDerWaalsContact O-CB 3.23Å; K263-S267 WeakPolarHBondContact O-CB 3.29Å; K263-S267 PolarHBondContact O-N 2.94Å |
| 268 | S | 62.7 | Low | 68.6 | Low | 92 Ų | 92 | 118.3 Ų | 118.3 | 64% | 0.643 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -91.1 | -20.9 | 177.3 | 51.6 | 0 | 0 | 0 | 0 | 113.4 | S264 Q265 S266 S270 | S264-S268 WeakPolarHBondContact O-CB 3.07Å; S264-S268 PolarHBondContact O-N 3.26Å; S264-S268 PolarHBondContact O-OG 2.89Å; Q265-S268 WeakPolarHBondContact CA-OG 3.33Å; Q265-S268 PolarHBondContact O-N 3.04Å; Q265-S268 PolarHBondContact O-OG 3.03Å; Q265-S268 VanDerWaalsContact O-OG 3.04Å; S266-S268 VanDerWaalsContact C-N 3.34Å; S268-S270 PolarHBondContact O-N 2.82Å |
| 269 | R | 56.3 | Low | 66.3 | Low | 130 Ų | 130 | 120.6 Ų | 120.6 | 49% | 0.491 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -79.4 | 99.5 | 166.5 | -81.7 | -175.1 | 166.7 | -172 | -4.1 | 109.8 | Q265 | Q265-R269 PolarHBondContact O-N 3.04Š|
| 270 | S | 52.6 | Low | 63.8 | Low | 86 Ų | 86 | 121.7 Ų | 121.7 | 60% | 0.601 | 66% | 0.656 | S | S | * | * | trans | -47 | 143.9 | 165.4 | 178.7 | 0 | 0 | 0 | 0 | 110.9 | S268 R272 | S268-S270 PolarHBondContact O-N 2.82Å; S270-R272 PolarHBondContact O-N 3.33Å | ||
| 271 | P | 53.4 | Low | 61.1 | Low | 121 Ų | 121 | 123.9 Ų | 123.9 | 79% | 0.786 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | 44.1 | -169.3 | 33.7 | -39 | 0 | 0 | 0 | 113.5 | ||
| 272 | R | 46.1 | Very low | 58.5 | Low | 235 Ų | 235 | 125.9 Ų | 125.9 | 89% | 0.887 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.6 | 3.9 | 179.7 | -83 | -170.4 | 166.9 | -167.8 | -3.2 | 114.4 | S270 | S270-R272 PolarHBondContact O-N 3.33Š|
| 273 | S | 50.5 | Low | 56.2 | Low | 67 Ų | 67 | 123.9 Ų | 123.9 | 47% | 0.469 | 68% | 0.684 | S | S | . | * | trans | -137.2 | 34.3 | -175.1 | -166.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 274 | D | 51.6 | Low | 53.9 | Low | 135 Ų | 135 | 122.2 Ų | 122.2 | 72% | 0.722 | 69% | 0.688 | S | S | * | * | trans | -99 | 6.9 | 179.6 | -84.9 | -11.5 | 0 | 0 | 0 | 115 | ||||
| 275 | V | 53.4 | Low | 51.4 | Low | 132 Ų | 132 | 127.2 Ų | 127.2 | 80% | 0.8 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -92.2 | -16.3 | -176.3 | -176.4 | 0 | 0 | 0 | 0 | 113.8 | ||
| 276 | I | 52.7 | Low | 49.1 | Very low | 123 Ų | 123 | 129.9 Ų | 129.9 | 63% | 0.631 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -110.9 | -20.7 | -166.2 | -55.5 | -178.7 | 0 | 0 | 0 | 114.3 | G278 | I276-G278 VanDerWaalsContact C-N 3.34Å; I276-G278 PolarHBondContact O-N 3.49Å |
| 277 | H | 46.6 | Very low | 47.6 | Very low | 135 Ų | 135 | 134.9 Ų | 134.9 | 63% | 0.625 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | -5.5 | -174.4 | -86.7 | -57.3 | 0 | 0 | 0 | 115.8 | ||
| 278 | G | 44.8 | Very low | 45.7 | Very low | 77 Ų | 77 | 137 Ų | 137 | 79% | 0.794 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -6.6 | -179 | 0 | 0 | 0 | 0 | 0 | 116.2 | I276 | I276-G278 VanDerWaalsContact C-N 3.34Å; I276-G278 PolarHBondContact O-N 3.49Å |
| 279 | L | 46.8 | Very low | 44.4 | Very low | 152 Ų | 152 | 141 Ų | 141 | 80% | 0.796 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -120.1 | 4.8 | -163.8 | -77.3 | 163.8 | 0 | 0 | 0 | 116.1 | ||
| 280 | L | 42.7 | Very low | 43.2 | Very low | 147 Ų | 147 | 138.3 Ų | 138.3 | 77% | 0.77 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -121.8 | 20.9 | -169.2 | -80.2 | 170.2 | 0 | 0 | 0 | 116.4 | ||
| 281 | L | 39.6 | Very low | 42.3 | Very low | 167 Ų | 167 | 139 Ų | 139 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | trans | -131.9 | 45.2 | 180 | -100.6 | 143.6 | 0 | 0 | 0 | 114.4 | ||||
| 282 | L | 37.8 | Very low | 41.5 | Very low | 154 Ų | 154 | 139.4 Ų | 139.4 | 81% | 0.806 | 77% | 0.769 | S | S | * | * | trans | -145.2 | 122.4 | 162.6 | -65.4 | 169.7 | 0 | 0 | 0 | 104.5 | ||||
| 283 | N | 41.7 | Very low | 41 | Very low | 141 Ų | 141 | 132.4 Ų | 132.4 | 75% | 0.754 | 76% | 0.761 | S | S | * | * | cis | -163.3 | -177.6 | 21.9 | -80.3 | -25.4 | 0 | 0 | 0 | 106.1 | ||||
| 284 | P | 43.6 | Very low | 40.3 | Very low | 107 Ų | 107 | 135.4 Ų | 135.4 | 70% | 0.695 | 78% | 0.776 | S | S | * | * | cis | -145.2 | 167.5 | 27.4 | 38.2 | -14.1 | 0 | 0 | 0 | 118.6 | ||||
| 285 | E | 34.2 | Very low | 39.4 | Very low | 180 Ų | 180 | 135.5 Ų | 135.5 | 84% | 0.841 | 78% | 0.781 | S | S | * | * | trans | 41.7 | 132.7 | 139.8 | -59.6 | 179.4 | 169.1 | 0 | 0 | 119.8 | ||||
| 286 | E | 35.3 | Very low | 38.5 | Very low | 165 Ų | 165 | 137.7 Ų | 137.7 | 77% | 0.771 | 78% | 0.78 | S | S | * | * | cis | -157.1 | 157.5 | 35.3 | -74.2 | -172.6 | 143.7 | 0 | 0 | 112.3 | ||||
| 287 | E | 37.8 | Very low | 37.5 | Very low | 180 Ų | 180 | 137.2 Ų | 137.2 | 84% | 0.841 | 79% | 0.788 | S | S | * | * | trans | 55.1 | 103.3 | 149.6 | -68.1 | -176 | 169.1 | 0 | 0 | 121 | ||||
| 288 | N | 29.4 | Very low | 37.2 | Very low | 150 Ų | 150 | 136.8 Ų | 136.8 | 80% | 0.802 | 80% | 0.797 | S | S | * | * | 158.5 | 130.8 | 109.4 | -161 | 26.5 | 0 | 0 | 0 | 110.6 | |||||
| 289 | E | 34.9 | Very low | 36.7 | Very low | 176 Ų | 176 | 137.6 Ų | 137.6 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | 56 | 121.5 | 155.9 | -73.8 | -88 | 165.7 | 0 | 0 | 120.3 | ||||
| 290 | G | 32.3 | Very low | 36.1 | Very low | 75 Ų | 75 | 136.2 Ų | 136.2 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | 98.7 | 103 | 150.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 291 | A | 33.5 | Very low | 35.7 | Very low | 100 Ų | 100 | 137.9 Ų | 137.9 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 157.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 292 | P | 37 | Very low | 35.7 | Very low | 130 Ų | 130 | 137.9 Ų | 137.9 | 84% | 0.844 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 163.7 | -163.4 | 36.5 | -37.2 | 0 | 0 | 0 | 116 | ||
| 293 | A | 34.8 | Very low | 35.8 | Very low | 87 Ų | 87 | 142.2 Ų | 142.2 | 72% | 0.719 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 146 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 294 | V | 34.8 | Very low | 35.3 | Very low | 131 Ų | 131 | 147.4 Ų | 147.4 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | trans | 63.4 | 106 | 130 | 179.7 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 295 | V | 32.7 | Very low | 34.7 | Very low | 137 Ų | 137 | 146.6 Ų | 146.6 | 83% | 0.83 | 81% | 0.813 | S | S | * | * | trans | -92.2 | 111.1 | 138.3 | 173.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 296 | K | 35 | Very low | 35 | Very low | 178 Ų | 178 | 143.6 Ų | 143.6 | 77% | 0.774 | 81% | 0.812 | S | S | * | * | trans | 31.6 | 112 | 133 | -58.2 | 173.7 | -177.7 | 174 | 0 | 117.5 | ||||
| 297 | S | 33.1 | Very low | 34.9 | Very low | 113 Ų | 113 | 144.7 Ų | 144.7 | 79% | 0.79 | 82% | 0.817 | S | S | * | * | trans | -12.9 | 158.1 | 158.3 | 30.6 | 0 | 0 | 0 | 0 | 122 | ||||
| 298 | P | 39.9 | Very low | 35.2 | Very low | 125 Ų | 125 | 147.3 Ų | 147.3 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | trans | -91.5 | 135.9 | -158.9 | 36 | -31.8 | 0 | 0 | 0 | 113.3 | ||||
| 299 | A | 33.7 | Very low | 35.2 | Very low | 95 Ų | 95 | 148.4 Ų | 148.4 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | -87.6 | 108.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | L301 | A299-L301 PolarHBondContact O-N 3.41Š| ||
| 300 | V | 35.2 | Very low | 35.3 | Very low | 122 Ų | 122 | 148.9 Ų | 148.9 | 74% | 0.739 | 82% | 0.824 | S | S | * | * | trans | 24.4 | 96.5 | 148.1 | -172.1 | 0 | 0 | 0 | 0 | 115.9 | K302 | V300-K302 HydrophobicContact CG1-CG 4.23Å; V300-K302 PolarHBondContact O-N 3.41Å | ||
| 301 | L | 32.7 | Very low | 35.4 | Very low | 183 Ų | 183 | 153.7 Ų | 153.7 | 96% | 0.958 | 82% | 0.823 | S | S | * | * | trans | -66.6 | 92 | 164.7 | -83.5 | 159.4 | 0 | 0 | 0 | 110.3 | A299 | A299-L301 PolarHBondContact O-N 3.41Š| ||
| 302 | K | 39.4 | Very low | 35.6 | Very low | 167 Ų | 167 | 153.8 Ų | 153.8 | 73% | 0.726 | 82% | 0.824 | S | S | * | * | trans | -88.2 | 115.8 | 158.9 | -85.3 | -174.6 | 177.4 | -179.6 | 0 | 109.3 | V300 W304 | V300-K302 HydrophobicContact CG1-CG 4.23Å; V300-K302 PolarHBondContact O-N 3.41Å; K302-W304 PolarHBondContact O-N 2.92Å | ||
| 303 | R | 40.5 | Very low | 35.3 | Very low | 245 Ų | 245 | 153.9 Ų | 153.9 | 93% | 0.925 | 82% | 0.822 | S | S | * | * | trans | -13 | 112 | 156.8 | -156.9 | -176.2 | -64.5 | 172.4 | -1.6 | 113.9 | ||||
| 304 | W | 30.8 | Very low | 35.4 | Very low | 249 Ų | 249 | 158.6 Ų | 158.6 | 94% | 0.943 | 83% | 0.83 | S | S | * | * | trans | -105.3 | 108.3 | 167.1 | -77.2 | 82.5 | 0 | 0 | 0 | 109.2 | K302 | K302-W304 PolarHBondContact O-N 2.92Š| ||
| 305 | A | 31.1 | Very low | 35.2 | Very low | 91 Ų | 91 | 156.8 Ų | 156.8 | 75% | 0.752 | 83% | 0.828 | S | S | * | * | trans | -84.7 | 138.8 | 158.4 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 306 | S | 41.6 | Very low | 35.9 | Very low | 117 Ų | 117 | 155.3 Ų | 155.3 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -65 | 127.1 | 175.3 | -175.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 307 | E | 32.6 | Very low | 35.9 | Very low | 187 Ų | 187 | 154 Ų | 154 | 87% | 0.874 | 82% | 0.823 | S | S | * | * | trans | -155.6 | 118.2 | 148.4 | -145.6 | 169.7 | -170.3 | 0 | 0 | 110.3 | ||||
| 308 | R | 43.3 | Very low | 35.9 | Very low | 236 Ų | 236 | 154.2 Ų | 154.2 | 89% | 0.891 | 82% | 0.824 | S | S | * | * | trans | -69.7 | 130.3 | 171.5 | -67.8 | -179.9 | -169.9 | -164.8 | 2.1 | 108.4 | ||||
| 309 | Q | 29.5 | Very low | 36.3 | Very low | 173 Ų | 173 | 153.8 Ų | 153.8 | 81% | 0.808 | 82% | 0.821 | S | S | * | * | trans | -136.4 | 103.2 | 154.6 | -138.8 | 164.6 | 37.6 | 0 | 0 | 110 | K311 | Q309-K311 PolarHBondContact O-N 3.26Š| ||
| 310 | M | 37 | Very low | 36.9 | Very low | 185 Ų | 185 | 155 Ų | 155 | 91% | 0.911 | 82% | 0.824 | S | S | * | * | trans | -58.6 | 120.7 | 164.1 | -80.6 | -78.5 | -155.7 | 0 | 0 | 108.8 | ||||
| 311 | K | 34.4 | Very low | 37.3 | Very low | 177 Ų | 177 | 160 Ų | 160 | 77% | 0.77 | 83% | 0.83 | S | S | * | * | trans | -125.2 | 99.7 | 155.5 | -77.3 | -172.7 | 178.4 | 179.2 | 0 | 108.4 | Q309 T313 | Q309-K311 PolarHBondContact O-N 3.26Å; K311-T313 PolarHBondContact O-N 3.47Å | ||
| 312 | A | 38.9 | Very low | 38 | Very low | 101 Ų | 101 | 159 Ų | 159 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -59.2 | 124.1 | 162.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 313 | T | 30.9 | Very low | 38.3 | Very low | 133 Ų | 133 | 159.2 Ų | 159.2 | 82% | 0.816 | 82% | 0.821 | S | S | * | * | trans | -125.3 | 116.9 | 159.1 | -42.9 | 0 | 0 | 0 | 0 | 106.6 | K311 | K311-T313 PolarHBondContact O-N 3.47Š| ||
| 314 | Q | 36.3 | Very low | 38.4 | Very low | 186 Ų | 186 | 154.1 Ų | 154.1 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | trans | -71 | 160.9 | 177.3 | -76.3 | 177.3 | 2.7 | 0 | 0 | 112.1 | ||||
| 315 | A | 30.7 | Very low | 39.3 | Very low | 93 Ų | 93 | 149.5 Ų | 149.5 | 77% | 0.769 | 80% | 0.801 | S | S | * | * | trans | 106.3 | 154.9 | 150.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 316 | P | 48 | Very low | 40 | Very low | 106 Ų | 106 | 151.9 Ų | 151.9 | 69% | 0.688 | 80% | 0.796 | S | S | * | * | -129.7 | -177.7 | -98.1 | 27.1 | -3.4 | 0 | 0 | 0 | 112.9 | |||||
| 317 | D | 34.1 | Very low | 40.4 | Very low | 150 Ų | 150 | 151 Ų | 151 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | 82.5 | 88.2 | 161.1 | -53.1 | -28.2 | 0 | 0 | 0 | 118.7 | ||||
| 318 | S | 33.8 | Very low | 41.1 | Very low | 117 Ų | 117 | 146.8 Ų | 146.8 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | -176.3 | 143.5 | 117.5 | 38.4 | 0 | 0 | 0 | 0 | 111 | |||||
| 319 | P | 48.5 | Very low | 41.4 | Very low | 116 Ų | 116 | 139.7 Ų | 139.7 | 75% | 0.753 | 77% | 0.766 | S | S | * | * | trans | -87 | 164.1 | -170.1 | 35.8 | -33.4 | 0 | 0 | 0 | 111.5 | ||||
| 320 | S | 45.1 | Very low | 42.1 | Very low | 120 Ų | 120 | 136 Ų | 136 | 84% | 0.839 | 76% | 0.755 | S | S | * | * | trans | 88 | 114.4 | 159.3 | 65 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 321 | R | 43.8 | Very low | 42.7 | Very low | 229 Ų | 229 | 136.9 Ų | 136.9 | 86% | 0.864 | 75% | 0.748 | S | S | * | * | S | Bend | trans | 130.5 | 26 | 130.8 | -138.6 | -179.5 | -159.4 | -167.5 | 4.3 | 117.3 | ||
| 322 | I | 47.4 | Very low | 43.5 | Very low | 160 Ų | 160 | 139 Ų | 139 | 82% | 0.821 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -111.9 | 3.5 | 177.3 | -53 | -178.8 | 0 | 0 | 0 | 113.3 | ||
| 323 | Y | 45.4 | Very low | 43.8 | Very low | 172 Ų | 172 | 137.9 Ų | 137.9 | 68% | 0.675 | 74% | 0.735 | S | S | * | * | trans | -113.3 | 25.6 | -169.1 | -94.9 | -75.7 | 0 | 0 | 0 | 117.1 | ||||
| 324 | D | 43.3 | Very low | 44.4 | Very low | 139 Ų | 139 | 137.3 Ų | 137.3 | 74% | 0.743 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -106.6 | -1.9 | -178 | -67.2 | -28.9 | 0 | 0 | 0 | 115.3 | ||
| 325 | H | 49.5 | Very low | 44.9 | Very low | 152 Ų | 152 | 134.8 Ų | 134.8 | 70% | 0.704 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -93.8 | -25.3 | 178.1 | -155.9 | -49.1 | 0 | 0 | 0 | 113.9 | C327 | H325-C327 VanDerWaalsContact C-N 3.31Å; H325-C327 PolarHBondContact O-N 2.94Å |
| 326 | E | 45.4 | Very low | 45.7 | Very low | 141 Ų | 141 | 134.8 Ų | 134.8 | 66% | 0.659 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | -20.3 | -177.8 | -67.3 | -173.6 | 159.7 | 0 | 0 | 113.1 | ||
| 327 | C | 49.2 | Very low | 46 | Very low | 98 Ų | 98 | 136 Ų | 136 | 66% | 0.662 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -15 | -176.1 | -67.3 | 0 | 0 | 0 | 0 | 114.6 | H325 | H325-C327 VanDerWaalsContact C-N 3.31Å; H325-C327 PolarHBondContact O-N 2.94Å |
| 328 | S | 48.4 | Very low | 46.7 | Very low | 98 Ų | 98 | 139.3 Ų | 139.3 | 69% | 0.685 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | -22.2 | -176.9 | -163.3 | 0 | 0 | 0 | 0 | 113.2 | V330 | S328-V330 PolarHBondContact O-N 2.97Š|
| 329 | C | 48.5 | Very low | 47.7 | Very low | 87 Ų | 87 | 144.5 Ų | 144.5 | 59% | 0.588 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -82.9 | -11.1 | -175.9 | -50.6 | 0 | 0 | 0 | 0 | 113.8 | R331 | C329-R331 PolarHBondContact O-N 3.4Š|
| 330 | V | 46.2 | Very low | 48 | Very low | 95 Ų | 95 | 142.2 Ų | 142.2 | 58% | 0.576 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -84.2 | -4 | -169.5 | -177.9 | 0 | 0 | 0 | 0 | 113.6 | S328 P333 | S328-V330 PolarHBondContact O-N 2.97Å; V330-P333 WeakPolarHBondContact O-CD 3.34Å |
| 331 | R | 48.7 | Very low | 48.8 | Very low | 204 Ų | 204 | 142 Ų | 142 | 77% | 0.77 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -95.1 | 1.5 | -176.4 | -64.9 | -68 | 174 | 100.6 | 0 | 115.8 | C329 | C329-R331 PolarHBondContact O-N 3.4Š|
| 332 | R | 50.5 | Low | 50.3 | Low | 223 Ų | 223 | 134.7 Ų | 134.7 | 84% | 0.842 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -96 | -11 | 175.7 | -66.6 | -172.5 | -178.1 | 177.6 | 2.2 | 118.1 | ||
| 333 | P | 46.1 | Very low | 51.6 | Low | 76 Ų | 76 | 133.6 Ų | 133.6 | 49% | 0.494 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -83.2 | -14.1 | -178.8 | 32 | -30 | 0 | 0 | 0 | 113.6 | V330 | V330-P333 WeakPolarHBondContact O-CD 3.34Š|
| 334 | E | 42.5 | Very low | 53.5 | Low | 122 Ų | 122 | 130.8 Ų | 130.8 | 57% | 0.57 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -83.7 | -19.7 | -175 | -88.8 | 170.6 | 161.7 | 0 | 0 | 115.1 | K337 | E334-K337 HydrophobicContact CG-CD 4.26Å; E334-K337 IonicContact OE1-NZ 3.83Å |
| 335 | V | 48.7 | Very low | 55.4 | Low | 132 Ų | 132 | 129.3 Ų | 129.3 | 80% | 0.8 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -86.8 | -10.6 | 179.7 | -176.7 | 0 | 0 | 0 | 0 | 112.4 | ||
| 336 | V | 46.2 | Very low | 57.2 | Low | 93 Ų | 93 | 126.5 Ų | 126.5 | 56% | 0.564 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -102.1 | -1.4 | 179.7 | -172.9 | 0 | 0 | 0 | 0 | 112.9 | Y338 R339 | V336-Y338 PolarHBondContact O-N 3.41Å; V336-R339 PolarHBondContact O-N 3.43Å |
| 337 | K | 54.3 | Low | 59.3 | Low | 131 Ų | 131 | 122.2 Ų | 122.2 | 57% | 0.57 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63 | -10.6 | -179.4 | -69.9 | -179.7 | 179.1 | 174.5 | 0 | 114.8 | E334 | E334-K337 HydrophobicContact CG-CD 4.26Å; E334-K337 IonicContact OE1-NZ 3.83Å |
| 338 | Y | 48.5 | Very low | 61.3 | Low | 221 Ų | 221 | 121.4 Ų | 121.4 | 87% | 0.867 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.4 | 10.8 | -178.1 | -65.7 | -75 | 0 | 0 | 0 | 115.5 | V336 | V336-Y338 PolarHBondContact O-N 3.41Š|
| 339 | R | 55.1 | Low | 63.2 | Low | 225 Ų | 225 | 119.6 Ų | 119.6 | 85% | 0.849 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -134.4 | 88.9 | 168.7 | -92.5 | -167.1 | 174.8 | -159.4 | 0.2 | 110.3 | V336 | V336-R339 PolarHBondContact O-N 3.43Š|
| 340 | G | 54.7 | Low | 65.3 | Low | 68 Ų | 68 | 121.1 Ų | 121.1 | 70% | 0.701 | 61% | 0.611 | S | S | * | * | trans | 60.2 | 88.2 | 164.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | S342 | G340-S342 PolarHBondContact O-N 3.47Å; G340-S342 VanDerWaalsContact O-N 3.08Å | ||
| 341 | I | 63.2 | Low | 67.5 | Low | 117 Ų | 117 | 124.1 Ų | 124.1 | 60% | 0.6 | 61% | 0.613 | S | S | * | * | trans | -49.7 | 119.2 | 154.7 | 38 | 168.9 | 0 | 0 | 0 | 107.8 | L343 | I341-L343 PolarHBondContact O-N 2.85Š| ||
| 342 | S | 73.6 | Confident | 69.6 | Low | 75 Ų | 75 | 117.5 Ų | 117.5 | 52% | 0.524 | 60% | 0.599 | S | S | . | * | trans | -56.5 | 136.8 | 175.5 | 176.6 | 0 | 0 | 0 | 0 | 108.5 | G340 L344 N345 E346 | G340-S342 PolarHBondContact O-N 3.47Å; G340-S342 VanDerWaalsContact O-N 3.08Å; S342-L344 PolarHBondContact O-N 2.88Å; S342-L344 PolarHBondContact OG-N 2.98Å; S342-N345 WeakPolarHBondContact O-CA 3.39Å; S342-N345 WeakPolarHBondContact O-CB 3.27Å; S342-N345 PolarHBondContact O-N 3.26Å; S342-E346 PolarHBondContact O-N 2.67Å | ||
| 343 | L | 74.6 | Confident | 71.6 | Confident | 137 Ų | 137 | 109.5 Ų | 109.5 | 72% | 0.717 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -48.5 | -34.9 | 175.5 | -169.6 | 97.6 | 0 | 0 | 0 | 111 | I341 N345 E346 V347 | I341-L343 PolarHBondContact O-N 2.85Å; L343-N345 PolarHBondContact O-N 3.18Å; L343-E346 PolarHBondContact O-N 3.38Å; L343-V347 WeakPolarHBondContact O-CB 3.25Å; L343-V347 VanDerWaalsContact O-CG2 3.25Å; L343-V347 WeakPolarHBondContact O-CG2 3.43Å; L343-V347 PolarHBondContact O-N 2.92Å |
| 344 | L | 85.9 | Confident | 73.9 | Confident | 113 Ų | 113 | 110.4 Ų | 110.4 | 59% | 0.592 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.3 | -38.9 | 177.3 | -168.2 | 65 | 0 | 0 | 0 | 112.8 | S342 E346 V347 D348 | S342-L344 PolarHBondContact O-N 2.88Å; S342-L344 PolarHBondContact OG-N 2.98Å; L344-E346 VanDerWaalsContact C-N 3.33Å; L344-V347 PolarHBondContact O-N 2.97Å; L344-D348 WeakPolarHBondContact O-CB 3.46Å; L344-D348 VanDerWaalsContact O-CG 3.23Å; L344-D348 PolarHBondContact O-N 2.98Å |
| 345 | N | 82.6 | Confident | 76.1 | Confident | 107 Ų | 107 | 110.4 Ų | 110.4 | 57% | 0.572 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -71.5 | -31.3 | 178.5 | -133.6 | 34.7 | 0 | 0 | 0 | 111.6 | S342 L343 A349 | S342-N345 WeakPolarHBondContact O-CA 3.39Å; S342-N345 WeakPolarHBondContact O-CB 3.27Å; S342-N345 PolarHBondContact O-N 3.26Å; L343-N345 PolarHBondContact O-N 3.18Å; N345-A349 VanDerWaalsContact O-CB 3.27Å; N345-A349 WeakPolarHBondContact O-CB 3.38Å; N345-A349 PolarHBondContact O-N 3.41Å |
| 346 | E | 88.7 | Confident | 78.3 | Confident | 93 Ų | 93 | 108.1 Ų | 108.1 | 44% | 0.435 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -72.7 | -40.8 | 172.5 | -176.3 | 158.9 | -156.1 | 0 | 0 | 111.3 | S342 L343 L344 A349 Q350 | S342-E346 PolarHBondContact O-N 2.67Å; L343-E346 PolarHBondContact O-N 3.38Å; L344-E346 VanDerWaalsContact C-N 3.33Å; E346-A349 PolarHBondContact O-N 2.92Å; E346-Q350 WeakPolarHBondContact O-CB 3.42Å; E346-Q350 WeakPolarHBondContact O-CG 3.46Å; E346-Q350 PolarHBondContact O-N 3.2Å |
| 347 | V | 89.8 | Confident | 80.5 | Confident | 52 Ų | 52 | 110.3 Ų | 110.3 | 32% | 0.315 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -62.8 | -44 | 172.2 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | L343 L344 A349 Q350 Y351 | L343-V347 WeakPolarHBondContact O-CB 3.25Å; L343-V347 VanDerWaalsContact O-CG2 3.25Å; L343-V347 WeakPolarHBondContact O-CG2 3.43Å; L343-V347 PolarHBondContact O-N 2.92Å; L344-V347 PolarHBondContact O-N 2.97Å; V347-A349 PolarHBondContact O-N 3.32Å; V347-Q350 WeakPolarHBondContact O-CB 3.27Å; V347-Q350 PolarHBondContact O-N 3Å; V347-Y351 HydrophobicContact CG1-CD2 3.73Å; V347-Y351 HydrophobicContact CG1-CE2 3.9Å; V347-Y351 WeakPolarHBondContact O-CD2 3.48Å; V347-Y351 PolarHBondContact O-N 3.18Å |
| 348 | D | 91.4 | Very high | 82.3 | Confident | 80 Ų | 80 | 111.1 Ų | 111.1 | 43% | 0.428 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.1 | -38.4 | 176.7 | -74.7 | -22.7 | 0 | 0 | 0 | 111.9 | L344 Q350 Y351 S352 | L344-D348 WeakPolarHBondContact O-CB 3.46Å; L344-D348 VanDerWaalsContact O-CG 3.23Å; L344-D348 PolarHBondContact O-N 2.98Å; D348-Q350 VanDerWaalsContact C-N 3.34Å; D348-Y351 PolarHBondContact O-N 3.42Å; D348-S352 VanDerWaalsContact O-CB 3.24Å; D348-S352 WeakPolarHBondContact O-CB 3.48Å; D348-S352 PolarHBondContact O-N 3.32Å; D348-S352 PolarHBondContact O-OG 2.96Å |
| 349 | A | 88.4 | Confident | 84.2 | Confident | 60 Ų | 60 | 104.1 Ų | 104.1 | 50% | 0.496 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.9 | -39.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | N345 E346 V347 A353 | N345-A349 VanDerWaalsContact O-CB 3.27Å; N345-A349 WeakPolarHBondContact O-CB 3.38Å; N345-A349 PolarHBondContact O-N 3.41Å; E346-A349 PolarHBondContact O-N 2.92Å; V347-A349 PolarHBondContact O-N 3.32Å; A349-A353 VanDerWaalsContact O-CB 3.23Å; A349-A353 WeakPolarHBondContact O-CB 3.25Å; A349-A353 PolarHBondContact O-N 2.97Å |
| 350 | Q | 92.1 | Very high | 85.9 | Confident | 119 Ų | 119 | 97 Ų | 97 | 56% | 0.556 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.6 | -43.5 | 175.4 | -73.7 | 175.3 | 14.8 | 0 | 0 | 111.9 | E346 V347 D348 A353 L354 | E346-Q350 WeakPolarHBondContact O-CB 3.42Å; E346-Q350 WeakPolarHBondContact O-CG 3.46Å; E346-Q350 PolarHBondContact O-N 3.2Å; V347-Q350 WeakPolarHBondContact O-CB 3.27Å; V347-Q350 PolarHBondContact O-N 3Å; D348-Q350 VanDerWaalsContact C-N 3.34Å; Q350-A353 PolarHBondContact O-N 3.32Å; Q350-L354 VanDerWaalsContact O-CB 3.31Å; Q350-L354 WeakPolarHBondContact O-CB 3.44Å; Q350-L354 PolarHBondContact O-N 3.35Å |
| 351 | Y | 92.2 | Very high | 87.6 | Confident | 158 Ų | 158 | 98.5 Ų | 98.5 | 62% | 0.62 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.6 | -44.1 | 174.6 | -96 | -82.7 | 0 | 0 | 0 | 111.6 | V347 D348 A353 L354 Q355 | V347-Y351 HydrophobicContact CG1-CD2 3.73Å; V347-Y351 HydrophobicContact CG1-CE2 3.9Å; V347-Y351 WeakPolarHBondContact O-CD2 3.48Å; V347-Y351 PolarHBondContact O-N 3.18Å; D348-Y351 PolarHBondContact O-N 3.42Å; Y351-A353 PolarHBondContact O-N 3.09Å; Y351-L354 PolarHBondContact O-N 2.97Å; Y351-Q355 VanDerWaalsContact O-CB 3.29Å; Y351-Q355 WeakPolarHBondContact O-CB 3.49Å; Y351-Q355 PolarHBondContact O-N 3.16Å |
| 352 | S | 92.3 | Very high | 88.5 | Confident | 66 Ų | 66 | 98.2 Ų | 98.2 | 46% | 0.462 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 177.2 | -59.1 | 0 | 0 | 0 | 0 | 111.3 | D348 Q355 V356 | D348-S352 VanDerWaalsContact O-CB 3.24Å; D348-S352 WeakPolarHBondContact O-CB 3.48Å; D348-S352 PolarHBondContact O-N 3.32Å; D348-S352 PolarHBondContact O-OG 2.96Å; S352-Q355 PolarHBondContact O-N 3.31Å; S352-V356 WeakPolarHBondContact O-CG2 3.37Å; S352-V356 PolarHBondContact O-N 2.93Å |
| 353 | A | 91.8 | Very high | 89.1 | Confident | 54 Ų | 54 | 102 Ų | 102 | 45% | 0.446 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.8 | -40 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | A349 Q350 Y351 K357 | A349-A353 VanDerWaalsContact O-CB 3.23Å; A349-A353 WeakPolarHBondContact O-CB 3.25Å; A349-A353 PolarHBondContact O-N 2.97Å; Q350-A353 PolarHBondContact O-N 3.32Å; Y351-A353 PolarHBondContact O-N 3.09Å; A353-K357 WeakPolarHBondContact O-CG 3.39Å; A353-K357 PolarHBondContact O-N 2.91Å; A353-K357 VanDerWaalsContact O-N 3.12Å |
| 354 | L | 94.5 | Very high | 89.5 | Confident | 96 Ų | 96 | 102.6 Ų | 102.6 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.6 | -42.1 | 175.7 | -177.2 | 62.2 | 0 | 0 | 0 | 111.3 | Q350 Y351 K357 Y358 | Q350-L354 VanDerWaalsContact O-CB 3.31Å; Q350-L354 WeakPolarHBondContact O-CB 3.44Å; Q350-L354 PolarHBondContact O-N 3.35Å; Y351-L354 PolarHBondContact O-N 2.97Å; L354-K357 PolarHBondContact O-N 2.92Å; L354-Y358 HydrophobicContact CD1-CD2 4.4Å; L354-Y358 PolarHBondContact O-N 3.18Å |
| 355 | Q | 90.4 | Very high | 89 | Confident | 121 Ų | 121 | 100.9 Ų | 100.9 | 57% | 0.565 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.7 | -46.8 | 177.2 | -173.4 | 173.7 | -5.4 | 0 | 0 | 111 | Y351 S352 K357 Y358 D359 | Y351-Q355 VanDerWaalsContact O-CB 3.29Å; Y351-Q355 WeakPolarHBondContact O-CB 3.49Å; Y351-Q355 PolarHBondContact O-N 3.16Å; S352-Q355 PolarHBondContact O-N 3.31Å; Q355-K357 VanDerWaalsContact C-N 3.3Å; Q355-K357 PolarHBondContact O-N 2.72Å; Q355-Y358 PolarHBondContact O-N 3.39Å; Q355-Y358 VanDerWaalsContact O-N 3.15Å; Q355-D359 WeakPolarHBondContact O-CB 3.34Å; Q355-D359 VanDerWaalsContact O-CG 3.26Å; Q355-D359 PolarHBondContact O-N 3.4Å |
| 356 | V | 93.3 | Very high | 88.5 | Confident | 84 Ų | 84 | 97.1 Ų | 97.1 | 51% | 0.509 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 175.8 | 172.3 | 0 | 0 | 0 | 0 | 111.7 | S352 D359 E360 | S352-V356 WeakPolarHBondContact O-CG2 3.37Å; S352-V356 PolarHBondContact O-N 2.93Å; V356-D359 PolarHBondContact O-N 3.24Å; V356-E360 WeakPolarHBondContact O-CB 3.49Å; V356-E360 PolarHBondContact O-N 3.42Å |
| 357 | K | 92.6 | Very high | 87.1 | Confident | 139 Ų | 139 | 98.4 Ų | 98.4 | 60% | 0.604 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.2 | -38.4 | 176.2 | -73.7 | -172 | 179.3 | -173 | 0 | 112.7 | A353 L354 Q355 E360 L361 | A353-K357 WeakPolarHBondContact O-CG 3.39Å; A353-K357 PolarHBondContact O-N 2.91Å; A353-K357 VanDerWaalsContact O-N 3.12Å; L354-K357 PolarHBondContact O-N 2.92Å; Q355-K357 VanDerWaalsContact C-N 3.3Å; Q355-K357 PolarHBondContact O-N 2.72Å; K357-E360 PolarHBondContact O-N 2.88Å; K357-L361 WeakPolarHBondContact O-CG 3.49Å; K357-L361 PolarHBondContact O-N 3.45Å |
| 358 | Y | 91.8 | Very high | 85.6 | Confident | 149 Ų | 149 | 101.3 Ų | 101.3 | 58% | 0.584 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65 | -43.7 | 174.2 | -117.2 | -86.6 | 0 | 0 | 0 | 111.3 | L354 Q355 E360 L361 L362 | L354-Y358 HydrophobicContact CD1-CD2 4.4Å; L354-Y358 PolarHBondContact O-N 3.18Å; Q355-Y358 PolarHBondContact O-N 3.39Å; Q355-Y358 VanDerWaalsContact O-N 3.15Å; Y358-E360 VanDerWaalsContact C-N 3.26Å; Y358-E360 PolarHBondContact O-N 3.47Å; Y358-L361 PolarHBondContact O-N 2.93Å; Y358-L362 WeakPolarHBondContact O-CB 3.27Å; Y358-L362 WeakPolarHBondContact O-CG 3.47Å; Y358-L362 PolarHBondContact O-N 3.27Å |
| 359 | D | 89.1 | Confident | 83.9 | Confident | 74 Ų | 74 | 103.9 Ų | 103.9 | 40% | 0.396 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.8 | -30.6 | 176.1 | -67.4 | -22.8 | 0 | 0 | 0 | 111.9 | Q355 V356 R363 | Q355-D359 WeakPolarHBondContact O-CB 3.34Å; Q355-D359 VanDerWaalsContact O-CG 3.26Å; Q355-D359 PolarHBondContact O-N 3.4Å; V356-D359 PolarHBondContact O-N 3.24Å; D359-R363 WeakPolarHBondContact O-CB 3.3Å; D359-R363 WeakPolarHBondContact O-CG 3.48Å; D359-R363 PolarHBondContact O-N 2.89Å; D359-R363 PolarHBondContact O-NE 2.88Å |
| 360 | E | 91.5 | Very high | 82.4 | Confident | 75 Ų | 75 | 107.3 Ų | 107.3 | 35% | 0.35 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -72.8 | -39.9 | 172.5 | -159.3 | 178.2 | 159.7 | 0 | 0 | 112.1 | V356 K357 Y358 R363 R364 | V356-E360 WeakPolarHBondContact O-CB 3.49Å; V356-E360 PolarHBondContact O-N 3.42Å; K357-E360 PolarHBondContact O-N 2.88Å; Y358-E360 VanDerWaalsContact C-N 3.26Å; Y358-E360 PolarHBondContact O-N 3.47Å; E360-R363 PolarHBondContact O-N 2.98Å; E360-R364 VanDerWaalsContact O-CG 3.29Å; E360-R364 WeakPolarHBondContact O-CG 3.15Å; E360-R364 PolarHBondContact O-N 2.88Å; E360-R364 IonicContact OE1-CZ 3.71Å; E360-R364 IonicContact OE1-NE 3.94Å; E360-R364 IonicContact OE1-NH2 3.69Å; E360-R364 PolarHBondContact OE1-NH2 3.43Å |
| 361 | L | 90.1 | Very high | 80.6 | Confident | 100 Ų | 100 | 107.1 Ų | 107.1 | 52% | 0.524 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 172.2 | -76.7 | 170.6 | 0 | 0 | 0 | 111.8 | K357 Y358 R363 R364 C365 | K357-L361 WeakPolarHBondContact O-CG 3.49Å; K357-L361 PolarHBondContact O-N 3.45Å; Y358-L361 PolarHBondContact O-N 2.93Å; L361-R363 VanDerWaalsContact C-N 3.32Å; L361-R363 PolarHBondContact O-N 3.38Å; L361-R364 PolarHBondContact O-N 3.45Å; L361-C365 PolarHBondContact O-N 3.3Å; L361-C365 PolarHBondContact O-SG 3.01Å; L361-C365 VanDerWaalsContact O-SG 3.35Å |
| 362 | L | 82.1 | Confident | 78.8 | Confident | 111 Ų | 111 | 105.7 Ų | 105.7 | 58% | 0.581 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.2 | -41.5 | 175.1 | -74.4 | 169.7 | 0 | 0 | 0 | 111.3 | Y358 C365 G366 | Y358-L362 WeakPolarHBondContact O-CB 3.27Å; Y358-L362 WeakPolarHBondContact O-CG 3.47Å; Y358-L362 PolarHBondContact O-N 3.27Å; L362-C365 PolarHBondContact O-N 3.49Å; L362-G366 PolarHBondContact O-N 3.32Å |
| 363 | R | 86.8 | Confident | 76.7 | Confident | 154 Ų | 154 | 110 Ų | 110 | 58% | 0.581 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.9 | -38.7 | 173.3 | -81.8 | -178.3 | -70.5 | 151.7 | -2.4 | 112.8 | D359 E360 L361 G366 H367 | D359-R363 WeakPolarHBondContact O-CB 3.3Å; D359-R363 WeakPolarHBondContact O-CG 3.48Å; D359-R363 PolarHBondContact O-N 2.89Å; D359-R363 PolarHBondContact O-NE 2.88Å; E360-R363 PolarHBondContact O-N 2.98Å; L361-R363 VanDerWaalsContact C-N 3.32Å; L361-R363 PolarHBondContact O-N 3.38Å; R363-G366 PolarHBondContact O-N 2.87Å; R363-H367 WeakPolarHBondContact O-CB 2.94Å; R363-H367 PolarHBondContact O-N 3.43Å |
| 364 | R | 81.8 | Confident | 74.5 | Confident | 150 Ų | 150 | 111.9 Ų | 111.9 | 57% | 0.566 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -67.2 | -39.9 | 175.7 | -72.8 | 176 | -169.4 | -150.5 | 5.7 | 111.8 | E360 L361 H367 L368 | E360-R364 VanDerWaalsContact O-CG 3.29Å; E360-R364 WeakPolarHBondContact O-CG 3.15Å; E360-R364 PolarHBondContact O-N 2.88Å; E360-R364 IonicContact OE1-CZ 3.71Å; E360-R364 IonicContact OE1-NE 3.94Å; E360-R364 IonicContact OE1-NH2 3.69Å; E360-R364 PolarHBondContact OE1-NH2 3.43Å; L361-R364 PolarHBondContact O-N 3.45Å; R364-H367 PolarHBondContact O-N 3.34Å; R364-L368 WeakPolarHBondContact O-CB 3.47Å; R364-L368 PolarHBondContact O-N 3.25Å |
| 365 | C | 76.8 | Confident | 72.2 | Confident | 77 Ų | 77 | 115.5 Ų | 115.5 | 52% | 0.52 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65 | -42.3 | 173.1 | -68.3 | 0 | 0 | 0 | 0 | 111.6 | L361 L362 L368 E369 | L361-C365 PolarHBondContact O-N 3.3Å; L361-C365 PolarHBondContact O-SG 3.01Å; L361-C365 VanDerWaalsContact O-SG 3.35Å; L362-C365 PolarHBondContact O-N 3.49Å; C365-L368 WeakPolarHBondContact O-CB 3.32Å; C365-L368 PolarHBondContact O-N 2.85Å; C365-L368 VanDerWaalsContact O-N 3.14Å; C365-E369 PolarHBondContact O-N 3.42Å |
| 366 | G | 71.6 | Confident | 69.9 | Low | 27 Ų | 27 | 117 Ų | 117 | 28% | 0.278 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.2 | -39.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L362 R363 L368 E369 E370 | L362-G366 PolarHBondContact O-N 3.32Å; R363-G366 PolarHBondContact O-N 2.87Å; G366-L368 VanDerWaalsContact C-N 3.31Å; G366-E369 PolarHBondContact O-N 2.85Å; G366-E370 PolarHBondContact O-N 3.32Å |
| 367 | H | 59.8 | Low | 67.4 | Low | 121 Ų | 121 | 118.7 Ų | 118.7 | 56% | 0.56 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.5 | -30.5 | 171.4 | -92.2 | 45.1 | 0 | 0 | 0 | 112.9 | R363 R364 L371 | R363-H367 WeakPolarHBondContact O-CB 2.94Å; R363-H367 PolarHBondContact O-N 3.43Å; R364-H367 PolarHBondContact O-N 3.34Å; H367-L371 WeakPolarHBondContact O-CB 3.45Å; H367-L371 VanDerWaalsContact O-CG 3.31Å; H367-L371 WeakPolarHBondContact O-CG 3.38Å; H367-L371 PolarHBondContact O-N 3.47Å |
| 368 | L | 56.7 | Low | 64.6 | Low | 112 Ų | 112 | 114.9 Ų | 114.9 | 59% | 0.586 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -72.8 | -35.7 | 176.5 | -158.8 | 70.6 | 0 | 0 | 0 | 111.3 | R364 C365 G366 Q372 | R364-L368 WeakPolarHBondContact O-CB 3.47Å; R364-L368 PolarHBondContact O-N 3.25Å; C365-L368 WeakPolarHBondContact O-CB 3.32Å; C365-L368 PolarHBondContact O-N 2.85Å; C365-L368 VanDerWaalsContact O-N 3.14Å; G366-L368 VanDerWaalsContact C-N 3.31Å; L368-Q372 WeakPolarHBondContact O-CB 3.31Å; L368-Q372 PolarHBondContact O-N 3.28Å |
| 369 | E | 57 | Low | 61.9 | Low | 134 Ų | 134 | 114 Ų | 114 | 63% | 0.626 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.3 | -41.9 | 170.7 | -80.8 | 177.9 | 157.3 | 0 | 0 | 111.8 | C365 G366 L371 Q372 E373 | C365-E369 PolarHBondContact O-N 3.42Å; G366-E369 PolarHBondContact O-N 2.85Å; E369-L371 VanDerWaalsContact C-N 3.33Å; E369-L371 PolarHBondContact O-N 2.94Å; E369-Q372 PolarHBondContact O-N 2.89Å; E369-E373 PolarHBondContact O-N 3.5Å |
| 370 | E | 56.5 | Low | 59.3 | Low | 132 Ų | 132 | 115.8 Ų | 115.8 | 62% | 0.617 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -66.2 | -32 | 176 | -76.4 | 179 | 168.7 | 0 | 0 | 113.1 | G366 S374 | G366-E370 PolarHBondContact O-N 3.32Å; E370-S374 PolarHBondContact O-N 3.12Å |
| 371 | L | 55 | Low | 57 | Low | 115 Ų | 115 | 118.1 Ų | 118.1 | 60% | 0.602 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -77.1 | -33.2 | 174.1 | -72.2 | 167.1 | 0 | 0 | 0 | 112.5 | H367 E369 S374 E375 | H367-L371 WeakPolarHBondContact O-CB 3.45Å; H367-L371 VanDerWaalsContact O-CG 3.31Å; H367-L371 WeakPolarHBondContact O-CG 3.38Å; H367-L371 PolarHBondContact O-N 3.47Å; E369-L371 VanDerWaalsContact C-N 3.33Å; E369-L371 PolarHBondContact O-N 2.94Å; L371-S374 PolarHBondContact O-N 3.03Å; L371-E375 PolarHBondContact O-N 3.38Å |
| 372 | Q | 53.3 | Low | 54.2 | Low | 128 Ų | 128 | 117.5 Ų | 117.5 | 60% | 0.598 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -72.3 | -32.1 | 174.2 | -104.9 | 176.4 | -17.7 | 0 | 0 | 113.4 | L368 E369 S374 | L368-Q372 WeakPolarHBondContact O-CB 3.31Å; L368-Q372 PolarHBondContact O-N 3.28Å; E369-Q372 PolarHBondContact O-N 2.89Å; Q372-S374 VanDerWaalsContact C-N 3.33Å |
| 373 | E | 48.5 | Very low | 52.9 | Low | 157 Ų | 157 | 118 Ų | 118 | 73% | 0.734 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -74.3 | -23.7 | 174.5 | -73.4 | -170 | 164.3 | 0 | 0 | 112.8 | E369 | E369-E373 PolarHBondContact O-N 3.5Å |
| 374 | S | 45.4 | Very low | 50.3 | Low | 94 Ų | 94 | 115.1 Ų | 115.1 | 66% | 0.657 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -77.8 | -29.5 | 177.8 | -152.4 | 0 | 0 | 0 | 0 | 113.5 | E370 L371 Q372 | E370-S374 PolarHBondContact O-N 3.12Å; L371-S374 PolarHBondContact O-N 3.03Å; Q372-S374 VanDerWaalsContact C-N 3.33Å |
| 375 | E | 46.1 | Very low | 47.9 | Very low | 172 Ų | 172 | 116.5 Ų | 116.5 | 80% | 0.804 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | -5.6 | -179 | -68 | -166.1 | 155.2 | 0 | 0 | 114.9 | L371 | L371-E375 PolarHBondContact O-N 3.38Š|
| 376 | L | 43.1 | Very low | 46.2 | Very low | 151 Ų | 151 | 117.2 Ų | 117.2 | 79% | 0.791 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | 6.5 | 180 | -74.2 | 168.7 | 0 | 0 | 0 | 115.1 | ||
| 377 | S | 39.4 | Very low | 44.5 | Very low | 121 Ų | 121 | 123.5 Ų | 123.5 | 85% | 0.846 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -106.2 | 64.5 | 169.2 | -78.2 | 0 | 0 | 0 | 0 | 111.9 | ||
| 378 | G | 34.5 | Very low | 43.9 | Very low | 59 Ų | 59 | 124.9 Ų | 124.9 | 61% | 0.608 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -167.2 | 70.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 379 | S | 35.7 | Very low | 43.5 | Very low | 129 Ų | 129 | 124.3 Ų | 124.3 | 90% | 0.902 | 74% | 0.743 | S | S | * | * | trans | 57.1 | 129.3 | 155.8 | 64.5 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 380 | S | 33.9 | Very low | 43.1 | Very low | 113 Ų | 113 | 127.1 Ų | 127.1 | 79% | 0.79 | 76% | 0.756 | S | S | * | * | trans | -90.4 | 159.1 | 159.5 | -138.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 381 | P | 43 | Very low | 42.5 | Very low | 123 Ų | 123 | 127 Ų | 127 | 80% | 0.799 | 76% | 0.76 | S | S | * | * | -144.4 | 160.7 | 50.3 | 35.4 | -12.6 | 0 | 0 | 0 | 119.2 | |||||
| 382 | A | 30.5 | Very low | 42.3 | Very low | 87 Ų | 87 | 127.5 Ų | 127.5 | 72% | 0.719 | 76% | 0.763 | S | S | * | * | trans | -21 | -176.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 383 | P | 56.2 | Low | 42.1 | Very low | 121 Ų | 121 | 130.2 Ų | 130.2 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | -131.4 | 149.5 | -55.5 | 35.8 | -20.2 | 0 | 0 | 0 | 112.9 | |||||
| 384 | A | 31.5 | Very low | 42.5 | Very low | 94 Ų | 94 | 130.5 Ų | 130.5 | 78% | 0.777 | 77% | 0.774 | S | S | * | * | trans | -179.3 | 130.5 | 152.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 385 | E | 31.8 | Very low | 43.2 | Very low | 180 Ų | 180 | 129.3 Ų | 129.3 | 84% | 0.841 | 76% | 0.758 | S | S | * | * | trans | 51 | 117.3 | 137.2 | -57.2 | -67.5 | 137.4 | 0 | 0 | 121.1 | ||||
| 386 | A | 41.7 | Very low | 44.6 | Very low | 91 Ų | 91 | 123.6 Ų | 123.6 | 75% | 0.752 | 74% | 0.736 | S | S | * | * | trans | 13.9 | 121.4 | 143.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 387 | D | 35.7 | Very low | 46.3 | Very low | 160 Ų | 160 | 124.2 Ų | 124.2 | 86% | 0.856 | 74% | 0.735 | S | S | * | * | -156.8 | 146.7 | 109.2 | -142.4 | -7.6 | 0 | 0 | 0 | 111.8 | |||||
| 388 | D | 47.1 | Very low | 48.1 | Very low | 150 Ų | 150 | 125 Ų | 125 | 80% | 0.802 | 72% | 0.72 | S | S | * | * | trans | -87.8 | 111.8 | -178.7 | 177.6 | 30.9 | 0 | 0 | 0 | 108.9 | ||||
| 389 | S | 47.1 | Very low | 50.4 | Low | 99 Ų | 99 | 127 Ų | 127 | 69% | 0.692 | 71% | 0.712 | S | S | * | * | trans | 157.8 | 142.4 | 151 | 42.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 390 | E | 49.2 | Very low | 52.7 | Low | 193 Ų | 193 | 126.1 Ų | 126.1 | 90% | 0.902 | 69% | 0.694 | S | S | * | * | trans | 89.6 | 59.6 | 177.9 | -47 | -166.5 | 161 | 0 | 0 | 116.3 | ||||
| 391 | D | 44.6 | Very low | 55.1 | Low | 131 Ų | 131 | 125.5 Ų | 125.5 | 70% | 0.701 | 68% | 0.681 | S | S | * | * | trans | -137.7 | 64.3 | 149.9 | -154.8 | 9.7 | 0 | 0 | 0 | 110.4 | ||||
| 392 | D | 51 | Low | 57.1 | Low | 125 Ų | 125 | 125.2 Ų | 125.2 | 67% | 0.668 | 67% | 0.667 | S | S | * | * | trans | -100.7 | 16.6 | -177.3 | -150.2 | 25 | 0 | 0 | 0 | 112.7 | ||||
| 393 | F | 49.2 | Very low | 59.8 | Low | 185 Ų | 185 | 126.6 Ų | 126.6 | 81% | 0.811 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -115.2 | 2.2 | -176 | -80.8 | -78.8 | 0 | 0 | 0 | 116.2 | ||
| 394 | H | 55.1 | Low | 61.5 | Low | 162 Ų | 162 | 126.2 Ų | 126.2 | 75% | 0.75 | 64% | 0.642 | S | S | * | * | trans | -140.5 | 46 | 174.1 | -65.3 | -63.7 | 0 | 0 | 0 | 113.7 | P396 | H394-P396 WeakPolarHBondContact O-CD 3.45Š| ||
| 395 | Q | 60.6 | Low | 64.3 | Low | 70 Ų | 70 | 125.1 Ų | 125.1 | 33% | 0.327 | 62% | 0.622 | S | S | . | * | trans | -78.1 | 123.2 | 166.9 | -75.4 | -173 | 17.5 | 0 | 0 | 110.5 | ||||
| 396 | P | 76.3 | Confident | 67.1 | Low | 52 Ų | 52 | 122.9 Ų | 122.9 | 34% | 0.338 | 61% | 0.61 | S | S | . | * | trans | -62.4 | 141.1 | 175 | -22.9 | 34.6 | 0 | 0 | 0 | 111.2 | H394 Y398 K399 | H394-P396 WeakPolarHBondContact O-CD 3.45Å; P396-Y398 HydrophobicContact CB-CD1 3.29Å; P396-Y398 HydrophobicContact CB-CE1 3.11Å; P396-Y398 HydrophobicContact CB-CG 4.16Å; P396-Y398 HydrophobicContact CG-CD1 4.2Å; P396-Y398 HydrophobicContact CG-CE1 3.49Å; P396-Y398 VanDerWaalsContact CG-CE1 3.49Å; P396-Y398 PolarHBondContact O-N 3.39Å; P396-K399 WeakPolarHBondContact O-CB 3.32Å; P396-K399 PolarHBondContact O-N 2.88Å | ||
| 397 | E | 77.6 | Confident | 69.5 | Low | 163 Ų | 163 | 122.3 Ų | 122.3 | 76% | 0.762 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -50 | -30.2 | 179.7 | -64.4 | 175.9 | -172.3 | 0 | 0 | 113.1 | K399 E400 L401 | E397-K399 VanDerWaalsContact C-N 3.3Å; E397-K399 PolarHBondContact O-N 2.86Å; E397-E400 PolarHBondContact O-N 2.9Å; E397-L401 PolarHBondContact O-N 2.84Å; E397-L401 VanDerWaalsContact O-N 3.07Å |
| 398 | Y | 77.9 | Confident | 72 | Confident | 137 Ų | 137 | 122.7 Ų | 122.7 | 54% | 0.537 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -63.3 | -32.7 | 176.7 | 74.5 | -104.6 | 0 | 0 | 0 | 112.8 | P396 L401 F402 | P396-Y398 HydrophobicContact CB-CD1 3.29Å; P396-Y398 HydrophobicContact CB-CE1 3.11Å; P396-Y398 HydrophobicContact CB-CG 4.16Å; P396-Y398 HydrophobicContact CG-CD1 4.2Å; P396-Y398 HydrophobicContact CG-CE1 3.49Å; P396-Y398 VanDerWaalsContact CG-CE1 3.49Å; P396-Y398 PolarHBondContact O-N 3.39Å; Y398-L401 WeakPolarHBondContact O-CB 3.4Å; Y398-L401 PolarHBondContact O-N 3.39Å; Y398-F402 AromaticContact CD2-CD2 3.97Å; Y398-F402 HydrophobicContact CD2-CD2 3.97Å; Y398-F402 HydrophobicContact CD2-CE2 4.14Å; Y398-F402 WeakPolarHBondContact O-CD2 3.4Å; Y398-F402 PolarHBondContact O-N 2.87Å |
| 399 | K | 83.2 | Confident | 74.1 | Confident | 101 Ų | 101 | 120.3 Ų | 120.3 | 44% | 0.439 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -68.4 | -37.5 | 177.7 | -88.1 | -170 | 175.2 | 177.6 | 0 | 111.7 | P396 E397 F402 R403 | P396-K399 WeakPolarHBondContact O-CB 3.32Å; P396-K399 PolarHBondContact O-N 2.88Å; E397-K399 VanDerWaalsContact C-N 3.3Å; E397-K399 PolarHBondContact O-N 2.86Å; K399-F402 PolarHBondContact O-N 3.27Å; K399-R403 WeakPolarHBondContact O-CG 3.28Å; K399-R403 PolarHBondContact O-N 2.83Å |
| 400 | E | 82.8 | Confident | 76 | Confident | 112 Ų | 112 | 120.9 Ų | 120.9 | 52% | 0.523 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.6 | -44.9 | 172.9 | -74.4 | 179.5 | -179.1 | 0 | 0 | 111 | E397 F402 R403 E404 | E397-E400 PolarHBondContact O-N 2.9Å; E400-F402 VanDerWaalsContact C-N 3.33Å; E400-F402 PolarHBondContact O-N 3.28Å; E400-R403 WeakPolarHBondContact O-CB 3.31Å; E400-R403 PolarHBondContact O-N 2.86Å; E400-E404 WeakPolarHBondContact O-CB 3.27Å; E400-E404 PolarHBondContact O-N 3.39Å |
| 401 | L | 84.6 | Confident | 78 | Confident | 100 Ų | 100 | 118 Ų | 118 | 52% | 0.524 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59 | -44.3 | 174.6 | -165.9 | 84.8 | 0 | 0 | 0 | 111.4 | E397 Y398 E404 I405 | E397-L401 PolarHBondContact O-N 2.84Å; E397-L401 VanDerWaalsContact O-N 3.07Å; Y398-L401 WeakPolarHBondContact O-CB 3.4Å; Y398-L401 PolarHBondContact O-N 3.39Å; L401-E404 PolarHBondContact O-N 2.91Å; L401-I405 HydrophobicContact CD2-CD1 3.97Å; L401-I405 HydrophobicContact CG-CD1 3.83Å; L401-I405 HydrophobicContact CG-CG1 4.44Å; L401-I405 WeakPolarHBondContact O-CB 3.35Å; L401-I405 WeakPolarHBondContact O-CG1 3.45Å; L401-I405 PolarHBondContact O-N 2.94Å |
| 402 | F | 86.3 | Confident | 80.1 | Confident | 116 Ų | 116 | 115.4 Ų | 115.4 | 51% | 0.509 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.3 | -40.6 | 176.2 | -86.8 | -69.1 | 0 | 0 | 0 | 112.1 | Y398 K399 E400 E404 I405 F406 | Y398-F402 AromaticContact CD2-CD2 3.97Å; Y398-F402 HydrophobicContact CD2-CD2 3.97Å; Y398-F402 HydrophobicContact CD2-CE2 4.14Å; Y398-F402 WeakPolarHBondContact O-CD2 3.4Å; Y398-F402 PolarHBondContact O-N 2.87Å; K399-F402 PolarHBondContact O-N 3.27Å; E400-F402 VanDerWaalsContact C-N 3.33Å; E400-F402 PolarHBondContact O-N 3.28Å; F402-E404 VanDerWaalsContact C-N 3.33Å; F402-I405 PolarHBondContact O-N 2.87Å; F402-F406 WeakPolarHBondContact O-CB 3.46Å; F402-F406 WeakPolarHBondContact O-CD2 3.35Å; F402-F406 PolarHBondContact O-N 3.41Å |
| 403 | R | 86.8 | Confident | 81.9 | Confident | 117 Ų | 117 | 115.9 Ų | 115.9 | 44% | 0.442 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 173.6 | -78 | -166 | -65.9 | -99.6 | 5.1 | 111.6 | K399 E400 S407 | K399-R403 WeakPolarHBondContact O-CG 3.28Å; K399-R403 PolarHBondContact O-N 2.83Å; E400-R403 WeakPolarHBondContact O-CB 3.31Å; E400-R403 PolarHBondContact O-N 2.86Å; R403-S407 VanDerWaalsContact O-CB 3.27Å; R403-S407 WeakPolarHBondContact O-CB 3.21Å; R403-S407 PolarHBondContact O-N 3.24Å; R403-S407 PolarHBondContact O-OG 3.43Å |
| 404 | E | 90.7 | Very high | 83.6 | Confident | 112 Ų | 112 | 112.3 Ų | 112.3 | 52% | 0.523 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.5 | -46 | 178.1 | -173.1 | 172.9 | 178.9 | 0 | 0 | 111.3 | E400 L401 F402 F406 S407 R408 | E400-E404 WeakPolarHBondContact O-CB 3.27Å; E400-E404 PolarHBondContact O-N 3.39Å; L401-E404 PolarHBondContact O-N 2.91Å; F402-E404 VanDerWaalsContact C-N 3.33Å; E404-F406 PolarHBondContact O-N 3.26Å; E404-S407 PolarHBondContact O-N 3.46Å; E404-R408 VanDerWaalsContact O-CB 3.31Å; E404-R408 WeakPolarHBondContact O-CB 3.45Å; E404-R408 PolarHBondContact O-N 3.45Å; E404-R408 IonicContact OE1-NH1 3.79Å |
| 405 | I | 91.1 | Very high | 84.8 | Confident | 72 Ų | 72 | 107.6 Ų | 107.6 | 37% | 0.369 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 176.2 | -69.9 | 165.8 | 0 | 0 | 0 | 110.4 | L401 F402 S407 R408 I409 | L401-I405 HydrophobicContact CD2-CD1 3.97Å; L401-I405 HydrophobicContact CG-CD1 3.83Å; L401-I405 HydrophobicContact CG-CG1 4.44Å; L401-I405 WeakPolarHBondContact O-CB 3.35Å; L401-I405 WeakPolarHBondContact O-CG1 3.45Å; L401-I405 PolarHBondContact O-N 2.94Å; F402-I405 PolarHBondContact O-N 2.87Å; I405-S407 PolarHBondContact O-N 2.96Å; I405-R408 PolarHBondContact O-N 3.17Å; I405-I409 HydrophobicContact CG2-CD1 3.59Å; I405-I409 HydrophobicContact CG2-CG1 4.29Å; I405-I409 WeakPolarHBondContact O-CB 3.46Å; I405-I409 VanDerWaalsContact O-CG1 3.25Å; I405-I409 WeakPolarHBondContact O-CG1 3.27Å; I405-I409 PolarHBondContact O-N 2.87Å |
| 406 | F | 90.4 | Very high | 85.8 | Confident | 132 Ų | 132 | 109.4 Ų | 109.4 | 58% | 0.579 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.6 | -43.7 | 177.8 | -99.2 | -81.7 | 0 | 0 | 0 | 111.9 | F402 E404 R408 I409 Q410 | F402-F406 WeakPolarHBondContact O-CB 3.46Å; F402-F406 WeakPolarHBondContact O-CD2 3.35Å; F402-F406 PolarHBondContact O-N 3.41Å; E404-F406 PolarHBondContact O-N 3.26Å; F406-R408 VanDerWaalsContact C-N 3.26Å; F406-R408 PolarHBondContact O-N 2.86Å; F406-I409 PolarHBondContact O-N 2.67Å; F406-Q410 VanDerWaalsContact O-CB 3.23Å; F406-Q410 WeakPolarHBondContact O-CB 3.49Å; F406-Q410 PolarHBondContact O-N 2.99Å |
| 407 | S | 91.4 | Very high | 85.8 | Confident | 79 Ų | 79 | 111.9 Ų | 111.9 | 55% | 0.552 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.9 | -39.2 | 176.4 | -58.8 | 0 | 0 | 0 | 0 | 111.2 | R403 E404 I405 Q410 K411 | R403-S407 VanDerWaalsContact O-CB 3.27Å; R403-S407 WeakPolarHBondContact O-CB 3.21Å; R403-S407 PolarHBondContact O-N 3.24Å; R403-S407 PolarHBondContact O-OG 3.43Å; E404-S407 PolarHBondContact O-N 3.46Å; I405-S407 PolarHBondContact O-N 2.96Å; S407-Q410 PolarHBondContact O-N 3.49Å; S407-K411 WeakPolarHBondContact O-CB 3.49Å; S407-K411 PolarHBondContact O-N 3.45Å |
| 408 | R | 88.8 | Confident | 85.8 | Confident | 168 Ų | 168 | 111.2 Ų | 111.2 | 63% | 0.634 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -71.4 | -43.8 | 179.9 | -149.6 | 146.7 | -170 | 128.3 | 0.8 | 112 | E404 I405 F406 Q410 K411 T412 | E404-R408 VanDerWaalsContact O-CB 3.31Å; E404-R408 WeakPolarHBondContact O-CB 3.45Å; E404-R408 PolarHBondContact O-N 3.45Å; E404-R408 IonicContact OE1-NH1 3.79Å; I405-R408 PolarHBondContact O-N 3.17Å; F406-R408 VanDerWaalsContact C-N 3.26Å; F406-R408 PolarHBondContact O-N 2.86Å; R408-Q410 VanDerWaalsContact C-N 3.3Å; R408-Q410 PolarHBondContact O-N 2.99Å; R408-K411 PolarHBondContact O-N 2.94Å; R408-T412 PolarHBondContact O-N 2.91Å; R408-T412 PolarHBondContact O-OG1 3.47Å |
| 409 | I | 91.1 | Very high | 85.3 | Confident | 100 Ų | 100 | 112.4 Ų | 112.4 | 51% | 0.513 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61 | -41.9 | 173.8 | -69.3 | 168.7 | 0 | 0 | 0 | 110.6 | I405 F406 T412 K413 | I405-I409 HydrophobicContact CG2-CD1 3.59Å; I405-I409 HydrophobicContact CG2-CG1 4.29Å; I405-I409 WeakPolarHBondContact O-CB 3.46Å; I405-I409 VanDerWaalsContact O-CG1 3.25Å; I405-I409 WeakPolarHBondContact O-CG1 3.27Å; I405-I409 PolarHBondContact O-N 2.87Å; F406-I409 PolarHBondContact O-N 2.67Å; I409-T412 PolarHBondContact O-N 2.83Å; I409-K413 WeakPolarHBondContact O-CB 3.37Å; I409-K413 PolarHBondContact O-N 3.4Å |
| 410 | Q | 87.9 | Confident | 84.5 | Confident | 111 Ų | 111 | 117.9 Ų | 117.9 | 52% | 0.519 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.5 | -40.8 | -179.9 | -167.5 | 150.4 | -9.4 | 0 | 0 | 111.6 | F406 S407 R408 K413 E414 | F406-Q410 VanDerWaalsContact O-CB 3.23Å; F406-Q410 WeakPolarHBondContact O-CB 3.49Å; F406-Q410 PolarHBondContact O-N 2.99Å; S407-Q410 PolarHBondContact O-N 3.49Å; R408-Q410 VanDerWaalsContact C-N 3.3Å; R408-Q410 PolarHBondContact O-N 2.99Å; Q410-K413 WeakPolarHBondContact O-CB 3.46Å; Q410-K413 PolarHBondContact O-N 3.02Å; Q410-E414 WeakPolarHBondContact O-CG 3.42Å; Q410-E414 PolarHBondContact O-N 3.25Å |
| 411 | K | 90.6 | Very high | 83.4 | Confident | 134 Ų | 134 | 115.9 Ų | 115.9 | 58% | 0.583 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -61.5 | -46.6 | 171.3 | -168.4 | 174.5 | -176.2 | 175.6 | 0 | 112.1 | S407 R408 K413 E414 D415 | S407-K411 WeakPolarHBondContact O-CB 3.49Å; S407-K411 PolarHBondContact O-N 3.45Å; R408-K411 PolarHBondContact O-N 2.94Å; K411-K413 VanDerWaalsContact C-N 3.27Å; K411-K413 PolarHBondContact O-N 3.45Å; K411-E414 PolarHBondContact O-N 3.12Å; K411-E414 VanDerWaalsContact O-N 3.15Å; K411-D415 PolarHBondContact O-N 3.18Å |
| 412 | T | 89.6 | Confident | 81.6 | Confident | 75 Ų | 75 | 113.6 Ų | 113.6 | 46% | 0.46 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.8 | -34.8 | 176.2 | -51.3 | 0 | 0 | 0 | 0 | 112 | R408 I409 L416 | R408-T412 PolarHBondContact O-N 2.91Å; R408-T412 PolarHBondContact O-OG1 3.47Å; I409-T412 PolarHBondContact O-N 2.83Å; T412-L416 HydrophobicContact CG2-CD1 4.29Å; T412-L416 WeakPolarHBondContact O-CB 3.32Å; T412-L416 PolarHBondContact O-N 2.77Å |
| 413 | K | 87.7 | Confident | 79.7 | Confident | 135 Ų | 135 | 114.6 Ų | 114.6 | 59% | 0.587 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -66.8 | -42.2 | 174.2 | -179.2 | -173.9 | 173.7 | -172 | 0 | 111.4 | I409 Q410 K411 L416 I417 | I409-K413 WeakPolarHBondContact O-CB 3.37Å; I409-K413 PolarHBondContact O-N 3.4Å; Q410-K413 WeakPolarHBondContact O-CB 3.46Å; Q410-K413 PolarHBondContact O-N 3.02Å; K411-K413 VanDerWaalsContact C-N 3.27Å; K411-K413 PolarHBondContact O-N 3.45Å; K413-L416 PolarHBondContact O-N 2.71Å; K413-I417 HydrophobicContact CG-CD1 4.02Å; K413-I417 WeakPolarHBondContact O-CD1 3.07Å; K413-I417 WeakPolarHBondContact O-CG1 3.5Å; K413-I417 PolarHBondContact O-N 3.4Å |
| 414 | E | 84.7 | Confident | 77.7 | Confident | 110 Ų | 110 | 114 Ų | 114 | 51% | 0.514 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.1 | -46.6 | 175.4 | -74.5 | 167.4 | -169.7 | 0 | 0 | 111.1 | Q410 K411 L416 I417 E418 | Q410-E414 WeakPolarHBondContact O-CG 3.42Å; Q410-E414 PolarHBondContact O-N 3.25Å; K411-E414 PolarHBondContact O-N 3.12Å; K411-E414 VanDerWaalsContact O-N 3.15Å; E414-L416 VanDerWaalsContact C-N 3.3Å; E414-L416 PolarHBondContact O-N 3.27Å; E414-I417 PolarHBondContact O-N 3.14Å; E414-E418 WeakPolarHBondContact O-CB 3.47Å; E414-E418 PolarHBondContact O-N 2.9Å |
| 415 | D | 81.4 | Confident | 75.6 | Confident | 64 Ų | 64 | 114.2 Ų | 114.2 | 34% | 0.342 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -57.4 | -42 | 174.7 | -63 | -23.6 | 0 | 0 | 0 | 111.2 | K411 I417 E418 H419 | K411-D415 PolarHBondContact O-N 3.18Å; D415-I417 PolarHBondContact O-N 3.15Å; D415-E418 PolarHBondContact O-N 2.84Å; D415-H419 WeakPolarHBondContact O-CB 3.27Å; D415-H419 PolarHBondContact O-CD2 2.79Å; D415-H419 VanDerWaalsContact O-CG 3.28Å; D415-H419 PolarHBondContact O-N 2.99Å |
| 416 | L | 80.4 | Confident | 73.4 | Confident | 107 Ų | 107 | 117.8 Ų | 117.8 | 56% | 0.56 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -65.7 | -34.8 | 175.9 | -102.9 | 146.6 | 0 | 0 | 0 | 113.3 | T412 K413 E414 R420 | T412-L416 HydrophobicContact CG2-CD1 4.29Å; T412-L416 WeakPolarHBondContact O-CB 3.32Å; T412-L416 PolarHBondContact O-N 2.77Å; K413-L416 PolarHBondContact O-N 2.71Å; E414-L416 VanDerWaalsContact C-N 3.3Å; E414-L416 PolarHBondContact O-N 3.27Å; L416-R420 WeakPolarHBondContact O-CB 3.32Å; L416-R420 PolarHBondContact O-N 3.31Å |
| 417 | I | 77.5 | Confident | 71.2 | Confident | 105 Ų | 105 | 120.6 Ų | 120.6 | 54% | 0.538 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -72.8 | -41.1 | 176.5 | -68.7 | 162.8 | 0 | 0 | 0 | 109.7 | K413 E414 D415 R420 G421 | K413-I417 HydrophobicContact CG-CD1 4.02Å; K413-I417 WeakPolarHBondContact O-CD1 3.07Å; K413-I417 WeakPolarHBondContact O-CG1 3.5Å; K413-I417 PolarHBondContact O-N 3.4Å; E414-I417 PolarHBondContact O-N 3.14Å; D415-I417 PolarHBondContact O-N 3.15Å; I417-R420 PolarHBondContact O-N 2.79Å; I417-G421 PolarHBondContact O-N 2.76Å; I417-G421 VanDerWaalsContact O-N 3.07Å |
| 418 | E | 77.1 | Confident | 68.7 | Low | 148 Ų | 148 | 122.8 Ų | 122.8 | 69% | 0.692 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -63.9 | -40.2 | 177.2 | -157.8 | 170.5 | -160.4 | 0 | 0 | 111.3 | E414 D415 G421 | E414-E418 WeakPolarHBondContact O-CB 3.47Å; E414-E418 PolarHBondContact O-N 2.9Å; D415-E418 PolarHBondContact O-N 2.84Å; E418-G421 PolarHBondContact O-N 2.82Å |
| 419 | H | 66.3 | Low | 66.6 | Low | 162 Ų | 162 | 122.4 Ų | 122.4 | 75% | 0.75 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -77.5 | -18.4 | 175.2 | -66.4 | -44.4 | 0 | 0 | 0 | 114.8 | D415 | D415-H419 WeakPolarHBondContact O-CB 3.27Å; D415-H419 PolarHBondContact O-CD2 2.79Å; D415-H419 VanDerWaalsContact O-CG 3.28Å; D415-H419 PolarHBondContact O-N 2.99Å |
| 420 | R | 66.6 | Low | 64.8 | Low | 217 Ų | 217 | 123.4 Ų | 123.4 | 82% | 0.819 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -89.1 | -13.1 | 174.6 | -171 | -177.2 | -90.1 | -111.2 | 4.2 | 112.3 | L416 I417 | L416-R420 WeakPolarHBondContact O-CB 3.32Å; L416-R420 PolarHBondContact O-N 3.31Å; I417-R420 PolarHBondContact O-N 2.79Å |
| 421 | G | 60.3 | Low | 62.9 | Low | 70 Ų | 70 | 124.2 Ų | 124.2 | 72% | 0.722 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -105.7 | 17.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | I417 E418 | I417-G421 PolarHBondContact O-N 2.76Å; I417-G421 VanDerWaalsContact O-N 3.07Å; E418-G421 PolarHBondContact O-N 2.82Å |
| 422 | G | 46.7 | Very low | 60.6 | Low | 51 Ų | 51 | 123.2 Ų | 123.2 | 53% | 0.526 | 69% | 0.689 | S | S | . | * | S | Bend | trans | -111.7 | 148.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 423 | P | 46.2 | Very low | 58.4 | Low | 137 Ų | 137 | 131.1 Ų | 131.1 | 89% | 0.89 | 73% | 0.729 | S | S | * | * | trans | -75.1 | 141.4 | -133 | 30.5 | -35.8 | 0 | 0 | 0 | 115.1 | ||||
| 424 | S | 45.2 | Very low | 56.9 | Low | 104 Ų | 104 | 131 Ų | 131 | 73% | 0.727 | 74% | 0.736 | S | S | * | * | trans | -75.2 | 141.9 | 159.7 | 60.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 425 | V | 46.3 | Very low | 55.4 | Low | 117 Ų | 117 | 132.1 Ų | 132.1 | 71% | 0.709 | 75% | 0.748 | S | S | * | * | trans | 94.6 | 125.5 | 150 | -168.8 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 426 | D | 44.7 | Very low | 54 | Low | 148 Ų | 148 | 135.8 Ų | 135.8 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | trans | 64.7 | 122 | 149.8 | -65.4 | -18.2 | 0 | 0 | 0 | 123.2 | ||||
| 427 | E | 44.1 | Very low | 52.4 | Low | 190 Ų | 190 | 137.5 Ų | 137.5 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | 138.4 | 110.9 | 150.9 | -86.5 | -167.5 | 151.7 | 0 | 0 | 106.8 | ||||
| 428 | V | 39.9 | Very low | 50.9 | Low | 126 Ų | 126 | 139.6 Ų | 139.6 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | -171 | 124.8 | 62.3 | 166.6 | 0 | 0 | 0 | 0 | 108 | |||||
| 429 | L | 45.1 | Very low | 49.1 | Very low | 160 Ų | 160 | 139 Ų | 139 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | trans | -65.1 | 155 | 157.3 | -75.1 | 160.2 | 0 | 0 | 0 | 110 | ||||
| 430 | P | 51.6 | Low | 47.9 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | trans | -123.3 | 126.1 | 134.4 | 31.5 | -20.9 | 0 | 0 | 0 | 112 | ||||
| 431 | T | 47.9 | Very low | 46.4 | Very low | 129 Ų | 129 | 131.2 Ų | 131.2 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -55.7 | 151.1 | 159.3 | 44.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 432 | S | 43.1 | Very low | 45.3 | Very low | 112 Ų | 112 | 136.3 Ų | 136.3 | 78% | 0.783 | 82% | 0.815 | S | S | * | * | trans | -40.2 | 142.4 | 171.3 | -62.8 | 0 | 0 | 0 | 0 | 116 | ||||
| 433 | N | 42.8 | Very low | 45.2 | Very low | 242 Ų | 242 | 144.1 Ų | 144.1 | 100% | 1.294 | 84% | 0.841 | S | S | * | * | -148.9 | 0 | 121.4 | -102.9 | -19 | 0 | 0 | 0 | 109.8 |
Retrieved 433 of 433 residues in 414.4 ms
(Link to these results)