| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 44.8 | Very low | 50.4 | Low | 242 Ų | 242 | 140.3 Ų | 140.3 | 100% | 1.192 | 68% | 0.683 | S | S | * | * | 0 | 69.8 | 0 | -60.1 | 176.6 | -161.4 | 0 | 0 | 111.4 | |||||
| 2 | R | 38.4 | Very low | 51.5 | Low | 225 Ų | 225 | 133.3 Ų | 133.3 | 85% | 0.849 | 66% | 0.664 | S | S | * | * | trans | -136.2 | 2.1 | -179.7 | -91.7 | -176 | 164 | -167.7 | -4.7 | 115.1 | ||||
| 3 | W | 43.8 | Very low | 52 | Low | 233 Ų | 233 | 129.5 Ų | 129.5 | 88% | 0.883 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -98 | -4.5 | -175.5 | -72.1 | 94.8 | 0 | 0 | 0 | 114.9 | ||
| 4 | L | 46.3 | Very low | 52.2 | Low | 141 Ų | 141 | 129.1 Ų | 129.1 | 74% | 0.738 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -89.5 | -14.5 | -179.7 | -79.8 | 151.3 | 0 | 0 | 0 | 114 | A8 | L4-A8 PolarHBondContact O-N 3.47Š|
| 5 | W | 43 | Very low | 52.1 | Low | 197 Ų | 197 | 128.3 Ų | 128.3 | 75% | 0.746 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -66.5 | -42.5 | -177.5 | -140.6 | -40.4 | 0 | 0 | 0 | 114.5 | L7 A8 V9 | W5-L7 VanDerWaalsContact C-N 3.34Å; W5-L7 PolarHBondContact O-N 2.83Å; W5-A8 PolarHBondContact O-N 2.96Å; W5-V9 VanDerWaalsContact O-CG2 3.32Å; W5-V9 WeakPolarHBondContact O-CG2 3.17Å; W5-V9 PolarHBondContact O-N 2.86Å; W5-V9 VanDerWaalsContact O-N 3.11Å |
| 6 | P | 53.1 | Low | 51.7 | Low | 78 Ų | 78 | 123.8 Ų | 123.8 | 51% | 0.506 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -71.7 | -27 | -177.8 | 24.3 | -30.3 | 0 | 0 | 0 | 113.6 | S10 | P6-S10 PolarHBondContact O-N 2.77Å; P6-S10 VanDerWaalsContact O-N 3.12Å; P6-S10 PolarHBondContact O-OG 2.94Å |
| 7 | L | 50.6 | Low | 51.5 | Low | 116 Ų | 116 | 122.2 Ų | 122.2 | 61% | 0.607 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -74.5 | -40.3 | 175 | -80.3 | 166.1 | 0 | 0 | 0 | 112 | W5 V9 S10 L11 | W5-L7 VanDerWaalsContact C-N 3.34Å; W5-L7 PolarHBondContact O-N 2.83Å; L7-V9 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 2.8Å; L7-S10 PolarHBondContact O-N 2.79Å; L7-L11 WeakPolarHBondContact O-CB 3.33Å; L7-L11 PolarHBondContact O-N 3.39Å |
| 8 | A | 59.4 | Low | 50.8 | Low | 58 Ų | 58 | 118.4 Ų | 118.4 | 48% | 0.479 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -65.1 | -37.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L4 W5 L11 A12 | L4-A8 PolarHBondContact O-N 3.47Å; W5-A8 PolarHBondContact O-N 2.96Å; A8-L11 PolarHBondContact O-N 2.9Å; A8-A12 WeakPolarHBondContact O-CB 3.13Å; A8-A12 PolarHBondContact O-N 2.99Å |
| 9 | V | 63 | Low | 50.3 | Low | 74 Ų | 74 | 119.2 Ų | 119.2 | 45% | 0.448 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -70.1 | -39.6 | 176.8 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | W5 L7 L11 A12 V13 | W5-V9 VanDerWaalsContact O-CG2 3.32Å; W5-V9 WeakPolarHBondContact O-CG2 3.17Å; W5-V9 PolarHBondContact O-N 2.86Å; W5-V9 VanDerWaalsContact O-N 3.11Å; L7-V9 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 2.8Å; V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L11 PolarHBondContact O-N 3.32Å; V9-A12 PolarHBondContact O-N 3.02Å; V9-V13 HydrophobicContact CG1-CG2 4.46Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.43Å; V9-V13 PolarHBondContact O-N 3.23Å |
| 10 | S | 57.5 | Low | 49.6 | Very low | 69 Ų | 69 | 118.2 Ų | 118.2 | 48% | 0.483 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -64.5 | -39.4 | 175.4 | -63.8 | 0 | 0 | 0 | 0 | 112.2 | P6 L7 I14 | P6-S10 PolarHBondContact O-N 2.77Å; P6-S10 VanDerWaalsContact O-N 3.12Å; P6-S10 PolarHBondContact O-OG 2.94Å; L7-S10 PolarHBondContact O-N 2.79Å; S10-I14 WeakPolarHBondContact O-CD1 3.29Å; S10-I14 VanDerWaalsContact O-CG1 3.27Å; S10-I14 WeakPolarHBondContact O-CG1 3.44Å; S10-I14 PolarHBondContact O-N 3.41Å |
| 11 | L | 55 | Low | 49.1 | Very low | 110 Ų | 110 | 123.6 Ų | 123.6 | 58% | 0.576 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -67.1 | -38.6 | 174.7 | -90.5 | 150.5 | 0 | 0 | 0 | 112.6 | L7 A8 V9 I14 L15 | L7-L11 WeakPolarHBondContact O-CB 3.33Å; L7-L11 PolarHBondContact O-N 3.39Å; A8-L11 PolarHBondContact O-N 2.9Å; V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L11 PolarHBondContact O-N 3.32Å; L11-I14 PolarHBondContact O-N 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.41Å; L11-L15 PolarHBondContact O-N 3.23Å; L11-L15 VanDerWaalsContact O-N 3.13Å |
| 12 | A | 62.5 | Low | 48.8 | Very low | 56 Ų | 56 | 118.2 Ų | 118.2 | 46% | 0.463 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -68.4 | -38 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | A8 V9 L15 A16 | A8-A12 WeakPolarHBondContact O-CB 3.13Å; A8-A12 PolarHBondContact O-N 2.99Å; V9-A12 PolarHBondContact O-N 3.02Å; A12-L15 PolarHBondContact O-N 2.9Å; A12-A16 WeakPolarHBondContact O-CB 3.43Å; A12-A16 PolarHBondContact O-N 3.22Å |
| 13 | V | 59 | Low | 48.8 | Very low | 85 Ų | 85 | 113.3 Ų | 113.3 | 52% | 0.515 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -67.5 | -38.4 | 177.1 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | V9 A16 V17 | V9-V13 HydrophobicContact CG1-CG2 4.46Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.43Å; V9-V13 PolarHBondContact O-N 3.23Å; V13-A16 PolarHBondContact O-N 3.36Å; V13-V17 HydrophobicContact CG1-CG2 4.49Å; V13-V17 VanDerWaalsContact O-CG2 3.29Å; V13-V17 WeakPolarHBondContact O-CG2 3.42Å; V13-V17 PolarHBondContact O-N 2.94Å; V13-V17 VanDerWaalsContact O-N 3.09Å |
| 14 | I | 55.1 | Low | 48.2 | Very low | 124 Ų | 124 | 106 Ų | 106 | 64% | 0.636 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.8 | -38.7 | 176.6 | -66.8 | 166.9 | 0 | 0 | 0 | 111.2 | S10 L11 G18 | S10-I14 WeakPolarHBondContact O-CD1 3.29Å; S10-I14 VanDerWaalsContact O-CG1 3.27Å; S10-I14 WeakPolarHBondContact O-CG1 3.44Å; S10-I14 PolarHBondContact O-N 3.41Å; L11-I14 PolarHBondContact O-N 3.28Å; I14-G18 PolarHBondContact O-N 2.86Å |
| 15 | L | 49.5 | Very low | 47.3 | Very low | 117 Ų | 117 | 103.2 Ų | 103.2 | 61% | 0.613 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.3 | -39.2 | 176.2 | -78.9 | 161.4 | 0 | 0 | 0 | 112.5 | L11 A12 G18 L19 | L11-L15 WeakPolarHBondContact O-CG 3.41Å; L11-L15 PolarHBondContact O-N 3.23Å; L11-L15 VanDerWaalsContact O-N 3.13Å; A12-L15 PolarHBondContact O-N 2.9Å; L15-G18 PolarHBondContact O-N 2.89Å; L15-L19 PolarHBondContact O-N 3.43Å |
| 16 | A | 46.9 | Very low | 46.7 | Very low | 55 Ų | 55 | 98.4 Ų | 98.4 | 46% | 0.455 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -68.3 | -40.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | A12 V13 G18 L19 S20 | A12-A16 WeakPolarHBondContact O-CB 3.43Å; A12-A16 PolarHBondContact O-N 3.22Å; V13-A16 PolarHBondContact O-N 3.36Å; A16-G18 VanDerWaalsContact C-N 3.26Å; A16-G18 PolarHBondContact O-N 3.16Å; A16-L19 PolarHBondContact O-N 3.01Å; A16-S20 PolarHBondContact O-N 3.04Å; A16-S20 PolarHBondContact O-OG 3.48Å |
| 17 | V | 46.8 | Very low | 45.9 | Very low | 98 Ų | 98 | 100.9 Ų | 100.9 | 59% | 0.594 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -67.8 | -26.5 | 177.9 | 173.5 | 0 | 0 | 0 | 0 | 112.1 | V13 | V13-V17 HydrophobicContact CG1-CG2 4.49Å; V13-V17 VanDerWaalsContact O-CG2 3.29Å; V13-V17 WeakPolarHBondContact O-CG2 3.42Å; V13-V17 PolarHBondContact O-N 2.94Å; V13-V17 VanDerWaalsContact O-N 3.09Å |
| 18 | G | 40.3 | Very low | 45 | Very low | 53 Ų | 53 | 102.9 Ų | 102.9 | 55% | 0.546 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -74 | -28.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | I14 L15 A16 | I14-G18 PolarHBondContact O-N 2.86Å; L15-G18 PolarHBondContact O-N 2.89Å; A16-G18 VanDerWaalsContact C-N 3.26Å; A16-G18 PolarHBondContact O-N 3.16Å |
| 19 | L | 41.5 | Very low | 43.4 | Very low | 134 Ų | 134 | 109.7 Ų | 109.7 | 70% | 0.702 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -82.8 | -27.4 | -178.3 | -92.1 | 140.9 | 0 | 0 | 0 | 113.3 | L15 A16 R21 | L15-L19 PolarHBondContact O-N 3.43Å; A16-L19 PolarHBondContact O-N 3.01Å; L19-R21 VanDerWaalsContact C-N 3.26Å; L19-R21 PolarHBondContact O-N 3.38Å |
| 20 | S | 34.9 | Very low | 41.7 | Very low | 99 Ų | 99 | 114.2 Ų | 114.2 | 69% | 0.692 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | -11 | -178.1 | -54.8 | 0 | 0 | 0 | 0 | 114.9 | A16 | A16-S20 PolarHBondContact O-N 3.04Å; A16-S20 PolarHBondContact O-OG 3.48Å |
| 21 | R | 38.7 | Very low | 40.2 | Very low | 232 Ų | 232 | 114.4 Ų | 114.4 | 88% | 0.875 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | 2.2 | 178.7 | -76.4 | -165 | -173.6 | -179.1 | 3.6 | 115.2 | L19 | L19-R21 VanDerWaalsContact C-N 3.26Å; L19-R21 PolarHBondContact O-N 3.38Å |
| 22 | V | 40.3 | Very low | 38.8 | Very low | 129 Ų | 129 | 120.7 Ų | 120.7 | 78% | 0.782 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -101.4 | -8.1 | -175.8 | 173.7 | 0 | 0 | 0 | 0 | 113.8 | ||
| 23 | S | 36.7 | Very low | 37.1 | Very low | 121 Ų | 121 | 126.9 Ų | 126.9 | 85% | 0.846 | 75% | 0.749 | S | S | * | * | trans | -110.4 | 97.4 | 179.7 | -162.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 24 | G | 31.8 | Very low | 35.5 | Very low | 81 Ų | 81 | 133.5 Ų | 133.5 | 84% | 0.835 | 77% | 0.765 | S | S | * | * | trans | 172 | 98 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 25 | G | 27.8 | Very low | 34.1 | Very low | 81 Ų | 81 | 131.5 Ų | 131.5 | 84% | 0.835 | 77% | 0.767 | S | S | * | * | trans | 143.2 | 83.6 | 160.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 26 | A | 31.1 | Very low | 32.9 | Very low | 97 Ų | 97 | 134.4 Ų | 134.4 | 80% | 0.802 | 78% | 0.778 | S | S | * | * | trans | -90.4 | 153.6 | 149 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 27 | P | 36.3 | Very low | 31.8 | Very low | 130 Ų | 130 | 138.1 Ų | 138.1 | 84% | 0.844 | 80% | 0.795 | S | S | * | * | -138.2 | 155.6 | 110.2 | 30.2 | -13.8 | 0 | 0 | 0 | 115 | |||||
| 28 | L | 30.2 | Very low | 30.8 | Very low | 158 Ų | 158 | 141.6 Ų | 141.6 | 83% | 0.827 | 81% | 0.805 | S | S | * | * | trans | -63.7 | 144.5 | 176.4 | -74.7 | 125.2 | 0 | 0 | 0 | 113.5 | ||||
| 29 | H | 26.3 | Very low | 30.1 | Very low | 200 Ų | 200 | 146.8 Ų | 146.8 | 93% | 0.926 | 82% | 0.815 | S | S | * | * | trans | -145.6 | 137.5 | 142.6 | -121 | -85.7 | 0 | 0 | 0 | 111.5 | ||||
| 30 | L | 27.9 | Very low | 29.4 | Very low | 170 Ų | 170 | 148.9 Ų | 148.9 | 89% | 0.89 | 82% | 0.821 | S | S | * | * | trans | -100.7 | 145.7 | -166 | -171.9 | 82 | 0 | 0 | 0 | 111.7 | ||||
| 31 | G | 25.8 | Very low | 29 | Very low | 73 Ų | 73 | 152.8 Ų | 152.8 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | trans | 128.2 | 144.9 | 155.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 32 | R | 25.9 | Very low | 28.4 | Very low | 242 Ų | 242 | 148 Ų | 148 | 91% | 0.913 | 82% | 0.82 | S | S | * | * | cis | -171.1 | 145.4 | -5.3 | -173.9 | 177.3 | -159.4 | 174.8 | 6.2 | 105.5 | ||||
| 33 | H | 26.7 | Very low | 27.7 | Very low | 185 Ų | 185 | 152.9 Ų | 152.9 | 86% | 0.856 | 82% | 0.824 | S | S | * | * | trans | -16.3 | 142.1 | 168.5 | -77.3 | -91.1 | 0 | 0 | 0 | 120.5 | ||||
| 34 | R | 24.8 | Very low | 27.1 | Very low | 224 Ų | 224 | 151.4 Ų | 151.4 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | -162.3 | 132.7 | 109 | -154.4 | 167.6 | -168.8 | 151.2 | 1.3 | 111.9 | |||||
| 35 | A | 25.1 | Very low | 27 | Very low | 82 Ų | 82 | 157 Ų | 157 | 68% | 0.678 | 82% | 0.815 | S | S | * | * | trans | -97.9 | 141.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 36 | E | 24.7 | Very low | 26.9 | Very low | 179 Ų | 179 | 165 Ų | 165 | 84% | 0.836 | 82% | 0.82 | S | S | * | * | trans | -138.6 | 123.6 | 154.4 | -85.3 | -177 | 172.2 | 0 | 0 | 108.4 | ||||
| 37 | T | 24.4 | Very low | 26.7 | Very low | 133 Ų | 133 | 163.1 Ų | 163.1 | 82% | 0.816 | 81% | 0.811 | S | S | * | * | trans | -115.8 | 126.1 | 170.8 | -47.9 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 38 | Q | 24.9 | Very low | 26.4 | Very low | 170 Ų | 170 | 163.2 Ų | 163.2 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -164 | 134.4 | 139.3 | -130.9 | 170.4 | -55.7 | 0 | 0 | 113.7 | ||||
| 39 | E | 26.6 | Very low | 26.4 | Very low | 162 Ų | 162 | 163.7 Ų | 163.7 | 76% | 0.757 | 81% | 0.807 | S | S | * | * | trans | 100.8 | 143.4 | 136.5 | -114.4 | 170.9 | 108.8 | 0 | 0 | 121.4 | ||||
| 40 | Q | 26.2 | Very low | 26.5 | Very low | 178 Ų | 178 | 160.6 Ų | 160.6 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -142 | 125.2 | -139.4 | 172.8 | -178.8 | 5.2 | 0 | 0 | 105.2 | ||||
| 41 | Q | 26.9 | Very low | 26.7 | Very low | 182 Ų | 182 | 160.2 Ų | 160.2 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -152.3 | 100.7 | 163.3 | -136.2 | 161.5 | -7.8 | 0 | 0 | 113.4 | ||||
| 42 | N | 25.4 | Very low | 26.9 | Very low | 131 Ų | 131 | 165 Ų | 165 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | 60.6 | 114.6 | 121 | -145 | 8.8 | 0 | 0 | 0 | 118.9 | |||||
| 43 | R | 25.7 | Very low | 27 | Very low | 231 Ų | 231 | 157 Ų | 157 | 87% | 0.872 | 78% | 0.779 | S | S | * | * | 160.4 | 140.8 | 91.4 | -152.6 | 169.6 | -171 | 167.2 | 0.9 | 110.8 | |||||
| 44 | S | 25.6 | Very low | 27 | Very low | 91 Ų | 91 | 158.4 Ų | 158.4 | 64% | 0.636 | 78% | 0.783 | S | S | * | * | trans | -120.1 | 141.4 | -176.7 | 145.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 45 | K | 29.6 | Very low | 27 | Very low | 198 Ų | 198 | 151.6 Ų | 151.6 | 86% | 0.861 | 78% | 0.783 | S | S | * | * | trans | 68.3 | 148.5 | 143.9 | -74.9 | -179.6 | 177.9 | -175 | 0 | 123.6 | ||||
| 46 | R | 25.2 | Very low | 27.1 | Very low | 248 Ų | 248 | 154.1 Ų | 154.1 | 94% | 0.936 | 79% | 0.789 | S | S | * | * | trans | 105.1 | 132.9 | 146.1 | -153.1 | -178.6 | -71.1 | -159.4 | -1.1 | 113.9 | ||||
| 47 | G | 27 | Very low | 27.2 | Very low | 59 Ų | 59 | 154.6 Ų | 154.6 | 61% | 0.608 | 79% | 0.792 | S | S | * | * | cis | 153.1 | 151.5 | 1.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 48 | T | 29.4 | Very low | 27.3 | Very low | 132 Ų | 132 | 156.8 Ų | 156.8 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | 47.9 | 142.1 | 149.2 | 49.5 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 49 | E | 30.1 | Very low | 27.3 | Very low | 167 Ų | 167 | 157.4 Ų | 157.4 | 78% | 0.78 | 79% | 0.789 | S | S | * | * | -167.9 | 133.2 | 76.8 | -79.7 | 173.4 | 147.2 | 0 | 0 | 109.8 | |||||
| 50 | D | 29.4 | Very low | 27.5 | Very low | 136 Ų | 136 | 155 Ų | 155 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | 93.9 | 146.2 | 95.6 | -65.5 | -21 | 0 | 0 | 0 | 112.9 | |||||
| 51 | E | 31.9 | Very low | 27.8 | Very low | 161 Ų | 161 | 151.9 Ų | 151.9 | 75% | 0.752 | 78% | 0.78 | S | S | * | * | cis | -166.6 | 161.4 | 7.1 | -127.8 | -168.1 | 142.9 | 0 | 0 | 111.3 | ||||
| 52 | E | 29 | Very low | 27.9 | Very low | 174 Ų | 174 | 149.7 Ų | 149.7 | 81% | 0.813 | 77% | 0.77 | S | S | * | * | trans | 56.6 | 147.2 | 152.1 | -81.4 | -161.2 | 119 | 0 | 0 | 123.4 | ||||
| 53 | A | 27.8 | Very low | 28.1 | Very low | 73 Ų | 73 | 148.8 Ų | 148.8 | 60% | 0.603 | 76% | 0.762 | S | S | * | * | cis | -169.8 | 164.7 | -0.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 54 | K | 27 | Very low | 28.1 | Very low | 215 Ų | 215 | 147.6 Ų | 147.6 | 94% | 0.935 | 76% | 0.757 | S | S | * | * | trans | 77.9 | 129.3 | 155.9 | -73.5 | 176 | -179.7 | 174 | 0 | 121.5 | ||||
| 55 | G | 26.1 | Very low | 28.2 | Very low | 81 Ų | 81 | 148.2 Ų | 148.2 | 84% | 0.835 | 77% | 0.768 | S | S | * | * | trans | 137.4 | 91.1 | 138.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 56 | V | 27.2 | Very low | 28 | Very low | 135 Ų | 135 | 146.3 Ų | 146.3 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -67.2 | 127 | 163.8 | 172 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 57 | Q | 26.5 | Very low | 28 | Very low | 190 Ų | 190 | 145.4 Ų | 145.4 | 89% | 0.888 | 76% | 0.76 | S | S | * | * | trans | -175.6 | 132 | 131.1 | -107.7 | 152 | -9.1 | 0 | 0 | 114.4 | ||||
| 58 | Q | 26 | Very low | 28.3 | Very low | 179 Ų | 179 | 147.7 Ų | 147.7 | 84% | 0.836 | 76% | 0.764 | S | S | * | * | trans | -65.1 | 133.6 | 167.3 | -165.7 | 116.7 | -12.6 | 0 | 0 | 110.4 | ||||
| 59 | Y | 24.8 | Very low | 28.5 | Very low | 183 Ų | 183 | 153 Ų | 153 | 72% | 0.718 | 77% | 0.769 | S | S | * | * | trans | -140.1 | 126.5 | 165.3 | -166.4 | -101.2 | 0 | 0 | 0 | 110.6 | ||||
| 60 | V | 31.7 | Very low | 28.6 | Very low | 111 Ų | 111 | 150.7 Ų | 150.7 | 67% | 0.673 | 77% | 0.769 | S | S | * | * | trans | -114.6 | 152 | 177 | 162.9 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 61 | P | 32.5 | Very low | 28.7 | Very low | 112 Ų | 112 | 152.1 Ų | 152.1 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | trans | -85.1 | 151.1 | -149.7 | 32.4 | -31.4 | 0 | 0 | 0 | 115.3 | ||||
| 62 | E | 28.1 | Very low | 28.7 | Very low | 136 Ų | 136 | 152.8 Ų | 152.8 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | trans | -77.2 | 161 | 161.2 | -89.5 | -163.9 | 172.6 | 0 | 0 | 111.4 | ||||
| 63 | E | 30.1 | Very low | 29.4 | Very low | 113 Ų | 113 | 149.8 Ų | 149.8 | 53% | 0.528 | 77% | 0.774 | S | S | . | * | cis | 177 | 170.5 | -20.8 | -177.2 | 168.2 | -166.1 | 0 | 0 | 105.9 | ||||
| 64 | W | 26 | Very low | 29.4 | Very low | 206 Ų | 206 | 151.4 Ų | 151.4 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | trans | 110.8 | 90.7 | 154 | -55 | 100 | 0 | 0 | 0 | 115.9 | ||||
| 65 | A | 27.9 | Very low | 29.4 | Very low | 104 Ų | 104 | 144.8 Ų | 144.8 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | -177.4 | 128.1 | 91.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 66 | E | 24.6 | Very low | 29.5 | Very low | 158 Ų | 158 | 152.5 Ų | 152.5 | 74% | 0.738 | 78% | 0.784 | S | S | * | * | trans | -93.1 | 154.1 | -173.9 | -169.8 | 132.6 | -162.5 | 0 | 0 | 113.1 | ||||
| 67 | Y | 25.5 | Very low | 29.5 | Very low | 229 Ų | 229 | 153.9 Ų | 153.9 | 90% | 0.898 | 78% | 0.781 | S | S | * | * | trans | -171.9 | 155.3 | 141.2 | -98.6 | -66.2 | 0 | 0 | 0 | 109.3 | ||||
| 68 | P | 32.6 | Very low | 30.2 | Very low | 107 Ų | 107 | 150.1 Ų | 150.1 | 70% | 0.695 | 77% | 0.773 | S | S | * | * | -112.7 | 158.5 | -121.3 | 16.4 | 7 | 0 | 0 | 0 | 114.4 | |||||
| 69 | R | 34.4 | Very low | 30.3 | Very low | 242 Ų | 242 | 148.6 Ų | 148.6 | 91% | 0.913 | 78% | 0.776 | S | S | * | * | trans | -94 | 150 | 167.6 | -82.9 | -162.9 | -72.2 | -146.4 | -4.1 | 112 | ||||
| 70 | P | 32.2 | Very low | 30.5 | Very low | 120 Ų | 120 | 149.2 Ų | 149.2 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | trans | -105.9 | 115.2 | 153.2 | 4.2 | 17 | 0 | 0 | 0 | 112.5 | ||||
| 71 | I | 31.4 | Very low | 30.5 | Very low | 166 Ų | 166 | 150.1 Ų | 150.1 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | 38.6 | 119.9 | 126 | -48.5 | 178.2 | 0 | 0 | 0 | 119.6 | |||||
| 72 | H | 30.8 | Very low | 30.3 | Very low | 174 Ų | 174 | 153.2 Ų | 153.2 | 81% | 0.806 | 80% | 0.8 | S | S | * | * | trans | -78.3 | -177.7 | 164 | -96.6 | 73.2 | 0 | 0 | 0 | 111.9 | ||||
| 73 | P | 44.9 | Very low | 30.4 | Very low | 112 Ų | 112 | 152.6 Ų | 152.6 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | -131.2 | 146.6 | -59.8 | 36.3 | -18.4 | 0 | 0 | 0 | 111.8 | |||||
| 74 | A | 27.7 | Very low | 30.4 | Very low | 106 Ų | 106 | 152.2 Ų | 152.2 | 88% | 0.876 | 82% | 0.822 | S | S | * | * | trans | -160.4 | 118.3 | 163.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 75 | G | 27.5 | Very low | 30.5 | Very low | 77 Ų | 77 | 148.7 Ų | 148.7 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | 59.9 | 117.1 | 129.9 | 0 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 76 | R | 27.4 | Very low | 30.5 | Very low | 242 Ų | 242 | 149 Ų | 149 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | trans | 88.3 | 122.5 | 137.7 | -71.9 | -169.8 | -177.8 | -174.5 | 3 | 121.8 | ||||
| 77 | Q | 27.5 | Very low | 31.2 | Very low | 164 Ų | 164 | 146.7 Ų | 146.7 | 77% | 0.766 | 82% | 0.818 | S | S | * | * | trans | 92.3 | 140.6 | 133.6 | -70.2 | -89.7 | -11.8 | 0 | 0 | 119.9 | ||||
| 78 | P | 40.9 | Very low | 31.4 | Very low | 112 Ų | 112 | 142.9 Ų | 142.9 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | trans | -90.9 | 138.6 | -171.9 | 35.4 | -25.9 | 0 | 0 | 0 | 111.4 | ||||
| 79 | T | 28.2 | Very low | 31.7 | Very low | 146 Ų | 146 | 143.3 Ų | 143.3 | 90% | 0.896 | 82% | 0.816 | S | S | * | * | trans | -124.8 | 133.1 | 175.5 | 8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 80 | K | 28.9 | Very low | 31.5 | Very low | 196 Ų | 196 | 138.3 Ų | 138.3 | 85% | 0.852 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -63 | 161.2 | -177.7 | -68 | 170.7 | 176.4 | 174.8 | 0 | 112.8 | ||
| 81 | P | 31.1 | Very low | 31.4 | Very low | 131 Ų | 131 | 140.9 Ų | 140.9 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 133.8 | 175.5 | -9.5 | 25.4 | 0 | 0 | 0 | 111.8 | ||
| 82 | L | 27.9 | Very low | 31.3 | Very low | 176 Ų | 176 | 139.9 Ų | 139.9 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 121.2 | 178.1 | -156 | 79.2 | 0 | 0 | 0 | 109.9 | ||
| 83 | V | 31.1 | Very low | 31.2 | Very low | 124 Ų | 124 | 135.6 Ų | 135.6 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -70 | 130.5 | 167.5 | 172.1 | 0 | 0 | 0 | 0 | 108.5 | ||
| 84 | A | 30.9 | Very low | 30.4 | Very low | 105 Ų | 105 | 134.1 Ų | 134.1 | 87% | 0.868 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 122.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 85 | T | 26.7 | Very low | 30.5 | Very low | 132 Ų | 132 | 135.9 Ų | 135.9 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | trans | -109.8 | 132.3 | 175.8 | -44.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 86 | S | 29.3 | Very low | 31.1 | Very low | 109 Ų | 109 | 138.1 Ų | 138.1 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | trans | -178.4 | 158.2 | 145.6 | -152.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 87 | P | 37.5 | Very low | 31.1 | Very low | 110 Ų | 110 | 130.4 Ų | 130.4 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | -123.8 | 160.8 | -53.3 | 32.8 | -18.3 | 0 | 0 | 0 | 111.9 | |||||
| 88 | N | 31.6 | Very low | 31.1 | Very low | 150 Ų | 150 | 128.8 Ų | 128.8 | 80% | 0.802 | 81% | 0.814 | S | S | * | * | trans | -75.5 | 160.7 | 174.8 | -135.9 | 10.8 | 0 | 0 | 0 | 111.6 | ||||
| 89 | P | 37.3 | Very low | 30.4 | Very low | 115 Ų | 115 | 126.7 Ų | 126.7 | 75% | 0.747 | 81% | 0.812 | S | S | * | * | -131.4 | 133.9 | 120.5 | 34.8 | -24 | 0 | 0 | 0 | 113.5 | |||||
| 90 | D | 30 | Very low | 30.4 | Very low | 138 Ų | 138 | 129.3 Ų | 129.3 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | 33.7 | 120.2 | 149 | -70 | -37.4 | 0 | 0 | 0 | 123.4 | ||||
| 91 | K | 30.3 | Very low | 30.4 | Very low | 174 Ų | 174 | 128.9 Ų | 128.9 | 76% | 0.757 | 82% | 0.816 | S | S | * | * | 90.6 | 126.2 | 125.1 | -86.1 | -173 | 172.2 | -179 | 0 | 122.5 | |||||
| 92 | D | 30.4 | Very low | 30.2 | Very low | 144 Ų | 144 | 130.3 Ų | 130.3 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | trans | 84.2 | 102.6 | 142.4 | -61.5 | -20.3 | 0 | 0 | 0 | 120.6 | ||||
| 93 | G | 28.3 | Very low | 30.2 | Very low | 84 Ų | 84 | 133.4 Ų | 133.4 | 87% | 0.866 | 82% | 0.815 | S | S | * | * | 103 | 120.7 | 119.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 94 | G | 27.6 | Very low | 30 | Very low | 82 Ų | 82 | 131.3 Ų | 131.3 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | trans | 104.2 | 121.8 | 142.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 95 | T | 29.4 | Very low | 30 | Very low | 142 Ų | 142 | 133.7 Ų | 133.7 | 87% | 0.871 | 82% | 0.816 | S | S | * | * | trans | -86.8 | -177.7 | 173.9 | -21.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 96 | P | 40.8 | Very low | 30.3 | Very low | 125 Ų | 125 | 134.7 Ų | 134.7 | 81% | 0.812 | 82% | 0.816 | S | S | * | * | -106.6 | 158.5 | -116.4 | 37.2 | -19 | 0 | 0 | 0 | 114.1 | |||||
| 97 | G | 27.6 | Very low | 30.5 | Very low | 79 Ų | 79 | 136.1 Ų | 136.1 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | trans | -147.5 | 106.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 98 | S | 27 | Very low | 30.1 | Very low | 130 Ų | 130 | 134.3 Ų | 134.3 | 91% | 0.909 | 82% | 0.821 | S | S | * | * | trans | -43.2 | 144.5 | 168.7 | 124.5 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 99 | G | 26.8 | Very low | 30.2 | Very low | 68 Ų | 68 | 132.1 Ų | 132.1 | 70% | 0.701 | 82% | 0.824 | S | S | * | * | trans | 148.3 | 108.8 | 143.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 100 | Q | 27.5 | Very low | 30.3 | Very low | 201 Ų | 201 | 132.8 Ų | 132.8 | 94% | 0.939 | 83% | 0.828 | S | S | * | * | trans | 98.5 | 115.8 | 133.6 | -136.4 | 162.9 | 4.9 | 0 | 0 | 119.8 | ||||
| 101 | E | 29.3 | Very low | 30.8 | Very low | 188 Ų | 188 | 129.5 Ų | 129.5 | 88% | 0.879 | 83% | 0.827 | S | S | * | * | trans | -55.3 | 149.9 | 170.4 | -63.1 | 172.8 | 84.2 | 0 | 0 | 114.1 | ||||
| 102 | L | 27.3 | Very low | 31.2 | Very low | 160 Ų | 160 | 130.5 Ų | 130.5 | 84% | 0.838 | 83% | 0.834 | S | S | * | * | -165.5 | 107 | 127.3 | -161.5 | 64.7 | 0 | 0 | 0 | 113.2 | |||||
| 103 | R | 27.6 | Very low | 31.5 | Very low | 242 Ų | 242 | 134.9 Ų | 134.9 | 91% | 0.913 | 84% | 0.84 | S | S | * | * | trans | 54.1 | 117.9 | 133.2 | -151.4 | 176.8 | -169.7 | 169.6 | 2.4 | 120.8 | ||||
| 104 | G | 27 | Very low | 32 | Very low | 80 Ų | 80 | 138.1 Ų | 138.1 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | trans | 177.4 | 112.3 | 154.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 105 | N | 30.9 | Very low | 32.6 | Very low | 155 Ų | 155 | 141.6 Ų | 141.6 | 83% | 0.829 | 83% | 0.831 | S | S | * | * | trans | -89.9 | 158.4 | -168.5 | -127.9 | -0.5 | 0 | 0 | 0 | 112.7 | ||||
| 106 | L | 33.8 | Very low | 33.3 | Very low | 153 Ų | 153 | 141.6 Ų | 141.6 | 80% | 0.801 | 82% | 0.824 | S | S | * | * | trans | 72.6 | 123.1 | 176.9 | -61.6 | 104.9 | 0 | 0 | 0 | 114.6 | ||||
| 107 | T | 32.1 | Very low | 33.3 | Very low | 139 Ų | 139 | 143 Ų | 143 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | -174.4 | 136.5 | 61.5 | -35.4 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 108 | G | 29.8 | Very low | 34.3 | Very low | 72 Ų | 72 | 143.7 Ų | 143.7 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | trans | 80.9 | 104.9 | 152.7 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 109 | A | 32.8 | Very low | 35.7 | Very low | 103 Ų | 103 | 142.5 Ų | 142.5 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | trans | -67.1 | 134.1 | 163 | 0 | 0 | 0 | 0 | 0 | 110.4 | G111 | A109-G111 PolarHBondContact O-N 2.96Š| ||
| 110 | P | 39.7 | Very low | 36.9 | Very low | 129 Ų | 129 | 142.9 Ų | 142.9 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | trans | -81.6 | 121.5 | 179.1 | 30.7 | -29.6 | 0 | 0 | 0 | 110.7 | ||||
| 111 | G | 41.3 | Very low | 37.2 | Very low | 69 Ų | 69 | 142.3 Ų | 142.3 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | 66.5 | 66.8 | 143.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | A109 R113 | A109-G111 PolarHBondContact O-N 2.96Å; G111-R113 PolarHBondContact O-N 3.29Å | ||
| 112 | Q | 38.3 | Very low | 38 | Very low | 196 Ų | 196 | 137.8 Ų | 137.8 | 92% | 0.916 | 76% | 0.757 | S | S | * | * | trans | -70.1 | 83.4 | 153.5 | -158.5 | 163.8 | 12.9 | 0 | 0 | 107.6 | L114 | Q112-L114 PolarHBondContact O-N 3.28Š| ||
| 113 | R | 35.4 | Very low | 39.1 | Very low | 235 Ų | 235 | 134.8 Ų | 134.8 | 89% | 0.887 | 75% | 0.745 | S | S | * | * | trans | -59 | 107.2 | 167.7 | -136.4 | -170.7 | -162.7 | -151.8 | 5.8 | 105.2 | G111 Q115 | G111-R113 PolarHBondContact O-N 3.29Å; R113-Q115 PolarHBondContact O-N 2.99Å | ||
| 114 | L | 39.9 | Very low | 40.4 | Very low | 152 Ų | 152 | 126.9 Ų | 126.9 | 80% | 0.796 | 72% | 0.724 | S | S | * | * | trans | -62.1 | 93.2 | 172 | -149.1 | 144.5 | 0 | 0 | 0 | 105.3 | Q112 I116 | Q112-L114 PolarHBondContact O-N 3.28Å; L114-I116 HydrophobicContact CD2-CG1 4.01Å; L114-I116 PolarHBondContact O-N 2.76Å | ||
| 115 | Q | 40.6 | Very low | 41.9 | Very low | 156 Ų | 156 | 131.7 Ų | 131.7 | 73% | 0.729 | 73% | 0.725 | S | S | * | * | trans | -72.2 | 88.3 | -179.1 | -158 | -172.7 | 14.9 | 0 | 0 | 105.4 | R113 Q117 | R113-Q115 PolarHBondContact O-N 2.99Å; Q115-Q117 PolarHBondContact O-N 3.15Å | ||
| 116 | I | 43 | Very low | 43.3 | Very low | 142 Ų | 142 | 127.9 Ų | 127.9 | 73% | 0.728 | 71% | 0.71 | S | S | * | * | trans | -61.5 | 90.2 | 163.7 | -66.4 | 170.1 | 0 | 0 | 0 | 104.8 | L114 N118 | L114-I116 HydrophobicContact CD2-CG1 4.01Å; L114-I116 PolarHBondContact O-N 2.76Å; I116-N118 VanDerWaalsContact C-N 3.28Å; I116-N118 PolarHBondContact O-N 3.09Å | ||
| 117 | Q | 41.2 | Very low | 44.9 | Very low | 154 Ų | 154 | 121.4 Ų | 121.4 | 72% | 0.72 | 68% | 0.678 | S | S | * | * | trans | -64.4 | 100.8 | 161.8 | -87 | 176.2 | 9.8 | 0 | 0 | 105.1 | Q115 P119 | Q115-Q117 PolarHBondContact O-N 3.15Å; Q117-P119 WeakPolarHBondContact O-CD 3.27Å | ||
| 118 | N | 48.8 | Very low | 47 | Very low | 93 Ų | 93 | 123.7 Ų | 123.7 | 50% | 0.497 | 67% | 0.672 | S | S | . | * | trans | -65.9 | 112.7 | 166.7 | -171.9 | -6.5 | 0 | 0 | 0 | 105.9 | I116 L120 Y121 | I116-N118 VanDerWaalsContact C-N 3.28Å; I116-N118 PolarHBondContact O-N 3.09Å; N118-L120 PolarHBondContact O-N 3.25Å; N118-L120 WeakPolarHBondContact OD1-CB 3.4Å; N118-L120 PolarHBondContact OD1-N 3.43Å; N118-Y121 PolarHBondContact O-N 3.28Å | ||
| 119 | P | 56.1 | Low | 49.1 | Very low | 106 Ų | 106 | 123.2 Ų | 123.2 | 69% | 0.688 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -1.1 | -177.9 | 26.5 | -33.5 | 0 | 0 | 0 | 113.1 | Q117 | Q117-P119 WeakPolarHBondContact O-CD 3.27Š|
| 120 | L | 52.2 | Low | 51.2 | Low | 75 Ų | 75 | 119.9 Ų | 119.9 | 39% | 0.393 | 63% | 0.63 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.1 | 12.5 | 180 | -60.7 | 171.2 | 0 | 0 | 0 | 114.4 | N118 | N118-L120 PolarHBondContact O-N 3.25Å; N118-L120 WeakPolarHBondContact OD1-CB 3.4Å; N118-L120 PolarHBondContact OD1-N 3.43Å |
| 121 | Y | 34.3 | Very low | 53.2 | Low | 190 Ų | 190 | 119.3 Ų | 119.3 | 75% | 0.745 | 61% | 0.612 | S | S | * | * | trans | -140.6 | 128.5 | 175.3 | -144 | -97.5 | 0 | 0 | 0 | 110.8 | N118 V123 | N118-Y121 PolarHBondContact O-N 3.28Å; Y121-V123 HydrophobicContact CD2-CG2 4.41Å; Y121-V123 HydrophobicContact CE2-CG2 4.25Å | ||
| 122 | P | 46.5 | Very low | 55.2 | Low | 92 Ų | 92 | 118.5 Ų | 118.5 | 60% | 0.597 | 60% | 0.598 | S | S | * | * | S | Bend | cis | -93.1 | 155 | 18.7 | 35.7 | -32.6 | 0 | 0 | 0 | 114.4 | T124 | P122-T124 PolarHBondContact O-N 3.04Š|
| 123 | V | 50.6 | Low | 57.3 | Low | 98 Ų | 98 | 111.5 Ų | 111.5 | 59% | 0.594 | 57% | 0.567 | S | S | * | * | trans | -70 | 93.2 | 176.3 | -178.4 | 0 | 0 | 0 | 0 | 109.8 | Y121 | Y121-V123 HydrophobicContact CD2-CG2 4.41Å; Y121-V123 HydrophobicContact CE2-CG2 4.25Å | ||
| 124 | T | 54.8 | Low | 59.7 | Low | 76 Ų | 76 | 104.4 Ų | 104.4 | 47% | 0.466 | 54% | 0.544 | S | S | . | . | trans | -92.2 | 166.9 | 166.5 | 44.6 | 0 | 0 | 0 | 0 | 110.7 | P122 S126 S127 | P122-T124 PolarHBondContact O-N 3.04Å; T124-S126 PolarHBondContact O-N 3.04Å; T124-S126 PolarHBondContact OG1-OG 2.94Å; T124-S127 PolarHBondContact N-OG 3.34Å; T124-S127 WeakPolarHBondContact O-CA 3.38Å; T124-S127 WeakPolarHBondContact O-CB 3.31Å; T124-S127 PolarHBondContact O-N 2.88Å; T124-S127 PolarHBondContact O-OG 3.4Å | ||
| 125 | E | 57 | Low | 62 | Low | 180 Ų | 180 | 102.8 Ų | 102.8 | 84% | 0.841 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -49.3 | -31.6 | 173.8 | -72.2 | -71 | 133.7 | 0 | 0 | 113.5 | S127 Y128 | E125-S127 PolarHBondContact O-N 3.35Å; E125-Y128 PolarHBondContact O-N 3.33Å |
| 126 | S | 60.8 | Low | 64.3 | Low | 75 Ų | 75 | 99.4 Ų | 99.4 | 52% | 0.524 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.5 | -26 | 172.7 | 53.9 | 0 | 0 | 0 | 0 | 113.9 | T124 S129 A130 | T124-S126 PolarHBondContact O-N 3.04Å; T124-S126 PolarHBondContact OG1-OG 2.94Å; S126-S129 PolarHBondContact O-OG 3.45Å; S126-A130 PolarHBondContact O-N 3.06Å |
| 127 | S | 66.6 | Low | 66.4 | Low | 17 Ų | 17 | 93 Ų | 93 | 12% | 0.119 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -71.7 | -40.6 | 179 | -56.1 | 0 | 0 | 0 | 0 | 111.9 | T124 E125 S129 A130 Y131 | T124-S127 PolarHBondContact N-OG 3.34Å; T124-S127 WeakPolarHBondContact O-CA 3.38Å; T124-S127 WeakPolarHBondContact O-CB 3.31Å; T124-S127 PolarHBondContact O-N 2.88Å; T124-S127 PolarHBondContact O-OG 3.4Å; E125-S127 PolarHBondContact O-N 3.35Å; S127-S129 VanDerWaalsContact C-N 3.31Å; S127-S129 PolarHBondContact O-N 3.3Å; S127-A130 WeakPolarHBondContact O-CB 3.13Å; S127-A130 PolarHBondContact O-N 3.12Å; S127-A130 VanDerWaalsContact O-N 3.14Å; S127-Y131 WeakPolarHBondContact O-CD2 2.92Å; S127-Y131 PolarHBondContact O-N 2.89Å |
| 128 | Y | 76.4 | Confident | 68.7 | Low | 188 Ų | 188 | 91.2 Ų | 91.2 | 74% | 0.737 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.6 | -41.9 | 178.1 | -172 | -98 | 0 | 0 | 0 | 111.4 | E125 A130 Y131 A132 | E125-Y128 PolarHBondContact O-N 3.33Å; Y128-A130 VanDerWaalsContact C-N 3.35Å; Y128-A130 PolarHBondContact O-N 3.26Å; Y128-Y131 PolarHBondContact O-N 3.33Å; Y128-A132 WeakPolarHBondContact O-CB 3.28Å; Y128-A132 PolarHBondContact O-N 3.02Å |
| 129 | S | 74.8 | Confident | 70.7 | Confident | 61 Ų | 61 | 90.5 Ų | 90.5 | 43% | 0.427 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.2 | -40.8 | 174.2 | 73 | 0 | 0 | 0 | 0 | 112.3 | S126 S127 A132 I133 | S126-S129 PolarHBondContact O-OG 3.45Å; S127-S129 VanDerWaalsContact C-N 3.31Å; S127-S129 PolarHBondContact O-N 3.3Å; S129-A132 PolarHBondContact O-N 2.01Å; S129-I133 WeakPolarHBondContact O-CB 3.07Å; S129-I133 WeakPolarHBondContact O-CD1 3.31Å; S129-I133 WeakPolarHBondContact O-CG1 3.18Å; S129-I133 PolarHBondContact O-N 3.15Å |
| 130 | A | 76.9 | Confident | 72.4 | Confident | 33 Ų | 33 | 85.9 Ų | 85.9 | 27% | 0.273 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.6 | -41.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S126 S127 Y128 I133 M134 | S126-A130 PolarHBondContact O-N 3.06Å; S127-A130 WeakPolarHBondContact O-CB 3.13Å; S127-A130 PolarHBondContact O-N 3.12Å; S127-A130 VanDerWaalsContact O-N 3.14Å; Y128-A130 VanDerWaalsContact C-N 3.35Å; Y128-A130 PolarHBondContact O-N 3.26Å; A130-I133 PolarHBondContact O-N 2.88Å; A130-M134 WeakPolarHBondContact O-CB 3.46Å; A130-M134 WeakPolarHBondContact O-CG 3.42Å; A130-M134 PolarHBondContact O-N 2.9Å |
| 131 | Y | 82.4 | Confident | 74.3 | Confident | 118 Ų | 118 | 85.1 Ų | 85.1 | 46% | 0.463 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 174.6 | -72.2 | -64.9 | 0 | 0 | 0 | 112.1 | S127 Y128 M134 L135 | S127-Y131 WeakPolarHBondContact O-CD2 2.92Å; S127-Y131 PolarHBondContact O-N 2.89Å; Y128-Y131 PolarHBondContact O-N 3.33Å; Y131-M134 PolarHBondContact O-N 2.92Å; Y131-L135 WeakPolarHBondContact O-CB 3.41Å; Y131-L135 PolarHBondContact O-N 3.21Å |
| 132 | A | 83.6 | Confident | 77.1 | Confident | 51 Ų | 51 | 78.4 Ų | 78.4 | 42% | 0.421 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.9 | -44 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y128 S129 L135 L136 | Y128-A132 WeakPolarHBondContact O-CB 3.28Å; Y128-A132 PolarHBondContact O-N 3.02Å; S129-A132 PolarHBondContact O-N 2.01Å; A132-L135 PolarHBondContact O-N 2.99Å; A132-L136 WeakPolarHBondContact O-CB 3.31Å; A132-L136 PolarHBondContact O-N 3.26Å |
| 133 | I | 82.3 | Confident | 79.2 | Confident | 49 Ų | 49 | 77.3 Ų | 77.3 | 25% | 0.251 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.9 | -44.9 | 176 | -72.4 | 168.5 | 0 | 0 | 0 | 110.9 | S129 A130 L136 A137 I188 F403 | S129-I133 WeakPolarHBondContact O-CB 3.07Å; S129-I133 WeakPolarHBondContact O-CD1 3.31Å; S129-I133 WeakPolarHBondContact O-CG1 3.18Å; S129-I133 PolarHBondContact O-N 3.15Å; A130-I133 PolarHBondContact O-N 2.88Å; I133-L136 PolarHBondContact O-N 2.99Å; I133-A137 VanDerWaalsContact O-CB 3.27Å; I133-A137 WeakPolarHBondContact O-CB 3.19Å; I133-A137 PolarHBondContact O-N 2.94Å; I133-I188 HydrophobicContact CG2-CD1 4.21Å; I133-F403 HydrophobicContact CG2-CE1 4.27Å; I133-F403 HydrophobicContact CG2-CE2 3.88Å; I133-F403 HydrophobicContact CG2-CZ 3.37Å |
| 134 | M | 85.2 | Confident | 81.1 | Confident | 86 Ų | 86 | 72.6 Ų | 72.6 | 42% | 0.424 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 176.5 | -86.3 | -69 | -79.8 | 0 | 0 | 112.7 | A130 Y131 A137 L138 I188 I192 | A130-M134 WeakPolarHBondContact O-CB 3.46Å; A130-M134 WeakPolarHBondContact O-CG 3.42Å; A130-M134 PolarHBondContact O-N 2.9Å; Y131-M134 PolarHBondContact O-N 2.92Å; M134-A137 PolarHBondContact O-N 3.26Å; M134-L138 WeakPolarHBondContact O-CB 3.39Å; M134-L138 PolarHBondContact O-N 3.49Å; M134-I188 HydrophobicContact SD-CG2 3.28Å; M134-I188 WeakPolarHBondContact SD-CG2 3.34Å; M134-I192 HydrophobicContact CE-CD1 4.2Å; M134-I192 HydrophobicContact CG-CD1 3.52Å; M134-I192 HydrophobicContact CG-CG1 4.47Å; M134-I192 HydrophobicContact SD-CD1 3.21Å; M134-I192 WeakPolarHBondContact SD-CD1 3.31Å |
| 135 | L | 88.1 | Confident | 82.9 | Confident | 119 Ų | 119 | 70.1 Ų | 70.1 | 62% | 0.623 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65.6 | -42.9 | 179.4 | -173.1 | 134 | 0 | 0 | 0 | 111.1 | Y131 A132 L138 V139 | Y131-L135 WeakPolarHBondContact O-CB 3.41Å; Y131-L135 PolarHBondContact O-N 3.21Å; A132-L135 PolarHBondContact O-N 2.99Å; L135-L138 PolarHBondContact O-N 3.28Å; L135-V139 WeakPolarHBondContact O-CG2 3.5Å; L135-V139 PolarHBondContact O-N 3.26Å |
| 136 | L | 87.9 | Confident | 84.5 | Confident | 85 Ų | 85 | 66 Ų | 66 | 45% | 0.445 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -61.5 | -46.6 | 174.8 | -179.3 | 62.6 | 0 | 0 | 0 | 111.5 | A132 I133 L138 V139 V140 | A132-L136 WeakPolarHBondContact O-CB 3.31Å; A132-L136 PolarHBondContact O-N 3.26Å; I133-L136 PolarHBondContact O-N 2.99Å; L136-L138 VanDerWaalsContact C-N 3.31Å; L136-L138 PolarHBondContact O-N 3.45Å; L136-V139 PolarHBondContact O-N 3.36Å; L136-V140 HydrophobicContact CD1-CG2 4.38Å; L136-V140 WeakPolarHBondContact O-CG2 3.2Å; L136-V140 PolarHBondContact O-N 3.49Å |
| 137 | A | 87.6 | Confident | 85.8 | Confident | 6 Ų | 6 | 62.8 Ų | 62.8 | 5% | 0.05 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.3 | -40.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | I133 M134 V140 F141 I188 F403 | I133-A137 VanDerWaalsContact O-CB 3.27Å; I133-A137 WeakPolarHBondContact O-CB 3.19Å; I133-A137 PolarHBondContact O-N 2.94Å; M134-A137 PolarHBondContact O-N 3.26Å; A137-V140 PolarHBondContact O-N 3.45Å; A137-F141 VanDerWaalsContact O-CB 3.23Å; A137-F141 WeakPolarHBondContact O-CB 3.4Å; A137-F141 PolarHBondContact O-N 2.98Å; A137-I188 HydrophobicContact CB-CD1 3.4Å; A137-I188 VanDerWaalsContact CB-CD1 3.4Å; A137-I188 HydrophobicContact CB-CG1 3.7Å; A137-F403 HydrophobicContact CB-CE1 4.27Å |
| 138 | L | 90.3 | Very high | 87 | Confident | 118 Ų | 118 | 62 Ų | 62 | 62% | 0.618 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -62.2 | -43.5 | 175.8 | -178.8 | 64.6 | 0 | 0 | 0 | 111.8 | M134 L135 L136 F141 A142 | M134-L138 WeakPolarHBondContact O-CB 3.39Å; M134-L138 PolarHBondContact O-N 3.49Å; L135-L138 PolarHBondContact O-N 3.28Å; L136-L138 VanDerWaalsContact C-N 3.31Å; L136-L138 PolarHBondContact O-N 3.45Å; L138-F141 PolarHBondContact O-N 3.08Å; L138-A142 WeakPolarHBondContact O-CB 3.37Å; L138-A142 PolarHBondContact O-N 2.9Å |
| 139 | V | 91.3 | Very high | 87.7 | Confident | 77 Ų | 77 | 56.3 Ų | 56.3 | 47% | 0.467 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.6 | -47.4 | 176.5 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | L135 L136 F141 A142 V143 | L135-V139 WeakPolarHBondContact O-CG2 3.5Å; L135-V139 PolarHBondContact O-N 3.26Å; L136-V139 PolarHBondContact O-N 3.36Å; V139-F141 VanDerWaalsContact C-N 3.33Å; V139-F141 PolarHBondContact O-N 3.18Å; V139-A142 PolarHBondContact O-N 3.39Å; V139-V143 HydrophobicContact CG1-CG2 4.33Å; V139-V143 WeakPolarHBondContact O-CB 3.4Å; V139-V143 VanDerWaalsContact O-CG2 3.3Å; V139-V143 WeakPolarHBondContact O-CG2 3.28Å; V139-V143 PolarHBondContact O-N 3.37Å |
| 140 | V | 91.4 | Very high | 88.2 | Confident | 10 Ų | 10 | 54.6 Ų | 54.6 | 6% | 0.061 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 178 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | L136 A137 G144 L180 F406 F407 A410 | L136-V140 HydrophobicContact CD1-CG2 4.38Å; L136-V140 WeakPolarHBondContact O-CG2 3.2Å; L136-V140 PolarHBondContact O-N 3.49Å; A137-V140 PolarHBondContact O-N 3.45Å; V140-G144 WeakPolarHBondContact O-CA 3.36Å; V140-G144 PolarHBondContact O-N 2.93Å; V140-L180 HydrophobicContact CG1-CD2 4.2Å; V140-F406 HydrophobicContact CG1-CB 4.14Å; V140-F407 HydrophobicContact CG2-CD2 4.18Å; V140-A410 HydrophobicContact CG1-CB 3.86Å |
| 141 | F | 92.1 | Very high | 88.7 | Confident | 59 Ų | 59 | 53 Ų | 53 | 26% | 0.259 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.7 | -52.5 | 175.7 | -174.7 | -101.6 | 0 | 0 | 0 | 111.2 | A137 L138 V139 V143 G144 I145 L180 F181 L184 P185 | A137-F141 VanDerWaalsContact O-CB 3.23Å; A137-F141 WeakPolarHBondContact O-CB 3.4Å; A137-F141 PolarHBondContact O-N 2.98Å; L138-F141 PolarHBondContact O-N 3.08Å; V139-F141 VanDerWaalsContact C-N 3.33Å; V139-F141 PolarHBondContact O-N 3.18Å; F141-V143 PolarHBondContact O-N 3.44Å; F141-G144 PolarHBondContact O-N 2.81Å; F141-I145 HydrophobicContact CD1-CG1 4.21Å; F141-I145 HydrophobicContact CD2-CD1 4.5Å; F141-I145 HydrophobicContact CD2-CG1 4.02Å; F141-I145 HydrophobicContact CE1-CG1 4.04Å; F141-I145 HydrophobicContact CE2-CD1 4.07Å; F141-I145 HydrophobicContact CE2-CG1 3.89Å; F141-I145 HydrophobicContact CG-CG1 4.21Å; F141-I145 HydrophobicContact CZ-CD1 4.25Å; F141-I145 HydrophobicContact CZ-CG1 3.89Å; F141-I145 VanDerWaalsContact O-CB 3.3Å; F141-I145 WeakPolarHBondContact O-CB 3.31Å; F141-I145 WeakPolarHBondContact O-CG1 3.44Å; F141-I145 PolarHBondContact O-N 3.18Å; F141-L180 WeakPolarHBondContact CD2-O 3.49Å; F141-L180 WeakPolarHBondContact CE2-O 3.4Å; F141-F181 HydrophobicContact CE2-CD2 4.42Å; F141-F181 HydrophobicContact CZ-CD2 4.19Å; F141-L184 HydrophobicContact CB-CD2 3.72Å; F141-L184 HydrophobicContact CD2-CD2 3.98Å; F141-L184 HydrophobicContact CG-CD2 4.35Å; F141-P185 HydrophobicContact CE2-CG 4.1Å |
| 142 | A | 92 | Very high | 88.9 | Confident | 49 Ų | 49 | 49.9 Ų | 49.9 | 41% | 0.405 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -60.7 | -50.9 | -178 | 0 | 0 | 0 | 0 | 0 | 111.7 | L138 V139 G144 V146 | L138-A142 WeakPolarHBondContact O-CB 3.37Å; L138-A142 PolarHBondContact O-N 2.9Å; V139-A142 PolarHBondContact O-N 3.39Å; A142-G144 PolarHBondContact O-N 2.91Å; A142-V146 WeakPolarHBondContact O-CB 3.08Å; A142-V146 VanDerWaalsContact O-CG2 3.25Å; A142-V146 WeakPolarHBondContact O-CG2 3.28Å; A142-V146 PolarHBondContact O-N 2.76Å |
| 143 | V | 91.1 | Very high | 88.9 | Confident | 68 Ų | 68 | 51.2 Ų | 51.2 | 41% | 0.412 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.1 | -44.9 | 179.4 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | V139 F141 G147 V414 | V139-V143 HydrophobicContact CG1-CG2 4.33Å; V139-V143 WeakPolarHBondContact O-CB 3.4Å; V139-V143 VanDerWaalsContact O-CG2 3.3Å; V139-V143 WeakPolarHBondContact O-CG2 3.28Å; V139-V143 PolarHBondContact O-N 3.37Å; F141-V143 PolarHBondContact O-N 3.44Å; V143-G147 PolarHBondContact O-N 2.91Å; V143-V414 HydrophobicContact CG1-CG2 4.21Å |
| 144 | G | 90.5 | Very high | 89 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -70.4 | -39.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V140 F141 A142 N148 | V140-G144 WeakPolarHBondContact O-CA 3.36Å; V140-G144 PolarHBondContact O-N 2.93Å; F141-G144 PolarHBondContact O-N 2.81Å; A142-G144 PolarHBondContact O-N 2.91Å; G144-N148 VanDerWaalsContact O-CB 3.23Å; G144-N148 WeakPolarHBondContact O-CB 3.24Å; G144-N148 PolarHBondContact O-N 3.48Å; G144-N148 PolarHBondContact O-ND2 3.14Å |
| 145 | I | 92.8 | Very high | 88.7 | Confident | 24 Ų | 24 | 45.6 Ų | 45.6 | 12% | 0.123 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66 | -50.1 | 176.1 | -66.5 | -66.8 | 0 | 0 | 0 | 110.2 | F141 G147 L149 F177 L180 F181 | F141-I145 HydrophobicContact CD1-CG1 4.21Å; F141-I145 HydrophobicContact CD2-CD1 4.5Å; F141-I145 HydrophobicContact CD2-CG1 4.02Å; F141-I145 HydrophobicContact CE1-CG1 4.04Å; F141-I145 HydrophobicContact CE2-CD1 4.07Å; F141-I145 HydrophobicContact CE2-CG1 3.89Å; F141-I145 HydrophobicContact CG-CG1 4.21Å; F141-I145 HydrophobicContact CZ-CD1 4.25Å; F141-I145 HydrophobicContact CZ-CG1 3.89Å; F141-I145 VanDerWaalsContact O-CB 3.3Å; F141-I145 WeakPolarHBondContact O-CB 3.31Å; F141-I145 WeakPolarHBondContact O-CG1 3.44Å; F141-I145 PolarHBondContact O-N 3.18Å; I145-G147 PolarHBondContact O-N 2.73Å; I145-L149 HydrophobicContact CG2-CD1 3.59Å; I145-L149 HydrophobicContact CG2-CG 4.32Å; I145-L149 VanDerWaalsContact O-CB 3.22Å; I145-L149 WeakPolarHBondContact O-CB 3.36Å; I145-L149 VanDerWaalsContact O-CG 3.24Å; I145-L149 WeakPolarHBondContact O-CG 3.37Å; I145-L149 PolarHBondContact O-N 3.36Å; I145-F177 HydrophobicContact CD1-CD2 3.58Å; I145-F177 HydrophobicContact CD1-CE2 3.53Å; I145-F177 HydrophobicContact CG2-CE2 4.19Å; I145-L180 HydrophobicContact CD1-CB 4.33Å; I145-F181 HydrophobicContact CD1-CB 3.96Å; I145-F181 HydrophobicContact CD1-CD2 4.17Å |
| 146 | V | 90.9 | Very high | 88.2 | Confident | 93 Ų | 93 | 49 Ų | 49 | 56% | 0.564 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -61.8 | -46.4 | 179.6 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | A142 S150 | A142-V146 WeakPolarHBondContact O-CB 3.08Å; A142-V146 VanDerWaalsContact O-CG2 3.25Å; A142-V146 WeakPolarHBondContact O-CG2 3.28Å; A142-V146 PolarHBondContact O-N 2.76Å; V146-S150 VanDerWaalsContact O-CB 3.25Å; V146-S150 WeakPolarHBondContact O-CB 3.21Å; V146-S150 PolarHBondContact O-N 2.75Å; V146-S150 PolarHBondContact O-OG 3.4Å |
| 147 | G | 88.4 | Confident | 87.5 | Confident | 8 Ų | 8 | 52.8 Ų | 52.8 | 8% | 0.082 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63 | -49.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | V143 I145 S150 V151 | V143-G147 PolarHBondContact O-N 2.91Å; I145-G147 PolarHBondContact O-N 2.73Å; G147-S150 PolarHBondContact O-N 3.33Å; G147-V151 WeakPolarHBondContact O-CG2 3.36Å; G147-V151 PolarHBondContact O-N 3.05Å; G147-V151 VanDerWaalsContact O-N 3.11Å |
| 148 | N | 91.2 | Very high | 86.6 | Confident | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.005 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -68.5 | -41.8 | -178.5 | -74 | -58.2 | 0 | 0 | 0 | 112.1 | G144 S150 V151 M152 A173 F177 L180 G409 P413 | G144-N148 VanDerWaalsContact O-CB 3.23Å; G144-N148 WeakPolarHBondContact O-CB 3.24Å; G144-N148 PolarHBondContact O-N 3.48Å; G144-N148 PolarHBondContact O-ND2 3.14Å; N148-S150 VanDerWaalsContact C-N 3.32Å; N148-S150 PolarHBondContact O-N 2.9Å; N148-V151 PolarHBondContact O-N 2.99Å; N148-M152 WeakPolarHBondContact O-CG 2.95Å; N148-M152 PolarHBondContact O-N 3.34Å; N148-A173 HydrophobicContact CB-CB 4.33Å; N148-A173 WeakPolarHBondContact OD1-CA 3.47Å; N148-F177 HydrophobicContact CB-CB 4.02Å; N148-L180 WeakPolarHBondContact ND2-CD1 3.41Å; N148-G409 PolarHBondContact ND2-O 3.36Å; N148-G409 VanDerWaalsContact ND2-O 3.12Å; N148-P413 WeakPolarHBondContact OD1-CG 3.49Å |
| 149 | L | 90 | Very high | 85 | Confident | 68 Ų | 68 | 56.7 Ų | 56.7 | 36% | 0.356 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61.7 | -41.2 | 174.3 | -73.9 | 174.2 | 0 | 0 | 0 | 111.7 | I145 V151 M152 C153 F177 | I145-L149 HydrophobicContact CG2-CD1 3.59Å; I145-L149 HydrophobicContact CG2-CG 4.32Å; I145-L149 VanDerWaalsContact O-CB 3.22Å; I145-L149 WeakPolarHBondContact O-CB 3.36Å; I145-L149 VanDerWaalsContact O-CG 3.24Å; I145-L149 WeakPolarHBondContact O-CG 3.37Å; I145-L149 PolarHBondContact O-N 3.36Å; L149-V151 PolarHBondContact O-N 3.44Å; L149-M152 PolarHBondContact O-N 3.41Å; L149-C153 WeakPolarHBondContact O-CB 3.39Å; L149-C153 PolarHBondContact O-N 3.03Å; L149-C153 PolarHBondContact O-SG 3.03Å; L149-F177 HydrophobicContact CD1-CE2 4.14Å; L149-F177 HydrophobicContact CD2-CD2 4.03Å; L149-F177 HydrophobicContact CD2-CE2 3.81Å; L149-F177 HydrophobicContact CD2-CZ 4.34Å; L149-F177 HydrophobicContact CG-CD2 4Å; L149-F177 HydrophobicContact CG-CE2 3.91Å |
| 150 | S | 87.3 | Confident | 83.2 | Confident | 24 Ų | 24 | 63.5 Ų | 63.5 | 17% | 0.168 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.8 | -47 | 177.6 | -62.1 | 0 | 0 | 0 | 0 | 111.6 | V146 G147 N148 M152 C153 I154 | V146-S150 VanDerWaalsContact O-CB 3.25Å; V146-S150 WeakPolarHBondContact O-CB 3.21Å; V146-S150 PolarHBondContact O-N 2.75Å; V146-S150 PolarHBondContact O-OG 3.4Å; G147-S150 PolarHBondContact O-N 3.33Å; N148-S150 VanDerWaalsContact C-N 3.32Å; N148-S150 PolarHBondContact O-N 2.9Å; S150-M152 VanDerWaalsContact C-N 3.35Å; S150-M152 PolarHBondContact O-N 3.17Å; S150-C153 PolarHBondContact O-N 2.98Å; S150-I154 WeakPolarHBondContact O-CD1 3.15Å; S150-I154 WeakPolarHBondContact O-CG1 3.43Å; S150-I154 PolarHBondContact O-N 3.21Å |
| 151 | V | 86.3 | Confident | 81.6 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.2 | -45.1 | 176.8 | 172.1 | 0 | 0 | 0 | 0 | 111 | G147 N148 L149 V155 A173 P413 L417 L423 | G147-V151 WeakPolarHBondContact O-CG2 3.36Å; G147-V151 PolarHBondContact O-N 3.05Å; G147-V151 VanDerWaalsContact O-N 3.11Å; N148-V151 PolarHBondContact O-N 2.99Å; L149-V151 PolarHBondContact O-N 3.44Å; V151-V155 WeakPolarHBondContact O-CG2 3.49Å; V151-V155 PolarHBondContact O-N 3.14Å; V151-A173 HydrophobicContact CB-CB 4.01Å; V151-A173 HydrophobicContact CG1-CB 3.81Å; V151-P413 HydrophobicContact CG2-CB 3.89Å; V151-L417 HydrophobicContact CG2-CD1 4.31Å; V151-L417 HydrophobicContact CG2-CD2 4.06Å; V151-L417 HydrophobicContact CG2-CG 4.03Å; V151-L423 HydrophobicContact CG1-CD2 4.37Å; V151-L423 HydrophobicContact CG2-CD2 4.46Å |
| 152 | M | 87.1 | Confident | 80.2 | Confident | 52 Ų | 52 | 64.8 Ų | 64.8 | 26% | 0.256 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.2 | -46 | 176.6 | -71.5 | 179.1 | 64.4 | 0 | 0 | 112.1 | N148 L149 S150 V155 W156 A173 L174 | N148-M152 WeakPolarHBondContact O-CG 2.95Å; N148-M152 PolarHBondContact O-N 3.34Å; L149-M152 PolarHBondContact O-N 3.41Å; S150-M152 VanDerWaalsContact C-N 3.35Å; S150-M152 PolarHBondContact O-N 3.17Å; M152-V155 PolarHBondContact O-N 3.2Å; M152-W156 WeakPolarHBondContact O-CB 3.47Å; M152-W156 PolarHBondContact O-N 3.16Å; M152-A173 HydrophobicContact CG-CB 3.86Å; M152-L174 HydrophobicContact CE-CB 4.17Å; M152-L174 HydrophobicContact CE-CD1 3.63Å; M152-L174 HydrophobicContact CE-CG 4.46Å; M152-L174 HydrophobicContact SD-CB 4.06Å; M152-L174 HydrophobicContact SD-CD1 4.15Å |
| 153 | C | 84.3 | Confident | 79.3 | Confident | 79 Ų | 79 | 64.6 Ų | 64.6 | 53% | 0.534 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | -178.9 | -68.9 | 0 | 0 | 0 | 0 | 111.9 | L149 S150 V155 W156 H157 | L149-C153 WeakPolarHBondContact O-CB 3.39Å; L149-C153 PolarHBondContact O-N 3.03Å; L149-C153 PolarHBondContact O-SG 3.03Å; S150-C153 PolarHBondContact O-N 2.98Å; C153-V155 VanDerWaalsContact C-N 3.34Å; C153-V155 PolarHBondContact O-N 2.85Å; C153-W156 PolarHBondContact O-N 3.15Å; C153-H157 VanDerWaalsContact O-CB 3.31Å; C153-H157 WeakPolarHBondContact O-CB 3.25Å; C153-H157 PolarHBondContact O-N 3.27Å |
| 154 | I | 82.6 | Confident | 78.5 | Confident | 9 Ų | 9 | 61.7 Ų | 61.7 | 5% | 0.046 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.9 | -44 | 179.8 | -66.3 | 159.3 | 0 | 0 | 0 | 111.1 | S150 W156 S158 L161 L417 L423 A426 F427 | S150-I154 WeakPolarHBondContact O-CD1 3.15Å; S150-I154 WeakPolarHBondContact O-CG1 3.43Å; S150-I154 PolarHBondContact O-N 3.21Å; I154-W156 VanDerWaalsContact C-N 3.33Å; I154-S158 WeakPolarHBondContact O-CB 3.41Å; I154-S158 PolarHBondContact O-N 3.17Å; I154-S158 VanDerWaalsContact O-N 3.11Å; I154-L161 HydrophobicContact CG2-CD1 3.83Å; I154-L417 HydrophobicContact CD1-CD2 4.2Å; I154-L423 HydrophobicContact CB-CD1 4.19Å; I154-L423 HydrophobicContact CG2-CD1 3.58Å; I154-A426 HydrophobicContact CG2-CB 3.7Å; I154-F427 HydrophobicContact CD1-CB 3.54Å; I154-F427 HydrophobicContact CD1-CD2 3.92Å; I154-F427 HydrophobicContact CD1-CG 4.2Å |
| 155 | V | 79.9 | Confident | 77.9 | Confident | 9 Ų | 9 | 62.5 Ų | 62.5 | 6% | 0.055 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.5 | -35.6 | 179.7 | 176.5 | 0 | 0 | 0 | 0 | 111.2 | V151 M152 C153 N166 A170 L423 | V151-V155 WeakPolarHBondContact O-CG2 3.49Å; V151-V155 PolarHBondContact O-N 3.14Å; M152-V155 PolarHBondContact O-N 3.2Å; C153-V155 VanDerWaalsContact C-N 3.34Å; C153-V155 PolarHBondContact O-N 2.85Å; V155-N166 HydrophobicContact CG1-CB 4.05Å; V155-N166 HydrophobicContact CG2-CB 4.23Å; V155-A170 HydrophobicContact CB-CB 3.99Å; V155-A170 HydrophobicContact CG1-CB 3.81Å; V155-A170 HydrophobicContact CG2-CB 4.24Å; V155-L423 HydrophobicContact CG2-CD1 4.2Å |
| 156 | W | 78.1 | Confident | 77.3 | Confident | 191 Ų | 191 | 62.4 Ų | 62.4 | 72% | 0.723 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -70.7 | -43.6 | 178.3 | -163.8 | -73.7 | 0 | 0 | 0 | 112.5 | M152 C153 I154 | M152-W156 WeakPolarHBondContact O-CB 3.47Å; M152-W156 PolarHBondContact O-N 3.16Å; C153-W156 PolarHBondContact O-N 3.15Å; I154-W156 VanDerWaalsContact C-N 3.33Å |
| 157 | H | 73.1 | Confident | 77 | Confident | 163 Ų | 163 | 59 Ų | 59 | 76% | 0.755 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -76 | -33.8 | -174.4 | -171.1 | -101.9 | 0 | 0 | 0 | 112.9 | C153 Y159 | C153-H157 VanDerWaalsContact O-CB 3.31Å; C153-H157 WeakPolarHBondContact O-CB 3.25Å; C153-H157 PolarHBondContact O-N 3.27Å; H157-Y159 PolarHBondContact O-N 2.88Å |
| 158 | S | 68.4 | Low | 76.9 | Confident | 34 Ų | 34 | 59.1 Ų | 59.1 | 24% | 0.238 | 28% | 0.28 | C | S | . | . | trans | -89.4 | 101.4 | -176 | -174.7 | 0 | 0 | 0 | 0 | 112.2 | I154 Y160 L161 K162 | I154-S158 WeakPolarHBondContact O-CB 3.41Å; I154-S158 PolarHBondContact O-N 3.17Å; I154-S158 VanDerWaalsContact O-N 3.11Å; S158-Y160 PolarHBondContact O-N 2.88Å; S158-L161 CarbonylContact O-C 3.55Å; S158-L161 WeakPolarHBondContact O-CA 3.26Å; S158-L161 PolarHBondContact O-N 3.28Å; S158-L161 VanDerWaalsContact OG-CG 3.3Å; S158-L161 WeakPolarHBondContact OG-CG 3.38Å; S158-L161 PolarHBondContact OG-N 3.32Å; S158-K162 PolarHBondContact O-N 2.81Å | ||
| 159 | Y | 56.5 | Low | 76.6 | Confident | 172 Ų | 172 | 59.1 Ų | 59.1 | 68% | 0.675 | 28% | 0.28 | S | S | * | . | G | 310 helix | trans | -54.8 | -38.1 | 175.3 | -176 | -98.9 | 0 | 0 | 0 | 112.6 | H157 L161 K162 | H157-Y159 PolarHBondContact O-N 2.88Å; Y159-L161 VanDerWaalsContact C-N 3.3Å; Y159-L161 PolarHBondContact O-N 3.16Å; Y159-K162 WeakPolarHBondContact O-CB 3.23Å; Y159-K162 PolarHBondContact O-N 3.4Å; Y159-K162 VanDerWaalsContact O-N 3.16Å |
| 160 | Y | 53.4 | Low | 76.5 | Confident | 220 Ų | 220 | 56.8 Ų | 56.8 | 86% | 0.863 | 27% | 0.27 | S | S | * | . | G | 310 helix | trans | -72.6 | -21 | 177.1 | -69.3 | -81.2 | 0 | 0 | 0 | 113.5 | S158 | S158-Y160 PolarHBondContact O-N 2.88Š|
| 161 | L | 58.5 | Low | 76.7 | Confident | 28 Ų | 28 | 55.9 Ų | 55.9 | 15% | 0.147 | 26% | 0.264 | C | S | . | . | G | 310 helix | trans | -89.5 | 2.7 | 171.3 | -63.5 | 175.1 | 0 | 0 | 0 | 112.3 | I154 S158 Y159 S163 N166 A426 | I154-L161 HydrophobicContact CG2-CD1 3.83Å; S158-L161 CarbonylContact O-C 3.55Å; S158-L161 WeakPolarHBondContact O-CA 3.26Å; S158-L161 PolarHBondContact O-N 3.28Å; S158-L161 VanDerWaalsContact OG-CG 3.3Å; S158-L161 WeakPolarHBondContact OG-CG 3.38Å; S158-L161 PolarHBondContact OG-N 3.32Å; Y159-L161 VanDerWaalsContact C-N 3.3Å; Y159-L161 PolarHBondContact O-N 3.16Å; L161-S163 PolarHBondContact O-N 3Å; L161-N166 WeakPolarHBondContact O-CB 3.2Å; L161-N166 VanDerWaalsContact O-CG 3.3Å; L161-N166 PolarHBondContact O-ND2 3.25Å; L161-A426 HydrophobicContact CD1-CB 4.29Å |
| 162 | K | 62.8 | Low | 76.8 | Confident | 68 Ų | 68 | 56.2 Ų | 56.2 | 30% | 0.296 | 27% | 0.266 | S | S | . | . | trans | -78.1 | 59.5 | 178 | -150.7 | 155.7 | -178.6 | 148 | 0 | 111.9 | S158 Y159 C481 | S158-K162 PolarHBondContact O-N 2.81Å; Y159-K162 WeakPolarHBondContact O-CB 3.23Å; Y159-K162 PolarHBondContact O-N 3.4Å; Y159-K162 VanDerWaalsContact O-N 3.16Å; K162-C481 PolarHBondContact NZ-O 3.48Å; K162-C481 PolarHBondContact NZ-OXT 3.27Å | ||
| 163 | S | 71.9 | Confident | 77 | Confident | 45 Ų | 45 | 53.9 Ų | 53.9 | 32% | 0.315 | 26% | 0.255 | S | S | . | . | S | Bend | trans | -99.7 | 155.7 | 174.6 | 178.5 | 0 | 0 | 0 | 0 | 110.1 | L161 W165 N166 S167 | L161-S163 PolarHBondContact O-N 3Å; S163-W165 PolarHBondContact O-N 2.92Å; S163-N166 PolarHBondContact O-N 2.79Å; S163-N166 VanDerWaalsContact O-N 3.1Å; S163-S167 PolarHBondContact O-N 3.37Å; S163-S167 PolarHBondContact O-OG 3.09Å |
| 164 | A | 74.5 | Confident | 77.4 | Confident | 8 Ų | 8 | 52.4 Ų | 52.4 | 7% | 0.066 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -53 | -38.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S167 I168 E243 I248 | A164-S167 PolarHBondContact O-N 2.89Å; A164-I168 WeakPolarHBondContact O-CG1 3.5Å; A164-I168 PolarHBondContact O-N 3.33Å; A164-I168 VanDerWaalsContact O-N 3.09Å; A164-E243 WeakPolarHBondContact CB-OE2 3.48Å; A164-I248 HydrophobicContact CB-CD1 4.49Å; A164-I248 HydrophobicContact CB-CG1 4.26Å |
| 165 | W | 78.3 | Confident | 77.9 | Confident | 16 Ų | 16 | 53.3 Ų | 53.3 | 6% | 0.061 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.1 | -51.1 | 176 | 178.5 | -87.8 | 0 | 0 | 0 | 112.4 | S163 S167 I168 L169 L224 R228 V361 | S163-W165 PolarHBondContact O-N 2.92Å; W165-S167 VanDerWaalsContact C-N 3.33Å; W165-S167 PolarHBondContact O-N 2.98Å; W165-I168 PolarHBondContact O-N 3.23Å; W165-L169 PolarHBondContact O-N 3.11Å; W165-L169 VanDerWaalsContact O-N 3.12Å; W165-L224 HydrophobicContact CD2-CD2 3.53Å; W165-L224 HydrophobicContact CE3-CB 4.2Å; W165-L224 HydrophobicContact CE3-CD2 3.13Å; W165-L224 HydrophobicContact CE3-CG 4.16Å; W165-L224 HydrophobicContact CG-CD2 4.26Å; W165-L224 HydrophobicContact CH2-CB 3.75Å; W165-L224 HydrophobicContact CH2-CD1 4.01Å; W165-L224 HydrophobicContact CH2-CD2 3.68Å; W165-L224 HydrophobicContact CH2-CG 3.98Å; W165-L224 HydrophobicContact CZ2-CD1 4.38Å; W165-L224 HydrophobicContact CZ2-CD2 4.07Å; W165-L224 HydrophobicContact CZ3-CB 3.43Å; W165-L224 VanDerWaalsContact CZ3-CB 3.43Å; W165-L224 HydrophobicContact CZ3-CD1 4.32Å; W165-L224 HydrophobicContact CZ3-CD2 3.24Å; W165-L224 HydrophobicContact CZ3-CG 3.77Å; W165-R228 VanDerWaalsContact CE3-CZ 3.42Å; W165-R228 HydrophobicContact CZ3-CG 4.02Å; W165-V361 HydrophobicContact CH2-CB 4.15Å; W165-V361 HydrophobicContact CH2-CG1 4.21Å; W165-V361 HydrophobicContact CH2-CG2 3.2Å; W165-V361 HydrophobicContact CZ2-CG2 4.01Å; W165-V361 HydrophobicContact CZ3-CG2 3.71Å |
| 166 | N | 80.6 | Confident | 78.5 | Confident | 22 Ų | 22 | 53 Ų | 53 | 12% | 0.118 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -72.5 | -29.3 | -178.1 | -67.2 | -31.5 | 0 | 0 | 0 | 111.9 | V155 L161 S163 I168 L169 A170 | V155-N166 HydrophobicContact CG1-CB 4.05Å; V155-N166 HydrophobicContact CG2-CB 4.23Å; L161-N166 WeakPolarHBondContact O-CB 3.2Å; L161-N166 VanDerWaalsContact O-CG 3.3Å; L161-N166 PolarHBondContact O-ND2 3.25Å; S163-N166 PolarHBondContact O-N 2.79Å; S163-N166 VanDerWaalsContact O-N 3.1Å; N166-I168 VanDerWaalsContact C-N 3.35Å; N166-L169 PolarHBondContact O-N 2.79Å; N166-A170 WeakPolarHBondContact O-CB 3.46Å; N166-A170 PolarHBondContact O-N 3.31Å |
| 167 | S | 83.6 | Confident | 79.2 | Confident | 21 Ų | 21 | 45.7 Ų | 45.7 | 15% | 0.147 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66 | -38.2 | 174.1 | -55.7 | 0 | 0 | 0 | 0 | 111.6 | S163 A164 W165 A170 S171 | S163-S167 PolarHBondContact O-N 3.37Å; S163-S167 PolarHBondContact O-OG 3.09Å; A164-S167 PolarHBondContact O-N 2.89Å; W165-S167 VanDerWaalsContact C-N 3.33Å; W165-S167 PolarHBondContact O-N 2.98Å; S167-A170 PolarHBondContact O-N 3.44Å; S167-S171 WeakPolarHBondContact O-CB 3.42Å; S167-S171 PolarHBondContact O-N 3.44Å |
| 168 | I | 87.3 | Confident | 80.1 | Confident | 11 Ų | 11 | 39.9 Ų | 39.9 | 6% | 0.056 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.9 | -44.1 | 172.2 | -67.2 | 165.4 | 0 | 0 | 0 | 110.2 | A164 W165 N166 A170 S171 L172 S220 A223 L224 L252 I255 | A164-I168 WeakPolarHBondContact O-CG1 3.5Å; A164-I168 PolarHBondContact O-N 3.33Å; A164-I168 VanDerWaalsContact O-N 3.09Å; W165-I168 PolarHBondContact O-N 3.23Å; N166-I168 VanDerWaalsContact C-N 3.35Å; I168-A170 PolarHBondContact O-N 3.25Å; I168-S171 WeakPolarHBondContact O-CB 3.44Å; I168-S171 PolarHBondContact O-N 2.84Å; I168-S171 VanDerWaalsContact O-N 3.15Å; I168-S171 PolarHBondContact O-OG 2.97Å; I168-L172 WeakPolarHBondContact O-CG 3.23Å; I168-L172 PolarHBondContact O-N 2.8Å; I168-S220 VanDerWaalsContact CG2-CB 3.49Å; I168-A223 HydrophobicContact CD1-CB 4.18Å; I168-L224 HydrophobicContact CB-CD2 4.05Å; I168-L224 HydrophobicContact CD1-CD2 3.97Å; I168-L224 HydrophobicContact CD1-CG 4.5Å; I168-L224 HydrophobicContact CG2-CD1 4.14Å; I168-L224 HydrophobicContact CG2-CD2 3.91Å; I168-L224 HydrophobicContact CG2-CG 3.95Å; I168-L252 HydrophobicContact CG1-CD2 4.19Å; I168-I255 HydrophobicContact CG1-CD1 4.42Å |
| 169 | L | 84.9 | Confident | 81.2 | Confident | 1 Ų | 1 | 38.8 Ų | 38.8 | 1% | 0.005 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.4 | -41 | 175.4 | -66.6 | -179.5 | 0 | 0 | 0 | 112.9 | W165 N166 S171 L172 A173 L224 L364 L416 | W165-L169 PolarHBondContact O-N 3.11Å; W165-L169 VanDerWaalsContact O-N 3.12Å; N166-L169 PolarHBondContact O-N 2.79Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 3.27Å; L169-L172 HydrophobicContact CD2-CD1 4.15Å; L169-L172 WeakPolarHBondContact O-CB 3.29Å; L169-L172 PolarHBondContact O-N 3.38Å; L169-A173 PolarHBondContact O-N 2.65Å; L169-L224 HydrophobicContact CD2-CD1 4.43Å; L169-L364 HydrophobicContact CD2-CD2 4.21Å; L169-L416 HydrophobicContact CD2-CD1 4.35Å; L169-L416 HydrophobicContact CD2-CD2 3.76Å |
| 170 | A | 87.4 | Confident | 82.9 | Confident | 19 Ų | 19 | 30.7 Ų | 30.7 | 16% | 0.157 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65.2 | -36.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V155 N166 S167 I168 L172 A173 L174 | V155-A170 HydrophobicContact CB-CB 3.99Å; V155-A170 HydrophobicContact CG1-CB 3.81Å; V155-A170 HydrophobicContact CG2-CB 4.24Å; N166-A170 WeakPolarHBondContact O-CB 3.46Å; N166-A170 PolarHBondContact O-N 3.31Å; S167-A170 PolarHBondContact O-N 3.44Å; I168-A170 PolarHBondContact O-N 3.25Å; A170-L172 VanDerWaalsContact C-N 3.31Å; A170-L172 PolarHBondContact O-N 3.44Å; A170-A173 PolarHBondContact O-N 2.89Å; A170-L174 WeakPolarHBondContact O-CB 3.41Å; A170-L174 PolarHBondContact O-N 3.3Å |
| 171 | S | 90.4 | Very high | 84.7 | Confident | 5 Ų | 5 | 24.7 Ų | 24.7 | 4% | 0.035 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -65.2 | -35 | 174.6 | 81.1 | 0 | 0 | 0 | 0 | 112.4 | S167 I168 L169 L174 W175 | S167-S171 WeakPolarHBondContact O-CB 3.42Å; S167-S171 PolarHBondContact O-N 3.44Å; I168-S171 WeakPolarHBondContact O-CB 3.44Å; I168-S171 PolarHBondContact O-N 2.84Å; I168-S171 VanDerWaalsContact O-N 3.15Å; I168-S171 PolarHBondContact O-OG 2.97Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 3.27Å; S171-L174 PolarHBondContact O-N 3.47Å; S171-W175 VanDerWaalsContact O-CD1 3.26Å; S171-W175 PolarHBondContact O-N 2.95Å; S171-W175 VanDerWaalsContact O-N 3.14Å |
| 172 | L | 89.5 | Confident | 86.2 | Confident | 8 Ų | 8 | 28.4 Ų | 28.4 | 4% | 0.042 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.8 | -50.1 | 172.9 | -69.4 | 167.7 | 0 | 0 | 0 | 111.1 | I168 L169 A170 L174 W175 D176 V216 T217 | I168-L172 WeakPolarHBondContact O-CG 3.23Å; I168-L172 PolarHBondContact O-N 2.8Å; L169-L172 HydrophobicContact CD2-CD1 4.15Å; L169-L172 WeakPolarHBondContact O-CB 3.29Å; L169-L172 PolarHBondContact O-N 3.38Å; A170-L172 VanDerWaalsContact C-N 3.31Å; A170-L172 PolarHBondContact O-N 3.44Å; L172-L174 PolarHBondContact O-N 3.05Å; L172-W175 PolarHBondContact O-N 2.85Å; L172-W175 VanDerWaalsContact O-N 3.13Å; L172-D176 PolarHBondContact O-N 2.96Å; L172-V216 HydrophobicContact CD2-CG1 4.15Å; L172-T217 VanDerWaalsContact CD2-CA 3.44Å; L172-T217 HydrophobicContact CD2-CG2 3.75Å |
| 173 | A | 90.9 | Very high | 87.5 | Confident | 2 Ų | 2 | 25.3 Ų | 25.3 | 2% | 0.017 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -59.6 | -35.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | N148 V151 M152 L169 A170 F177 | N148-A173 HydrophobicContact CB-CB 4.33Å; N148-A173 WeakPolarHBondContact OD1-CA 3.47Å; V151-A173 HydrophobicContact CB-CB 4.01Å; V151-A173 HydrophobicContact CG1-CB 3.81Å; M152-A173 HydrophobicContact CG-CB 3.86Å; L169-A173 PolarHBondContact O-N 2.65Å; A170-A173 PolarHBondContact O-N 2.89Å; A173-F177 WeakPolarHBondContact O-CB 3.26Å; A173-F177 PolarHBondContact O-N 3.5Å |
| 174 | L | 92.6 | Very high | 88.2 | Confident | 49 Ų | 49 | 23.3 Ų | 23.3 | 26% | 0.257 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -62.9 | -47.6 | 174.3 | 177.1 | 67.6 | 0 | 0 | 0 | 111.8 | M152 A170 S171 L172 F177 L178 W256 | M152-L174 HydrophobicContact CE-CB 4.17Å; M152-L174 HydrophobicContact CE-CD1 3.63Å; M152-L174 HydrophobicContact CE-CG 4.46Å; M152-L174 HydrophobicContact SD-CB 4.06Å; M152-L174 HydrophobicContact SD-CD1 4.15Å; A170-L174 WeakPolarHBondContact O-CB 3.41Å; A170-L174 PolarHBondContact O-N 3.3Å; S171-L174 PolarHBondContact O-N 3.47Å; L172-L174 PolarHBondContact O-N 3.05Å; L174-F177 WeakPolarHBondContact O-CB 3.41Å; L174-F177 PolarHBondContact O-N 2.95Å; L174-L178 HydrophobicContact CG-CD1 4.37Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.16Å; L174-L178 PolarHBondContact O-N 3.47Å; L174-W256 HydrophobicContact CD2-CH2 4.05Å; L174-W256 HydrophobicContact CD2-CZ2 4.06Å |
| 175 | W | 93.2 | Very high | 88.9 | Confident | 27 Ų | 27 | 25.8 Ų | 25.8 | 10% | 0.102 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -69.1 | -39.1 | -179.5 | -83 | 96.7 | 0 | 0 | 0 | 112.7 | S171 L172 F177 L178 V179 M209 V216 W256 M260 | S171-W175 VanDerWaalsContact O-CD1 3.26Å; S171-W175 PolarHBondContact O-N 2.95Å; S171-W175 VanDerWaalsContact O-N 3.14Å; L172-W175 PolarHBondContact O-N 2.85Å; L172-W175 VanDerWaalsContact O-N 3.13Å; W175-F177 VanDerWaalsContact C-N 3.35Å; W175-L178 HydrophobicContact CD2-CD1 4.48Å; W175-L178 HydrophobicContact CE3-CD1 4.32Å; W175-L178 HydrophobicContact CZ3-CD1 4.47Å; W175-L178 PolarHBondContact O-N 3.47Å; W175-V179 WeakPolarHBondContact O-CG2 3.31Å; W175-V179 PolarHBondContact O-N 3.35Å; W175-V179 VanDerWaalsContact O-N 3.09Å; W175-M209 HydrophobicContact CE3-CE 4.48Å; W175-M209 HydrophobicContact CZ3-CE 3.91Å; W175-M209 HydrophobicContact CZ3-SD 4.14Å; W175-V216 HydrophobicContact CB-CG1 4.42Å; W175-V216 HydrophobicContact CD2-CG2 3.94Å; W175-V216 HydrophobicContact CG-CB 4.18Å; W175-V216 HydrophobicContact CG-CG1 4.06Å; W175-V216 HydrophobicContact CG-CG2 3.89Å; W175-W256 AromaticContact CD1-NE1 3.81Å; W175-W256 AromaticContact NE1-CD1 3.44Å; W175-W256 AromaticContact NE1-CD2 3.9Å; W175-W256 AromaticContact NE1-CE2 3.62Å; W175-W256 AromaticContact NE1-CG 3.81Å; W175-W256 AromaticContact NE1-NE1 3.32Å; W175-M260 HydrophobicContact CD2-CE 4.43Å; W175-M260 HydrophobicContact CE3-CE 4.22Å; W175-M260 HydrophobicContact CH2-CE 3.01Å; W175-M260 HydrophobicContact CH2-SD 3.53Å; W175-M260 VanDerWaalsContact CH2-SD 3.53Å; W175-M260 HydrophobicContact CZ2-CE 3.21Å; W175-M260 HydrophobicContact CZ2-SD 4.19Å; W175-M260 HydrophobicContact CZ3-CE 3.55Å; W175-M260 HydrophobicContact CZ3-SD 4.11Å |
| 176 | D | 92.1 | Very high | 89.2 | Confident | 3 Ų | 3 | 27.1 Ų | 27.1 | 2% | 0.016 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.9 | -40.8 | 172.9 | -72.7 | -35.6 | 0 | 0 | 0 | 111.1 | L172 V179 L180 S213 | L172-D176 PolarHBondContact O-N 2.96Å; D176-V179 PolarHBondContact O-N 2.9Å; D176-L180 WeakPolarHBondContact O-CB 3.49Å; D176-L180 VanDerWaalsContact O-CG 3.26Å; D176-L180 WeakPolarHBondContact O-CG 3.18Å; D176-L180 PolarHBondContact O-N 3.45Å; D176-S213 PolarHBondContact OD1-OG 2.91Å |
| 177 | F | 92.9 | Very high | 89.3 | Confident | 38 Ų | 38 | 26.4 Ų | 26.4 | 17% | 0.167 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.1 | -46.3 | 172.6 | 171.2 | -94.1 | 0 | 0 | 0 | 112.1 | I145 N148 L149 A173 L174 W175 V179 L180 F181 | I145-F177 HydrophobicContact CD1-CD2 3.58Å; I145-F177 HydrophobicContact CD1-CE2 3.53Å; I145-F177 HydrophobicContact CG2-CE2 4.19Å; N148-F177 HydrophobicContact CB-CB 4.02Å; L149-F177 HydrophobicContact CD1-CE2 4.14Å; L149-F177 HydrophobicContact CD2-CD2 4.03Å; L149-F177 HydrophobicContact CD2-CE2 3.81Å; L149-F177 HydrophobicContact CD2-CZ 4.34Å; L149-F177 HydrophobicContact CG-CD2 4Å; L149-F177 HydrophobicContact CG-CE2 3.91Å; A173-F177 WeakPolarHBondContact O-CB 3.26Å; A173-F177 PolarHBondContact O-N 3.5Å; L174-F177 WeakPolarHBondContact O-CB 3.41Å; L174-F177 PolarHBondContact O-N 2.95Å; W175-F177 VanDerWaalsContact C-N 3.35Å; F177-V179 PolarHBondContact O-N 3.38Å; F177-L180 PolarHBondContact O-N 3.45Å; F177-F181 HydrophobicContact CE1-CB 4.27Å; F177-F181 HydrophobicContact CE1-CG 4.48Å; F177-F181 HydrophobicContact CE2-CB 4.4Å; F177-F181 HydrophobicContact CZ-CB 4.14Å; F177-F181 HydrophobicContact CZ-CD2 4.26Å; F177-F181 HydrophobicContact CZ-CG 4.14Å; F177-F181 WeakPolarHBondContact O-CB 3.39Å; F177-F181 PolarHBondContact O-N 2.81Å |
| 178 | L | 92.5 | Very high | 89.2 | Confident | 40 Ų | 40 | 26.1 Ų | 26.1 | 21% | 0.209 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 179.7 | -72 | 173.1 | 0 | 0 | 0 | 111.8 | L174 W175 F182 M209 | L174-L178 HydrophobicContact CG-CD1 4.37Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.16Å; L174-L178 PolarHBondContact O-N 3.47Å; W175-L178 HydrophobicContact CD2-CD1 4.48Å; W175-L178 HydrophobicContact CE3-CD1 4.32Å; W175-L178 HydrophobicContact CZ3-CD1 4.47Å; W175-L178 PolarHBondContact O-N 3.47Å; L178-F182 HydrophobicContact CD2-CD2 3.99Å; L178-F182 HydrophobicContact CD2-CE2 3.63Å; L178-F182 WeakPolarHBondContact O-CB 3.23Å; L178-F182 WeakPolarHBondContact O-CD2 3.15Å; L178-F182 PolarHBondContact O-N 2.88Å; L178-M209 HydrophobicContact CB-CE 4.06Å |
| 179 | V | 91.7 | Very high | 88.9 | Confident | 12 Ų | 12 | 29.2 Ų | 29.2 | 7% | 0.073 | 15% | 0.146 | C | C | . | . | I | π-helix | trans | -65.6 | -44.5 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 111 | W175 D176 F177 C183 L184 M209 E210 F406 | W175-V179 WeakPolarHBondContact O-CG2 3.31Å; W175-V179 PolarHBondContact O-N 3.35Å; W175-V179 VanDerWaalsContact O-N 3.09Å; D176-V179 PolarHBondContact O-N 2.9Å; F177-V179 PolarHBondContact O-N 3.38Å; V179-C183 HydrophobicContact CG1-CB 4.22Å; V179-C183 WeakPolarHBondContact O-CA 3.32Å; V179-C183 WeakPolarHBondContact O-CB 3.25Å; V179-C183 PolarHBondContact O-N 3.39Å; V179-L184 PolarHBondContact O-N 2.93Å; V179-M209 HydrophobicContact CG2-CB 4.47Å; V179-E210 HydrophobicContact CG1-CG 4.47Å; V179-F406 HydrophobicContact CG1-CD1 4.03Å; V179-F406 HydrophobicContact CG1-CE1 3.82Å |
| 180 | L | 92.1 | Very high | 88.5 | Confident | 1 Ų | 1 | 30.6 Ų | 30.6 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | I | π-helix | trans | -68.5 | -36.8 | 178.9 | -71.1 | 169.1 | 0 | 0 | 0 | 112.9 | V140 F141 I145 N148 D176 F177 L184 P185 F406 | V140-L180 HydrophobicContact CG1-CD2 4.2Å; F141-L180 WeakPolarHBondContact CD2-O 3.49Å; F141-L180 WeakPolarHBondContact CE2-O 3.4Å; I145-L180 HydrophobicContact CD1-CB 4.33Å; N148-L180 WeakPolarHBondContact ND2-CD1 3.41Å; D176-L180 WeakPolarHBondContact O-CB 3.49Å; D176-L180 VanDerWaalsContact O-CG 3.26Å; D176-L180 WeakPolarHBondContact O-CG 3.18Å; D176-L180 PolarHBondContact O-N 3.45Å; F177-L180 PolarHBondContact O-N 3.45Å; L180-L184 HydrophobicContact CD2-CD2 4.4Å; L180-L184 WeakPolarHBondContact O-CB 3.25Å; L180-P185 WeakPolarHBondContact O-CD 3.23Å; L180-F406 HydrophobicContact CD2-CB 4.21Å; L180-F406 HydrophobicContact CD2-CD1 4.39Å |
| 181 | F | 91.9 | Very high | 87.9 | Confident | 94 Ų | 94 | 32.5 Ų | 32.5 | 41% | 0.412 | 16% | 0.159 | S | C | . | . | I | π-helix | trans | -76.7 | -43.2 | -177.4 | -174.3 | -101.3 | 0 | 0 | 0 | 112.4 | F141 I145 F177 P185 | F141-F181 HydrophobicContact CE2-CD2 4.42Å; F141-F181 HydrophobicContact CZ-CD2 4.19Å; I145-F181 HydrophobicContact CD1-CB 3.96Å; I145-F181 HydrophobicContact CD1-CD2 4.17Å; F177-F181 HydrophobicContact CE1-CB 4.27Å; F177-F181 HydrophobicContact CE1-CG 4.48Å; F177-F181 HydrophobicContact CE2-CB 4.4Å; F177-F181 HydrophobicContact CZ-CB 4.14Å; F177-F181 HydrophobicContact CZ-CD2 4.26Å; F177-F181 HydrophobicContact CZ-CG 4.14Å; F177-F181 WeakPolarHBondContact O-CB 3.39Å; F177-F181 PolarHBondContact O-N 2.81Å; F181-P185 VanDerWaalsContact O-CD 3.31Å; F181-P185 WeakPolarHBondContact O-CD 3.24Å; F181-P185 VanDerWaalsContact O-CG 3.31Å; F181-P185 WeakPolarHBondContact O-CG 3.22Å |
| 182 | F | 89.9 | Confident | 87.1 | Confident | 106 Ų | 106 | 35.2 Ų | 35.2 | 47% | 0.465 | 17% | 0.173 | S | C | . | . | I | π-helix | trans | -95.9 | -47.2 | -175.9 | -66.8 | -69.7 | 0 | 0 | 0 | 113 | L178 I186 | L178-F182 HydrophobicContact CD2-CD2 3.99Å; L178-F182 HydrophobicContact CD2-CE2 3.63Å; L178-F182 WeakPolarHBondContact O-CB 3.23Å; L178-F182 WeakPolarHBondContact O-CD2 3.15Å; L178-F182 PolarHBondContact O-N 2.88Å; F182-I186 WeakPolarHBondContact O-CD1 3.3Å; F182-I186 WeakPolarHBondContact O-CG1 3.43Å |
| 183 | C | 88.6 | Confident | 86.1 | Confident | 4 Ų | 4 | 36.8 Ų | 36.8 | 3% | 0.027 | 18% | 0.183 | C | C | . | . | I | π-helix | trans | -78.9 | -43.2 | -171.7 | -55.9 | 0 | 0 | 0 | 0 | 112.1 | V179 I186 V187 V206 M209 F406 | V179-C183 HydrophobicContact CG1-CB 4.22Å; V179-C183 WeakPolarHBondContact O-CA 3.32Å; V179-C183 WeakPolarHBondContact O-CB 3.25Å; V179-C183 PolarHBondContact O-N 3.39Å; C183-I186 PolarHBondContact O-N 3.42Å; C183-V187 WeakPolarHBondContact O-CB 3.38Å; C183-V187 VanDerWaalsContact O-CG2 3.28Å; C183-V187 WeakPolarHBondContact O-CG2 3.3Å; C183-V187 PolarHBondContact O-N 2.94Å; C183-V206 HydrophobicContact CB-CG1 4.34Å; C183-V206 HydrophobicContact CB-CG2 4.49Å; C183-M209 VanDerWaalsContact SG-CB 3.57Å; C183-F406 HydrophobicContact CB-CE1 3.98Å; C183-F406 HydrophobicContact CB-CZ 4.31Å |
| 184 | L | 88.2 | Confident | 84.9 | Confident | 3 Ų | 3 | 42.8 Ų | 42.8 | 2% | 0.016 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.9 | -49.9 | -176.4 | -177.1 | 72.8 | 0 | 0 | 0 | 112.5 | F141 V179 L180 I186 V187 I188 F406 | F141-L184 HydrophobicContact CB-CD2 3.72Å; F141-L184 HydrophobicContact CD2-CD2 3.98Å; F141-L184 HydrophobicContact CG-CD2 4.35Å; V179-L184 PolarHBondContact O-N 2.93Å; L180-L184 HydrophobicContact CD2-CD2 4.4Å; L180-L184 WeakPolarHBondContact O-CB 3.25Å; L184-I186 VanDerWaalsContact C-N 3.32Å; L184-I186 PolarHBondContact O-N 3.35Å; L184-V187 PolarHBondContact O-N 3.37Å; L184-I188 HydrophobicContact CD1-CG1 4.2Å; L184-I188 HydrophobicContact CG-CG1 4.36Å; L184-I188 VanDerWaalsContact O-CG1 3.24Å; L184-I188 WeakPolarHBondContact O-CG1 3.27Å; L184-I188 PolarHBondContact O-N 2.97Å; L184-F406 HydrophobicContact CB-CD1 4.11Å; L184-F406 HydrophobicContact CB-CE1 4.11Å; L184-F406 HydrophobicContact CB-CG 4.46Å; L184-F406 HydrophobicContact CB-CZ 4.43Å; L184-F406 HydrophobicContact CD1-CB 3.98Å; L184-F406 HydrophobicContact CD1-CD1 4.04Å; L184-F406 HydrophobicContact CD1-CD2 3.37Å; L184-F406 HydrophobicContact CD1-CE1 4.41Å; L184-F406 HydrophobicContact CD1-CE2 3.76Å; L184-F406 HydrophobicContact CD1-CG 3.53Å; L184-F406 HydrophobicContact CD1-CZ 4.29Å |
| 185 | P | 87.5 | Confident | 83.4 | Confident | 60 Ų | 60 | 47.1 Ų | 47.1 | 39% | 0.39 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.9 | -36.6 | 179.4 | -22.8 | 35.9 | 0 | 0 | 0 | 113 | F141 L180 F181 F189 | F141-P185 HydrophobicContact CE2-CG 4.1Å; L180-P185 WeakPolarHBondContact O-CD 3.23Å; F181-P185 VanDerWaalsContact O-CD 3.31Å; F181-P185 WeakPolarHBondContact O-CD 3.24Å; F181-P185 VanDerWaalsContact O-CG 3.31Å; F181-P185 WeakPolarHBondContact O-CG 3.22Å; P185-F189 VanDerWaalsContact O-CB 3.27Å; P185-F189 WeakPolarHBondContact O-CB 3.34Å; P185-F189 PolarHBondContact O-N 3.29Å |
| 186 | I | 85.3 | Confident | 82.1 | Confident | 43 Ų | 43 | 48.5 Ų | 48.5 | 22% | 0.221 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.8 | -44.9 | 177 | -68.3 | 173.4 | 0 | 0 | 0 | 110.4 | F182 C183 L184 F189 N190 V206 | F182-I186 WeakPolarHBondContact O-CD1 3.3Å; F182-I186 WeakPolarHBondContact O-CG1 3.43Å; C183-I186 PolarHBondContact O-N 3.42Å; L184-I186 VanDerWaalsContact C-N 3.32Å; L184-I186 PolarHBondContact O-N 3.35Å; I186-F189 PolarHBondContact O-N 2.86Å; I186-N190 WeakPolarHBondContact O-CB 3.49Å; I186-N190 PolarHBondContact O-N 3.23Å; I186-N190 PolarHBondContact O-ND2 3.43Å; I186-N190 PolarHBondContact O-OD1 3.27Å; I186-V206 HydrophobicContact CG2-CG2 4.05Å |
| 187 | V | 82.8 | Confident | 80.5 | Confident | 8 Ų | 8 | 53.8 Ų | 53.8 | 5% | 0.048 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64.2 | -47.3 | 179.4 | 169.3 | 0 | 0 | 0 | 0 | 110.9 | C183 L184 F189 N190 E191 V206 Q402 F406 | C183-V187 WeakPolarHBondContact O-CB 3.38Å; C183-V187 VanDerWaalsContact O-CG2 3.28Å; C183-V187 WeakPolarHBondContact O-CG2 3.3Å; C183-V187 PolarHBondContact O-N 2.94Å; L184-V187 PolarHBondContact O-N 3.37Å; V187-F189 VanDerWaalsContact C-N 3.35Å; V187-F189 PolarHBondContact O-N 3.29Å; V187-N190 PolarHBondContact O-N 2.94Å; V187-E191 PolarHBondContact O-N 3.38Å; V187-V206 HydrophobicContact CG2-CG1 3.74Å; V187-V206 HydrophobicContact CG2-CG2 4.41Å; V187-Q402 HydrophobicContact CG1-CG 4.14Å; V187-F406 HydrophobicContact CB-CE2 4.24Å; V187-F406 HydrophobicContact CB-CZ 4.27Å; V187-F406 HydrophobicContact CG1-CE2 4.12Å; V187-F406 HydrophobicContact CG2-CE2 4.3Å; V187-F406 HydrophobicContact CG2-CZ 3.94Å |
| 188 | I | 82.6 | Confident | 79.1 | Confident | 15 Ų | 15 | 56 Ų | 56 | 8% | 0.077 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 179.2 | -64.3 | -61.9 | 0 | 0 | 0 | 111.4 | I133 M134 A137 L184 N190 E191 I192 F403 | I133-I188 HydrophobicContact CG2-CD1 4.21Å; M134-I188 HydrophobicContact SD-CG2 3.28Å; M134-I188 WeakPolarHBondContact SD-CG2 3.34Å; A137-I188 HydrophobicContact CB-CD1 3.4Å; A137-I188 VanDerWaalsContact CB-CD1 3.4Å; A137-I188 HydrophobicContact CB-CG1 3.7Å; L184-I188 HydrophobicContact CD1-CG1 4.2Å; L184-I188 HydrophobicContact CG-CG1 4.36Å; L184-I188 VanDerWaalsContact O-CG1 3.24Å; L184-I188 WeakPolarHBondContact O-CG1 3.27Å; L184-I188 PolarHBondContact O-N 2.97Å; I188-N190 PolarHBondContact O-N 3Å; I188-E191 PolarHBondContact O-N 3.23Å; I188-I192 HydrophobicContact CG2-CD1 3.66Å; I188-I192 WeakPolarHBondContact O-CD1 3.35Å; I188-I192 VanDerWaalsContact O-CG1 3.31Å; I188-I192 WeakPolarHBondContact O-CG1 3.36Å; I188-I192 PolarHBondContact O-N 3.39Å; I188-I192 VanDerWaalsContact O-N 3.08Å; I188-F403 HydrophobicContact CD1-CE1 3.81Å; I188-F403 HydrophobicContact CD1-CZ 3.57Å |
| 189 | F | 81.1 | Confident | 78.2 | Confident | 76 Ų | 76 | 55 Ų | 55 | 33% | 0.333 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 176.5 | -175.8 | -84 | 0 | 0 | 0 | 112.1 | P185 I186 V187 E191 I192 T193 L197 | P185-F189 VanDerWaalsContact O-CB 3.27Å; P185-F189 WeakPolarHBondContact O-CB 3.34Å; P185-F189 PolarHBondContact O-N 3.29Å; I186-F189 PolarHBondContact O-N 2.86Å; V187-F189 VanDerWaalsContact C-N 3.35Å; V187-F189 PolarHBondContact O-N 3.29Å; F189-E191 VanDerWaalsContact C-N 3.29Å; F189-E191 PolarHBondContact O-N 2.79Å; F189-I192 PolarHBondContact O-N 3.03Å; F189-T193 HydrophobicContact CE1-CG2 4.05Å; F189-T193 VanDerWaalsContact CE1-OG1 3.29Å; F189-T193 WeakPolarHBondContact CE1-OG1 3.18Å; F189-T193 WeakPolarHBondContact CE2-OG1 3.39Å; F189-T193 HydrophobicContact CZ-CG2 3.91Å; F189-T193 WeakPolarHBondContact CZ-OG1 3.45Å; F189-T193 WeakPolarHBondContact O-CB 3.43Å; F189-T193 PolarHBondContact O-N 2.92Å; F189-T193 PolarHBondContact O-OG1 2.89Å; F189-L197 HydrophobicContact CD1-CB 3.76Å; F189-L197 HydrophobicContact CD1-CD1 3.62Å; F189-L197 HydrophobicContact CD1-CG 4.29Å; F189-L197 HydrophobicContact CD2-CD1 4.13Å; F189-L197 HydrophobicContact CE1-CB 3.77Å; F189-L197 HydrophobicContact CE1-CD1 3.12Å; F189-L197 HydrophobicContact CE1-CG 4.05Å; F189-L197 HydrophobicContact CE2-CD1 3.67Å; F189-L197 HydrophobicContact CG-CD1 4.11Å; F189-L197 HydrophobicContact CZ-CD1 3.15Å; F189-L197 HydrophobicContact CZ-CG 4.46Å |
| 190 | N | 76.4 | Confident | 77.3 | Confident | 29 Ų | 29 | 57 Ų | 57 | 16% | 0.155 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.2 | -37.7 | 177.9 | -69.4 | -20.2 | 0 | 0 | 0 | 111.3 | I186 V187 I188 K194 | I186-N190 WeakPolarHBondContact O-CB 3.49Å; I186-N190 PolarHBondContact O-N 3.23Å; I186-N190 PolarHBondContact O-ND2 3.43Å; I186-N190 PolarHBondContact O-OD1 3.27Å; V187-N190 PolarHBondContact O-N 2.94Å; I188-N190 PolarHBondContact O-N 3Å; N190-K194 WeakPolarHBondContact O-CA 3.1Å; N190-K194 PolarHBondContact O-N 3.41Å; N190-K194 VanDerWaalsContact O-N 3.16Å |
| 191 | E | 74.6 | Confident | 76.6 | Confident | 60 Ų | 60 | 61.5 Ų | 61.5 | 28% | 0.28 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -68.2 | -37.3 | 178.4 | -80.7 | -53.2 | 142.1 | 0 | 0 | 113.5 | V187 I188 F189 K194 L399 | V187-E191 PolarHBondContact O-N 3.38Å; I188-E191 PolarHBondContact O-N 3.23Å; F189-E191 VanDerWaalsContact C-N 3.29Å; F189-E191 PolarHBondContact O-N 2.79Å; E191-K194 WeakPolarHBondContact O-CD 3.36Å; E191-K194 WeakPolarHBondContact O-CE 3.42Å; E191-K194 PolarHBondContact O-NZ 3.03Å; E191-K194 IonicContact OE2-NZ 3.42Å; E191-K194 PolarHBondContact OE2-NZ 3.06Å; E191-L399 HydrophobicContact CG-CD2 3.91Å |
| 192 | I | 72.6 | Confident | 76 | Confident | 62 Ų | 62 | 57.2 Ų | 57.2 | 32% | 0.318 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -80.8 | -48.5 | -177.2 | -66 | 163.3 | 0 | 0 | 0 | 111.6 | M134 I188 F189 K194 | M134-I192 HydrophobicContact CE-CD1 4.2Å; M134-I192 HydrophobicContact CG-CD1 3.52Å; M134-I192 HydrophobicContact CG-CG1 4.47Å; M134-I192 HydrophobicContact SD-CD1 3.21Å; M134-I192 WeakPolarHBondContact SD-CD1 3.31Å; I188-I192 HydrophobicContact CG2-CD1 3.66Å; I188-I192 WeakPolarHBondContact O-CD1 3.35Å; I188-I192 VanDerWaalsContact O-CG1 3.31Å; I188-I192 WeakPolarHBondContact O-CG1 3.36Å; I188-I192 PolarHBondContact O-N 3.39Å; I188-I192 VanDerWaalsContact O-N 3.08Å; F189-I192 PolarHBondContact O-N 3.03Å; I192-K194 VanDerWaalsContact C-N 3.25Å; I192-K194 PolarHBondContact O-N 3.21Å |
| 193 | T | 68.6 | Low | 75.4 | Confident | 41 Ų | 41 | 52.3 Ų | 52.3 | 25% | 0.252 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -78.8 | -18 | -172.9 | -44.1 | 0 | 0 | 0 | 0 | 110.9 | F189 Q195 | F189-T193 HydrophobicContact CE1-CG2 4.05Å; F189-T193 VanDerWaalsContact CE1-OG1 3.29Å; F189-T193 WeakPolarHBondContact CE1-OG1 3.18Å; F189-T193 WeakPolarHBondContact CE2-OG1 3.39Å; F189-T193 HydrophobicContact CZ-CG2 3.91Å; F189-T193 WeakPolarHBondContact CZ-OG1 3.45Å; F189-T193 WeakPolarHBondContact O-CB 3.43Å; F189-T193 PolarHBondContact O-N 2.92Å; F189-T193 PolarHBondContact O-OG1 2.89Å; T193-Q195 HydrophobicContact CG2-CB 3.83Å; T193-Q195 HydrophobicContact CG2-CG 4.23Å; T193-Q195 PolarHBondContact O-N 3.45Å |
| 194 | K | 65.4 | Low | 75.1 | Confident | 128 Ų | 128 | 55.8 Ų | 55.8 | 56% | 0.557 | 28% | 0.284 | S | S | * | . | S | Bend | trans | 50.1 | 17.4 | -168.5 | -57.9 | -61.2 | -177.7 | -169.2 | 0 | 112.7 | N190 E191 I192 L283 | N190-K194 WeakPolarHBondContact O-CA 3.1Å; N190-K194 PolarHBondContact O-N 3.41Å; N190-K194 VanDerWaalsContact O-N 3.16Å; E191-K194 WeakPolarHBondContact O-CD 3.36Å; E191-K194 WeakPolarHBondContact O-CE 3.42Å; E191-K194 PolarHBondContact O-NZ 3.03Å; E191-K194 IonicContact OE2-NZ 3.42Å; E191-K194 PolarHBondContact OE2-NZ 3.06Å; I192-K194 VanDerWaalsContact C-N 3.25Å; I192-K194 PolarHBondContact O-N 3.21Å; K194-L283 WeakPolarHBondContact O-CD1 3.23Å |
| 195 | Q | 61.8 | Low | 74.9 | Confident | 139 Ų | 139 | 57.5 Ų | 57.5 | 65% | 0.65 | 30% | 0.298 | S | S | * | . | S | Bend | trans | -125.7 | 142.5 | 176.5 | -66.3 | -173.3 | -17.9 | 0 | 0 | 107.9 | T193 | T193-Q195 HydrophobicContact CG2-CB 3.83Å; T193-Q195 HydrophobicContact CG2-CG 4.23Å; T193-Q195 PolarHBondContact O-N 3.45Å |
| 196 | R | 65.3 | Low | 74.7 | Confident | 56 Ų | 56 | 55.2 Ų | 55.2 | 21% | 0.211 | 28% | 0.283 | C | S | . | . | trans | -90.1 | 118.5 | -177.5 | -68.7 | -138.6 | 168.8 | 114.7 | 11 | 111.7 | L198 S285 C286 | R196-L198 VanDerWaalsContact C-N 3.33Å; R196-L198 PolarHBondContact O-N 3.29Å; R196-S285 PolarHBondContact NH1-O 3.43Å; R196-C286 PolarHBondContact NH1-SG 2.69Å; R196-C286 PolarHBondContact NH2-SG 2.91Å | ||
| 197 | L | 58.5 | Low | 74.6 | Confident | 115 Ų | 115 | 53.8 Ų | 53.8 | 60% | 0.602 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | -31.1 | -179.3 | -154.4 | 108.7 | 0 | 0 | 0 | 113.3 | F189 | F189-L197 HydrophobicContact CD1-CB 3.76Å; F189-L197 HydrophobicContact CD1-CD1 3.62Å; F189-L197 HydrophobicContact CD1-CG 4.29Å; F189-L197 HydrophobicContact CD2-CD1 4.13Å; F189-L197 HydrophobicContact CE1-CB 3.77Å; F189-L197 HydrophobicContact CE1-CD1 3.12Å; F189-L197 HydrophobicContact CE1-CG 4.05Å; F189-L197 HydrophobicContact CE2-CD1 3.67Å; F189-L197 HydrophobicContact CG-CD1 4.11Å; F189-L197 HydrophobicContact CZ-CD1 3.15Å; F189-L197 HydrophobicContact CZ-CG 4.46Å |
| 198 | L | 64.6 | Low | 74.8 | Confident | 83 Ų | 83 | 55.2 Ų | 55.2 | 44% | 0.435 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -120.2 | 13.5 | -179.2 | -78.8 | 93.5 | 0 | 0 | 0 | 114 | R196 D200 V201 | R196-L198 VanDerWaalsContact C-N 3.33Å; R196-L198 PolarHBondContact O-N 3.29Å; L198-D200 PolarHBondContact O-N 2.94Å; L198-V201 PolarHBondContact O-N 2.64Å |
| 199 | G | 73.1 | Confident | 75.2 | Confident | 19 Ų | 19 | 56.2 Ų | 56.2 | 20% | 0.196 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | 55.6 | -119.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | S202 | G199-S202 PolarHBondContact O-OG 3.32Å |
| 200 | D | 72.8 | Confident | 75.5 | Confident | 55 Ų | 55 | 54.9 Ų | 54.9 | 29% | 0.294 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -75.6 | -28.1 | -177.1 | -178.9 | 71.5 | 0 | 0 | 0 | 113 | L198 C203 R204 L272 | L198-D200 PolarHBondContact O-N 2.94Å; D200-C203 WeakPolarHBondContact O-CB 3.22Å; D200-C203 PolarHBondContact O-N 3.48Å; D200-R204 VanDerWaalsContact CG-NH2 3.31Å; D200-R204 PolarHBondContact O-N 3.39Å; D200-R204 IonicContact OD1-CZ 3.11Å; D200-R204 IonicContact OD1-NE 3.02Å; D200-R204 PolarHBondContact OD1-NE 2.82Å; D200-R204 IonicContact OD1-NH2 2.9Å; D200-R204 PolarHBondContact OD1-NH2 2.91Å; D200-R204 IonicContact OD2-CZ 2.81Å; D200-R204 IonicContact OD2-NE 3.49Å; D200-R204 PolarHBondContact OD2-NE 3.32Å; D200-R204 IonicContact OD2-NH2 2.74Å; D200-R204 PolarHBondContact OD2-NH2 2.9Å; D200-L272 HydrophobicContact CB-CB 4.03Å; D200-L272 HydrophobicContact CB-CD2 4.22Å; D200-L272 PolarHBondContact OD1-N 3.3Å |
| 201 | V | 77.1 | Confident | 76 | Confident | 95 Ų | 95 | 53.8 Ų | 53.8 | 58% | 0.576 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -67.8 | -47.8 | -176.6 | 178.3 | 0 | 0 | 0 | 0 | 111.1 | L198 C203 R204 A205 | L198-V201 PolarHBondContact O-N 2.64Å; V201-C203 VanDerWaalsContact C-N 3.27Å; V201-C203 PolarHBondContact O-N 2.93Å; V201-R204 PolarHBondContact O-N 3.49Å; V201-A205 WeakPolarHBondContact O-CB 3.27Å; V201-A205 PolarHBondContact O-N 3.48Å |
| 202 | S | 78.5 | Confident | 76.8 | Confident | 5 Ų | 5 | 50.9 Ų | 50.9 | 4% | 0.035 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.5 | -33 | 176.9 | 50.4 | 0 | 0 | 0 | 0 | 112.3 | G199 R204 V206 | G199-S202 PolarHBondContact O-OG 3.32Å; S202-R204 VanDerWaalsContact C-N 3.25Å; S202-R204 PolarHBondContact O-N 3.39Å; S202-V206 WeakPolarHBondContact O-CB 3.46Å; S202-V206 VanDerWaalsContact O-CG2 3.31Å; S202-V206 WeakPolarHBondContact O-CG2 3.5Å; S202-V206 PolarHBondContact O-N 3.44Å; S202-V206 VanDerWaalsContact O-N 3.15Å |
| 203 | C | 77.8 | Confident | 77.7 | Confident | 3 Ų | 3 | 48.2 Ų | 48.2 | 2% | 0.02 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.9 | -35.5 | 179 | -170.4 | 0 | 0 | 0 | 0 | 112.8 | D200 V201 P207 C286 | D200-C203 WeakPolarHBondContact O-CB 3.22Å; D200-C203 PolarHBondContact O-N 3.48Å; V201-C203 VanDerWaalsContact C-N 3.27Å; V201-C203 PolarHBondContact O-N 2.93Å; C203-P207 VanDerWaalsContact O-CD 3.23Å; C203-P207 WeakPolarHBondContact O-CD 3.44Å; C203-P207 VanDerWaalsContact O-CG 3.23Å; C203-P207 WeakPolarHBondContact O-CG 3.38Å; C203-C286 WeakPolarHBondContact CA-SG 3.12Å; C203-C286 WeakPolarHBondContact CB-SG 3.5Å; C203-C286 VanDerWaalsContact SG-CA 3.56Å; C203-C286 WeakPolarHBondContact SG-CB 3.26Å; C203-C286 CovalentContact SG-SG 2.01Å; C203-C286 PolarHBondContact SG-SG 3.5Å |
| 204 | R | 82.1 | Confident | 78.6 | Confident | 77 Ų | 77 | 46.6 Ų | 46.6 | 29% | 0.291 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -92.5 | -39.4 | 179.1 | -59.5 | -178.4 | -164.7 | -164.7 | 9.6 | 112.4 | D200 V201 S202 P207 F208 L267 W270 | D200-R204 VanDerWaalsContact CG-NH2 3.31Å; D200-R204 PolarHBondContact O-N 3.39Å; D200-R204 IonicContact OD1-CZ 3.11Å; D200-R204 IonicContact OD1-NE 3.02Å; D200-R204 PolarHBondContact OD1-NE 2.82Å; D200-R204 IonicContact OD1-NH2 2.9Å; D200-R204 PolarHBondContact OD1-NH2 2.91Å; D200-R204 IonicContact OD2-CZ 2.81Å; D200-R204 IonicContact OD2-NE 3.49Å; D200-R204 PolarHBondContact OD2-NE 3.32Å; D200-R204 IonicContact OD2-NH2 2.74Å; D200-R204 PolarHBondContact OD2-NH2 2.9Å; V201-R204 PolarHBondContact O-N 3.49Å; S202-R204 VanDerWaalsContact C-N 3.25Å; S202-R204 PolarHBondContact O-N 3.39Å; R204-P207 WeakPolarHBondContact O-CG 3.33Å; R204-F208 VanDerWaalsContact O-CB 3.26Å; R204-F208 WeakPolarHBondContact O-CB 3.5Å; R204-F208 PolarHBondContact O-N 3.38Å; R204-L267 HydrophobicContact CB-CD2 4.03Å; R204-W270 HydrophobicContact CG-CB 4.43Å; R204-W270 WeakPolarHBondContact CG-O 3.37Å |
| 205 | A | 84.1 | Confident | 79.8 | Confident | 38 Ų | 38 | 40.5 Ų | 40.5 | 31% | 0.314 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -69.8 | -40.6 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | V201 F208 M209 | V201-A205 WeakPolarHBondContact O-CB 3.27Å; V201-A205 PolarHBondContact O-N 3.48Å; A205-F208 PolarHBondContact O-N 3.48Å; A205-M209 WeakPolarHBondContact O-CB 3.26Å; A205-M209 WeakPolarHBondContact O-CG 3.26Å; A205-M209 PolarHBondContact O-N 3.03Å |
| 206 | V | 84.6 | Confident | 81.2 | Confident | 12 Ų | 12 | 33.9 Ų | 33.9 | 7% | 0.073 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -59.6 | -58.2 | -179.5 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | C183 I186 V187 S202 F208 M209 E210 | C183-V206 HydrophobicContact CB-CG1 4.34Å; C183-V206 HydrophobicContact CB-CG2 4.49Å; I186-V206 HydrophobicContact CG2-CG2 4.05Å; V187-V206 HydrophobicContact CG2-CG1 3.74Å; V187-V206 HydrophobicContact CG2-CG2 4.41Å; S202-V206 WeakPolarHBondContact O-CB 3.46Å; S202-V206 VanDerWaalsContact O-CG2 3.31Å; S202-V206 WeakPolarHBondContact O-CG2 3.5Å; S202-V206 PolarHBondContact O-N 3.44Å; S202-V206 VanDerWaalsContact O-N 3.15Å; V206-F208 VanDerWaalsContact C-N 3.27Å; V206-F208 PolarHBondContact O-N 3.38Å; V206-M209 PolarHBondContact O-N 3.02Å; V206-M209 VanDerWaalsContact O-N 3.16Å; V206-E210 WeakPolarHBondContact CG1-OE1 3.26Å; V206-E210 WeakPolarHBondContact O-CG 3.28Å; V206-E210 PolarHBondContact O-N 2.89Å |
| 207 | P | 82.6 | Confident | 82.3 | Confident | 14 Ų | 14 | 31.7 Ų | 31.7 | 9% | 0.091 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.7 | -34.1 | 179.4 | 23.3 | -32.5 | 0 | 0 | 0 | 111.9 | C203 R204 E210 V211 W270 | C203-P207 VanDerWaalsContact O-CD 3.23Å; C203-P207 WeakPolarHBondContact O-CD 3.44Å; C203-P207 VanDerWaalsContact O-CG 3.23Å; C203-P207 WeakPolarHBondContact O-CG 3.38Å; R204-P207 WeakPolarHBondContact O-CG 3.33Å; P207-E210 PolarHBondContact O-N 3.4Å; P207-V211 WeakPolarHBondContact O-CB 3.43Å; P207-V211 WeakPolarHBondContact O-CG2 3.47Å; P207-V211 PolarHBondContact O-N 2.92Å; P207-V211 VanDerWaalsContact O-N 3.07Å; P207-W270 HydrophobicContact CB-CD2 4.41Å; P207-W270 HydrophobicContact CB-CG 4.34Å; P207-W270 HydrophobicContact CB-CZ2 4.38Å; P207-W270 HydrophobicContact CG-CB 4.33Å; P207-W270 VanDerWaalsContact CG-CD1 3.43Å; P207-W270 HydrophobicContact CG-CD2 3.94Å; P207-W270 HydrophobicContact CG-CG 3.66Å |
| 208 | F | 87.5 | Confident | 83.8 | Confident | 37 Ų | 37 | 26.4 Ų | 26.4 | 16% | 0.162 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.5 | -46.8 | 173.7 | 171.7 | -102.2 | 0 | 0 | 0 | 112.5 | R204 A205 V206 S212 M260 A263 L267 | R204-F208 VanDerWaalsContact O-CB 3.26Å; R204-F208 WeakPolarHBondContact O-CB 3.5Å; R204-F208 PolarHBondContact O-N 3.38Å; A205-F208 PolarHBondContact O-N 3.48Å; V206-F208 VanDerWaalsContact C-N 3.27Å; V206-F208 PolarHBondContact O-N 3.38Å; F208-S212 WeakPolarHBondContact O-CB 3.37Å; F208-S212 PolarHBondContact O-N 3.12Å; F208-S212 PolarHBondContact O-OG 3.05Å; F208-M260 HydrophobicContact CE1-SD 4.09Å; F208-M260 HydrophobicContact CZ-CB 4.35Å; F208-M260 HydrophobicContact CZ-CG 4.41Å; F208-M260 HydrophobicContact CZ-SD 3.72Å; F208-A263 HydrophobicContact CD2-CB 3.82Å; F208-A263 HydrophobicContact CE2-CB 3.8Å; F208-L267 HydrophobicContact CB-CD2 3.5Å; F208-L267 HydrophobicContact CB-CG 3.85Å; F208-L267 HydrophobicContact CD1-CD2 4.31Å; F208-L267 HydrophobicContact CD2-CD1 3.6Å; F208-L267 HydrophobicContact CD2-CD2 4.03Å; F208-L267 HydrophobicContact CD2-CG 3.51Å; F208-L267 HydrophobicContact CE2-CD1 3.78Å; F208-L267 HydrophobicContact CE2-CG 4.22Å; F208-L267 HydrophobicContact CG-CD1 4.02Å; F208-L267 HydrophobicContact CG-CD2 3.68Å; F208-L267 HydrophobicContact CG-CG 3.73Å; F208-L267 HydrophobicContact CZ-CD1 4.35Å |
| 209 | M | 89.5 | Confident | 85 | Confident | 37 Ų | 37 | 25.7 Ų | 25.7 | 18% | 0.182 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -67.6 | -39 | -179.5 | -72.5 | -66.3 | -70.5 | 0 | 0 | 112.1 | W175 L178 V179 C183 A205 V206 S213 | W175-M209 HydrophobicContact CE3-CE 4.48Å; W175-M209 HydrophobicContact CZ3-CE 3.91Å; W175-M209 HydrophobicContact CZ3-SD 4.14Å; L178-M209 HydrophobicContact CB-CE 4.06Å; V179-M209 HydrophobicContact CG2-CB 4.47Å; C183-M209 VanDerWaalsContact SG-CB 3.57Å; A205-M209 WeakPolarHBondContact O-CB 3.26Å; A205-M209 WeakPolarHBondContact O-CG 3.26Å; A205-M209 PolarHBondContact O-N 3.03Å; V206-M209 PolarHBondContact O-N 3.02Å; V206-M209 VanDerWaalsContact O-N 3.16Å; M209-S213 WeakPolarHBondContact O-CB 3.08Å; M209-S213 PolarHBondContact O-N 3.11Å |
| 210 | E | 88.1 | Confident | 85.7 | Confident | 47 Ų | 47 | 24.8 Ų | 24.8 | 22% | 0.22 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61 | -48.1 | 175.9 | -72.9 | 172.8 | 177.8 | 0 | 0 | 111.3 | V179 V206 P207 S213 L214 | V179-E210 HydrophobicContact CG1-CG 4.47Å; V206-E210 WeakPolarHBondContact CG1-OE1 3.26Å; V206-E210 WeakPolarHBondContact O-CG 3.28Å; V206-E210 PolarHBondContact O-N 2.89Å; P207-E210 PolarHBondContact O-N 3.4Å; E210-S213 PolarHBondContact O-N 3.29Å; E210-L214 PolarHBondContact O-N 3.28Å |
| 211 | V | 88 | Confident | 86.4 | Confident | 6 Ų | 6 | 22.5 Ų | 22.5 | 4% | 0.036 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -71.7 | -36.3 | -178.8 | 178.8 | 0 | 0 | 0 | 0 | 111.9 | P207 L214 G215 A263 E266 Y313 Y317 | P207-V211 WeakPolarHBondContact O-CB 3.43Å; P207-V211 WeakPolarHBondContact O-CG2 3.47Å; P207-V211 PolarHBondContact O-N 2.92Å; P207-V211 VanDerWaalsContact O-N 3.07Å; V211-L214 PolarHBondContact O-N 3.07Å; V211-G215 PolarHBondContact O-N 2.81Å; V211-A263 HydrophobicContact CB-CB 4.19Å; V211-A263 HydrophobicContact CG1-CB 3.91Å; V211-E266 HydrophobicContact CB-CG 4.28Å; V211-E266 HydrophobicContact CG1-CG 4.25Å; V211-E266 HydrophobicContact CG2-CG 4Å; V211-Y313 HydrophobicContact CG2-CE1 4.14Å; V211-Y313 WeakPolarHBondContact CG2-OH 3.09Å; V211-Y317 HydrophobicContact CG1-CE2 4.3Å |
| 212 | S | 90.8 | Very high | 86.8 | Confident | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.7 | -46.6 | 171.8 | -71.1 | 0 | 0 | 0 | 0 | 111.5 | F208 G215 V216 M260 A263 | F208-S212 WeakPolarHBondContact O-CB 3.37Å; F208-S212 PolarHBondContact O-N 3.12Å; F208-S212 PolarHBondContact O-OG 3.05Å; S212-G215 PolarHBondContact O-N 3.03Å; S212-V216 WeakPolarHBondContact O-CG2 2.84Å; S212-V216 PolarHBondContact O-N 3.31Å; S212-M260 VanDerWaalsContact CB-CE 3.48Å; S212-M260 VanDerWaalsContact CB-SD 3.59Å; S212-M260 PolarHBondContact OG-SD 3.42Å; S212-A263 VanDerWaalsContact OG-CB 3.24Å; S212-A263 WeakPolarHBondContact OG-CB 3.24Å |
| 213 | S | 90.7 | Very high | 87.2 | Confident | 5 Ų | 5 | 19.9 Ų | 19.9 | 4% | 0.035 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.7 | -47 | 174.7 | 176.1 | 0 | 0 | 0 | 0 | 111.3 | D176 M209 E210 G215 V216 T217 | D176-S213 PolarHBondContact OD1-OG 2.91Å; M209-S213 WeakPolarHBondContact O-CB 3.08Å; M209-S213 PolarHBondContact O-N 3.11Å; E210-S213 PolarHBondContact O-N 3.29Å; S213-G215 VanDerWaalsContact C-N 3.29Å; S213-G215 PolarHBondContact O-N 3.18Å; S213-V216 PolarHBondContact O-N 2.89Å; S213-V216 VanDerWaalsContact O-N 3.1Å; S213-T217 WeakPolarHBondContact O-CG2 3.44Å; S213-T217 PolarHBondContact O-N 2.74Å |
| 214 | L | 88.1 | Confident | 87.4 | Confident | 8 Ų | 8 | 19.8 Ų | 19.8 | 4% | 0.042 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -55.6 | -44 | 174.6 | -177 | 64.3 | 0 | 0 | 0 | 112 | E210 V211 T217 T218 Y313 Y317 T372 | E210-L214 PolarHBondContact O-N 3.28Å; V211-L214 PolarHBondContact O-N 3.07Å; L214-T217 PolarHBondContact O-N 2.96Å; L214-T217 PolarHBondContact O-OG1 3.35Å; L214-T218 PolarHBondContact O-N 3.49Å; L214-T218 PolarHBondContact O-OG1 3.33Å; L214-T218 VanDerWaalsContact O-OG1 3.11Å; L214-Y313 HydrophobicContact CD2-CD1 3.76Å; L214-Y313 HydrophobicContact CD2-CE1 3.86Å; L214-Y317 HydrophobicContact CD2-CD2 3.8Å; L214-Y317 HydrophobicContact CD2-CG 3.83Å; L214-Y317 HydrophobicContact CG-CD1 4.3Å; L214-Y317 HydrophobicContact CG-CD2 4.42Å; L214-Y317 HydrophobicContact CG-CG 4.03Å; L214-T372 HydrophobicContact CD1-CG2 4.11Å |
| 215 | G | 89.8 | Confident | 87.3 | Confident | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.8 | -45 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | V211 S212 S213 T217 T218 F219 S259 | V211-G215 PolarHBondContact O-N 2.81Å; S212-G215 PolarHBondContact O-N 3.03Å; S213-G215 VanDerWaalsContact C-N 3.29Å; S213-G215 PolarHBondContact O-N 3.18Å; G215-T217 VanDerWaalsContact C-N 3.32Å; G215-T217 PolarHBondContact O-N 2.85Å; G215-T218 PolarHBondContact O-N 3Å; G215-F219 WeakPolarHBondContact O-CB 3.35Å; G215-F219 WeakPolarHBondContact O-CD2 3.49Å; G215-F219 PolarHBondContact O-N 2.69Å; G215-S259 VanDerWaalsContact C-CB 3.5Å |
| 216 | V | 91.6 | Very high | 87.3 | Confident | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -59.9 | -43.8 | 175.9 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | L172 W175 S212 S213 T218 S220 I255 S259 M260 | L172-V216 HydrophobicContact CD2-CG1 4.15Å; W175-V216 HydrophobicContact CB-CG1 4.42Å; W175-V216 HydrophobicContact CD2-CG2 3.94Å; W175-V216 HydrophobicContact CG-CB 4.18Å; W175-V216 HydrophobicContact CG-CG1 4.06Å; W175-V216 HydrophobicContact CG-CG2 3.89Å; S212-V216 WeakPolarHBondContact O-CG2 2.84Å; S212-V216 PolarHBondContact O-N 3.31Å; S213-V216 PolarHBondContact O-N 2.89Å; S213-V216 VanDerWaalsContact O-N 3.1Å; V216-T218 PolarHBondContact O-N 3.24Å; V216-S220 WeakPolarHBondContact O-CB 3.15Å; V216-S220 PolarHBondContact O-N 2.88Å; V216-S220 PolarHBondContact O-OG 3.43Å; V216-I255 HydrophobicContact CB-CG2 4.49Å; V216-I255 HydrophobicContact CG1-CG2 4.02Å; V216-S259 WeakPolarHBondContact CG2-OG 3.39Å; V216-M260 HydrophobicContact CG2-CE 4.25Å |
| 217 | T | 89.3 | Confident | 87 | Confident | 9 Ų | 9 | 18.6 Ų | 18.6 | 6% | 0.055 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -60 | -46.8 | 176.5 | 66.2 | 0 | 0 | 0 | 0 | 112.2 | L172 S213 L214 G215 S220 L221 Y368 | L172-T217 VanDerWaalsContact CD2-CA 3.44Å; L172-T217 HydrophobicContact CD2-CG2 3.75Å; S213-T217 WeakPolarHBondContact O-CG2 3.44Å; S213-T217 PolarHBondContact O-N 2.74Å; L214-T217 PolarHBondContact O-N 2.96Å; L214-T217 PolarHBondContact O-OG1 3.35Å; G215-T217 VanDerWaalsContact C-N 3.32Å; G215-T217 PolarHBondContact O-N 2.85Å; T217-S220 PolarHBondContact O-N 3.5Å; T217-L221 VanDerWaalsContact O-CG 3.29Å; T217-L221 WeakPolarHBondContact O-CG 3.45Å; T217-L221 PolarHBondContact O-N 3.48Å; T217-Y368 WeakPolarHBondContact OG1-CE2 3.46Å |
| 218 | T | 88.4 | Confident | 86.6 | Confident | 5 Ų | 5 | 18.6 Ų | 18.6 | 3% | 0.031 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -61.1 | -52.3 | 178.9 | -68.1 | 0 | 0 | 0 | 0 | 112.4 | L214 G215 V216 S220 L221 C222 Y317 P321 Y368 | L214-T218 PolarHBondContact O-N 3.49Å; L214-T218 PolarHBondContact O-OG1 3.33Å; L214-T218 VanDerWaalsContact O-OG1 3.11Å; G215-T218 PolarHBondContact O-N 3Å; V216-T218 PolarHBondContact O-N 3.24Å; T218-S220 VanDerWaalsContact C-N 3.32Å; T218-S220 PolarHBondContact O-N 3.22Å; T218-L221 PolarHBondContact O-N 3.32Å; T218-C222 PolarHBondContact O-N 3.35Å; T218-C222 PolarHBondContact O-SG 3.49Å; T218-Y317 HydrophobicContact CG2-CD1 4.23Å; T218-Y317 PolarHBondContact OG1-O 3.24Å; T218-P321 HydrophobicContact CG2-CB 4Å; T218-P321 HydrophobicContact CG2-CG 3.72Å; T218-Y368 PolarHBondContact OG1-OH 2.88Å; T218-Y368 VanDerWaalsContact OG1-OH 3.04Å |
| 219 | F | 90.4 | Very high | 86 | Confident | 67 Ų | 67 | 19.9 Ų | 19.9 | 29% | 0.294 | 10% | 0.103 | S | C | . | . | H | α-helix | trans | -67 | -35.6 | -178.7 | -76.2 | -57 | 0 | 0 | 0 | 112.1 | G215 C222 A223 I255 L262 | G215-F219 WeakPolarHBondContact O-CB 3.35Å; G215-F219 WeakPolarHBondContact O-CD2 3.49Å; G215-F219 PolarHBondContact O-N 2.69Å; F219-C222 PolarHBondContact O-N 3.07Å; F219-A223 WeakPolarHBondContact O-CB 3.47Å; F219-A223 PolarHBondContact O-N 3.15Å; F219-I255 HydrophobicContact CB-CB 4.4Å; F219-I255 HydrophobicContact CB-CG1 4.24Å; F219-I255 HydrophobicContact CB-CG2 3.91Å; F219-L262 HydrophobicContact CE2-CD1 3.85Å; F219-L262 HydrophobicContact CZ-CD1 3.58Å |
| 220 | S | 89.2 | Confident | 85.2 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.7 | -47.5 | 173.1 | -64.5 | 0 | 0 | 0 | 0 | 111.3 | I168 V216 T217 T218 C222 A223 L224 | I168-S220 VanDerWaalsContact CG2-CB 3.49Å; V216-S220 WeakPolarHBondContact O-CB 3.15Å; V216-S220 PolarHBondContact O-N 2.88Å; V216-S220 PolarHBondContact O-OG 3.43Å; T217-S220 PolarHBondContact O-N 3.5Å; T218-S220 VanDerWaalsContact C-N 3.32Å; T218-S220 PolarHBondContact O-N 3.22Å; S220-C222 VanDerWaalsContact C-N 3.29Å; S220-C222 PolarHBondContact O-N 3.14Å; S220-A223 PolarHBondContact O-N 2.91Å; S220-A223 VanDerWaalsContact O-N 3.17Å; S220-L224 WeakPolarHBondContact O-CB 3.49Å; S220-L224 WeakPolarHBondContact O-CG 3.49Å; S220-L224 PolarHBondContact O-N 3.36Å |
| 221 | L | 85.4 | Confident | 84.3 | Confident | 8 Ų | 8 | 22.3 Ų | 22.3 | 4% | 0.042 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59.2 | -40.7 | 176.4 | -71 | 171.4 | 0 | 0 | 0 | 112.5 | T217 T218 L224 G225 T325 L364 Y368 | T217-L221 VanDerWaalsContact O-CG 3.29Å; T217-L221 WeakPolarHBondContact O-CG 3.45Å; T217-L221 PolarHBondContact O-N 3.48Å; T218-L221 PolarHBondContact O-N 3.32Å; L221-L224 PolarHBondContact O-N 3.48Å; L221-G225 PolarHBondContact O-N 3.13Å; L221-T325 HydrophobicContact CB-CG2 4.34Å; L221-T325 WeakPolarHBondContact O-CG2 3.14Å; L221-L364 HydrophobicContact CD2-CD1 4.46Å; L221-L364 HydrophobicContact CD2-CD2 3.76Å; L221-L364 HydrophobicContact CD2-CG 3.63Å; L221-Y368 HydrophobicContact CD1-CD1 3.47Å; L221-Y368 VanDerWaalsContact CD1-CD1 3.47Å; L221-Y368 HydrophobicContact CD1-CD2 3.54Å; L221-Y368 HydrophobicContact CD1-CE1 3.92Å; L221-Y368 HydrophobicContact CD1-CE2 3.99Å; L221-Y368 HydrophobicContact CD1-CG 3.25Å |
| 222 | C | 87.4 | Confident | 83.3 | Confident | 16 Ų | 16 | 22.5 Ų | 22.5 | 11% | 0.108 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -63 | -47.1 | 175.1 | -64.1 | 0 | 0 | 0 | 0 | 111.4 | T218 F219 S220 L224 G225 I226 F324 | T218-C222 PolarHBondContact O-N 3.35Å; T218-C222 PolarHBondContact O-SG 3.49Å; F219-C222 PolarHBondContact O-N 3.07Å; S220-C222 VanDerWaalsContact C-N 3.29Å; S220-C222 PolarHBondContact O-N 3.14Å; C222-L224 VanDerWaalsContact C-N 3.33Å; C222-L224 PolarHBondContact O-N 2.91Å; C222-G225 PolarHBondContact O-N 2.98Å; C222-G225 VanDerWaalsContact O-N 3.15Å; C222-I226 WeakPolarHBondContact O-CG1 3.08Å; C222-I226 PolarHBondContact O-N 3.29Å; C222-F324 HydrophobicContact CB-CD1 4.18Å; C222-F324 HydrophobicContact CB-CE1 4.39Å; C222-F324 WeakPolarHBondContact O-CE1 3.34Å |
| 223 | A | 86.3 | Confident | 82.2 | Confident | 28 Ų | 28 | 25 Ų | 25 | 23% | 0.231 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.3 | -41.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I168 F219 S220 I226 D227 I255 | I168-A223 HydrophobicContact CD1-CB 4.18Å; F219-A223 WeakPolarHBondContact O-CB 3.47Å; F219-A223 PolarHBondContact O-N 3.15Å; S220-A223 PolarHBondContact O-N 2.91Å; S220-A223 VanDerWaalsContact O-N 3.17Å; A223-I226 PolarHBondContact O-N 3.06Å; A223-D227 PolarHBondContact O-N 3Å; A223-I255 HydrophobicContact CB-CD1 4.1Å |
| 224 | L | 81.9 | Confident | 81 | Confident | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.5 | -41.8 | 174.2 | -68.5 | 173 | 0 | 0 | 0 | 111.1 | W165 I168 L169 S220 L221 C222 D227 R228 L364 | W165-L224 HydrophobicContact CD2-CD2 3.53Å; W165-L224 HydrophobicContact CE3-CB 4.2Å; W165-L224 HydrophobicContact CE3-CD2 3.13Å; W165-L224 HydrophobicContact CE3-CG 4.16Å; W165-L224 HydrophobicContact CG-CD2 4.26Å; W165-L224 HydrophobicContact CH2-CB 3.75Å; W165-L224 HydrophobicContact CH2-CD1 4.01Å; W165-L224 HydrophobicContact CH2-CD2 3.68Å; W165-L224 HydrophobicContact CH2-CG 3.98Å; W165-L224 HydrophobicContact CZ2-CD1 4.38Å; W165-L224 HydrophobicContact CZ2-CD2 4.07Å; W165-L224 HydrophobicContact CZ3-CB 3.43Å; W165-L224 VanDerWaalsContact CZ3-CB 3.43Å; W165-L224 HydrophobicContact CZ3-CD1 4.32Å; W165-L224 HydrophobicContact CZ3-CD2 3.24Å; W165-L224 HydrophobicContact CZ3-CG 3.77Å; I168-L224 HydrophobicContact CB-CD2 4.05Å; I168-L224 HydrophobicContact CD1-CD2 3.97Å; I168-L224 HydrophobicContact CD1-CG 4.5Å; I168-L224 HydrophobicContact CG2-CD1 4.14Å; I168-L224 HydrophobicContact CG2-CD2 3.91Å; I168-L224 HydrophobicContact CG2-CG 3.95Å; L169-L224 HydrophobicContact CD2-CD1 4.43Å; S220-L224 WeakPolarHBondContact O-CB 3.49Å; S220-L224 WeakPolarHBondContact O-CG 3.49Å; S220-L224 PolarHBondContact O-N 3.36Å; L221-L224 PolarHBondContact O-N 3.48Å; C222-L224 VanDerWaalsContact C-N 3.33Å; C222-L224 PolarHBondContact O-N 2.91Å; L224-D227 PolarHBondContact O-N 3.32Å; L224-R228 WeakPolarHBondContact O-CG 3.47Å; L224-R228 PolarHBondContact O-N 3.46Å; L224-R228 VanDerWaalsContact O-N 3.12Å; L224-L364 HydrophobicContact CD1-CD2 3.66Å |
| 225 | G | 79.8 | Confident | 79.1 | Confident | 2 Ų | 2 | 34.9 Ų | 34.9 | 2% | 0.021 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L221 C222 R228 F229 | L221-G225 PolarHBondContact O-N 3.13Å; C222-G225 PolarHBondContact O-N 2.98Å; C222-G225 VanDerWaalsContact O-N 3.15Å; G225-R228 PolarHBondContact O-N 3.35Å; G225-F229 WeakPolarHBondContact O-CB 3.46Å; G225-F229 PolarHBondContact O-N 2.97Å |
| 226 | I | 83 | Confident | 77.1 | Confident | 73 Ų | 73 | 40.7 Ų | 40.7 | 37% | 0.374 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.7 | -48.2 | 176.9 | -66.2 | 164.9 | 0 | 0 | 0 | 110.8 | C222 A223 R228 F229 H230 F324 | C222-I226 WeakPolarHBondContact O-CG1 3.08Å; C222-I226 PolarHBondContact O-N 3.29Å; A223-I226 PolarHBondContact O-N 3.06Å; I226-R228 VanDerWaalsContact C-N 3.28Å; I226-R228 PolarHBondContact O-N 2.94Å; I226-F229 PolarHBondContact O-N 3.25Å; I226-F229 VanDerWaalsContact O-N 3.14Å; I226-H230 PolarHBondContact O-N 3.45Å; I226-F324 HydrophobicContact CD1-CE1 4.31Å; I226-F324 HydrophobicContact CD1-CZ 4.08Å; I226-F324 HydrophobicContact CG1-CE1 3.66Å; I226-F324 HydrophobicContact CG1-CZ 3.48Å; I226-F324 VanDerWaalsContact CG1-CZ 3.48Å |
| 227 | D | 78.4 | Confident | 74.9 | Confident | 28 Ų | 28 | 46.4 Ų | 46.4 | 15% | 0.15 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -55.8 | -45.4 | 179.4 | 177.4 | 74.1 | 0 | 0 | 0 | 110.8 | A223 L224 H230 V231 R240 | A223-D227 PolarHBondContact O-N 3Å; L224-D227 PolarHBondContact O-N 3.32Å; D227-H230 PolarHBondContact O-N 3.36Å; D227-V231 WeakPolarHBondContact O-CB 3.36Å; D227-V231 WeakPolarHBondContact O-CG2 3.44Å; D227-V231 PolarHBondContact O-N 3.31Å; D227-R240 IonicContact OD1-NH1 2.94Å; D227-R240 IonicContact OD2-NH1 3.04Å |
| 228 | R | 74.9 | Confident | 73 | Confident | 14 Ų | 14 | 53.9 Ų | 53.9 | 5% | 0.053 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -66.8 | -40.5 | 176.9 | -66 | -53.8 | 107 | 155.6 | 9.7 | 113.1 | W165 L224 G225 I226 V231 A232 V361 | W165-R228 VanDerWaalsContact CE3-CZ 3.42Å; W165-R228 HydrophobicContact CZ3-CG 4.02Å; L224-R228 WeakPolarHBondContact O-CG 3.47Å; L224-R228 PolarHBondContact O-N 3.46Å; L224-R228 VanDerWaalsContact O-N 3.12Å; G225-R228 PolarHBondContact O-N 3.35Å; I226-R228 VanDerWaalsContact C-N 3.28Å; I226-R228 PolarHBondContact O-N 2.94Å; R228-V231 PolarHBondContact O-N 3.23Å; R228-A232 WeakPolarHBondContact O-CB 3.4Å; R228-A232 PolarHBondContact O-N 3.38Å; R228-V361 HydrophobicContact CG-CB 4.46Å; R228-V361 HydrophobicContact CG-CG2 3.48Å; R228-V361 VanDerWaalsContact CG-CG2 3.48Å |
| 229 | F | 74.3 | Confident | 71 | Confident | 64 Ų | 64 | 60.1 Ų | 60.1 | 28% | 0.281 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 177.5 | 176.9 | -102.5 | 0 | 0 | 0 | 111.6 | G225 I226 A232 T233 C328 V331 | G225-F229 WeakPolarHBondContact O-CB 3.46Å; G225-F229 PolarHBondContact O-N 2.97Å; I226-F229 PolarHBondContact O-N 3.25Å; I226-F229 VanDerWaalsContact O-N 3.14Å; F229-A232 PolarHBondContact O-N 3.22Å; F229-T233 HydrophobicContact CD2-CG2 4.19Å; F229-T233 HydrophobicContact CE1-CG2 4.19Å; F229-T233 HydrophobicContact CE2-CG2 3.7Å; F229-T233 HydrophobicContact CZ-CG2 3.71Å; F229-T233 WeakPolarHBondContact O-CG2 3.34Å; F229-T233 PolarHBondContact O-N 3.35Å; F229-T233 PolarHBondContact O-OG1 2.98Å; F229-C328 HydrophobicContact CB-CB 4.23Å; F229-V331 HydrophobicContact CD2-CB 4.49Å; F229-V331 HydrophobicContact CD2-CG1 4.46Å; F229-V331 HydrophobicContact CE2-CB 4.04Å; F229-V331 HydrophobicContact CE2-CG1 3.63Å |
| 230 | H | 74.2 | Confident | 69.2 | Low | 109 Ų | 109 | 62.5 Ų | 62.5 | 51% | 0.505 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.7 | -43.4 | 175.2 | -75.1 | -176.7 | 0 | 0 | 0 | 111.8 | I226 D227 A232 T233 S234 | I226-H230 PolarHBondContact O-N 3.45Å; D227-H230 PolarHBondContact O-N 3.36Å; H230-A232 PolarHBondContact O-N 2.89Å; H230-T233 PolarHBondContact O-N 3.36Å; H230-T233 PolarHBondContact O-OG1 3.47Å; H230-S234 VanDerWaalsContact O-CB 3.25Å; H230-S234 WeakPolarHBondContact O-CB 3.39Å; H230-S234 PolarHBondContact O-N 3.05Å; H230-S234 PolarHBondContact O-OG 2.91Å |
| 231 | V | 68.5 | Low | 67.5 | Low | 26 Ų | 26 | 67.1 Ų | 67.1 | 16% | 0.158 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.7 | -31.5 | 176.4 | 170 | 0 | 0 | 0 | 0 | 111.6 | D227 R228 R240 R336 E354 | D227-V231 WeakPolarHBondContact O-CB 3.36Å; D227-V231 WeakPolarHBondContact O-CG2 3.44Å; D227-V231 PolarHBondContact O-N 3.31Å; R228-V231 PolarHBondContact O-N 3.23Å; V231-R240 VanDerWaalsContact CG2-CZ 3.48Å; V231-R336 PolarHBondContact O-NH2 3.24Å; V231-R336 VanDerWaalsContact O-NH2 3.11Å; V231-E354 WeakPolarHBondContact CG1-OE1 3.34Å |
| 232 | A | 66.1 | Low | 66.2 | Low | 9 Ų | 9 | 73.4 Ų | 73.4 | 7% | 0.074 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -76.9 | -33.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | R228 F229 H230 T332 R336 | R228-A232 WeakPolarHBondContact O-CB 3.4Å; R228-A232 PolarHBondContact O-N 3.38Å; F229-A232 PolarHBondContact O-N 3.22Å; H230-A232 PolarHBondContact O-N 2.89Å; A232-T332 HydrophobicContact CB-CG2 3.37Å; A232-T332 WeakPolarHBondContact CB-OG1 3.37Å; A232-R336 VanDerWaalsContact CA-CZ 3.5Å |
| 233 | T | 67.9 | Low | 65.1 | Low | 54 Ų | 54 | 75.9 Ų | 75.9 | 33% | 0.331 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -93.6 | -16.2 | -176.2 | 50.3 | 0 | 0 | 0 | 0 | 112.5 | F229 H230 T235 | F229-T233 HydrophobicContact CD2-CG2 4.19Å; F229-T233 HydrophobicContact CE1-CG2 4.19Å; F229-T233 HydrophobicContact CE2-CG2 3.7Å; F229-T233 HydrophobicContact CZ-CG2 3.71Å; F229-T233 WeakPolarHBondContact O-CG2 3.34Å; F229-T233 PolarHBondContact O-N 3.35Å; F229-T233 PolarHBondContact O-OG1 2.98Å; H230-T233 PolarHBondContact O-N 3.36Å; H230-T233 PolarHBondContact O-OG1 3.47Å; T233-T235 PolarHBondContact O-N 3.12Å; T233-T235 VanDerWaalsContact O-N 3.16Å |
| 234 | S | 65.7 | Low | 64.5 | Low | 78 Ų | 78 | 84.6 Ų | 84.6 | 55% | 0.545 | 44% | 0.44 | S | S | . | . | trans | -70.7 | 106.8 | 173.6 | -63.5 | 0 | 0 | 0 | 0 | 110.4 | H230 L236 | H230-S234 VanDerWaalsContact O-CB 3.25Å; H230-S234 WeakPolarHBondContact O-CB 3.39Å; H230-S234 PolarHBondContact O-N 3.05Å; H230-S234 PolarHBondContact O-OG 2.91Å; S234-L236 VanDerWaalsContact C-N 3.27Å; S234-L236 PolarHBondContact O-N 3.39Å | ||
| 235 | T | 48.8 | Very low | 64.1 | Low | 141 Ų | 141 | 87.6 Ų | 87.6 | 87% | 0.865 | 46% | 0.46 | S | S | * | . | trans | -81.2 | -1.8 | 177.8 | 50.7 | 0 | 0 | 0 | 0 | 114.1 | T233 | T233-T235 PolarHBondContact O-N 3.12Å; T233-T235 VanDerWaalsContact O-N 3.16Å | ||
| 236 | L | 48.8 | Very low | 64.2 | Low | 122 Ų | 122 | 94.6 Ų | 94.6 | 64% | 0.639 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -99.3 | 132.5 | 180 | -130.9 | 70.4 | 0 | 0 | 0 | 110 | S234 K238 | S234-L236 VanDerWaalsContact C-N 3.27Å; S234-L236 PolarHBondContact O-N 3.39Å; L236-K238 PolarHBondContact O-N 3.31Å |
| 237 | P | 45 | Very low | 64.2 | Low | 121 Ų | 121 | 93.7 Ų | 93.7 | 79% | 0.786 | 49% | 0.493 | S | S | * | . | trans | -71.3 | 71.1 | 172.4 | 30.4 | -32.3 | 0 | 0 | 0 | 108.9 | V239 | P237-V239 PolarHBondContact O-N 2.95Å; P237-V239 VanDerWaalsContact O-N 3.11Å | ||
| 238 | K | 48.3 | Very low | 64.4 | Low | 166 Ų | 166 | 93.4 Ų | 93.4 | 72% | 0.722 | 49% | 0.491 | S | S | * | . | trans | -74.8 | 101.9 | 166.8 | -104.1 | 176 | 177.7 | 171.8 | 0 | 105.8 | L236 R240 | L236-K238 PolarHBondContact O-N 3.31Å; K238-R240 VanDerWaalsContact C-N 3.3Å; K238-R240 PolarHBondContact O-N 3.25Å | ||
| 239 | V | 47.2 | Very low | 64.8 | Low | 135 Ų | 135 | 97.1 Ų | 97.1 | 82% | 0.818 | 51% | 0.511 | S | S | * | . | trans | -39.7 | 107.5 | 146.3 | 175.1 | 0 | 0 | 0 | 0 | 105 | P237 P241 | P237-V239 PolarHBondContact O-N 2.95Å; P237-V239 VanDerWaalsContact O-N 3.11Å; V239-P241 WeakPolarHBondContact O-CD 3.21Å | ||
| 240 | R | 52.1 | Low | 65.5 | Low | 117 Ų | 117 | 96.6 Ų | 96.6 | 44% | 0.442 | 52% | 0.519 | S | S | . | . | trans | -58.3 | 113.1 | -176.2 | -69.4 | -171.9 | -166 | -163.6 | 8.3 | 105.6 | D227 V231 K238 I242 | D227-R240 IonicContact OD1-NH1 2.94Å; D227-R240 IonicContact OD2-NH1 3.04Å; V231-R240 VanDerWaalsContact CG2-CZ 3.48Å; K238-R240 VanDerWaalsContact C-N 3.3Å; K238-R240 PolarHBondContact O-N 3.25Å; R240-I242 PolarHBondContact O-N 3.11Å | ||
| 241 | P | 53.2 | Low | 66.1 | Low | 97 Ų | 97 | 95 Ų | 95 | 63% | 0.63 | 51% | 0.51 | S | S | * | . | trans | -59.9 | 136.6 | 168.5 | 26.5 | -30.1 | 0 | 0 | 0 | 105.8 | V239 E243 | V239-P241 WeakPolarHBondContact O-CD 3.21Å; P241-E243 PolarHBondContact O-N 2.97Å | ||
| 242 | I | 57.5 | Low | 67.1 | Low | 140 Ų | 140 | 94.8 Ų | 94.8 | 72% | 0.718 | 51% | 0.508 | S | S | * | . | trans | -46.3 | 114.2 | 170.1 | -67.8 | 163.1 | 0 | 0 | 0 | 106.2 | R240 R244 | R240-I242 PolarHBondContact O-N 3.11Å; I242-R244 PolarHBondContact O-N 2.98Å | ||
| 243 | E | 66.1 | Low | 68.4 | Low | 68 Ų | 68 | 96.6 Ų | 96.6 | 32% | 0.318 | 52% | 0.523 | S | S | . | . | trans | -57.9 | 132.9 | 179.7 | -75.2 | -165.5 | 166 | 0 | 0 | 107.4 | A164 P241 C245 I248 K251 | A164-E243 WeakPolarHBondContact CB-OE2 3.48Å; P241-E243 PolarHBondContact O-N 2.97Å; E243-C245 PolarHBondContact O-N 3.03Å; E243-I248 HydrophobicContact CB-CD1 4.16Å; E243-I248 HydrophobicContact CB-CG1 4.01Å; E243-K251 IonicContact OE1-NZ 3.97Å; E243-K251 PolarHBondContact OE1-NZ 3.4Å; E243-K251 IonicContact OE2-NZ 3.77Å; E243-K251 PolarHBondContact OE2-NZ 3.22Å | ||
| 244 | R | 72.1 | Confident | 69.6 | Low | 211 Ų | 211 | 99.1 Ų | 99.1 | 80% | 0.796 | 54% | 0.538 | S | S | * | . | trans | -57.4 | 136.4 | 177.3 | -62.5 | -176.2 | -152.8 | 163.1 | 6.1 | 108 | I242 Q246 S247 I248 | I242-R244 PolarHBondContact O-N 2.98Å; R244-Q246 PolarHBondContact O-N 3.45Å; R244-S247 WeakPolarHBondContact O-CB 3.3Å; R244-S247 PolarHBondContact O-N 3.2Å; R244-I248 PolarHBondContact O-N 3.05Å | ||
| 245 | C | 74.3 | Confident | 70.8 | Confident | 64 Ų | 64 | 95.9 Ų | 95.9 | 43% | 0.432 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -48.5 | -39.7 | 179.3 | -176.2 | 0 | 0 | 0 | 0 | 112.2 | E243 S247 I248 L249 | E243-C245 PolarHBondContact O-N 3.03Å; C245-S247 VanDerWaalsContact C-N 3.3Å; C245-S247 PolarHBondContact O-N 3.45Å; C245-I248 PolarHBondContact O-N 3.35Å; C245-I248 VanDerWaalsContact O-N 3.11Å; C245-L249 WeakPolarHBondContact O-CG 3.28Å; C245-L249 PolarHBondContact O-N 3.11Å |
| 246 | Q | 81.3 | Confident | 73 | Confident | 149 Ų | 149 | 93.3 Ų | 93.3 | 70% | 0.696 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -55.9 | -38.5 | 175 | -65.1 | -64.4 | -20.5 | 0 | 0 | 113.8 | R244 A250 | R244-Q246 PolarHBondContact O-N 3.45Å; Q246-A250 VanDerWaalsContact O-CB 3.27Å; Q246-A250 WeakPolarHBondContact O-CB 3.18Å; Q246-A250 PolarHBondContact O-N 3.33Å |
| 247 | S | 82.7 | Confident | 75.2 | Confident | 55 Ų | 55 | 91.9 Ų | 91.9 | 39% | 0.385 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -72.3 | -34.7 | 178 | -173 | 0 | 0 | 0 | 0 | 112.2 | R244 C245 K251 | R244-S247 WeakPolarHBondContact O-CB 3.3Å; R244-S247 PolarHBondContact O-N 3.2Å; C245-S247 VanDerWaalsContact C-N 3.3Å; C245-S247 PolarHBondContact O-N 3.45Å; S247-K251 WeakPolarHBondContact O-CG 3.37Å; S247-K251 PolarHBondContact O-N 3.47Å; S247-K251 VanDerWaalsContact O-N 3.1Å |
| 248 | I | 82.6 | Confident | 77.4 | Confident | 21 Ų | 21 | 87.3 Ų | 87.3 | 11% | 0.108 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -70.1 | -47.6 | 177.4 | -60.3 | 175.5 | 0 | 0 | 0 | 109.1 | A164 E243 R244 C245 A250 K251 L252 | A164-I248 HydrophobicContact CB-CD1 4.49Å; A164-I248 HydrophobicContact CB-CG1 4.26Å; E243-I248 HydrophobicContact CB-CD1 4.16Å; E243-I248 HydrophobicContact CB-CG1 4.01Å; R244-I248 PolarHBondContact O-N 3.05Å; C245-I248 PolarHBondContact O-N 3.35Å; C245-I248 VanDerWaalsContact O-N 3.11Å; I248-A250 VanDerWaalsContact C-N 3.3Å; I248-A250 PolarHBondContact O-N 3.4Å; I248-K251 PolarHBondContact O-N 2.86Å; I248-K251 VanDerWaalsContact O-N 3.15Å; I248-L252 HydrophobicContact CG2-CD1 4.34Å; I248-L252 WeakPolarHBondContact O-CG 3.46Å; I248-L252 PolarHBondContact O-N 3.12Å |
| 249 | L | 85.3 | Confident | 79.5 | Confident | 93 Ų | 93 | 79.4 Ų | 79.4 | 49% | 0.487 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -57.6 | -42.6 | 174.7 | -75.7 | 163.2 | 0 | 0 | 0 | 111.6 | C245 K251 L252 A253 | C245-L249 WeakPolarHBondContact O-CG 3.28Å; C245-L249 PolarHBondContact O-N 3.11Å; L249-K251 PolarHBondContact O-N 3.43Å; L249-L252 PolarHBondContact O-N 2.89Å; L249-A253 VanDerWaalsContact O-CB 3.28Å; L249-A253 WeakPolarHBondContact O-CB 3.38Å; L249-A253 PolarHBondContact O-N 3.05Å |
| 250 | A | 87.8 | Confident | 81.6 | Confident | 53 Ų | 53 | 74.8 Ų | 74.8 | 44% | 0.438 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.5 | -43.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q246 I248 A253 V254 | Q246-A250 VanDerWaalsContact O-CB 3.27Å; Q246-A250 WeakPolarHBondContact O-CB 3.18Å; Q246-A250 PolarHBondContact O-N 3.33Å; I248-A250 VanDerWaalsContact C-N 3.3Å; I248-A250 PolarHBondContact O-N 3.4Å; A250-A253 PolarHBondContact O-N 3.32Å; A250-V254 WeakPolarHBondContact O-CG2 3.33Å; A250-V254 PolarHBondContact O-N 2.88Å |
| 251 | K | 87.3 | Confident | 83.4 | Confident | 75 Ų | 75 | 73.3 Ų | 73.3 | 33% | 0.326 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.5 | -46 | 175.6 | -71.8 | 170.9 | -177 | 175.5 | 0 | 111.4 | E243 S247 I248 L249 V254 I255 | E243-K251 IonicContact OE1-NZ 3.97Å; E243-K251 PolarHBondContact OE1-NZ 3.4Å; E243-K251 IonicContact OE2-NZ 3.77Å; E243-K251 PolarHBondContact OE2-NZ 3.22Å; S247-K251 WeakPolarHBondContact O-CG 3.37Å; S247-K251 PolarHBondContact O-N 3.47Å; S247-K251 VanDerWaalsContact O-N 3.1Å; I248-K251 PolarHBondContact O-N 2.86Å; I248-K251 VanDerWaalsContact O-N 3.15Å; L249-K251 PolarHBondContact O-N 3.43Å; K251-V254 PolarHBondContact O-N 2.96Å; K251-I255 VanDerWaalsContact O-CG1 3.31Å; K251-I255 WeakPolarHBondContact O-CG1 3.39Å; K251-I255 PolarHBondContact O-N 3.41Å |
| 252 | L | 90.1 | Very high | 84.9 | Confident | 22 Ų | 22 | 71.2 Ų | 71.2 | 12% | 0.115 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63 | -42.7 | 177.2 | -67.5 | 179.7 | 0 | 0 | 0 | 111.7 | I168 I248 L249 V254 I255 W256 | I168-L252 HydrophobicContact CG1-CD2 4.19Å; I248-L252 HydrophobicContact CG2-CD1 4.34Å; I248-L252 WeakPolarHBondContact O-CG 3.46Å; I248-L252 PolarHBondContact O-N 3.12Å; L249-L252 PolarHBondContact O-N 2.89Å; L252-V254 VanDerWaalsContact C-N 3.34Å; L252-V254 PolarHBondContact O-N 2.86Å; L252-I255 PolarHBondContact O-N 2.96Å; L252-W256 WeakPolarHBondContact O-CB 3.2Å; L252-W256 VanDerWaalsContact O-CD1 3.32Å; L252-W256 VanDerWaalsContact O-CG 3.22Å; L252-W256 PolarHBondContact O-N 3.12Å |
| 253 | A | 91.8 | Very high | 86.3 | Confident | 46 Ų | 46 | 64.5 Ų | 64.5 | 38% | 0.38 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.9 | -42.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L249 A250 I255 W256 V257 | L249-A253 VanDerWaalsContact O-CB 3.28Å; L249-A253 WeakPolarHBondContact O-CB 3.38Å; L249-A253 PolarHBondContact O-N 3.05Å; A250-A253 PolarHBondContact O-N 3.32Å; A253-I255 VanDerWaalsContact C-N 3.35Å; A253-I255 PolarHBondContact O-N 2.87Å; A253-W256 PolarHBondContact O-N 3.37Å; A253-V257 VanDerWaalsContact O-CB 3.26Å; A253-V257 WeakPolarHBondContact O-CB 3.4Å; A253-V257 VanDerWaalsContact O-CG2 3.26Å; A253-V257 WeakPolarHBondContact O-CG2 3.42Å; A253-V257 PolarHBondContact O-N 3.1Å |
| 254 | V | 92.8 | Very high | 87.2 | Confident | 108 Ų | 108 | 64.5 Ų | 64.5 | 66% | 0.655 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -62.4 | -43 | 175 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | A250 K251 L252 G258 | A250-V254 WeakPolarHBondContact O-CG2 3.33Å; A250-V254 PolarHBondContact O-N 2.88Å; K251-V254 PolarHBondContact O-N 2.96Å; L252-V254 VanDerWaalsContact C-N 3.34Å; L252-V254 PolarHBondContact O-N 2.86Å; V254-G258 WeakPolarHBondContact O-CA 3.33Å; V254-G258 PolarHBondContact O-N 2.78Å |
| 255 | I | 92.7 | Very high | 87.6 | Confident | 10 Ų | 10 | 56 Ų | 56 | 5% | 0.051 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -62 | -47.8 | 177.4 | -68.3 | 166.8 | 0 | 0 | 0 | 110.3 | I168 V216 F219 A223 K251 L252 A253 S259 | I168-I255 HydrophobicContact CG1-CD1 4.42Å; V216-I255 HydrophobicContact CB-CG2 4.49Å; V216-I255 HydrophobicContact CG1-CG2 4.02Å; F219-I255 HydrophobicContact CB-CB 4.4Å; F219-I255 HydrophobicContact CB-CG1 4.24Å; F219-I255 HydrophobicContact CB-CG2 3.91Å; A223-I255 HydrophobicContact CB-CD1 4.1Å; K251-I255 VanDerWaalsContact O-CG1 3.31Å; K251-I255 WeakPolarHBondContact O-CG1 3.39Å; K251-I255 PolarHBondContact O-N 3.41Å; L252-I255 PolarHBondContact O-N 2.96Å; A253-I255 VanDerWaalsContact C-N 3.35Å; A253-I255 PolarHBondContact O-N 2.87Å; I255-S259 WeakPolarHBondContact O-CB 3.18Å; I255-S259 PolarHBondContact O-N 2.74Å; I255-S259 PolarHBondContact O-OG 2.81Å |
| 256 | W | 94.3 | Very high | 87.8 | Confident | 86 Ų | 86 | 53 Ų | 53 | 33% | 0.326 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -71.8 | -49 | -175.9 | -64.6 | -1 | 0 | 0 | 0 | 112.4 | L174 W175 L252 A253 G258 S259 M260 | L174-W256 HydrophobicContact CD2-CH2 4.05Å; L174-W256 HydrophobicContact CD2-CZ2 4.06Å; W175-W256 AromaticContact CD1-NE1 3.81Å; W175-W256 AromaticContact NE1-CD1 3.44Å; W175-W256 AromaticContact NE1-CD2 3.9Å; W175-W256 AromaticContact NE1-CE2 3.62Å; W175-W256 AromaticContact NE1-CG 3.81Å; W175-W256 AromaticContact NE1-NE1 3.32Å; L252-W256 WeakPolarHBondContact O-CB 3.2Å; L252-W256 VanDerWaalsContact O-CD1 3.32Å; L252-W256 VanDerWaalsContact O-CG 3.22Å; L252-W256 PolarHBondContact O-N 3.12Å; A253-W256 PolarHBondContact O-N 3.37Å; W256-G258 VanDerWaalsContact C-N 3.31Å; W256-G258 PolarHBondContact O-N 3.28Å; W256-S259 PolarHBondContact O-N 3.06Å; W256-S259 PolarHBondContact O-OG 3.44Å; W256-M260 WeakPolarHBondContact O-CB 3.39Å; W256-M260 VanDerWaalsContact O-CG 3.26Å; W256-M260 WeakPolarHBondContact O-CG 3.46Å; W256-M260 PolarHBondContact O-N 3.33Å |
| 257 | V | 94.3 | Very high | 87.6 | Confident | 93 Ų | 93 | 48.5 Ų | 48.5 | 56% | 0.564 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -65.8 | -40.5 | 178.8 | 176.3 | 0 | 0 | 0 | 0 | 109.8 | A253 T261 | A253-V257 VanDerWaalsContact O-CB 3.26Å; A253-V257 WeakPolarHBondContact O-CB 3.4Å; A253-V257 VanDerWaalsContact O-CG2 3.26Å; A253-V257 WeakPolarHBondContact O-CG2 3.42Å; A253-V257 PolarHBondContact O-N 3.1Å; V257-T261 VanDerWaalsContact O-CB 3.26Å; V257-T261 WeakPolarHBondContact O-CB 3.48Å; V257-T261 PolarHBondContact O-N 3.24Å; V257-T261 PolarHBondContact O-OG1 3.43Å |
| 258 | G | 91.6 | Very high | 87 | Confident | 25 Ų | 25 | 48.7 Ų | 48.7 | 26% | 0.258 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.3 | -46.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V254 W256 T261 L262 | V254-G258 WeakPolarHBondContact O-CA 3.33Å; V254-G258 PolarHBondContact O-N 2.78Å; W256-G258 VanDerWaalsContact C-N 3.31Å; W256-G258 PolarHBondContact O-N 3.28Å; G258-T261 PolarHBondContact O-N 2.79Å; G258-L262 WeakPolarHBondContact O-CG 3.18Å; G258-L262 PolarHBondContact O-N 2.9Å |
| 259 | S | 92 | Very high | 86.5 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -66.5 | -45.8 | 177.5 | 59.6 | 0 | 0 | 0 | 0 | 112.7 | G215 V216 I255 W256 T261 L262 A263 | G215-S259 VanDerWaalsContact C-CB 3.5Å; V216-S259 WeakPolarHBondContact CG2-OG 3.39Å; I255-S259 WeakPolarHBondContact O-CB 3.18Å; I255-S259 PolarHBondContact O-N 2.74Å; I255-S259 PolarHBondContact O-OG 2.81Å; W256-S259 PolarHBondContact O-N 3.06Å; W256-S259 PolarHBondContact O-OG 3.44Å; S259-T261 VanDerWaalsContact C-N 3.3Å; S259-T261 PolarHBondContact O-N 3.38Å; S259-L262 PolarHBondContact O-N 2.94Å; S259-A263 PolarHBondContact O-N 3.32Å |
| 260 | M | 91.3 | Very high | 85.6 | Confident | 38 Ų | 38 | 45.7 Ų | 45.7 | 19% | 0.187 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.6 | -43.7 | 177 | -67.4 | -42.3 | 109.5 | 0 | 0 | 110.9 | W175 F208 S212 V216 W256 L262 A263 V264 | W175-M260 HydrophobicContact CD2-CE 4.43Å; W175-M260 HydrophobicContact CE3-CE 4.22Å; W175-M260 HydrophobicContact CH2-CE 3.01Å; W175-M260 HydrophobicContact CH2-SD 3.53Å; W175-M260 VanDerWaalsContact CH2-SD 3.53Å; W175-M260 HydrophobicContact CZ2-CE 3.21Å; W175-M260 HydrophobicContact CZ2-SD 4.19Å; W175-M260 HydrophobicContact CZ3-CE 3.55Å; W175-M260 HydrophobicContact CZ3-SD 4.11Å; F208-M260 HydrophobicContact CE1-SD 4.09Å; F208-M260 HydrophobicContact CZ-CB 4.35Å; F208-M260 HydrophobicContact CZ-CG 4.41Å; F208-M260 HydrophobicContact CZ-SD 3.72Å; S212-M260 VanDerWaalsContact CB-CE 3.48Å; S212-M260 VanDerWaalsContact CB-SD 3.59Å; S212-M260 PolarHBondContact OG-SD 3.42Å; V216-M260 HydrophobicContact CG2-CE 4.25Å; W256-M260 WeakPolarHBondContact O-CB 3.39Å; W256-M260 VanDerWaalsContact O-CG 3.26Å; W256-M260 WeakPolarHBondContact O-CG 3.46Å; W256-M260 PolarHBondContact O-N 3.33Å; M260-L262 VanDerWaalsContact C-N 3.31Å; M260-L262 PolarHBondContact O-N 3.32Å; M260-A263 CarbonylContact O-C 3.57Å; M260-A263 PolarHBondContact O-N 3.09Å; M260-V264 WeakPolarHBondContact O-CG2 3.19Å; M260-V264 PolarHBondContact O-N 3.36Å |
| 261 | T | 89.6 | Confident | 84.6 | Confident | 86 Ų | 86 | 45.3 Ų | 45.3 | 53% | 0.528 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.9 | -41.2 | -178.5 | -57.8 | 0 | 0 | 0 | 0 | 111.3 | V257 G258 S259 A263 V264 | V257-T261 VanDerWaalsContact O-CB 3.26Å; V257-T261 WeakPolarHBondContact O-CB 3.48Å; V257-T261 PolarHBondContact O-N 3.24Å; V257-T261 PolarHBondContact O-OG1 3.43Å; G258-T261 PolarHBondContact O-N 2.79Å; S259-T261 VanDerWaalsContact C-N 3.3Å; S259-T261 PolarHBondContact O-N 3.38Å; T261-A263 VanDerWaalsContact C-N 3.29Å; T261-A263 PolarHBondContact O-N 2.99Å; T261-V264 PolarHBondContact O-N 3.35Å |
| 262 | L | 85.9 | Confident | 83.3 | Confident | 52 Ų | 52 | 44.3 Ų | 44.3 | 27% | 0.272 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -72.9 | -20.4 | 175.9 | -67.4 | -171.9 | 0 | 0 | 0 | 113.6 | F219 G258 S259 M260 P265 W312 Y317 | F219-L262 HydrophobicContact CE2-CD1 3.85Å; F219-L262 HydrophobicContact CZ-CD1 3.58Å; G258-L262 WeakPolarHBondContact O-CG 3.18Å; G258-L262 PolarHBondContact O-N 2.9Å; S259-L262 PolarHBondContact O-N 2.94Å; M260-L262 VanDerWaalsContact C-N 3.31Å; M260-L262 PolarHBondContact O-N 3.32Å; L262-P265 WeakPolarHBondContact O-CD 3.33Å; L262-W312 HydrophobicContact CD1-CZ2 4.37Å; L262-W312 HydrophobicContact CD2-CZ2 3.95Å; L262-Y317 WeakPolarHBondContact CB-OH 3.37Å |
| 263 | A | 86.6 | Confident | 81.8 | Confident | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -87.2 | -15.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | F208 V211 S212 S259 M260 T261 P265 E266 | F208-A263 HydrophobicContact CD2-CB 3.82Å; F208-A263 HydrophobicContact CE2-CB 3.8Å; V211-A263 HydrophobicContact CB-CB 4.19Å; V211-A263 HydrophobicContact CG1-CB 3.91Å; S212-A263 VanDerWaalsContact OG-CB 3.24Å; S212-A263 WeakPolarHBondContact OG-CB 3.24Å; S259-A263 PolarHBondContact O-N 3.32Å; M260-A263 CarbonylContact O-C 3.57Å; M260-A263 PolarHBondContact O-N 3.09Å; T261-A263 VanDerWaalsContact C-N 3.29Å; T261-A263 PolarHBondContact O-N 2.99Å; A263-P265 VanDerWaalsContact C-N 3.33Å; A263-E266 WeakPolarHBondContact O-CB 3.15Å; A263-E266 PolarHBondContact O-N 3.18Å |
| 264 | V | 84.8 | Confident | 80 | Confident | 67 Ų | 67 | 48.2 Ų | 48.2 | 41% | 0.406 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -50.4 | -41.5 | 178.8 | 174.3 | 0 | 0 | 0 | 0 | 114 | M260 T261 E266 L267 | M260-V264 WeakPolarHBondContact O-CG2 3.19Å; M260-V264 PolarHBondContact O-N 3.36Å; T261-V264 PolarHBondContact O-N 3.35Å; V264-E266 PolarHBondContact O-N 2.96Å; V264-E266 VanDerWaalsContact O-N 3.12Å; V264-L267 WeakPolarHBondContact O-CB 3.35Å; V264-L267 PolarHBondContact O-N 2.8Å |
| 265 | P | 79.9 | Confident | 78.1 | Confident | 33 Ų | 33 | 48.6 Ų | 48.6 | 21% | 0.214 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -57.1 | -28.4 | 179.3 | -26.1 | 36.2 | 0 | 0 | 0 | 113.9 | L262 A263 L268 L269 Y305 | L262-P265 WeakPolarHBondContact O-CD 3.33Å; A263-P265 VanDerWaalsContact C-N 3.33Å; P265-L268 PolarHBondContact O-N 3.15Å; P265-L269 WeakPolarHBondContact O-CB 3.39Å; P265-L269 PolarHBondContact O-N 2.95Å; P265-Y305 HydrophobicContact CB-CD1 3.72Å; P265-Y305 HydrophobicContact CB-CD2 3.88Å; P265-Y305 HydrophobicContact CB-CE1 3.77Å; P265-Y305 HydrophobicContact CB-CE2 3.93Å; P265-Y305 HydrophobicContact CB-CG 3.78Å; P265-Y305 HydrophobicContact CG-CD2 4.18Å; P265-Y305 HydrophobicContact CG-CE2 4.16Å |
| 266 | E | 78.9 | Confident | 75.9 | Confident | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.5 | -38.7 | 176.5 | -64.2 | -68.8 | 148.8 | 0 | 0 | 111.7 | V211 A263 V264 L268 L269 W270 Y305 R309 Y313 | V211-E266 HydrophobicContact CB-CG 4.28Å; V211-E266 HydrophobicContact CG1-CG 4.25Å; V211-E266 HydrophobicContact CG2-CG 4Å; A263-E266 WeakPolarHBondContact O-CB 3.15Å; A263-E266 PolarHBondContact O-N 3.18Å; V264-E266 PolarHBondContact O-N 2.96Å; V264-E266 VanDerWaalsContact O-N 3.12Å; E266-L268 PolarHBondContact O-N 3.1Å; E266-L268 VanDerWaalsContact O-N 3.15Å; E266-L269 PolarHBondContact O-N 2.65Å; E266-L269 VanDerWaalsContact O-N 3.14Å; E266-W270 VanDerWaalsContact O-CD1 3.23Å; E266-W270 PolarHBondContact O-N 3.39Å; E266-W270 PolarHBondContact OE2-NE1 3.28Å; E266-Y305 WeakPolarHBondContact OE1-CE1 3.41Å; E266-Y305 PolarHBondContact OE1-OH 2.92Å; E266-R309 WeakPolarHBondContact OE1-CD 3.31Å; E266-R309 IonicContact OE1-CZ 3.24Å; E266-R309 IonicContact OE1-NE 2.76Å; E266-R309 PolarHBondContact OE1-NE 3.47Å; E266-R309 IonicContact OE1-NH1 2.76Å; E266-R309 PolarHBondContact OE1-NH1 2.63Å; E266-R309 IonicContact OE2-CZ 3.45Å; E266-R309 IonicContact OE2-NH1 3.35Å; E266-R309 PolarHBondContact OE2-NH1 3.4Å; E266-Y313 PolarHBondContact OE1-OH 3.18Å |
| 267 | L | 77.7 | Confident | 73.8 | Confident | 55 Ų | 55 | 50.8 Ų | 50.8 | 29% | 0.288 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.6 | -27.9 | 177 | -70.1 | 169.9 | 0 | 0 | 0 | 113 | R204 F208 V264 | R204-L267 HydrophobicContact CB-CD2 4.03Å; F208-L267 HydrophobicContact CB-CD2 3.5Å; F208-L267 HydrophobicContact CB-CG 3.85Å; F208-L267 HydrophobicContact CD1-CD2 4.31Å; F208-L267 HydrophobicContact CD2-CD1 3.6Å; F208-L267 HydrophobicContact CD2-CD2 4.03Å; F208-L267 HydrophobicContact CD2-CG 3.51Å; F208-L267 HydrophobicContact CE2-CD1 3.78Å; F208-L267 HydrophobicContact CE2-CG 4.22Å; F208-L267 HydrophobicContact CG-CD1 4.02Å; F208-L267 HydrophobicContact CG-CD2 3.68Å; F208-L267 HydrophobicContact CG-CG 3.73Å; F208-L267 HydrophobicContact CZ-CD1 4.35Å; V264-L267 WeakPolarHBondContact O-CB 3.35Å; V264-L267 PolarHBondContact O-N 2.8Å |
| 268 | L | 70.8 | Confident | 71.8 | Confident | 60 Ų | 60 | 52.6 Ų | 52.6 | 31% | 0.314 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -91.1 | -19.8 | -178.4 | -58.8 | 179.2 | 0 | 0 | 0 | 112.8 | P265 E266 L294 V302 | P265-L268 PolarHBondContact O-N 3.15Å; E266-L268 PolarHBondContact O-N 3.1Å; E266-L268 VanDerWaalsContact O-N 3.15Å; L268-L294 HydrophobicContact CB-CD2 4.28Å; L268-L294 HydrophobicContact CD1-CD2 4.42Å; L268-L294 HydrophobicContact CD2-CD2 4.45Å; L268-V302 HydrophobicContact CB-CG2 3.99Å; L268-V302 HydrophobicContact CD1-CG2 4.35Å |
| 269 | L | 70.6 | Confident | 70.2 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -90.4 | -30.7 | -175.4 | -169.6 | 67.2 | 0 | 0 | 0 | 112.8 | P265 E266 M288 K289 P290 V302 Y305 Q306 | P265-L269 WeakPolarHBondContact O-CB 3.39Å; P265-L269 PolarHBondContact O-N 2.95Å; E266-L269 PolarHBondContact O-N 2.65Å; E266-L269 VanDerWaalsContact O-N 3.14Å; L269-M288 HydrophobicContact CD2-CE 3.58Å; L269-M288 HydrophobicContact CD2-CG 4.18Å; L269-M288 HydrophobicContact CG-CE 4.44Å; L269-M288 HydrophobicContact CG-CG 4.13Å; L269-K289 CarbonylContact O-C 3.44Å; L269-K289 PolarHBondContact O-N 3.07Å; L269-K289 VanDerWaalsContact O-N 3.16Å; L269-K289 VanDerWaalsContact O-O 3.11Å; L269-P290 HydrophobicContact CD1-CG 4.29Å; L269-V302 HydrophobicContact CB-CG1 4.21Å; L269-V302 HydrophobicContact CD1-CG1 3.39Å; L269-V302 HydrophobicContact CG-CG1 4.39Å; L269-Y305 HydrophobicContact CD2-CD1 4.25Å; L269-Y305 HydrophobicContact CD2-CE1 4.27Å; L269-Q306 HydrophobicContact CD1-CB 4.06Å; L269-Q306 HydrophobicContact CD1-CG 4.45Å |
| 270 | W | 67.5 | Low | 68.3 | Low | 50 Ų | 50 | 66.1 Ų | 66.1 | 19% | 0.189 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 129.4 | 178.9 | -70.9 | 94.6 | 0 | 0 | 0 | 111.3 | R204 P207 E266 C286 M288 | R204-W270 HydrophobicContact CG-CB 4.43Å; R204-W270 WeakPolarHBondContact CG-O 3.37Å; P207-W270 HydrophobicContact CB-CD2 4.41Å; P207-W270 HydrophobicContact CB-CG 4.34Å; P207-W270 HydrophobicContact CB-CZ2 4.38Å; P207-W270 HydrophobicContact CG-CB 4.33Å; P207-W270 VanDerWaalsContact CG-CD1 3.43Å; P207-W270 HydrophobicContact CG-CD2 3.94Å; P207-W270 HydrophobicContact CG-CG 3.66Å; E266-W270 VanDerWaalsContact O-CD1 3.23Å; E266-W270 PolarHBondContact O-N 3.39Å; E266-W270 PolarHBondContact OE2-NE1 3.28Å; W270-C286 HydrophobicContact CE3-CB 3.92Å; W270-C286 HydrophobicContact CZ3-CB 3.94Å; W270-M288 HydrophobicContact CD2-CG 3.84Å; W270-M288 HydrophobicContact CE3-CG 4.06Å; W270-M288 HydrophobicContact CG-CG 4.5Å; W270-M288 HydrophobicContact CH2-CG 3.95Å; W270-M288 HydrophobicContact CH2-SD 3.88Å; W270-M288 HydrophobicContact CZ2-CG 3.71Å; W270-M288 HydrophobicContact CZ2-SD 3.46Å; W270-M288 WeakPolarHBondContact CZ2-SD 3.39Å; W270-M288 HydrophobicContact CZ3-CG 4.11Å |
| 271 | Q | 67.4 | Low | 66.5 | Low | 45 Ų | 45 | 67 Ų | 67 | 21% | 0.21 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.9 | 147.9 | 175.5 | -67.4 | -163.3 | -68.9 | 0 | 0 | 112 | A273 I287 K289 P290 S291 | Q271-A273 PolarHBondContact O-N 2.86Å; Q271-I287 PolarHBondContact N-O 3.1Å; Q271-I287 PolarHBondContact O-N 3.27Å; Q271-K289 VanDerWaalsContact CG-O 3.31Å; Q271-K289 WeakPolarHBondContact CG-O 3.16Å; Q271-K289 PolarHBondContact OE1-O 3.43Å; Q271-K289 VanDerWaalsContact OE1-O 3.04Å; Q271-P290 PolarHBondContact OE1-O 2.91Å; Q271-S291 VanDerWaalsContact NE2-CA 3.27Å; Q271-S291 VanDerWaalsContact OE1-N 3.17Å |
| 272 | L | 59 | Low | 64.7 | Low | 54 Ų | 54 | 67 Ų | 67 | 28% | 0.283 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 114.8 | 164.7 | -163.8 | 67.2 | 0 | 0 | 0 | 109.1 | D200 D284 | D200-L272 HydrophobicContact CB-CB 4.03Å; D200-L272 HydrophobicContact CB-CD2 4.22Å; D200-L272 PolarHBondContact OD1-N 3.3Å; L272-D284 HydrophobicContact CD1-CB 3.87Å; L272-D284 HydrophobicContact CG-CB 4.41Å |
| 273 | A | 58.2 | Low | 63.2 | Low | 30 Ų | 30 | 68.7 Ų | 68.7 | 25% | 0.248 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 129.4 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | Q271 S285 I287 | Q271-A273 PolarHBondContact O-N 2.86Å; A273-S285 PolarHBondContact N-O 2.94Å; A273-S285 PolarHBondContact O-N 3.45Å; A273-S285 VanDerWaalsContact O-O 3.04Å; A273-I287 HydrophobicContact CB-CB 4.08Å; A273-I287 HydrophobicContact CB-CD1 3.42Å; A273-I287 VanDerWaalsContact CB-CD1 3.42Å; A273-I287 HydrophobicContact CB-CG1 3.69Å |
| 274 | Q | 54.9 | Low | 62 | Low | 120 Ų | 120 | 71.2 Ų | 71.2 | 56% | 0.561 | 41% | 0.411 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 105.8 | -177.3 | -163.8 | 160.1 | 58.1 | 0 | 0 | 108.2 | T282 D284 | Q274-T282 VanDerWaalsContact CG-CB 3.41Å; Q274-T282 HydrophobicContact CG-CG2 3.66Å; Q274-D284 WeakPolarHBondContact CG-OD1 3.34Å; Q274-D284 PolarHBondContact NE2-OD1 3.34Å |
| 275 | E | 52.2 | Low | 60.7 | Low | 116 Ų | 116 | 70 Ų | 70 | 54% | 0.542 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 132.3 | 176.5 | -116.5 | -163.3 | 113.3 | 0 | 0 | 109.7 | A277 L283 | E275-A277 PolarHBondContact O-N 3.07Å; E275-L283 PolarHBondContact N-O 3.41Å; E275-L283 PolarHBondContact O-N 3.09Å |
| 276 | P | 47.6 | Very low | 60 | Low | 107 Ų | 107 | 70 Ų | 70 | 70% | 0.695 | 41% | 0.406 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 114.5 | 174.4 | 25.4 | -29.4 | 0 | 0 | 0 | 110 | ||
| 277 | A | 48.8 | Very low | 59.3 | Low | 35 Ų | 35 | 72.3 Ų | 72.3 | 29% | 0.289 | 42% | 0.418 | S | S | . | . | trans | -80.9 | 136.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | E275 T279 G281 L283 | E275-A277 PolarHBondContact O-N 3.07Å; A277-T279 PolarHBondContact O-N 3.34Å; A277-G281 WeakPolarHBondContact CB-O 3.5Å; A277-G281 PolarHBondContact N-O 3Å; A277-L283 HydrophobicContact CB-CB 4.35Å | ||
| 278 | P | 53.4 | Low | 58.5 | Low | 132 Ų | 132 | 72.3 Ų | 72.3 | 86% | 0.857 | 42% | 0.417 | S | S | * | . | S | Bend | trans | -67.5 | -7.8 | -171 | 21.4 | -30.7 | 0 | 0 | 0 | 115.7 | ||
| 279 | T | 56.9 | Low | 57.9 | Low | 135 Ų | 135 | 75.6 Ų | 75.6 | 83% | 0.828 | 43% | 0.429 | S | S | * | . | S | Bend | trans | -140.6 | -12 | -176.1 | 29.5 | 0 | 0 | 0 | 0 | 116.3 | A277 | A277-T279 PolarHBondContact O-N 3.34Š|
| 280 | M | 51.6 | Low | 57.5 | Low | 173 Ų | 173 | 76.4 Ų | 76.4 | 85% | 0.852 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -149.2 | 80.9 | 175.9 | -71.2 | -159.8 | 170.9 | 0 | 0 | 111.3 | ||
| 281 | G | 54.2 | Low | 57 | Low | 57 Ų | 57 | 74.5 Ų | 74.5 | 59% | 0.588 | 43% | 0.429 | S | S | * | . | S | Bend | trans | 58.4 | -159.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 116 | A277 | A277-G281 WeakPolarHBondContact CB-O 3.5Å; A277-G281 PolarHBondContact N-O 3Å |
| 282 | T | 51.5 | Low | 56.5 | Low | 87 Ų | 87 | 77.3 Ų | 77.3 | 53% | 0.534 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 125.8 | 178.8 | 43.1 | 0 | 0 | 0 | 0 | 111.2 | Q274 | Q274-T282 VanDerWaalsContact CG-CB 3.41Å; Q274-T282 HydrophobicContact CG-CG2 3.66Å |
| 283 | L | 55.7 | Low | 56.4 | Low | 86 Ų | 86 | 79.8 Ų | 79.8 | 45% | 0.45 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 123 | 172.9 | -166.5 | 74.3 | 0 | 0 | 0 | 109.6 | K194 E275 A277 S285 | K194-L283 WeakPolarHBondContact O-CD1 3.23Å; E275-L283 PolarHBondContact N-O 3.41Å; E275-L283 PolarHBondContact O-N 3.09Å; A277-L283 HydrophobicContact CB-CB 4.35Å; L283-S285 PolarHBondContact O-N 2.67Å |
| 284 | D | 59.7 | Low | 56.5 | Low | 53 Ų | 53 | 80 Ų | 80 | 28% | 0.283 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.7 | 101.5 | -179.8 | -75.4 | -5.2 | 0 | 0 | 0 | 110.4 | L272 Q274 | L272-D284 HydrophobicContact CD1-CB 3.87Å; L272-D284 HydrophobicContact CG-CB 4.41Å; Q274-D284 WeakPolarHBondContact CG-OD1 3.34Å; Q274-D284 PolarHBondContact NE2-OD1 3.34Å |
| 285 | S | 58 | Low | 57.3 | Low | 43 Ų | 43 | 78 Ų | 78 | 30% | 0.301 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 153.6 | 178.3 | -167.1 | 0 | 0 | 0 | 0 | 112 | R196 A273 L283 | R196-S285 PolarHBondContact NH1-O 3.43Å; A273-S285 PolarHBondContact N-O 2.94Å; A273-S285 PolarHBondContact O-N 3.45Å; A273-S285 VanDerWaalsContact O-O 3.04Å; L283-S285 PolarHBondContact O-N 2.67Å |
| 286 | C | 66.5 | Low | 58.1 | Low | 32 Ų | 32 | 79.9 Ų | 79.9 | 22% | 0.216 | 48% | 0.484 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 112.6 | 177.6 | -93.3 | 0 | 0 | 0 | 0 | 103.9 | R196 C203 W270 | R196-C286 PolarHBondContact NH1-SG 2.69Å; R196-C286 PolarHBondContact NH2-SG 2.91Å; C203-C286 WeakPolarHBondContact CA-SG 3.12Å; C203-C286 WeakPolarHBondContact CB-SG 3.5Å; C203-C286 VanDerWaalsContact SG-CA 3.56Å; C203-C286 WeakPolarHBondContact SG-CB 3.26Å; C203-C286 CovalentContact SG-SG 2.01Å; C203-C286 PolarHBondContact SG-SG 3.5Å; W270-C286 HydrophobicContact CE3-CB 3.92Å; W270-C286 HydrophobicContact CZ3-CB 3.94Å |
| 287 | I | 62.6 | Low | 59.2 | Low | 48 Ų | 48 | 79.1 Ų | 79.1 | 25% | 0.246 | 48% | 0.481 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.3 | 132.6 | 176.4 | -53.3 | -177.5 | 0 | 0 | 0 | 106.9 | Q271 A273 K289 | Q271-I287 PolarHBondContact N-O 3.1Å; Q271-I287 PolarHBondContact O-N 3.27Å; A273-I287 HydrophobicContact CB-CB 4.08Å; A273-I287 HydrophobicContact CB-CD1 3.42Å; A273-I287 VanDerWaalsContact CB-CD1 3.42Å; A273-I287 HydrophobicContact CB-CG1 3.69Å; I287-K289 HydrophobicContact CG2-CB 4.29Å; I287-K289 HydrophobicContact CG2-CD 3.93Å; I287-K289 HydrophobicContact CG2-CG 3.79Å; I287-K289 PolarHBondContact O-N 2.71Å |
| 288 | M | 60.9 | Low | 60.1 | Low | 56 Ų | 56 | 80.8 Ų | 80.8 | 28% | 0.276 | 49% | 0.485 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 84.4 | 163.6 | -100.9 | 167.3 | 79.2 | 0 | 0 | 107.9 | L269 W270 R309 | L269-M288 HydrophobicContact CD2-CE 3.58Å; L269-M288 HydrophobicContact CD2-CG 4.18Å; L269-M288 HydrophobicContact CG-CE 4.44Å; L269-M288 HydrophobicContact CG-CG 4.13Å; W270-M288 HydrophobicContact CD2-CG 3.84Å; W270-M288 HydrophobicContact CE3-CG 4.06Å; W270-M288 HydrophobicContact CG-CG 4.5Å; W270-M288 HydrophobicContact CH2-CG 3.95Å; W270-M288 HydrophobicContact CH2-SD 3.88Å; W270-M288 HydrophobicContact CZ2-CG 3.71Å; W270-M288 HydrophobicContact CZ2-SD 3.46Å; W270-M288 WeakPolarHBondContact CZ2-SD 3.39Å; W270-M288 HydrophobicContact CZ3-CG 4.11Å; M288-R309 PolarHBondContact SD-NH1 3.45Å |
| 289 | K | 59.3 | Low | 61 | Low | 129 Ų | 129 | 78.6 Ų | 78.6 | 56% | 0.561 | 46% | 0.46 | S | S | * | . | trans | -136.5 | 128.3 | 172.7 | -88.7 | -178.4 | -178.7 | 178.8 | 0 | 108.2 | L269 Q271 I287 | L269-K289 CarbonylContact O-C 3.44Å; L269-K289 PolarHBondContact O-N 3.07Å; L269-K289 VanDerWaalsContact O-N 3.16Å; L269-K289 VanDerWaalsContact O-O 3.11Å; Q271-K289 VanDerWaalsContact CG-O 3.31Å; Q271-K289 WeakPolarHBondContact CG-O 3.16Å; Q271-K289 PolarHBondContact OE1-O 3.43Å; Q271-K289 VanDerWaalsContact OE1-O 3.04Å; I287-K289 HydrophobicContact CG2-CB 4.29Å; I287-K289 HydrophobicContact CG2-CD 3.93Å; I287-K289 HydrophobicContact CG2-CG 3.79Å; I287-K289 PolarHBondContact O-N 2.71Å | ||
| 290 | P | 60.6 | Low | 61.7 | Low | 16 Ų | 16 | 75.6 Ų | 75.6 | 10% | 0.104 | 45% | 0.445 | C | S | . | . | trans | -63.1 | 139.3 | 175.8 | -12 | 23.1 | 0 | 0 | 0 | 110.5 | L269 Q271 A292 Y299 V302 | L269-P290 HydrophobicContact CD1-CG 4.29Å; Q271-P290 PolarHBondContact OE1-O 2.91Å; P290-A292 PolarHBondContact O-N 3.31Å; P290-Y299 HydrophobicContact CB-CD2 3.87Å; P290-Y299 HydrophobicContact CB-CE2 3.73Å; P290-Y299 HydrophobicContact CG-CE2 4.06Å; P290-V302 HydrophobicContact CB-CB 4.5Å; P290-V302 HydrophobicContact CB-CG1 3.83Å; P290-V302 HydrophobicContact CG-CG1 3.94Å | ||
| 291 | S | 57.7 | Low | 62.6 | Low | 11 Ų | 11 | 72.7 Ų | 72.7 | 8% | 0.077 | 43% | 0.432 | C | S | . | . | trans | -56.3 | 121.4 | 173.7 | 163.4 | 0 | 0 | 0 | 0 | 112.1 | Q271 S293 L294 | Q271-S291 VanDerWaalsContact NE2-CA 3.27Å; Q271-S291 VanDerWaalsContact OE1-N 3.17Å; S291-S293 PolarHBondContact O-N 2.9Å; S291-S293 VanDerWaalsContact O-N 3.09Å; S291-S293 PolarHBondContact OG-N 3.11Å; S291-S293 PolarHBondContact OG-OG 2.98Å; S291-L294 PolarHBondContact O-N 3.36Å; S291-L294 VanDerWaalsContact O-N 3.15Å; S291-L294 VanDerWaalsContact OG-CD1 3.25Å; S291-L294 WeakPolarHBondContact OG-CD1 3.34Å | ||
| 292 | A | 56.9 | Low | 63.5 | Low | 104 Ų | 104 | 70.2 Ų | 70.2 | 86% | 0.86 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -7.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | P290 | P290-A292 PolarHBondContact O-N 3.31Š|
| 293 | S | 57.3 | Low | 64.5 | Low | 106 Ų | 106 | 69.4 Ų | 69.4 | 74% | 0.741 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.4 | 3.8 | 176.4 | 64.7 | 0 | 0 | 0 | 0 | 113.7 | S291 | S291-S293 PolarHBondContact O-N 2.9Å; S291-S293 VanDerWaalsContact O-N 3.09Å; S291-S293 PolarHBondContact OG-N 3.11Å; S291-S293 PolarHBondContact OG-OG 2.98Å |
| 294 | L | 60.7 | Low | 65.5 | Low | 35 Ų | 35 | 69.3 Ų | 69.3 | 18% | 0.183 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -78 | 145.4 | 176.6 | -95.5 | 59.7 | 0 | 0 | 0 | 111.4 | L268 S291 L298 V302 | L268-L294 HydrophobicContact CB-CD2 4.28Å; L268-L294 HydrophobicContact CD1-CD2 4.42Å; L268-L294 HydrophobicContact CD2-CD2 4.45Å; S291-L294 PolarHBondContact O-N 3.36Å; S291-L294 VanDerWaalsContact O-N 3.15Å; S291-L294 VanDerWaalsContact OG-CD1 3.25Å; S291-L294 WeakPolarHBondContact OG-CD1 3.34Å; L294-L298 HydrophobicContact CB-CB 4.31Å; L294-L298 HydrophobicContact CD2-CB 3.99Å; L294-L298 HydrophobicContact CG-CB 4.3Å; L294-V302 HydrophobicContact CD2-CG2 4.33Å |
| 295 | P | 70.9 | Confident | 66.3 | Low | 77 Ų | 77 | 68 Ų | 68 | 50% | 0.5 | 39% | 0.391 | S | S | . | . | trans | -49.7 | 140.4 | 165.7 | -22.5 | 29.5 | 0 | 0 | 0 | 111.5 | S297 L298 Y299 | P295-S297 PolarHBondContact O-N 2.87Å; P295-L298 HydrophobicContact CB-CG 4.49Å; P295-L298 HydrophobicContact CG-CD1 4.11Å; P295-L298 HydrophobicContact CG-CG 4.48Å; P295-L298 WeakPolarHBondContact O-CA 3.08Å; P295-L298 PolarHBondContact O-N 3.08Å; P295-Y299 PolarHBondContact O-N 3.09Å | ||
| 296 | E | 69.9 | Low | 67.1 | Low | 156 Ų | 156 | 68.9 Ų | 68.9 | 73% | 0.729 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -49.3 | -35.8 | -178.6 | -69.3 | -67.2 | 164.1 | 0 | 0 | 113.7 | Y299 S300 | E296-Y299 PolarHBondContact O-N 3.44Å; E296-S300 PolarHBondContact O-N 3.16Å |
| 297 | S | 69.5 | Low | 67.3 | Low | 90 Ų | 90 | 73.2 Ų | 73.2 | 63% | 0.629 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -67.1 | -37.5 | 176.5 | 59.8 | 0 | 0 | 0 | 0 | 113.4 | P295 L301 | P295-S297 PolarHBondContact O-N 2.87Å; S297-L301 PolarHBondContact O-N 2.93Å |
| 298 | L | 68.8 | Low | 68 | Low | 70 Ų | 70 | 72.8 Ų | 72.8 | 37% | 0.366 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -77.2 | -35.1 | 177 | -64.3 | -176.5 | 0 | 0 | 0 | 110.8 | L294 P295 L301 V302 | L294-L298 HydrophobicContact CB-CB 4.31Å; L294-L298 HydrophobicContact CD2-CB 3.99Å; L294-L298 HydrophobicContact CG-CB 4.3Å; P295-L298 HydrophobicContact CB-CG 4.49Å; P295-L298 HydrophobicContact CG-CD1 4.11Å; P295-L298 HydrophobicContact CG-CG 4.48Å; P295-L298 WeakPolarHBondContact O-CA 3.08Å; P295-L298 PolarHBondContact O-N 3.08Å; L298-L301 PolarHBondContact O-N 3.1Å; L298-V302 WeakPolarHBondContact O-CB 3.38Å; L298-V302 VanDerWaalsContact O-CG2 3.22Å; L298-V302 WeakPolarHBondContact O-CG2 3.03Å; L298-V302 PolarHBondContact O-N 2.78Å |
| 299 | Y | 70.9 | Confident | 68.8 | Low | 86 Ų | 86 | 72.2 Ų | 72.2 | 34% | 0.337 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 174.8 | -173.6 | -95.7 | 0 | 0 | 0 | 111.9 | P290 P295 E296 L301 V302 M303 | P290-Y299 HydrophobicContact CB-CD2 3.87Å; P290-Y299 HydrophobicContact CB-CE2 3.73Å; P290-Y299 HydrophobicContact CG-CE2 4.06Å; P295-Y299 PolarHBondContact O-N 3.09Å; E296-Y299 PolarHBondContact O-N 3.44Å; Y299-L301 VanDerWaalsContact C-N 3.34Å; Y299-L301 PolarHBondContact O-N 3.29Å; Y299-V302 PolarHBondContact O-N 2.73Å; Y299-M303 WeakPolarHBondContact O-CB 3.42Å; Y299-M303 PolarHBondContact O-N 3.49Å |
| 300 | S | 72.3 | Confident | 69.6 | Low | 72 Ų | 72 | 68.4 Ų | 68.4 | 50% | 0.503 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 175.6 | -176.6 | 0 | 0 | 0 | 0 | 112.6 | E296 T304 | E296-S300 PolarHBondContact O-N 3.16Å; S300-T304 WeakPolarHBondContact O-CB 3.47Å; S300-T304 PolarHBondContact O-N 2.83Å; S300-T304 PolarHBondContact O-OG1 3.35Å |
| 301 | L | 71.3 | Confident | 70.5 | Confident | 113 Ų | 113 | 75.9 Ų | 75.9 | 59% | 0.592 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -64.5 | -45 | 176.6 | -174.9 | 69.6 | 0 | 0 | 0 | 111.8 | S297 L298 Y299 T304 Y305 | S297-L301 PolarHBondContact O-N 2.93Å; L298-L301 PolarHBondContact O-N 3.1Å; Y299-L301 VanDerWaalsContact C-N 3.34Å; Y299-L301 PolarHBondContact O-N 3.29Å; L301-T304 PolarHBondContact O-N 3.44Å; L301-Y305 WeakPolarHBondContact O-CB 3.36Å; L301-Y305 PolarHBondContact O-N 2.91Å |
| 302 | V | 72.8 | Confident | 71.7 | Confident | 4 Ų | 4 | 80 Ų | 80 | 2% | 0.024 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -66.5 | -38.8 | 179.5 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | L268 L269 P290 L294 L298 Y299 Y305 Q306 | L268-V302 HydrophobicContact CB-CG2 3.99Å; L268-V302 HydrophobicContact CD1-CG2 4.35Å; L269-V302 HydrophobicContact CB-CG1 4.21Å; L269-V302 HydrophobicContact CD1-CG1 3.39Å; L269-V302 HydrophobicContact CG-CG1 4.39Å; P290-V302 HydrophobicContact CB-CB 4.5Å; P290-V302 HydrophobicContact CB-CG1 3.83Å; P290-V302 HydrophobicContact CG-CG1 3.94Å; L294-V302 HydrophobicContact CD2-CG2 4.33Å; L298-V302 WeakPolarHBondContact O-CB 3.38Å; L298-V302 VanDerWaalsContact O-CG2 3.22Å; L298-V302 WeakPolarHBondContact O-CG2 3.03Å; L298-V302 PolarHBondContact O-N 2.78Å; Y299-V302 PolarHBondContact O-N 2.73Å; V302-Y305 CarbonylContact O-C 3.59Å; V302-Y305 PolarHBondContact O-N 3.37Å; V302-Q306 WeakPolarHBondContact O-CB 3.45Å; V302-Q306 PolarHBondContact O-N 3.27Å |
| 303 | M | 72.9 | Confident | 72.8 | Confident | 71 Ų | 71 | 76 Ų | 76 | 35% | 0.35 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -68.1 | -38 | 175.7 | -161.5 | 67 | 123.9 | 0 | 0 | 111.9 | Y299 Q306 N307 | Y299-M303 WeakPolarHBondContact O-CB 3.42Å; Y299-M303 PolarHBondContact O-N 3.49Å; M303-Q306 PolarHBondContact O-N 3.46Å; M303-N307 PolarHBondContact O-N 3.12Å; M303-N307 VanDerWaalsContact O-N 3.09Å; M303-N307 PolarHBondContact O-ND2 3.12Å |
| 304 | T | 76.9 | Confident | 74 | Confident | 83 Ų | 83 | 74.8 Ų | 74.8 | 51% | 0.509 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -65.2 | -43.1 | 173.1 | -55.1 | 0 | 0 | 0 | 0 | 110.6 | S300 L301 N307 A308 | S300-T304 WeakPolarHBondContact O-CB 3.47Å; S300-T304 PolarHBondContact O-N 2.83Å; S300-T304 PolarHBondContact O-OG1 3.35Å; L301-T304 PolarHBondContact O-N 3.44Å; T304-N307 PolarHBondContact O-N 3.28Å; T304-A308 WeakPolarHBondContact O-CB 3.48Å; T304-A308 PolarHBondContact O-N 3.24Å |
| 305 | Y | 75.2 | Confident | 75.1 | Confident | 25 Ų | 25 | 74.3 Ų | 74.3 | 10% | 0.098 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 173.6 | 177.8 | -96 | 0 | 0 | 0 | 110.9 | P265 E266 L269 L301 V302 N307 A308 R309 | P265-Y305 HydrophobicContact CB-CD1 3.72Å; P265-Y305 HydrophobicContact CB-CD2 3.88Å; P265-Y305 HydrophobicContact CB-CE1 3.77Å; P265-Y305 HydrophobicContact CB-CE2 3.93Å; P265-Y305 HydrophobicContact CB-CG 3.78Å; P265-Y305 HydrophobicContact CG-CD2 4.18Å; P265-Y305 HydrophobicContact CG-CE2 4.16Å; E266-Y305 WeakPolarHBondContact OE1-CE1 3.41Å; E266-Y305 PolarHBondContact OE1-OH 2.92Å; L269-Y305 HydrophobicContact CD2-CD1 4.25Å; L269-Y305 HydrophobicContact CD2-CE1 4.27Å; L301-Y305 WeakPolarHBondContact O-CB 3.36Å; L301-Y305 PolarHBondContact O-N 2.91Å; V302-Y305 CarbonylContact O-C 3.59Å; V302-Y305 PolarHBondContact O-N 3.37Å; Y305-N307 PolarHBondContact O-N 3.46Å; Y305-A308 CarbonylContact O-C 3.39Å; Y305-A308 PolarHBondContact O-N 2.91Å; Y305-R309 HydrophobicContact CE1-CB 4.34Å; Y305-R309 HydrophobicContact CE1-CG 4.1Å; Y305-R309 WeakPolarHBondContact O-CA 3.29Å; Y305-R309 WeakPolarHBondContact O-CB 3.3Å; Y305-R309 PolarHBondContact O-N 3.46Å |
| 306 | Q | 74.4 | Confident | 75.7 | Confident | 62 Ų | 62 | 72.3 Ų | 72.3 | 29% | 0.29 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -56.8 | -47 | 176.6 | 180 | 172.4 | -4.3 | 0 | 0 | 112.3 | L269 V302 M303 R309 | L269-Q306 HydrophobicContact CD1-CB 4.06Å; L269-Q306 HydrophobicContact CD1-CG 4.45Å; V302-Q306 WeakPolarHBondContact O-CB 3.45Å; V302-Q306 PolarHBondContact O-N 3.27Å; M303-Q306 PolarHBondContact O-N 3.46Å; Q306-R309 PolarHBondContact O-N 3.44Å |
| 307 | N | 72.2 | Confident | 76.3 | Confident | 123 Ų | 123 | 65 Ų | 65 | 66% | 0.658 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -69.9 | -34.1 | 178.2 | -69.6 | -25.3 | 0 | 0 | 0 | 112.6 | M303 T304 Y305 | M303-N307 PolarHBondContact O-N 3.12Å; M303-N307 VanDerWaalsContact O-N 3.09Å; M303-N307 PolarHBondContact O-ND2 3.12Å; T304-N307 PolarHBondContact O-N 3.28Å; Y305-N307 PolarHBondContact O-N 3.46Å |
| 308 | A | 77 | Confident | 77 | Confident | 39 Ų | 39 | 62.2 Ų | 62.2 | 32% | 0.322 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -89.6 | -7.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | T304 Y305 M310 W311 W312 | T304-A308 WeakPolarHBondContact O-CB 3.48Å; T304-A308 PolarHBondContact O-N 3.24Å; Y305-A308 CarbonylContact O-C 3.39Å; Y305-A308 PolarHBondContact O-N 2.91Å; A308-M310 VanDerWaalsContact C-N 3.31Å; A308-M310 PolarHBondContact O-N 2.64Å; A308-W311 CarbonylContact O-C 3.54Å; A308-W311 PolarHBondContact O-N 2.93Å; A308-W312 WeakPolarHBondContact O-CB 3.47Å; A308-W312 PolarHBondContact O-N 2.97Å |
| 309 | R | 78 | Confident | 77.7 | Confident | 45 Ų | 45 | 60.5 Ų | 60.5 | 17% | 0.17 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.2 | -47 | -169 | 179.9 | 175.2 | 149.8 | 174.5 | -16.3 | 110.3 | E266 M288 Y305 Q306 W311 W312 Y313 | E266-R309 WeakPolarHBondContact OE1-CD 3.31Å; E266-R309 IonicContact OE1-CZ 3.24Å; E266-R309 IonicContact OE1-NE 2.76Å; E266-R309 PolarHBondContact OE1-NE 3.47Å; E266-R309 IonicContact OE1-NH1 2.76Å; E266-R309 PolarHBondContact OE1-NH1 2.63Å; E266-R309 IonicContact OE2-CZ 3.45Å; E266-R309 IonicContact OE2-NH1 3.35Å; E266-R309 PolarHBondContact OE2-NH1 3.4Å; M288-R309 PolarHBondContact SD-NH1 3.45Å; Y305-R309 HydrophobicContact CE1-CB 4.34Å; Y305-R309 HydrophobicContact CE1-CG 4.1Å; Y305-R309 WeakPolarHBondContact O-CA 3.29Å; Y305-R309 WeakPolarHBondContact O-CB 3.3Å; Y305-R309 PolarHBondContact O-N 3.46Å; Q306-R309 PolarHBondContact O-N 3.44Å; R309-W311 PolarHBondContact O-N 3.31Å; R309-W312 WeakPolarHBondContact O-CB 3.24Å; R309-W312 PolarHBondContact O-N 2.96Å; R309-W312 VanDerWaalsContact O-N 3.17Å; R309-Y313 HydrophobicContact CG-CD2 3.67Å; R309-Y313 HydrophobicContact CG-CE2 3.49Å; R309-Y313 VanDerWaalsContact CG-CE2 3.49Å; R309-Y313 VanDerWaalsContact O-CD2 3.23Å; R309-Y313 WeakPolarHBondContact O-CD2 3.48Å; R309-Y313 PolarHBondContact O-N 2.94Å |
| 310 | M | 75.1 | Confident | 78.4 | Confident | 48 Ų | 48 | 60.7 Ų | 60.7 | 24% | 0.236 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -54.8 | -51.3 | 175 | -76.8 | -100.8 | -70 | 0 | 0 | 112.8 | A308 W312 Y313 F314 N379 I380 A383 Y384 | A308-M310 VanDerWaalsContact C-N 3.31Å; A308-M310 PolarHBondContact O-N 2.64Å; M310-W312 VanDerWaalsContact C-N 3.27Å; M310-W312 PolarHBondContact O-N 2.7Å; M310-Y313 PolarHBondContact O-N 3.3Å; M310-F314 WeakPolarHBondContact O-CB 3.37Å; M310-F314 PolarHBondContact O-N 3.27Å; M310-N379 VanDerWaalsContact SD-O 3.4Å; M310-I380 HydrophobicContact CE-CG1 4.42Å; M310-A383 HydrophobicContact CE-CB 3.13Å; M310-A383 HydrophobicContact CG-CB 4.09Å; M310-A383 HydrophobicContact SD-CB 3.34Å; M310-A383 WeakPolarHBondContact SD-CB 3.43Å; M310-Y384 HydrophobicContact CE-CD2 3.84Å; M310-Y384 HydrophobicContact CE-CE2 3.51Å |
| 311 | W | 79.6 | Confident | 78.9 | Confident | 174 Ų | 174 | 57.3 Ų | 57.3 | 66% | 0.659 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -66.2 | -32.5 | 178.5 | -67 | 96.4 | 0 | 0 | 0 | 112.1 | A308 R309 G315 | A308-W311 CarbonylContact O-C 3.54Å; A308-W311 PolarHBondContact O-N 2.93Å; R309-W311 PolarHBondContact O-N 3.31Å; W311-G315 WeakPolarHBondContact O-CA 3.31Å; W311-G315 PolarHBondContact O-N 3.31Å |
| 312 | W | 82.2 | Confident | 79.5 | Confident | 97 Ų | 97 | 53.4 Ų | 53.4 | 37% | 0.367 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -69.2 | -47.3 | 176.2 | -170.1 | -91.5 | 0 | 0 | 0 | 111.3 | L262 A308 R309 M310 C316 Y317 | L262-W312 HydrophobicContact CD1-CZ2 4.37Å; L262-W312 HydrophobicContact CD2-CZ2 3.95Å; A308-W312 WeakPolarHBondContact O-CB 3.47Å; A308-W312 PolarHBondContact O-N 2.97Å; R309-W312 WeakPolarHBondContact O-CB 3.24Å; R309-W312 PolarHBondContact O-N 2.96Å; R309-W312 VanDerWaalsContact O-N 3.17Å; M310-W312 VanDerWaalsContact C-N 3.27Å; M310-W312 PolarHBondContact O-N 2.7Å; W312-C316 HydrophobicContact CD2-CB 4.39Å; W312-C316 WeakPolarHBondContact O-CA 3.34Å; W312-C316 WeakPolarHBondContact O-CB 3.44Å; W312-C316 PolarHBondContact O-N 2.88Å; W312-Y317 AromaticContact CD1-CE2 3.91Å |
| 313 | Y | 81.7 | Confident | 80.2 | Confident | 19 Ų | 19 | 58.6 Ų | 58.6 | 8% | 0.075 | 30% | 0.295 | C | S | . | . | I | π-helix | trans | -63.7 | -50.2 | 176.9 | -88.1 | -110.3 | 0 | 0 | 0 | 111.7 | V211 L214 E266 R309 M310 Y317 F318 | V211-Y313 HydrophobicContact CG2-CE1 4.14Å; V211-Y313 WeakPolarHBondContact CG2-OH 3.09Å; L214-Y313 HydrophobicContact CD2-CD1 3.76Å; L214-Y313 HydrophobicContact CD2-CE1 3.86Å; E266-Y313 PolarHBondContact OE1-OH 3.18Å; R309-Y313 HydrophobicContact CG-CD2 3.67Å; R309-Y313 HydrophobicContact CG-CE2 3.49Å; R309-Y313 VanDerWaalsContact CG-CE2 3.49Å; R309-Y313 VanDerWaalsContact O-CD2 3.23Å; R309-Y313 WeakPolarHBondContact O-CD2 3.48Å; R309-Y313 PolarHBondContact O-N 2.94Å; M310-Y313 PolarHBondContact O-N 3.3Å; Y313-Y317 AromaticContact CD1-CD2 3.99Å; Y313-Y317 HydrophobicContact CD1-CD2 3.99Å; Y313-Y317 HydrophobicContact CD2-CD2 4.38Å; Y313-Y317 HydrophobicContact CD2-CE2 4.46Å; Y313-Y317 HydrophobicContact CE1-CD2 4.5Å; Y313-Y317 AromaticContact CG-CD2 3.99Å; Y313-Y317 HydrophobicContact CG-CD2 3.99Å; Y313-Y317 HydrophobicContact CG-CE2 4.49Å; Y313-Y317 WeakPolarHBondContact O-CA 3.48Å; Y313-Y317 WeakPolarHBondContact O-CB 3.49Å; Y313-Y317 PolarHBondContact O-N 3.07Å; Y313-Y317 VanDerWaalsContact O-N 3.1Å; Y313-F318 PolarHBondContact O-N 3.47Å; Y313-F318 VanDerWaalsContact O-N 3.14Å |
| 314 | F | 82.4 | Confident | 80.8 | Confident | 82 Ų | 82 | 58.7 Ų | 58.7 | 36% | 0.36 | 29% | 0.293 | S | S | . | . | I | π-helix | trans | -64.8 | -46.1 | 178.8 | -177.7 | -103.7 | 0 | 0 | 0 | 112 | M310 F318 C319 I380 | M310-F314 WeakPolarHBondContact O-CB 3.37Å; M310-F314 PolarHBondContact O-N 3.27Å; F314-F318 HydrophobicContact CD2-CD1 4.1Å; F314-F318 AromaticContact CE2-CD1 3.84Å; F314-F318 HydrophobicContact CE2-CD1 3.84Å; F314-F318 HydrophobicContact CE2-CE1 4.17Å; F314-F318 VanDerWaalsContact O-CB 3.31Å; F314-F318 WeakPolarHBondContact O-CB 3.49Å; F314-F318 PolarHBondContact O-N 2.91Å; F314-C319 WeakPolarHBondContact CE1-SG 3.17Å; F314-C319 PolarHBondContact O-N 2.93Å; F314-C319 PolarHBondContact O-SG 3.48Å; F314-C319 VanDerWaalsContact O-SG 3.34Å; F314-I380 HydrophobicContact CD2-CD1 4.31Å |
| 315 | G | 83.9 | Confident | 81 | Confident | 25 Ų | 25 | 54.8 Ų | 54.8 | 26% | 0.258 | 27% | 0.269 | S | S | . | . | I | π-helix | trans | -73.5 | -54.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | W311 C319 L320 | W311-G315 WeakPolarHBondContact O-CA 3.31Å; W311-G315 PolarHBondContact O-N 3.31Å; G315-C319 WeakPolarHBondContact O-CB 3.4Å; G315-C319 PolarHBondContact O-N 3.04Å; G315-L320 WeakPolarHBondContact O-CB 3.16Å; G315-L320 PolarHBondContact O-N 3.15Å |
| 316 | C | 82.4 | Confident | 81.4 | Confident | 34 Ų | 34 | 56.3 Ų | 56.3 | 23% | 0.23 | 28% | 0.281 | C | S | . | . | I | π-helix | trans | -84.1 | -41.4 | -170.9 | -58.1 | 0 | 0 | 0 | 0 | 112.9 | W312 P321 | W312-C316 HydrophobicContact CD2-CB 4.39Å; W312-C316 WeakPolarHBondContact O-CA 3.34Å; W312-C316 WeakPolarHBondContact O-CB 3.44Å; W312-C316 PolarHBondContact O-N 2.88Å; C316-P321 VanDerWaalsContact O-CD 3.28Å; C316-P321 WeakPolarHBondContact O-CD 3.28Å |
| 317 | Y | 83.1 | Confident | 81.8 | Confident | 4 Ų | 4 | 57.1 Ų | 57.1 | 2% | 0.016 | 29% | 0.29 | C | S | . | . | I | π-helix | trans | -89.2 | -28.7 | -178.3 | -63.5 | -55.7 | 0 | 0 | 0 | 113.3 | V211 L214 T218 L262 W312 Y313 P321 Y368 | V211-Y317 HydrophobicContact CG1-CE2 4.3Å; L214-Y317 HydrophobicContact CD2-CD2 3.8Å; L214-Y317 HydrophobicContact CD2-CG 3.83Å; L214-Y317 HydrophobicContact CG-CD1 4.3Å; L214-Y317 HydrophobicContact CG-CD2 4.42Å; L214-Y317 HydrophobicContact CG-CG 4.03Å; T218-Y317 HydrophobicContact CG2-CD1 4.23Å; T218-Y317 PolarHBondContact OG1-O 3.24Å; L262-Y317 WeakPolarHBondContact CB-OH 3.37Å; W312-Y317 AromaticContact CD1-CE2 3.91Å; Y313-Y317 AromaticContact CD1-CD2 3.99Å; Y313-Y317 HydrophobicContact CD1-CD2 3.99Å; Y313-Y317 HydrophobicContact CD2-CD2 4.38Å; Y313-Y317 HydrophobicContact CD2-CE2 4.46Å; Y313-Y317 HydrophobicContact CE1-CD2 4.5Å; Y313-Y317 AromaticContact CG-CD2 3.99Å; Y313-Y317 HydrophobicContact CG-CD2 3.99Å; Y313-Y317 HydrophobicContact CG-CE2 4.49Å; Y313-Y317 WeakPolarHBondContact O-CA 3.48Å; Y313-Y317 WeakPolarHBondContact O-CB 3.49Å; Y313-Y317 PolarHBondContact O-N 3.07Å; Y313-Y317 VanDerWaalsContact O-N 3.1Å; Y317-P321 WeakPolarHBondContact O-CG 3.37Å; Y317-Y368 PolarHBondContact O-OH 3.43Å |
| 318 | F | 83.5 | Confident | 82.2 | Confident | 30 Ų | 30 | 52 Ų | 52 | 13% | 0.132 | 26% | 0.264 | C | S | . | . | I | π-helix | trans | -101.3 | -62.3 | 178.8 | -177.1 | -100.7 | 0 | 0 | 0 | 113 | Y313 F314 I322 L373 | Y313-F318 PolarHBondContact O-N 3.47Å; Y313-F318 VanDerWaalsContact O-N 3.14Å; F314-F318 HydrophobicContact CD2-CD1 4.1Å; F314-F318 AromaticContact CE2-CD1 3.84Å; F314-F318 HydrophobicContact CE2-CD1 3.84Å; F314-F318 HydrophobicContact CE2-CE1 4.17Å; F314-F318 VanDerWaalsContact O-CB 3.31Å; F314-F318 WeakPolarHBondContact O-CB 3.49Å; F314-F318 PolarHBondContact O-N 2.91Å; F318-I322 HydrophobicContact CD1-CD1 4.25Å; F318-I322 HydrophobicContact CD2-CD1 3.72Å; F318-I322 HydrophobicContact CE1-CD1 4.04Å; F318-I322 HydrophobicContact CE2-CD1 3.49Å; F318-I322 VanDerWaalsContact CE2-CD1 3.49Å; F318-I322 HydrophobicContact CG-CD1 4.1Å; F318-I322 HydrophobicContact CZ-CD1 3.66Å; F318-I322 WeakPolarHBondContact O-CD1 3.47Å; F318-I322 VanDerWaalsContact O-CG1 3.24Å; F318-I322 WeakPolarHBondContact O-CG1 3.36Å; F318-I322 PolarHBondContact O-N 3.42Å; F318-L373 HydrophobicContact CZ-CD1 4.48Å; F318-L373 HydrophobicContact CZ-CG 4.43Å |
| 319 | C | 84.3 | Confident | 82.2 | Confident | 34 Ų | 34 | 51.1 Ų | 51.1 | 23% | 0.23 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -68.3 | -46.9 | -172.5 | -65.9 | 0 | 0 | 0 | 0 | 113.6 | F314 G315 I322 L323 | F314-C319 WeakPolarHBondContact CE1-SG 3.17Å; F314-C319 PolarHBondContact O-N 2.93Å; F314-C319 PolarHBondContact O-SG 3.48Å; F314-C319 VanDerWaalsContact O-SG 3.34Å; G315-C319 WeakPolarHBondContact O-CB 3.4Å; G315-C319 PolarHBondContact O-N 3.04Å; C319-I322 PolarHBondContact O-N 3.3Å; C319-L323 HydrophobicContact CB-CD1 4.32Å; C319-L323 VanDerWaalsContact O-CB 3.29Å; C319-L323 WeakPolarHBondContact O-CB 3.28Å; C319-L323 VanDerWaalsContact O-CG 3.22Å; C319-L323 WeakPolarHBondContact O-CG 3.4Å; C319-L323 PolarHBondContact O-N 2.86Å |
| 320 | L | 85 | Confident | 82.2 | Confident | 90 Ų | 90 | 53 Ų | 53 | 47% | 0.471 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -57.6 | -55.2 | -175.7 | -168.6 | 165.7 | 0 | 0 | 0 | 112.7 | G315 I322 L323 F324 | G315-L320 WeakPolarHBondContact O-CB 3.16Å; G315-L320 PolarHBondContact O-N 3.15Å; L320-I322 VanDerWaalsContact C-N 3.34Å; L320-I322 PolarHBondContact O-N 2.99Å; L320-L323 PolarHBondContact O-N 3.35Å; L320-F324 HydrophobicContact CD2-CB 4.48Å; L320-F324 WeakPolarHBondContact O-CB 3.42Å; L320-F324 PolarHBondContact O-N 3.43Å |
| 321 | P | 83.8 | Confident | 82.4 | Confident | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.006 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.1 | -36.9 | -179.8 | 23.2 | -33.8 | 0 | 0 | 0 | 112.7 | T218 C316 Y317 T325 Y368 | T218-P321 HydrophobicContact CG2-CB 4Å; T218-P321 HydrophobicContact CG2-CG 3.72Å; C316-P321 VanDerWaalsContact O-CD 3.28Å; C316-P321 WeakPolarHBondContact O-CD 3.28Å; Y317-P321 WeakPolarHBondContact O-CG 3.37Å; P321-T325 VanDerWaalsContact O-CB 3.28Å; P321-T325 WeakPolarHBondContact O-CB 3.37Å; P321-T325 WeakPolarHBondContact O-CG2 3.38Å; P321-T325 PolarHBondContact O-N 2.87Å; P321-T325 PolarHBondContact O-OG1 3.4Å; P321-Y368 HydrophobicContact CG-CE1 4.17Å |
| 322 | I | 84 | Confident | 82.1 | Confident | 32 Ų | 32 | 45.4 Ų | 45.4 | 16% | 0.164 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.4 | -52.8 | 178.4 | -65.4 | 172.4 | 0 | 0 | 0 | 110 | F318 C319 L320 F324 T325 V326 Y368 A369 | F318-I322 HydrophobicContact CD1-CD1 4.25Å; F318-I322 HydrophobicContact CD2-CD1 3.72Å; F318-I322 HydrophobicContact CE1-CD1 4.04Å; F318-I322 HydrophobicContact CE2-CD1 3.49Å; F318-I322 VanDerWaalsContact CE2-CD1 3.49Å; F318-I322 HydrophobicContact CG-CD1 4.1Å; F318-I322 HydrophobicContact CZ-CD1 3.66Å; F318-I322 WeakPolarHBondContact O-CD1 3.47Å; F318-I322 VanDerWaalsContact O-CG1 3.24Å; F318-I322 WeakPolarHBondContact O-CG1 3.36Å; F318-I322 PolarHBondContact O-N 3.42Å; C319-I322 PolarHBondContact O-N 3.3Å; L320-I322 VanDerWaalsContact C-N 3.34Å; L320-I322 PolarHBondContact O-N 2.99Å; I322-F324 VanDerWaalsContact C-N 3.29Å; I322-F324 PolarHBondContact O-N 2.76Å; I322-T325 PolarHBondContact O-N 2.76Å; I322-T325 PolarHBondContact O-OG1 2.9Å; I322-T325 VanDerWaalsContact O-OG1 3.14Å; I322-V326 HydrophobicContact CG2-CG2 4.19Å; I322-V326 VanDerWaalsContact O-CB 3.24Å; I322-V326 WeakPolarHBondContact O-CB 3.19Å; I322-V326 WeakPolarHBondContact O-CG2 3.42Å; I322-V326 PolarHBondContact O-N 3.1Å; I322-Y368 HydrophobicContact CG1-CD1 4.47Å; I322-A369 HydrophobicContact CD1-CB 3.96Å |
| 323 | L | 86.6 | Confident | 81.5 | Confident | 113 Ų | 113 | 46 Ų | 46 | 59% | 0.592 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -60.3 | -42.1 | 179.1 | -70.2 | 172.6 | 0 | 0 | 0 | 111.3 | C319 L320 T327 | C319-L323 HydrophobicContact CB-CD1 4.32Å; C319-L323 VanDerWaalsContact O-CB 3.29Å; C319-L323 WeakPolarHBondContact O-CB 3.28Å; C319-L323 VanDerWaalsContact O-CG 3.22Å; C319-L323 WeakPolarHBondContact O-CG 3.4Å; C319-L323 PolarHBondContact O-N 2.86Å; L320-L323 PolarHBondContact O-N 3.35Å; L323-T327 WeakPolarHBondContact O-CB 3.11Å; L323-T327 PolarHBondContact O-N 3.17Å; L323-T327 PolarHBondContact O-OG1 2.95Å |
| 324 | F | 85.3 | Confident | 81.2 | Confident | 72 Ų | 72 | 55.5 Ų | 55.5 | 32% | 0.316 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -65.2 | -50.1 | 179.6 | -177.5 | -95.3 | 0 | 0 | 0 | 111.8 | C222 I226 L320 I322 T327 C328 | C222-F324 HydrophobicContact CB-CD1 4.18Å; C222-F324 HydrophobicContact CB-CE1 4.39Å; C222-F324 WeakPolarHBondContact O-CE1 3.34Å; I226-F324 HydrophobicContact CD1-CE1 4.31Å; I226-F324 HydrophobicContact CD1-CZ 4.08Å; I226-F324 HydrophobicContact CG1-CE1 3.66Å; I226-F324 HydrophobicContact CG1-CZ 3.48Å; I226-F324 VanDerWaalsContact CG1-CZ 3.48Å; L320-F324 HydrophobicContact CD2-CB 4.48Å; L320-F324 WeakPolarHBondContact O-CB 3.42Å; L320-F324 PolarHBondContact O-N 3.43Å; I322-F324 VanDerWaalsContact C-N 3.29Å; I322-F324 PolarHBondContact O-N 2.76Å; F324-T327 PolarHBondContact O-N 3.03Å; F324-C328 WeakPolarHBondContact O-CB 3.34Å; F324-C328 PolarHBondContact O-N 3.28Å; F324-C328 PolarHBondContact O-SG 3.4Å |
| 325 | T | 81.9 | Confident | 80.7 | Confident | 1 Ų | 1 | 55.5 Ų | 55.5 | 1% | 0.006 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.6 | -43 | 179.5 | 54.2 | 0 | 0 | 0 | 0 | 111.9 | L221 P321 I322 C328 Q329 T365 | L221-T325 HydrophobicContact CB-CG2 4.34Å; L221-T325 WeakPolarHBondContact O-CG2 3.14Å; P321-T325 VanDerWaalsContact O-CB 3.28Å; P321-T325 WeakPolarHBondContact O-CB 3.37Å; P321-T325 WeakPolarHBondContact O-CG2 3.38Å; P321-T325 PolarHBondContact O-N 2.87Å; P321-T325 PolarHBondContact O-OG1 3.4Å; I322-T325 PolarHBondContact O-N 2.76Å; I322-T325 PolarHBondContact O-OG1 2.9Å; I322-T325 VanDerWaalsContact O-OG1 3.14Å; T325-C328 PolarHBondContact O-N 2.76Å; T325-Q329 WeakPolarHBondContact O-CB 3.34Å; T325-Q329 VanDerWaalsContact O-CG 3.23Å; T325-Q329 WeakPolarHBondContact O-CG 3.34Å; T325-Q329 PolarHBondContact O-N 3.17Å; T325-T365 VanDerWaalsContact OG1-CG2 3.3Å; T325-T365 WeakPolarHBondContact OG1-CG2 3.29Å; T325-T365 PolarHBondContact OG1-OG1 3.35Å |
| 326 | V | 83.2 | Confident | 79.8 | Confident | 57 Ų | 57 | 58.1 Ų | 58.1 | 35% | 0.345 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63 | -44 | 175.8 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | I322 C328 Q329 L330 | I322-V326 HydrophobicContact CG2-CG2 4.19Å; I322-V326 VanDerWaalsContact O-CB 3.24Å; I322-V326 WeakPolarHBondContact O-CB 3.19Å; I322-V326 WeakPolarHBondContact O-CG2 3.42Å; I322-V326 PolarHBondContact O-N 3.1Å; V326-C328 PolarHBondContact O-N 3.14Å; V326-Q329 PolarHBondContact O-N 2.81Å; V326-L330 HydrophobicContact CG1-CD1 3.89Å; V326-L330 HydrophobicContact CG1-CG 4.15Å; V326-L330 WeakPolarHBondContact O-CB 3.44Å; V326-L330 VanDerWaalsContact O-CG 3.28Å; V326-L330 WeakPolarHBondContact O-CG 3.2Å; V326-L330 PolarHBondContact O-N 3.45Å |
| 327 | T | 83.4 | Confident | 78.6 | Confident | 79 Ų | 79 | 57.5 Ų | 57.5 | 49% | 0.485 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.2 | -46.2 | 176.9 | -58.6 | 0 | 0 | 0 | 0 | 110.9 | L323 F324 Q329 L330 V331 | L323-T327 WeakPolarHBondContact O-CB 3.11Å; L323-T327 PolarHBondContact O-N 3.17Å; L323-T327 PolarHBondContact O-OG1 2.95Å; F324-T327 PolarHBondContact O-N 3.03Å; T327-Q329 VanDerWaalsContact C-N 3.28Å; T327-Q329 PolarHBondContact O-N 2.79Å; T327-L330 PolarHBondContact O-N 2.92Å; T327-V331 HydrophobicContact CG2-CG2 4.4Å; T327-V331 VanDerWaalsContact O-CG2 3.31Å; T327-V331 WeakPolarHBondContact O-CG2 3.47Å; T327-V331 PolarHBondContact O-N 3.19Å |
| 328 | C | 80.2 | Confident | 77.3 | Confident | 15 Ų | 15 | 61.4 Ų | 61.4 | 10% | 0.101 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -58.3 | -41 | 175.9 | -70.6 | 0 | 0 | 0 | 0 | 111.9 | F229 F324 T325 V326 T332 | F229-C328 HydrophobicContact CB-CB 4.23Å; F324-C328 WeakPolarHBondContact O-CB 3.34Å; F324-C328 PolarHBondContact O-N 3.28Å; F324-C328 PolarHBondContact O-SG 3.4Å; T325-C328 PolarHBondContact O-N 2.76Å; V326-C328 PolarHBondContact O-N 3.14Å; C328-T332 VanDerWaalsContact O-CB 3.27Å; C328-T332 WeakPolarHBondContact O-CB 3.42Å; C328-T332 PolarHBondContact O-N 3.35Å; C328-T332 PolarHBondContact O-OG1 3.43Å |
| 329 | Q | 76.3 | Confident | 75.7 | Confident | 21 Ų | 21 | 65 Ų | 65 | 10% | 0.098 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -69.2 | -44 | 177.2 | -73.6 | 173.6 | 7.8 | 0 | 0 | 112.2 | T325 V326 T327 V331 T332 W333 V361 V362 | T325-Q329 WeakPolarHBondContact O-CB 3.34Å; T325-Q329 VanDerWaalsContact O-CG 3.23Å; T325-Q329 WeakPolarHBondContact O-CG 3.34Å; T325-Q329 PolarHBondContact O-N 3.17Å; V326-Q329 PolarHBondContact O-N 2.81Å; T327-Q329 VanDerWaalsContact C-N 3.28Å; T327-Q329 PolarHBondContact O-N 2.79Å; Q329-V331 PolarHBondContact O-N 2.84Å; Q329-T332 CarbonylContact O-C 3.58Å; Q329-T332 WeakPolarHBondContact O-CB 3.32Å; Q329-T332 PolarHBondContact O-N 3.29Å; Q329-W333 WeakPolarHBondContact O-CB 3.36Å; Q329-W333 PolarHBondContact O-N 3.07Å; Q329-V361 VanDerWaalsContact NE2-C 3.35Å; Q329-V361 PolarHBondContact NE2-O 3.34Å; Q329-V362 VanDerWaalsContact CD-CG2 3.48Å; Q329-V362 HydrophobicContact CG-CG2 4.36Å |
| 330 | L | 78.2 | Confident | 74.3 | Confident | 86 Ų | 86 | 67.4 Ų | 67.4 | 45% | 0.45 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 176.3 | -73.8 | 174.8 | 0 | 0 | 0 | 110.8 | V326 T327 T332 W333 R334 | V326-L330 HydrophobicContact CG1-CD1 3.89Å; V326-L330 HydrophobicContact CG1-CG 4.15Å; V326-L330 WeakPolarHBondContact O-CB 3.44Å; V326-L330 VanDerWaalsContact O-CG 3.28Å; V326-L330 WeakPolarHBondContact O-CG 3.2Å; V326-L330 PolarHBondContact O-N 3.45Å; T327-L330 PolarHBondContact O-N 2.92Å; L330-T332 VanDerWaalsContact C-N 3.32Å; L330-T332 PolarHBondContact O-N 2.98Å; L330-W333 HydrophobicContact CD2-CE3 4.34Å; L330-W333 PolarHBondContact O-N 3.32Å; L330-R334 WeakPolarHBondContact O-CB 3.22Å; L330-R334 WeakPolarHBondContact O-CG 3.43Å; L330-R334 PolarHBondContact O-N 3.04Å |
| 331 | V | 80.4 | Confident | 72.6 | Confident | 59 Ų | 59 | 73.1 Ų | 73.1 | 36% | 0.358 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.8 | -42.1 | 176.9 | -178.3 | 0 | 0 | 0 | 0 | 110.4 | F229 T327 Q329 W333 R334 V335 | F229-V331 HydrophobicContact CD2-CB 4.49Å; F229-V331 HydrophobicContact CD2-CG1 4.46Å; F229-V331 HydrophobicContact CE2-CB 4.04Å; F229-V331 HydrophobicContact CE2-CG1 3.63Å; T327-V331 HydrophobicContact CG2-CG2 4.4Å; T327-V331 VanDerWaalsContact O-CG2 3.31Å; T327-V331 WeakPolarHBondContact O-CG2 3.47Å; T327-V331 PolarHBondContact O-N 3.19Å; Q329-V331 PolarHBondContact O-N 2.84Å; V331-W333 VanDerWaalsContact C-N 3.31Å; V331-W333 PolarHBondContact O-N 3.44Å; V331-R334 PolarHBondContact O-N 2.68Å; V331-V335 HydrophobicContact CG1-CG2 4.31Å; V331-V335 VanDerWaalsContact O-CG2 3.31Å; V331-V335 WeakPolarHBondContact O-CG2 3.44Å; V331-V335 PolarHBondContact O-N 3.29Å |
| 332 | T | 72.4 | Confident | 70.5 | Confident | 3 Ų | 3 | 81.6 Ų | 81.6 | 2% | 0.018 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -57 | -43.7 | 173.7 | -64.2 | 0 | 0 | 0 | 0 | 112 | A232 C328 Q329 L330 V335 R336 N358 | A232-T332 HydrophobicContact CB-CG2 3.37Å; A232-T332 WeakPolarHBondContact CB-OG1 3.37Å; C328-T332 VanDerWaalsContact O-CB 3.27Å; C328-T332 WeakPolarHBondContact O-CB 3.42Å; C328-T332 PolarHBondContact O-N 3.35Å; C328-T332 PolarHBondContact O-OG1 3.43Å; Q329-T332 CarbonylContact O-C 3.58Å; Q329-T332 WeakPolarHBondContact O-CB 3.32Å; Q329-T332 PolarHBondContact O-N 3.29Å; L330-T332 VanDerWaalsContact C-N 3.32Å; L330-T332 PolarHBondContact O-N 2.98Å; T332-V335 PolarHBondContact O-N 2.8Å; T332-R336 PolarHBondContact O-N 3.45Å; T332-N358 WeakPolarHBondContact CG2-ND2 3.36Å |
| 333 | W | 70.1 | Confident | 68.4 | Low | 109 Ų | 109 | 85.3 Ų | 85.3 | 41% | 0.413 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -68.8 | -35.6 | 177.4 | -68.8 | 3.3 | 0 | 0 | 0 | 112.4 | Q329 L330 V331 G337 V362 | Q329-W333 WeakPolarHBondContact O-CB 3.36Å; Q329-W333 PolarHBondContact O-N 3.07Å; L330-W333 HydrophobicContact CD2-CE3 4.34Å; L330-W333 PolarHBondContact O-N 3.32Å; V331-W333 VanDerWaalsContact C-N 3.31Å; V331-W333 PolarHBondContact O-N 3.44Å; W333-G337 CarbonylContact O-C 3.27Å; W333-G337 VanDerWaalsContact O-C 3.27Å; W333-G337 WeakPolarHBondContact O-CA 3.41Å; W333-G337 PolarHBondContact O-N 3Å; W333-V362 HydrophobicContact CZ2-CG2 3.86Å |
| 334 | R | 75.5 | Confident | 66.2 | Low | 218 Ų | 218 | 89.2 Ų | 89.2 | 82% | 0.823 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -68.1 | -37.9 | 175.9 | -69.3 | -66.6 | -172.7 | 141.2 | 3.6 | 112 | L330 V331 | L330-R334 WeakPolarHBondContact O-CB 3.22Å; L330-R334 WeakPolarHBondContact O-CG 3.43Å; L330-R334 PolarHBondContact O-N 3.04Å; V331-R334 PolarHBondContact O-N 2.68Å |
| 335 | V | 72.3 | Confident | 64 | Low | 82 Ų | 82 | 91.4 Ų | 91.4 | 50% | 0.497 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -72.6 | -44.1 | 178.5 | 174.1 | 0 | 0 | 0 | 0 | 111.4 | V331 T332 | V331-V335 HydrophobicContact CG1-CG2 4.31Å; V331-V335 VanDerWaalsContact O-CG2 3.31Å; V331-V335 WeakPolarHBondContact O-CG2 3.44Å; V331-V335 PolarHBondContact O-N 3.29Å; T332-V335 PolarHBondContact O-N 2.8Å |
| 336 | R | 63.6 | Low | 62.1 | Low | 80 Ų | 80 | 102.9 Ų | 102.9 | 30% | 0.302 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -83.1 | -21.6 | -179.9 | -76.8 | -177.9 | 166.7 | 120.9 | 0.3 | 114.2 | V231 A232 T332 E354 | V231-R336 PolarHBondContact O-NH2 3.24Å; V231-R336 VanDerWaalsContact O-NH2 3.11Å; A232-R336 VanDerWaalsContact CA-CZ 3.5Å; T332-R336 PolarHBondContact O-N 3.45Å; R336-E354 IonicContact CZ-OE2 3.34Å; R336-E354 IonicContact NE-OE2 3.69Å; R336-E354 IonicContact NH2-OE1 3.17Å; R336-E354 PolarHBondContact NH2-OE1 2.9Å; R336-E354 IonicContact NH2-OE2 2.63Å; R336-E354 PolarHBondContact NH2-OE2 3.03Å |
| 337 | G | 58 | Low | 60.2 | Low | 21 Ų | 21 | 104.3 Ų | 104.3 | 22% | 0.216 | 55% | 0.55 | C | S | . | * | trans | 89 | 154.4 | -170.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | W333 | W333-G337 CarbonylContact O-C 3.27Å; W333-G337 VanDerWaalsContact O-C 3.27Å; W333-G337 WeakPolarHBondContact O-CA 3.41Å; W333-G337 PolarHBondContact O-N 3Å | ||
| 338 | P | 55.5 | Low | 58.6 | Low | 86 Ų | 86 | 103.3 Ų | 103.3 | 56% | 0.558 | 55% | 0.547 | S | S | * | . | trans | -61.7 | 142.7 | 179.9 | 18.9 | -25.2 | 0 | 0 | 0 | 111.6 | G340 R341 | P338-G340 PolarHBondContact O-N 3.26Å; P338-R341 HydrophobicContact CG-CB 4.47Å; P338-R341 PolarHBondContact O-N 3.37Å | ||
| 339 | P | 50.8 | Low | 57.1 | Low | 106 Ų | 106 | 107.8 Ų | 107.8 | 69% | 0.688 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | 109 | 177.3 | 24.2 | -30.9 | 0 | 0 | 0 | 108.6 | ||
| 340 | G | 52.9 | Low | 55.6 | Low | 85 Ų | 85 | 112.6 Ų | 112.6 | 88% | 0.876 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 121.1 | -1.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | P338 | P338-G340 PolarHBondContact O-N 3.26Š|
| 341 | R | 49.3 | Very low | 54.2 | Low | 210 Ų | 210 | 113.9 Ų | 113.9 | 79% | 0.792 | 59% | 0.59 | S | S | * | * | trans | -128.4 | 83.6 | 175.3 | -155.2 | 176.1 | -176.9 | -178.8 | 0.9 | 112.2 | P338 | P338-R341 HydrophobicContact CG-CB 4.47Å; P338-R341 PolarHBondContact O-N 3.37Å | ||
| 342 | K | 41.5 | Very low | 52.5 | Low | 179 Ų | 179 | 118.3 Ų | 118.3 | 78% | 0.778 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -164.7 | 147.1 | 147.4 | -101.5 | 158.5 | -166.4 | -177.2 | 0 | 112 | ||
| 343 | S | 39.1 | Very low | 51.5 | Low | 109 Ų | 109 | 121.4 Ų | 121.4 | 76% | 0.762 | 63% | 0.628 | S | S | * | * | trans | -55.6 | 149.4 | -165.8 | 170.3 | 0 | 0 | 0 | 0 | 115.3 | C345 | S343-C345 VanDerWaalsContact C-N 3.34Å; S343-C345 PolarHBondContact O-N 3.49Å | ||
| 344 | E | 40.7 | Very low | 50.6 | Low | 196 Ų | 196 | 117.7 Ų | 117.7 | 92% | 0.916 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -47.3 | 86.1 | 168.9 | -68 | 165.7 | 120.3 | 0 | 0 | 112.6 | ||
| 345 | C | 38.3 | Very low | 49.6 | Very low | 117 Ų | 117 | 110.5 Ų | 110.5 | 79% | 0.791 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -155.6 | 100 | 156.3 | -135.1 | 0 | 0 | 0 | 0 | 109.6 | S343 A347 | S343-C345 VanDerWaalsContact C-N 3.34Å; S343-C345 PolarHBondContact O-N 3.49Å; C345-A347 PolarHBondContact O-N 3.49Å |
| 346 | R | 42 | Very low | 48.7 | Very low | 243 Ų | 243 | 110.8 Ų | 110.8 | 92% | 0.917 | 59% | 0.594 | S | S | * | * | trans | 30 | 78.1 | 171.5 | -79.5 | -178.1 | 168.8 | 176.1 | -2.2 | 114.7 | S348 | R346-S348 PolarHBondContact O-N 2.9Š| ||
| 347 | A | 43.4 | Very low | 48.5 | Very low | 86 Ų | 86 | 109.3 Ų | 109.3 | 71% | 0.711 | 59% | 0.592 | S | S | * | * | trans | -54.6 | 112.7 | 160.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | C345 E351 | C345-A347 PolarHBondContact O-N 3.49Å; A347-E351 WeakPolarHBondContact CA-OE2 3.29Å | ||
| 348 | S | 49.4 | Very low | 48.7 | Very low | 59 Ų | 59 | 109.2 Ų | 109.2 | 41% | 0.413 | 59% | 0.586 | S | S | . | * | trans | -68.2 | 145.1 | 179.6 | 68.8 | 0 | 0 | 0 | 0 | 108.3 | R346 H350 E351 | R346-S348 PolarHBondContact O-N 2.9Å; S348-H350 PolarHBondContact O-N 3.03Å; S348-E351 PolarHBondContact N-OE2 3.5Å; S348-E351 VanDerWaalsContact N-OE2 3.12Å; S348-E351 PolarHBondContact O-N 3.26Å | ||
| 349 | K | 48.2 | Very low | 49.3 | Very low | 108 Ų | 108 | 108.9 Ų | 108.9 | 47% | 0.47 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -50.7 | -20.9 | 176.1 | -68.8 | 177 | -177.4 | 169 | 0 | 113.4 | C353 I463 Y464 | K349-C353 PolarHBondContact O-N 3.17Å; K349-I463 HydrophobicContact CD-CG2 4.43Å; K349-I463 VanDerWaalsContact NZ-CG2 3.31Å; K349-Y464 HydrophobicContact CD-CE2 3.9Å |
| 350 | H | 44.9 | Very low | 50.1 | Low | 123 Ų | 123 | 104.3 Ų | 104.3 | 57% | 0.569 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.4 | -40.5 | 174.9 | -168.1 | -111.6 | 0 | 0 | 0 | 113 | S348 Q352 C353 E354 | S348-H350 PolarHBondContact O-N 3.03Å; H350-Q352 VanDerWaalsContact C-N 3.34Å; H350-Q352 PolarHBondContact O-N 3.36Å; H350-C353 PolarHBondContact O-N 3.48Å; H350-E354 PolarHBondContact O-N 3.23Å |
| 351 | E | 49.6 | Very low | 51 | Low | 112 Ų | 112 | 100.4 Ų | 100.4 | 52% | 0.523 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.5 | -31.4 | -179.7 | -68.6 | 176.7 | 114.8 | 0 | 0 | 112.5 | A347 S348 S355 | A347-E351 WeakPolarHBondContact CA-OE2 3.29Å; S348-E351 PolarHBondContact N-OE2 3.5Å; S348-E351 VanDerWaalsContact N-OE2 3.12Å; S348-E351 PolarHBondContact O-N 3.26Å; E351-S355 PolarHBondContact O-N 3.06Å; E351-S355 VanDerWaalsContact O-N 3.1Å |
| 352 | Q | 45.7 | Very low | 52.2 | Low | 152 Ų | 152 | 92.2 Ų | 92.2 | 71% | 0.71 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -71.6 | -35.9 | 177.5 | -164.3 | 168.1 | -1.6 | 0 | 0 | 112.3 | H350 Q356 | H350-Q352 VanDerWaalsContact C-N 3.34Å; H350-Q352 PolarHBondContact O-N 3.36Å; Q352-Q356 PolarHBondContact O-N 2.66Å |
| 353 | C | 49.8 | Very low | 53.9 | Low | 68 Ų | 68 | 84.5 Ų | 84.5 | 46% | 0.459 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -70.3 | -37.8 | 175.4 | -162 | 0 | 0 | 0 | 0 | 111.7 | K349 H350 Q356 L357 | K349-C353 PolarHBondContact O-N 3.17Å; H350-C353 PolarHBondContact O-N 3.48Å; C353-Q356 PolarHBondContact O-N 2.89Å; C353-L357 VanDerWaalsContact O-CG 3.31Å; C353-L357 WeakPolarHBondContact O-CG 3.42Å; C353-L357 PolarHBondContact O-N 2.92Å; C353-L357 VanDerWaalsContact O-N 3.11Å |
| 354 | E | 52.7 | Low | 55.7 | Low | 32 Ų | 32 | 79.9 Ų | 79.9 | 15% | 0.15 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -71.8 | -35.8 | 177.7 | -69.7 | -155.5 | 122.8 | 0 | 0 | 113.8 | V231 R336 H350 Q356 L357 N358 | V231-E354 WeakPolarHBondContact CG1-OE1 3.34Å; R336-E354 IonicContact CZ-OE2 3.34Å; R336-E354 IonicContact NE-OE2 3.69Å; R336-E354 IonicContact NH2-OE1 3.17Å; R336-E354 PolarHBondContact NH2-OE1 2.9Å; R336-E354 IonicContact NH2-OE2 2.63Å; R336-E354 PolarHBondContact NH2-OE2 3.03Å; H350-E354 PolarHBondContact O-N 3.23Å; E354-Q356 VanDerWaalsContact C-N 3.31Å; E354-Q356 PolarHBondContact O-N 2.96Å; E354-L357 PolarHBondContact O-N 3.46Å; E354-N358 PolarHBondContact O-N 3.23Å |
| 355 | S | 53.4 | Low | 57.6 | Low | 66 Ų | 66 | 70.9 Ų | 70.9 | 46% | 0.462 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -61.3 | -41.1 | 171.4 | -176.4 | 0 | 0 | 0 | 0 | 111.7 | E351 L357 N358 S359 | E351-S355 PolarHBondContact O-N 3.06Å; E351-S355 VanDerWaalsContact O-N 3.1Å; S355-L357 PolarHBondContact O-N 3.39Å; S355-N358 PolarHBondContact O-N 3.14Å; S355-S359 PolarHBondContact O-N 3.11Å; S355-S359 VanDerWaalsContact O-N 3.08Å |
| 356 | Q | 54.4 | Low | 59.7 | Low | 88 Ų | 88 | 69.6 Ų | 69.6 | 41% | 0.411 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.1 | -39.9 | 176.8 | -166.5 | 175.6 | -0.6 | 0 | 0 | 112.1 | Q352 C353 E354 S359 T360 | Q352-Q356 PolarHBondContact O-N 2.66Å; C353-Q356 PolarHBondContact O-N 2.89Å; E354-Q356 VanDerWaalsContact C-N 3.31Å; E354-Q356 PolarHBondContact O-N 2.96Å; Q356-S359 WeakPolarHBondContact O-CB 3.36Å; Q356-S359 PolarHBondContact O-N 3.45Å; Q356-T360 PolarHBondContact O-N 2.93Å; Q356-T360 PolarHBondContact O-OG1 3.48Å; Q356-T360 VanDerWaalsContact O-OG1 3.13Å |
| 357 | L | 57.8 | Low | 61.6 | Low | 50 Ų | 50 | 58.8 Ų | 58.8 | 26% | 0.262 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -70.7 | -35.6 | 178.3 | -68.8 | 169.6 | 0 | 0 | 0 | 113.2 | C353 E354 S355 S359 T360 V361 | C353-L357 VanDerWaalsContact O-CG 3.31Å; C353-L357 WeakPolarHBondContact O-CG 3.42Å; C353-L357 PolarHBondContact O-N 2.92Å; C353-L357 VanDerWaalsContact O-N 3.11Å; E354-L357 PolarHBondContact O-N 3.46Å; S355-L357 PolarHBondContact O-N 3.39Å; L357-S359 VanDerWaalsContact C-N 3.34Å; L357-T360 PolarHBondContact O-N 2.97Å; L357-V361 VanDerWaalsContact O-CG2 3.24Å; L357-V361 WeakPolarHBondContact O-CG2 3.1Å; L357-V361 PolarHBondContact O-N 3.27Å |
| 358 | N | 62.9 | Low | 63.5 | Low | 18 Ų | 18 | 55.5 Ų | 55.5 | 10% | 0.096 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66.2 | -38 | 172.3 | -77.6 | -13.8 | 0 | 0 | 0 | 111.6 | T332 E354 S355 T360 V361 V362 | T332-N358 WeakPolarHBondContact CG2-ND2 3.36Å; E354-N358 PolarHBondContact O-N 3.23Å; S355-N358 PolarHBondContact O-N 3.14Å; N358-T360 VanDerWaalsContact C-N 3.33Å; N358-T360 PolarHBondContact O-N 3.32Å; N358-V361 PolarHBondContact O-N 3.28Å; N358-V362 WeakPolarHBondContact O-CG2 3.26Å; N358-V362 PolarHBondContact O-N 3.49Å; N358-V362 VanDerWaalsContact O-N 3.08Å |
| 359 | S | 67.3 | Low | 65.2 | Low | 79 Ų | 79 | 53.7 Ų | 53.7 | 55% | 0.552 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -63.3 | -36.7 | 173.6 | -177.9 | 0 | 0 | 0 | 0 | 112.3 | S355 Q356 L357 V362 G363 | S355-S359 PolarHBondContact O-N 3.11Å; S355-S359 VanDerWaalsContact O-N 3.08Å; Q356-S359 WeakPolarHBondContact O-CB 3.36Å; Q356-S359 PolarHBondContact O-N 3.45Å; L357-S359 VanDerWaalsContact C-N 3.34Å; S359-V362 PolarHBondContact O-N 3.39Å; S359-G363 PolarHBondContact O-N 3.49Å |
| 360 | T | 69.1 | Low | 66.9 | Low | 11 Ų | 11 | 56.1 Ų | 56.1 | 7% | 0.067 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.7 | -39.8 | 174.1 | -59.1 | 0 | 0 | 0 | 0 | 112.6 | Q356 L357 N358 G363 L364 I419 C420 | Q356-T360 PolarHBondContact O-N 2.93Å; Q356-T360 PolarHBondContact O-OG1 3.48Å; Q356-T360 VanDerWaalsContact O-OG1 3.13Å; L357-T360 PolarHBondContact O-N 2.97Å; N358-T360 VanDerWaalsContact C-N 3.33Å; N358-T360 PolarHBondContact O-N 3.32Å; T360-G363 PolarHBondContact O-N 3.41Å; T360-L364 WeakPolarHBondContact O-CB 3.2Å; T360-L364 PolarHBondContact O-N 2.86Å; T360-I419 HydrophobicContact CG2-CG2 4.08Å; T360-C420 HydrophobicContact CG2-CB 4.39Å; T360-C420 WeakPolarHBondContact CG2-SG 3.32Å |
| 361 | V | 72.3 | Confident | 68.7 | Low | 3 Ų | 3 | 51.1 Ų | 51.1 | 2% | 0.018 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -71 | -40.6 | 178.7 | -169.9 | 0 | 0 | 0 | 0 | 111.2 | W165 R228 Q329 L357 N358 G363 L364 T365 | W165-V361 HydrophobicContact CH2-CB 4.15Å; W165-V361 HydrophobicContact CH2-CG1 4.21Å; W165-V361 HydrophobicContact CH2-CG2 3.2Å; W165-V361 HydrophobicContact CZ2-CG2 4.01Å; W165-V361 HydrophobicContact CZ3-CG2 3.71Å; R228-V361 HydrophobicContact CG-CB 4.46Å; R228-V361 HydrophobicContact CG-CG2 3.48Å; R228-V361 VanDerWaalsContact CG-CG2 3.48Å; Q329-V361 VanDerWaalsContact NE2-C 3.35Å; Q329-V361 PolarHBondContact NE2-O 3.34Å; L357-V361 VanDerWaalsContact O-CG2 3.24Å; L357-V361 WeakPolarHBondContact O-CG2 3.1Å; L357-V361 PolarHBondContact O-N 3.27Å; N358-V361 PolarHBondContact O-N 3.28Å; V361-G363 VanDerWaalsContact C-N 3.31Å; V361-G363 PolarHBondContact O-N 3.14Å; V361-L364 PolarHBondContact O-N 2.88Å; V361-T365 PolarHBondContact O-N 3.46Å; V361-T365 PolarHBondContact O-OG1 2.94Å |
| 362 | V | 73.8 | Confident | 70.3 | Confident | 37 Ų | 37 | 45.9 Ų | 45.9 | 22% | 0.224 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59 | -47.3 | 173.1 | 177.1 | 0 | 0 | 0 | 0 | 109.5 | Q329 W333 N358 S359 L364 T365 V366 | Q329-V362 VanDerWaalsContact CD-CG2 3.48Å; Q329-V362 HydrophobicContact CG-CG2 4.36Å; W333-V362 HydrophobicContact CZ2-CG2 3.86Å; N358-V362 WeakPolarHBondContact O-CG2 3.26Å; N358-V362 PolarHBondContact O-N 3.49Å; N358-V362 VanDerWaalsContact O-N 3.08Å; S359-V362 PolarHBondContact O-N 3.39Å; V362-L364 VanDerWaalsContact C-N 3.33Å; V362-L364 PolarHBondContact O-N 3.01Å; V362-T365 PolarHBondContact O-N 2.93Å; V362-V366 HydrophobicContact CG1-CG2 4.45Å; V362-V366 VanDerWaalsContact O-CG2 3.29Å; V362-V366 WeakPolarHBondContact O-CG2 3.42Å; V362-V366 PolarHBondContact O-N 3.35Å |
| 363 | G | 76.9 | Confident | 72 | Confident | 18 Ų | 18 | 42.7 Ų | 42.7 | 19% | 0.186 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.6 | -45.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S359 T360 V361 V366 V367 | S359-G363 PolarHBondContact O-N 3.49Å; T360-G363 PolarHBondContact O-N 3.41Å; V361-G363 VanDerWaalsContact C-N 3.31Å; V361-G363 PolarHBondContact O-N 3.14Å; G363-V366 PolarHBondContact O-N 2.87Å; G363-V367 WeakPolarHBondContact O-CB 3.49Å; G363-V367 VanDerWaalsContact O-CG2 3.29Å; G363-V367 WeakPolarHBondContact O-CG2 3.43Å; G363-V367 PolarHBondContact O-N 3.22Å |
| 364 | L | 76.9 | Confident | 73.5 | Confident | 11 Ų | 11 | 42.4 Ų | 42.4 | 6% | 0.058 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.2 | -41.5 | 178.3 | -177.2 | 56.7 | 0 | 0 | 0 | 112.7 | L169 L221 L224 T360 V361 V362 V367 Y368 L416 | L169-L364 HydrophobicContact CD2-CD2 4.21Å; L221-L364 HydrophobicContact CD2-CD1 4.46Å; L221-L364 HydrophobicContact CD2-CD2 3.76Å; L221-L364 HydrophobicContact CD2-CG 3.63Å; L224-L364 HydrophobicContact CD1-CD2 3.66Å; T360-L364 WeakPolarHBondContact O-CB 3.2Å; T360-L364 PolarHBondContact O-N 2.86Å; V361-L364 PolarHBondContact O-N 2.88Å; V362-L364 VanDerWaalsContact C-N 3.33Å; V362-L364 PolarHBondContact O-N 3.01Å; L364-V367 PolarHBondContact O-N 3.12Å; L364-Y368 WeakPolarHBondContact O-CB 3.24Å; L364-Y368 PolarHBondContact O-N 2.84Å; L364-L416 HydrophobicContact CD1-CD2 3.45Å; L364-L416 VanDerWaalsContact CD1-CD2 3.45Å; L364-L416 HydrophobicContact CD1-CG 4.25Å; L364-L416 HydrophobicContact CD2-CD2 4.31Å; L364-L416 HydrophobicContact CG-CD2 4.41Å |
| 365 | T | 80.4 | Confident | 74.8 | Confident | 8 Ų | 8 | 42 Ų | 42 | 5% | 0.049 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.9 | -41.8 | 174.3 | -60 | 0 | 0 | 0 | 0 | 111.4 | T325 V361 V362 Y368 A369 | T325-T365 VanDerWaalsContact OG1-CG2 3.3Å; T325-T365 WeakPolarHBondContact OG1-CG2 3.29Å; T325-T365 PolarHBondContact OG1-OG1 3.35Å; V361-T365 PolarHBondContact O-N 3.46Å; V361-T365 PolarHBondContact O-OG1 2.94Å; V362-T365 PolarHBondContact O-N 2.93Å; T365-Y368 PolarHBondContact O-N 3.33Å; T365-A369 WeakPolarHBondContact O-CB 3.3Å; T365-A369 PolarHBondContact O-N 2.8Å |
| 366 | V | 82.9 | Confident | 76.1 | Confident | 90 Ų | 90 | 39.6 Ų | 39.6 | 55% | 0.545 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -64.6 | -43.9 | 177.3 | 169.9 | 0 | 0 | 0 | 0 | 110.9 | V362 G363 A369 F370 | V362-V366 HydrophobicContact CG1-CG2 4.45Å; V362-V366 VanDerWaalsContact O-CG2 3.29Å; V362-V366 WeakPolarHBondContact O-CG2 3.42Å; V362-V366 PolarHBondContact O-N 3.35Å; G363-V366 PolarHBondContact O-N 2.87Å; V366-A369 PolarHBondContact O-N 3.34Å; V366-F370 WeakPolarHBondContact O-CB 3.45Å; V366-F370 PolarHBondContact O-N 3.15Å |
| 367 | V | 82.7 | Confident | 77.4 | Confident | 15 Ų | 15 | 38.9 Ų | 38.9 | 9% | 0.091 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.4 | -46.8 | 176.1 | 164.2 | 0 | 0 | 0 | 0 | 111.2 | G363 L364 A369 F370 C371 L415 I419 | G363-V367 WeakPolarHBondContact O-CB 3.49Å; G363-V367 VanDerWaalsContact O-CG2 3.29Å; G363-V367 WeakPolarHBondContact O-CG2 3.43Å; G363-V367 PolarHBondContact O-N 3.22Å; L364-V367 PolarHBondContact O-N 3.12Å; V367-A369 PolarHBondContact O-N 2.86Å; V367-F370 PolarHBondContact O-N 3.43Å; V367-C371 WeakPolarHBondContact O-CB 3.46Å; V367-C371 PolarHBondContact O-N 3.25Å; V367-C371 PolarHBondContact O-SG 2.86Å; V367-L415 HydrophobicContact CB-CD1 4.21Å; V367-L415 HydrophobicContact CG1-CB 3.87Å; V367-L415 HydrophobicContact CG1-CD1 3.39Å; V367-L415 HydrophobicContact CG1-CG 4.28Å; V367-L415 HydrophobicContact CG2-CB 4.03Å; V367-L415 HydrophobicContact CG2-CD1 3.82Å; V367-L415 HydrophobicContact CG2-CG 4.42Å; V367-I419 HydrophobicContact CB-CD1 4.48Å; V367-I419 HydrophobicContact CG2-CD1 3.35Å |
| 368 | Y | 83.4 | Confident | 78.3 | Confident | 17 Ų | 17 | 37.7 Ų | 37.7 | 7% | 0.067 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.8 | -48 | 175.9 | 176.7 | -103.9 | 0 | 0 | 0 | 111.6 | T217 T218 L221 Y317 P321 I322 L364 T365 F370 C371 T372 | T217-Y368 WeakPolarHBondContact OG1-CE2 3.46Å; T218-Y368 PolarHBondContact OG1-OH 2.88Å; T218-Y368 VanDerWaalsContact OG1-OH 3.04Å; L221-Y368 HydrophobicContact CD1-CD1 3.47Å; L221-Y368 VanDerWaalsContact CD1-CD1 3.47Å; L221-Y368 HydrophobicContact CD1-CD2 3.54Å; L221-Y368 HydrophobicContact CD1-CE1 3.92Å; L221-Y368 HydrophobicContact CD1-CE2 3.99Å; L221-Y368 HydrophobicContact CD1-CG 3.25Å; Y317-Y368 PolarHBondContact O-OH 3.43Å; P321-Y368 HydrophobicContact CG-CE1 4.17Å; I322-Y368 HydrophobicContact CG1-CD1 4.47Å; L364-Y368 WeakPolarHBondContact O-CB 3.24Å; L364-Y368 PolarHBondContact O-N 2.84Å; T365-Y368 PolarHBondContact O-N 3.33Å; Y368-F370 PolarHBondContact O-N 3.47Å; Y368-C371 PolarHBondContact O-N 3.4Å; Y368-T372 WeakPolarHBondContact CE2-OG1 3.37Å; Y368-T372 VanDerWaalsContact O-CB 3.29Å; Y368-T372 WeakPolarHBondContact O-CB 3.47Å; Y368-T372 PolarHBondContact O-N 3.45Å; Y368-T372 PolarHBondContact O-OG1 2.87Å |
| 369 | A | 84.1 | Confident | 78.9 | Confident | 22 Ų | 22 | 38.5 Ų | 38.5 | 18% | 0.182 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.3 | -48.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | I322 T365 V366 V367 T372 L373 | I322-A369 HydrophobicContact CD1-CB 3.96Å; T365-A369 WeakPolarHBondContact O-CB 3.3Å; T365-A369 PolarHBondContact O-N 2.8Å; V366-A369 PolarHBondContact O-N 3.34Å; V367-A369 PolarHBondContact O-N 2.86Å; A369-T372 PolarHBondContact O-N 3.11Å; A369-L373 VanDerWaalsContact O-CB 3.29Å; A369-L373 WeakPolarHBondContact O-CB 3.1Å; A369-L373 PolarHBondContact O-N 3.42Å |
| 370 | F | 83.9 | Confident | 79.5 | Confident | 158 Ų | 158 | 37.8 Ų | 37.8 | 69% | 0.693 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -63 | -43 | 179.7 | -178.3 | -99.1 | 0 | 0 | 0 | 112.8 | V366 V367 Y368 P374 | V366-F370 WeakPolarHBondContact O-CB 3.45Å; V366-F370 PolarHBondContact O-N 3.15Å; V367-F370 PolarHBondContact O-N 3.43Å; Y368-F370 PolarHBondContact O-N 3.47Å; F370-P374 WeakPolarHBondContact O-CD 3.41Å |
| 371 | C | 83.1 | Confident | 80.1 | Confident | 18 Ų | 18 | 39.7 Ų | 39.7 | 12% | 0.122 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -76.9 | -25.3 | -177.6 | -57.9 | 0 | 0 | 0 | 0 | 113.1 | V367 Y368 K408 | V367-C371 WeakPolarHBondContact O-CB 3.46Å; V367-C371 PolarHBondContact O-N 3.25Å; V367-C371 PolarHBondContact O-SG 2.86Å; Y368-C371 PolarHBondContact O-N 3.4Å; C371-K408 HydrophobicContact CB-CB 4.26Å; C371-K408 HydrophobicContact CB-CD 4.3Å; C371-K408 HydrophobicContact CB-CG 3.75Å |
| 372 | T | 82.1 | Confident | 80.1 | Confident | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.012 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -94.7 | -17.4 | -178.6 | -38.7 | 0 | 0 | 0 | 0 | 112.1 | L214 Y368 A369 N376 | L214-T372 HydrophobicContact CD1-CG2 4.11Å; Y368-T372 WeakPolarHBondContact CE2-OG1 3.37Å; Y368-T372 VanDerWaalsContact O-CB 3.29Å; Y368-T372 WeakPolarHBondContact O-CB 3.47Å; Y368-T372 PolarHBondContact O-N 3.45Å; Y368-T372 PolarHBondContact O-OG1 2.87Å; A369-T372 PolarHBondContact O-N 3.11Å; T372-N376 VanDerWaalsContact CG2-ND2 3.34Å; T372-N376 WeakPolarHBondContact CG2-ND2 3.09Å; T372-N376 PolarHBondContact O-N 3.47Å; T372-N376 VanDerWaalsContact O-N 3.14Å; T372-N376 PolarHBondContact O-ND2 3.49Å |
| 373 | L | 82.3 | Confident | 80 | Confident | 86 Ų | 86 | 42.1 Ų | 42.1 | 45% | 0.45 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -59.2 | -48.8 | -179.9 | -140.6 | 148.5 | 0 | 0 | 0 | 113.2 | F318 A369 E375 N376 V377 | F318-L373 HydrophobicContact CZ-CD1 4.48Å; F318-L373 HydrophobicContact CZ-CG 4.43Å; A369-L373 VanDerWaalsContact O-CB 3.29Å; A369-L373 WeakPolarHBondContact O-CB 3.1Å; A369-L373 PolarHBondContact O-N 3.42Å; L373-E375 VanDerWaalsContact C-N 3.33Å; L373-E375 PolarHBondContact O-N 3.03Å; L373-N376 PolarHBondContact O-N 2.96Å; L373-V377 HydrophobicContact CD2-CG2 3.71Å; L373-V377 WeakPolarHBondContact O-CG2 3.08Å; L373-V377 PolarHBondContact O-N 3.12Å |
| 374 | P | 81 | Confident | 80 | Confident | 61 Ų | 61 | 48 Ų | 48 | 40% | 0.396 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | -177.7 | -23 | 34.1 | 0 | 0 | 0 | 112.1 | F370 N376 V377 C378 | F370-P374 WeakPolarHBondContact O-CD 3.41Å; P374-N376 PolarHBondContact O-N 2.9Å; P374-V377 PolarHBondContact O-N 2.69Å; P374-C378 WeakPolarHBondContact O-CB 3.36Å; P374-C378 PolarHBondContact O-N 3.15Å; P374-C378 PolarHBondContact O-SG 3.3Å; P374-C378 VanDerWaalsContact O-SG 3.32Å |
| 375 | E | 80.2 | Confident | 80 | Confident | 24 Ų | 24 | 50.5 Ų | 50.5 | 11% | 0.112 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 177.6 | -165.9 | -172.9 | 147.5 | 0 | 0 | 111.3 | L373 V377 C378 N379 N401 | L373-E375 VanDerWaalsContact C-N 3.33Å; L373-E375 PolarHBondContact O-N 3.03Å; E375-V377 PolarHBondContact O-N 2.87Å; E375-C378 PolarHBondContact O-N 2.89Å; E375-N379 WeakPolarHBondContact O-CB 3.35Å; E375-N379 VanDerWaalsContact O-CG 3.24Å; E375-N379 PolarHBondContact O-N 3.43Å; E375-N379 PolarHBondContact O-ND2 3.25Å; E375-N379 VanDerWaalsContact O-ND2 3.08Å; E375-N401 WeakPolarHBondContact CG-OD1 3.44Å; E375-N401 PolarHBondContact O-OD1 2.96Å |
| 376 | N | 80.4 | Confident | 79.5 | Confident | 16 Ų | 16 | 52.7 Ų | 52.7 | 9% | 0.086 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.9 | -40.4 | 176.5 | -76.9 | -69 | 0 | 0 | 0 | 112.3 | T372 L373 P374 N379 I380 | T372-N376 VanDerWaalsContact CG2-ND2 3.34Å; T372-N376 WeakPolarHBondContact CG2-ND2 3.09Å; T372-N376 PolarHBondContact O-N 3.47Å; T372-N376 VanDerWaalsContact O-N 3.14Å; T372-N376 PolarHBondContact O-ND2 3.49Å; L373-N376 PolarHBondContact O-N 2.96Å; P374-N376 PolarHBondContact O-N 2.9Å; N376-N379 PolarHBondContact O-N 2.9Å; N376-I380 WeakPolarHBondContact O-CB 3.47Å; N376-I380 WeakPolarHBondContact O-CD1 3.31Å; N376-I380 WeakPolarHBondContact O-CG1 3.34Å; N376-I380 PolarHBondContact O-N 3.34Å |
| 377 | V | 81.3 | Confident | 78.6 | Confident | 73 Ų | 73 | 54.5 Ų | 54.5 | 44% | 0.442 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.8 | -46.2 | 176.9 | 172.3 | 0 | 0 | 0 | 0 | 110.4 | L373 P374 E375 N379 I380 V381 | L373-V377 HydrophobicContact CD2-CG2 3.71Å; L373-V377 WeakPolarHBondContact O-CG2 3.08Å; L373-V377 PolarHBondContact O-N 3.12Å; P374-V377 PolarHBondContact O-N 2.69Å; E375-V377 PolarHBondContact O-N 2.87Å; V377-N379 PolarHBondContact O-N 3.49Å; V377-I380 PolarHBondContact O-N 3.48Å; V377-V381 HydrophobicContact CG1-CG2 4.31Å; V377-V381 VanDerWaalsContact O-CG2 3.26Å; V377-V381 WeakPolarHBondContact O-CG2 3.44Å; V377-V381 PolarHBondContact O-N 3.23Å |
| 378 | C | 76.6 | Confident | 78.1 | Confident | 24 Ų | 24 | 61.2 Ų | 61.2 | 16% | 0.162 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.4 | -47.4 | 176.2 | -73.2 | 0 | 0 | 0 | 0 | 111.7 | P374 E375 I380 V381 V382 N401 | P374-C378 WeakPolarHBondContact O-CB 3.36Å; P374-C378 PolarHBondContact O-N 3.15Å; P374-C378 PolarHBondContact O-SG 3.3Å; P374-C378 VanDerWaalsContact O-SG 3.32Å; E375-C378 PolarHBondContact O-N 2.89Å; C378-I380 VanDerWaalsContact C-N 3.31Å; C378-I380 PolarHBondContact O-N 3.43Å; C378-V381 PolarHBondContact O-N 3.31Å; C378-V382 WeakPolarHBondContact O-CG2 3.28Å; C378-V382 PolarHBondContact O-N 2.87Å; C378-N401 HydrophobicContact CB-CB 4.22Å |
| 379 | N | 76.9 | Confident | 77.6 | Confident | 36 Ų | 36 | 62.9 Ų | 62.9 | 19% | 0.193 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.5 | -42 | 176.7 | -75.4 | -37.2 | 0 | 0 | 0 | 112.3 | M310 E375 N376 V377 A383 N401 | M310-N379 VanDerWaalsContact SD-O 3.4Å; E375-N379 WeakPolarHBondContact O-CB 3.35Å; E375-N379 VanDerWaalsContact O-CG 3.24Å; E375-N379 PolarHBondContact O-N 3.43Å; E375-N379 PolarHBondContact O-ND2 3.25Å; E375-N379 VanDerWaalsContact O-ND2 3.08Å; N376-N379 PolarHBondContact O-N 2.9Å; V377-N379 PolarHBondContact O-N 3.49Å; N379-A383 PolarHBondContact O-N 3.49Å; N379-N401 PolarHBondContact OD1-ND2 3.49Å; N379-N401 PolarHBondContact OD1-OD1 2.91Å |
| 380 | I | 80.3 | Confident | 77.1 | Confident | 64 Ų | 64 | 66.1 Ų | 66.1 | 33% | 0.328 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.6 | -47.4 | 176.8 | -70.1 | 166.5 | 0 | 0 | 0 | 110.7 | M310 F314 N376 V377 C378 V382 A383 Y384 | M310-I380 HydrophobicContact CE-CG1 4.42Å; F314-I380 HydrophobicContact CD2-CD1 4.31Å; N376-I380 WeakPolarHBondContact O-CB 3.47Å; N376-I380 WeakPolarHBondContact O-CD1 3.31Å; N376-I380 WeakPolarHBondContact O-CG1 3.34Å; N376-I380 PolarHBondContact O-N 3.34Å; V377-I380 PolarHBondContact O-N 3.48Å; C378-I380 VanDerWaalsContact C-N 3.31Å; C378-I380 PolarHBondContact O-N 3.43Å; I380-V382 PolarHBondContact O-N 3.41Å; I380-A383 PolarHBondContact O-N 3.06Å; I380-Y384 HydrophobicContact CG2-CD2 3.71Å; I380-Y384 HydrophobicContact CG2-CE2 3.99Å; I380-Y384 VanDerWaalsContact O-CD2 3.32Å; I380-Y384 WeakPolarHBondContact O-CD2 3.2Å; I380-Y384 PolarHBondContact O-N 2.86Å |
| 381 | V | 80.3 | Confident | 76.4 | Confident | 51 Ų | 51 | 68.5 Ų | 68.5 | 31% | 0.309 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.4 | -46.5 | 179.8 | 171.1 | 0 | 0 | 0 | 0 | 111 | V377 C378 A383 Y384 L385 L397 | V377-V381 HydrophobicContact CG1-CG2 4.31Å; V377-V381 VanDerWaalsContact O-CG2 3.26Å; V377-V381 WeakPolarHBondContact O-CG2 3.44Å; V377-V381 PolarHBondContact O-N 3.23Å; C378-V381 PolarHBondContact O-N 3.31Å; V381-A383 VanDerWaalsContact C-N 3.3Å; V381-A383 PolarHBondContact O-N 3.43Å; V381-Y384 PolarHBondContact O-N 3.29Å; V381-L385 HydrophobicContact CG1-CD1 4.04Å; V381-L385 WeakPolarHBondContact O-CB 3.24Å; V381-L385 PolarHBondContact O-N 3.13Å; V381-L397 HydrophobicContact CB-CD2 4.31Å; V381-L397 HydrophobicContact CG1-CD2 3.58Å |
| 382 | V | 73.4 | Confident | 75.7 | Confident | 47 Ų | 47 | 75.1 Ų | 75.1 | 29% | 0.285 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -57.1 | -45.2 | 177.5 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | C378 I380 S386 L394 L397 | C378-V382 WeakPolarHBondContact O-CG2 3.28Å; C378-V382 PolarHBondContact O-N 2.87Å; I380-V382 PolarHBondContact O-N 3.41Å; V382-S386 WeakPolarHBondContact O-CA 3.38Å; V382-S386 WeakPolarHBondContact O-CB 3.39Å; V382-S386 PolarHBondContact O-N 3.34Å; V382-S386 VanDerWaalsContact O-N 3.09Å; V382-L394 HydrophobicContact CG1-CD2 4.36Å; V382-L397 HydrophobicContact CG2-CB 3.78Å; V382-L397 HydrophobicContact CG2-CD2 3.72Å; V382-L397 HydrophobicContact CG2-CG 4.24Å |
| 383 | A | 72.1 | Confident | 75.3 | Confident | 43 Ų | 43 | 77.6 Ų | 77.6 | 36% | 0.355 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -71.9 | -43.2 | -176 | 0 | 0 | 0 | 0 | 0 | 113.6 | M310 N379 I380 V381 S386 | M310-A383 HydrophobicContact CE-CB 3.13Å; M310-A383 HydrophobicContact CG-CB 4.09Å; M310-A383 HydrophobicContact SD-CB 3.34Å; M310-A383 WeakPolarHBondContact SD-CB 3.43Å; N379-A383 PolarHBondContact O-N 3.49Å; I380-A383 PolarHBondContact O-N 3.06Å; V381-A383 VanDerWaalsContact C-N 3.3Å; V381-A383 PolarHBondContact O-N 3.43Å; A383-S386 PolarHBondContact O-OG 2.89Å; A383-S386 VanDerWaalsContact O-OG 3.07Å |
| 384 | Y | 76 | Confident | 74.8 | Confident | 142 Ų | 142 | 75.6 Ų | 75.6 | 56% | 0.557 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -82.1 | -32.3 | -176.5 | -75.6 | -78.4 | 0 | 0 | 0 | 113.8 | M310 I380 V381 | M310-Y384 HydrophobicContact CE-CD2 3.84Å; M310-Y384 HydrophobicContact CE-CE2 3.51Å; I380-Y384 HydrophobicContact CG2-CD2 3.71Å; I380-Y384 HydrophobicContact CG2-CE2 3.99Å; I380-Y384 VanDerWaalsContact O-CD2 3.32Å; I380-Y384 WeakPolarHBondContact O-CD2 3.2Å; I380-Y384 PolarHBondContact O-N 2.86Å; V381-Y384 PolarHBondContact O-N 3.29Å |
| 385 | L | 77.3 | Confident | 74.3 | Confident | 64 Ų | 64 | 78.1 Ų | 78.1 | 34% | 0.335 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -101.3 | 7.7 | 179.6 | -69.3 | 110.1 | 0 | 0 | 0 | 113.3 | V381 T387 E388 L389 | V381-L385 HydrophobicContact CG1-CD1 4.04Å; V381-L385 WeakPolarHBondContact O-CB 3.24Å; V381-L385 PolarHBondContact O-N 3.13Å; L385-T387 PolarHBondContact O-N 2.9Å; L385-T387 VanDerWaalsContact O-N 3.11Å; L385-E388 PolarHBondContact O-N 2.87Å; L385-L389 HydrophobicContact CB-CD1 3.67Å; L385-L389 HydrophobicContact CB-CG 3.94Å; L385-L389 WeakPolarHBondContact O-CB 3.33Å; L385-L389 WeakPolarHBondContact O-CG 3.24Å; L385-L389 PolarHBondContact O-N 2.92Å |
| 386 | S | 68.7 | Low | 73.8 | Confident | 54 Ų | 54 | 81.7 Ų | 81.7 | 38% | 0.378 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.1 | -31.4 | 177.3 | 50.2 | 0 | 0 | 0 | 0 | 114.2 | V382 A383 | V382-S386 WeakPolarHBondContact O-CA 3.38Å; V382-S386 WeakPolarHBondContact O-CB 3.39Å; V382-S386 PolarHBondContact O-N 3.34Å; V382-S386 VanDerWaalsContact O-N 3.09Å; A383-S386 PolarHBondContact O-OG 2.89Å; A383-S386 VanDerWaalsContact O-OG 3.07Å |
| 387 | T | 64.7 | Low | 73.4 | Confident | 127 Ų | 127 | 82.2 Ų | 82.2 | 78% | 0.779 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84 | -18.8 | -178.9 | 48 | 0 | 0 | 0 | 0 | 114 | L385 | L385-T387 PolarHBondContact O-N 2.9Å; L385-T387 VanDerWaalsContact O-N 3.11Å |
| 388 | E | 71.8 | Confident | 73 | Confident | 157 Ų | 157 | 80.3 Ų | 80.3 | 73% | 0.734 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.2 | -21.3 | -177.5 | -66.4 | -179.2 | 172.9 | 0 | 0 | 112.4 | L385 | L385-E388 PolarHBondContact O-N 2.87Š|
| 389 | L | 72.4 | Confident | 73 | Confident | 52 Ų | 52 | 81.2 Ų | 81.2 | 27% | 0.272 | 43% | 0.428 | S | S | . | . | S | Bend | trans | -87.9 | 145.1 | -175.7 | -67 | 171.7 | 0 | 0 | 0 | 112.7 | L385 T393 L394 L397 | L385-L389 HydrophobicContact CB-CD1 3.67Å; L385-L389 HydrophobicContact CB-CG 3.94Å; L385-L389 WeakPolarHBondContact O-CB 3.33Å; L385-L389 WeakPolarHBondContact O-CG 3.24Å; L385-L389 PolarHBondContact O-N 2.92Å; L389-T393 HydrophobicContact CD1-CG2 4.43Å; L389-T393 HydrophobicContact CD2-CG2 3.98Å; L389-L394 HydrophobicContact CB-CD2 4.32Å; L389-L394 HydrophobicContact CB-CG 4.17Å; L389-L394 HydrophobicContact CD1-CD2 4.27Å; L389-L397 HydrophobicContact CD1-CD2 4.43Å |
| 390 | T | 74 | Confident | 73 | Confident | 90 Ų | 90 | 83.1 Ų | 83.1 | 55% | 0.552 | 44% | 0.437 | S | S | * | . | trans | -68.1 | 148.7 | 173.1 | -55.3 | 0 | 0 | 0 | 0 | 110.1 | Q392 T393 L394 | T390-Q392 HydrophobicContact CG2-CB 4.49Å; T390-Q392 PolarHBondContact O-N 2.64Å; T390-Q392 VanDerWaalsContact O-N 3.12Å; T390-T393 WeakPolarHBondContact O-CB 3.29Å; T390-T393 PolarHBondContact O-N 2.97Å; T390-L394 PolarHBondContact O-N 3.39Å | ||
| 391 | R | 69.9 | Low | 73 | Confident | 207 Ų | 207 | 81.5 Ų | 81.5 | 78% | 0.781 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -49.9 | -39.3 | 178.1 | -75.8 | -170 | 179 | 174.5 | -1.9 | 113.4 | T393 L394 D395 | R391-T393 VanDerWaalsContact C-N 3.32Å; R391-T393 PolarHBondContact O-N 3.4Å; R391-L394 PolarHBondContact O-N 3.35Å; R391-D395 PolarHBondContact O-N 2.77Å |
| 392 | Q | 69.2 | Low | 73 | Confident | 157 Ų | 157 | 81.4 Ų | 81.4 | 73% | 0.734 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -61 | -37.7 | 176.8 | -67.7 | 179.9 | -34.2 | 0 | 0 | 113.3 | T390 L396 | T390-Q392 HydrophobicContact CG2-CB 4.49Å; T390-Q392 PolarHBondContact O-N 2.64Å; T390-Q392 VanDerWaalsContact O-N 3.12Å; Q392-L396 WeakPolarHBondContact O-CB 3.29Å; Q392-L396 PolarHBondContact O-N 3Å; Q392-L396 VanDerWaalsContact O-N 3.12Å |
| 393 | T | 72.2 | Confident | 73.4 | Confident | 55 Ų | 55 | 80.6 Ų | 80.6 | 34% | 0.337 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -72.9 | -33.3 | 178.8 | -49.2 | 0 | 0 | 0 | 0 | 111.4 | L389 T390 R391 L397 | L389-T393 HydrophobicContact CD1-CG2 4.43Å; L389-T393 HydrophobicContact CD2-CG2 3.98Å; T390-T393 WeakPolarHBondContact O-CB 3.29Å; T390-T393 PolarHBondContact O-N 2.97Å; R391-T393 VanDerWaalsContact C-N 3.32Å; R391-T393 PolarHBondContact O-N 3.4Å; T393-L397 HydrophobicContact CG2-CD1 4.25Å; T393-L397 WeakPolarHBondContact O-CB 3.25Å; T393-L397 PolarHBondContact O-N 3.19Å |
| 394 | L | 71.8 | Confident | 73.8 | Confident | 44 Ų | 44 | 79.9 Ų | 79.9 | 23% | 0.23 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -69.3 | -42.4 | 176 | -70.9 | 168.5 | 0 | 0 | 0 | 112 | V382 L389 T390 R391 L396 L397 G398 | V382-L394 HydrophobicContact CG1-CD2 4.36Å; L389-L394 HydrophobicContact CB-CD2 4.32Å; L389-L394 HydrophobicContact CB-CG 4.17Å; L389-L394 HydrophobicContact CD1-CD2 4.27Å; T390-L394 PolarHBondContact O-N 3.39Å; R391-L394 PolarHBondContact O-N 3.35Å; L394-L396 VanDerWaalsContact C-N 3.32Å; L394-L396 PolarHBondContact O-N 2.89Å; L394-L397 PolarHBondContact O-N 3.48Å; L394-G398 PolarHBondContact O-N 3.33Å |
| 395 | D | 70.1 | Confident | 74.2 | Confident | 114 Ų | 114 | 73.9 Ų | 73.9 | 61% | 0.61 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -62.6 | -41.4 | 174.9 | -66.8 | -19.6 | 0 | 0 | 0 | 111 | R391 G398 L399 | R391-D395 PolarHBondContact O-N 2.77Å; D395-G398 PolarHBondContact O-N 3.16Å; D395-L399 WeakPolarHBondContact O-CG 3.31Å; D395-L399 PolarHBondContact O-N 2.85Å |
| 396 | L | 71.5 | Confident | 74.7 | Confident | 99 Ų | 99 | 70.9 Ų | 70.9 | 52% | 0.518 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -67.9 | -38.9 | 177.6 | -167.3 | 140.3 | 0 | 0 | 0 | 112.5 | Q392 L394 L399 I400 | Q392-L396 WeakPolarHBondContact O-CB 3.29Å; Q392-L396 PolarHBondContact O-N 3Å; Q392-L396 VanDerWaalsContact O-N 3.12Å; L394-L396 VanDerWaalsContact C-N 3.32Å; L394-L396 PolarHBondContact O-N 2.89Å; L396-L399 PolarHBondContact O-N 3.39Å; L396-I400 HydrophobicContact CD2-CD1 3.53Å; L396-I400 HydrophobicContact CD2-CG1 4.36Å; L396-I400 VanDerWaalsContact O-CG1 3.3Å; L396-I400 WeakPolarHBondContact O-CG1 3.36Å; L396-I400 PolarHBondContact O-N 2.71Å |
| 397 | L | 70.9 | Confident | 75.6 | Confident | 27 Ų | 27 | 73.6 Ų | 73.6 | 14% | 0.141 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 173.2 | -107.5 | 63.5 | 0 | 0 | 0 | 112.2 | V381 V382 L389 T393 L394 I400 N401 | V381-L397 HydrophobicContact CB-CD2 4.31Å; V381-L397 HydrophobicContact CG1-CD2 3.58Å; V382-L397 HydrophobicContact CG2-CB 3.78Å; V382-L397 HydrophobicContact CG2-CD2 3.72Å; V382-L397 HydrophobicContact CG2-CG 4.24Å; L389-L397 HydrophobicContact CD1-CD2 4.43Å; T393-L397 HydrophobicContact CG2-CD1 4.25Å; T393-L397 WeakPolarHBondContact O-CB 3.25Å; T393-L397 PolarHBondContact O-N 3.19Å; L394-L397 PolarHBondContact O-N 3.48Å; L397-I400 PolarHBondContact O-N 3.14Å; L397-N401 VanDerWaalsContact O-CB 3.29Å; L397-N401 WeakPolarHBondContact O-CB 3.46Å; L397-N401 PolarHBondContact O-N 3.11Å |
| 398 | G | 73.9 | Confident | 76.7 | Confident | 33 Ų | 33 | 68.2 Ų | 68.2 | 34% | 0.34 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59.8 | -46.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | L394 D395 N401 Q402 | L394-G398 PolarHBondContact O-N 3.33Å; D395-G398 PolarHBondContact O-N 3.16Å; G398-N401 PolarHBondContact O-N 3.36Å; G398-Q402 WeakPolarHBondContact O-CB 3.29Å; G398-Q402 PolarHBondContact O-N 2.86Å |
| 399 | L | 74.8 | Confident | 77.4 | Confident | 42 Ų | 42 | 60.9 Ų | 60.9 | 22% | 0.22 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.9 | -50.5 | 173.7 | -75.3 | 167.2 | 0 | 0 | 0 | 111.7 | E191 D395 L396 N401 Q402 F403 | E191-L399 HydrophobicContact CG-CD2 3.91Å; D395-L399 WeakPolarHBondContact O-CG 3.31Å; D395-L399 PolarHBondContact O-N 2.85Å; L396-L399 PolarHBondContact O-N 3.39Å; L399-N401 VanDerWaalsContact C-N 3.29Å; L399-N401 PolarHBondContact O-N 3.3Å; L399-Q402 PolarHBondContact O-N 3.35Å; L399-F403 HydrophobicContact CD2-CE2 4.2Å; L399-F403 WeakPolarHBondContact O-CD2 3.08Å; L399-F403 PolarHBondContact O-N 3.39Å |
| 400 | I | 78.3 | Confident | 78.1 | Confident | 76 Ų | 76 | 58.5 Ų | 58.5 | 39% | 0.39 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -57.8 | -44.3 | 178.9 | -71.3 | 170.1 | 0 | 0 | 0 | 111.1 | L396 L397 Q402 F403 S404 | L396-I400 HydrophobicContact CD2-CD1 3.53Å; L396-I400 HydrophobicContact CD2-CG1 4.36Å; L396-I400 VanDerWaalsContact O-CG1 3.3Å; L396-I400 WeakPolarHBondContact O-CG1 3.36Å; L396-I400 PolarHBondContact O-N 2.71Å; L397-I400 PolarHBondContact O-N 3.14Å; I400-Q402 VanDerWaalsContact C-N 3.35Å; I400-F403 PolarHBondContact O-N 2.92Å; I400-S404 VanDerWaalsContact O-CB 3.31Å; I400-S404 WeakPolarHBondContact O-CB 3.33Å; I400-S404 PolarHBondContact O-N 3.38Å; I400-S404 PolarHBondContact O-OG 2.86Å |
| 401 | N | 79.6 | Confident | 78.7 | Confident | 31 Ų | 31 | 56.4 Ų | 56.4 | 17% | 0.166 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.8 | -45.4 | 179.8 | -169.5 | 57.8 | 0 | 0 | 0 | 111.2 | E375 C378 N379 L397 G398 L399 S404 A405 | E375-N401 WeakPolarHBondContact CG-OD1 3.44Å; E375-N401 PolarHBondContact O-OD1 2.96Å; C378-N401 HydrophobicContact CB-CB 4.22Å; N379-N401 PolarHBondContact OD1-ND2 3.49Å; N379-N401 PolarHBondContact OD1-OD1 2.91Å; L397-N401 VanDerWaalsContact O-CB 3.29Å; L397-N401 WeakPolarHBondContact O-CB 3.46Å; L397-N401 PolarHBondContact O-N 3.11Å; G398-N401 PolarHBondContact O-N 3.36Å; L399-N401 VanDerWaalsContact C-N 3.29Å; L399-N401 PolarHBondContact O-N 3.3Å; N401-S404 WeakPolarHBondContact O-CB 3.41Å; N401-S404 PolarHBondContact O-N 2.87Å; N401-A405 PolarHBondContact O-N 3.17Å; N401-A405 VanDerWaalsContact O-N 3.12Å |
| 402 | Q | 80.2 | Confident | 79.4 | Confident | 48 Ų | 48 | 47.4 Ų | 47.4 | 22% | 0.224 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -67.3 | -42.4 | 179.8 | -165.9 | 163.1 | 20.6 | 0 | 0 | 112.2 | V187 G398 L399 I400 S404 A405 F406 | V187-Q402 HydrophobicContact CG1-CG 4.14Å; G398-Q402 WeakPolarHBondContact O-CB 3.29Å; G398-Q402 PolarHBondContact O-N 2.86Å; L399-Q402 PolarHBondContact O-N 3.35Å; I400-Q402 VanDerWaalsContact C-N 3.35Å; Q402-S404 VanDerWaalsContact C-N 3.33Å; Q402-S404 PolarHBondContact O-N 3.14Å; Q402-A405 PolarHBondContact O-N 3.35Å; Q402-F406 HydrophobicContact CG-CD2 4.47Å; Q402-F406 HydrophobicContact CG-CE2 3.73Å; Q402-F406 HydrophobicContact CG-CZ 4.37Å; Q402-F406 WeakPolarHBondContact O-CD2 3.22Å; Q402-F406 PolarHBondContact O-N 2.9Å |
| 403 | F | 81.8 | Confident | 80.1 | Confident | 31 Ų | 31 | 40 Ų | 40 | 14% | 0.136 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.6 | -37.4 | 172.7 | -84.3 | -69.8 | 0 | 0 | 0 | 112.7 | I133 A137 I188 L399 I400 A405 F406 F407 | I133-F403 HydrophobicContact CG2-CE1 4.27Å; I133-F403 HydrophobicContact CG2-CE2 3.88Å; I133-F403 HydrophobicContact CG2-CZ 3.37Å; A137-F403 HydrophobicContact CB-CE1 4.27Å; I188-F403 HydrophobicContact CD1-CE1 3.81Å; I188-F403 HydrophobicContact CD1-CZ 3.57Å; L399-F403 HydrophobicContact CD2-CE2 4.2Å; L399-F403 WeakPolarHBondContact O-CD2 3.08Å; L399-F403 PolarHBondContact O-N 3.39Å; I400-F403 PolarHBondContact O-N 2.92Å; F403-A405 VanDerWaalsContact C-N 3.3Å; F403-A405 PolarHBondContact O-N 2.84Å; F403-F406 PolarHBondContact O-N 3.11Å; F403-F407 VanDerWaalsContact O-CB 3.28Å; F403-F407 WeakPolarHBondContact O-CB 3.49Å; F403-F407 PolarHBondContact O-N 3.48Å |
| 404 | S | 81.9 | Confident | 80.6 | Confident | 27 Ų | 27 | 40.3 Ų | 40.3 | 19% | 0.189 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62 | -39.1 | 177.1 | -61.4 | 0 | 0 | 0 | 0 | 111.6 | I400 N401 Q402 F407 K408 | I400-S404 VanDerWaalsContact O-CB 3.31Å; I400-S404 WeakPolarHBondContact O-CB 3.33Å; I400-S404 PolarHBondContact O-N 3.38Å; I400-S404 PolarHBondContact O-OG 2.86Å; N401-S404 WeakPolarHBondContact O-CB 3.41Å; N401-S404 PolarHBondContact O-N 2.87Å; Q402-S404 VanDerWaalsContact C-N 3.33Å; Q402-S404 PolarHBondContact O-N 3.14Å; S404-F407 PolarHBondContact O-N 3.44Å; S404-K408 WeakPolarHBondContact O-CB 3.42Å; S404-K408 PolarHBondContact O-N 3.06Å |
| 405 | A | 83.5 | Confident | 81 | Confident | 16 Ų | 16 | 40.6 Ų | 40.6 | 13% | 0.132 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.3 | -44.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | N401 Q402 F403 K408 G409 | N401-A405 PolarHBondContact O-N 3.17Å; N401-A405 VanDerWaalsContact O-N 3.12Å; Q402-A405 PolarHBondContact O-N 3.35Å; F403-A405 VanDerWaalsContact C-N 3.3Å; F403-A405 PolarHBondContact O-N 2.84Å; A405-K408 WeakPolarHBondContact O-CB 3.41Å; A405-G409 PolarHBondContact O-N 3.21Å |
| 406 | F | 87.7 | Confident | 81.4 | Confident | 2 Ų | 2 | 35.5 Ų | 35.5 | 1% | 0.009 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -69.4 | -41.2 | 176.6 | -61.9 | -56.2 | 0 | 0 | 0 | 112.8 | V140 V179 L180 C183 L184 V187 Q402 F403 K408 G409 A410 | V140-F406 HydrophobicContact CG1-CB 4.14Å; V179-F406 HydrophobicContact CG1-CD1 4.03Å; V179-F406 HydrophobicContact CG1-CE1 3.82Å; L180-F406 HydrophobicContact CD2-CB 4.21Å; L180-F406 HydrophobicContact CD2-CD1 4.39Å; C183-F406 HydrophobicContact CB-CE1 3.98Å; C183-F406 HydrophobicContact CB-CZ 4.31Å; L184-F406 HydrophobicContact CB-CD1 4.11Å; L184-F406 HydrophobicContact CB-CE1 4.11Å; L184-F406 HydrophobicContact CB-CG 4.46Å; L184-F406 HydrophobicContact CB-CZ 4.43Å; L184-F406 HydrophobicContact CD1-CB 3.98Å; L184-F406 HydrophobicContact CD1-CD1 4.04Å; L184-F406 HydrophobicContact CD1-CD2 3.37Å; L184-F406 HydrophobicContact CD1-CE1 4.41Å; L184-F406 HydrophobicContact CD1-CE2 3.76Å; L184-F406 HydrophobicContact CD1-CG 3.53Å; L184-F406 HydrophobicContact CD1-CZ 4.29Å; V187-F406 HydrophobicContact CB-CE2 4.24Å; V187-F406 HydrophobicContact CB-CZ 4.27Å; V187-F406 HydrophobicContact CG1-CE2 4.12Å; V187-F406 HydrophobicContact CG2-CE2 4.3Å; V187-F406 HydrophobicContact CG2-CZ 3.94Å; Q402-F406 HydrophobicContact CG-CD2 4.47Å; Q402-F406 HydrophobicContact CG-CE2 3.73Å; Q402-F406 HydrophobicContact CG-CZ 4.37Å; Q402-F406 WeakPolarHBondContact O-CD2 3.22Å; Q402-F406 PolarHBondContact O-N 2.9Å; F403-F406 PolarHBondContact O-N 3.11Å; F406-K408 VanDerWaalsContact C-N 3.29Å; F406-K408 PolarHBondContact O-N 3.4Å; F406-G409 PolarHBondContact O-N 3.39Å; F406-A410 PolarHBondContact O-N 3.5Å |
| 407 | F | 87.8 | Confident | 81.8 | Confident | 110 Ų | 110 | 31.8 Ų | 31.8 | 48% | 0.482 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -60.1 | -40.8 | 177.6 | -176 | -109.9 | 0 | 0 | 0 | 111.7 | V140 F403 S404 G409 A410 I411 | V140-F407 HydrophobicContact CG2-CD2 4.18Å; F403-F407 VanDerWaalsContact O-CB 3.28Å; F403-F407 WeakPolarHBondContact O-CB 3.49Å; F403-F407 PolarHBondContact O-N 3.48Å; S404-F407 PolarHBondContact O-N 3.44Å; F407-G409 VanDerWaalsContact C-N 3.34Å; F407-G409 PolarHBondContact O-N 3.34Å; F407-A410 PolarHBondContact O-N 3.27Å; F407-I411 HydrophobicContact CD1-CD1 3.86Å; F407-I411 HydrophobicContact CD1-CG1 4.48Å; F407-I411 HydrophobicContact CD2-CD1 4.27Å; F407-I411 HydrophobicContact CD2-CG1 4.47Å; F407-I411 HydrophobicContact CE1-CD1 3.21Å; F407-I411 HydrophobicContact CE1-CG1 4.23Å; F407-I411 HydrophobicContact CE2-CD1 3.67Å; F407-I411 HydrophobicContact CE2-CG1 4.2Å; F407-I411 HydrophobicContact CG-CD1 4.37Å; F407-I411 HydrophobicContact CZ-CD1 3.12Å; F407-I411 HydrophobicContact CZ-CG1 4.11Å; F407-I411 WeakPolarHBondContact O-CB 3.3Å; F407-I411 PolarHBondContact O-N 3.42Å |
| 408 | K | 87.8 | Confident | 82.1 | Confident | 14 Ų | 14 | 35 Ų | 35 | 6% | 0.061 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -54.9 | -49 | 170.5 | 174.9 | -175.2 | 76.8 | 69.2 | 0 | 111.3 | C371 S404 A405 F406 A410 I411 T412 | C371-K408 HydrophobicContact CB-CB 4.26Å; C371-K408 HydrophobicContact CB-CD 4.3Å; C371-K408 HydrophobicContact CB-CG 3.75Å; S404-K408 WeakPolarHBondContact O-CB 3.42Å; S404-K408 PolarHBondContact O-N 3.06Å; A405-K408 WeakPolarHBondContact O-CB 3.41Å; F406-K408 VanDerWaalsContact C-N 3.29Å; F406-K408 PolarHBondContact O-N 3.4Å; K408-A410 VanDerWaalsContact C-N 3.26Å; K408-A410 PolarHBondContact O-N 3.08Å; K408-I411 PolarHBondContact O-N 3.49Å; K408-T412 WeakPolarHBondContact O-CB 3.24Å; K408-T412 PolarHBondContact O-N 3.1Å; K408-T412 PolarHBondContact O-OG1 2.97Å |
| 409 | G | 85.8 | Confident | 82 | Confident | 3 Ų | 3 | 35.7 Ų | 35.7 | 3% | 0.031 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.6 | -31.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | N148 A405 F406 F407 P413 | N148-G409 PolarHBondContact ND2-O 3.36Å; N148-G409 VanDerWaalsContact ND2-O 3.12Å; A405-G409 PolarHBondContact O-N 3.21Å; F406-G409 PolarHBondContact O-N 3.39Å; F407-G409 VanDerWaalsContact C-N 3.34Å; F407-G409 PolarHBondContact O-N 3.34Å; G409-P413 WeakPolarHBondContact O-CD 3.23Å |
| 410 | A | 87.9 | Confident | 81.8 | Confident | 3 Ų | 3 | 34 Ų | 34 | 3% | 0.025 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -79.3 | -36.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V140 F406 F407 K408 P413 | V140-A410 HydrophobicContact CG1-CB 3.86Å; F406-A410 PolarHBondContact O-N 3.5Å; F407-A410 PolarHBondContact O-N 3.27Å; K408-A410 VanDerWaalsContact C-N 3.26Å; K408-A410 PolarHBondContact O-N 3.08Å; A410-P413 WeakPolarHBondContact O-CD 3.29Å; A410-P413 WeakPolarHBondContact O-CG 3.19Å |
| 411 | I | 86.6 | Confident | 81.4 | Confident | 46 Ų | 46 | 38.1 Ų | 38.1 | 24% | 0.236 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -80.3 | -33.5 | -178.2 | -75.3 | -164.7 | 0 | 0 | 0 | 112.9 | F407 K408 V414 L415 | F407-I411 HydrophobicContact CD1-CD1 3.86Å; F407-I411 HydrophobicContact CD1-CG1 4.48Å; F407-I411 HydrophobicContact CD2-CD1 4.27Å; F407-I411 HydrophobicContact CD2-CG1 4.47Å; F407-I411 HydrophobicContact CE1-CD1 3.21Å; F407-I411 HydrophobicContact CE1-CG1 4.23Å; F407-I411 HydrophobicContact CE2-CD1 3.67Å; F407-I411 HydrophobicContact CE2-CG1 4.2Å; F407-I411 HydrophobicContact CG-CD1 4.37Å; F407-I411 HydrophobicContact CZ-CD1 3.12Å; F407-I411 HydrophobicContact CZ-CG1 4.11Å; F407-I411 WeakPolarHBondContact O-CB 3.3Å; F407-I411 PolarHBondContact O-N 3.42Å; K408-I411 PolarHBondContact O-N 3.49Å; I411-V414 WeakPolarHBondContact O-CB 3.31Å; I411-V414 PolarHBondContact O-N 3.42Å; I411-V414 VanDerWaalsContact O-N 3.07Å; I411-L415 HydrophobicContact CG2-CD1 3.26Å; I411-L415 HydrophobicContact CG2-CG 3.61Å; I411-L415 PolarHBondContact O-N 2.66Å |
| 412 | T | 85.2 | Confident | 80.8 | Confident | 18 Ų | 18 | 40.2 Ų | 40.2 | 11% | 0.11 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -49.6 | -51.7 | -178.5 | -62.7 | 0 | 0 | 0 | 0 | 113.4 | K408 V414 L415 L416 | K408-T412 WeakPolarHBondContact O-CB 3.24Å; K408-T412 PolarHBondContact O-N 3.1Å; K408-T412 PolarHBondContact O-OG1 2.97Å; T412-V414 PolarHBondContact O-N 3.47Å; T412-L415 PolarHBondContact O-N 3.08Å; T412-L416 HydrophobicContact CG2-CD1 4Å; T412-L416 HydrophobicContact CG2-CG 4.49Å; T412-L416 WeakPolarHBondContact O-CB 3.27Å; T412-L416 VanDerWaalsContact O-CG 3.24Å; T412-L416 WeakPolarHBondContact O-CG 3.17Å; T412-L416 PolarHBondContact O-N 3.11Å |
| 413 | P | 83.7 | Confident | 80.2 | Confident | 1 Ų | 1 | 38.1 Ų | 38.1 | 1% | 0.006 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.7 | -36.9 | 177.4 | 26.7 | -37.8 | 0 | 0 | 0 | 113.2 | N148 V151 G409 A410 L416 L417 | N148-P413 WeakPolarHBondContact OD1-CG 3.49Å; V151-P413 HydrophobicContact CG2-CB 3.89Å; G409-P413 WeakPolarHBondContact O-CD 3.23Å; A410-P413 WeakPolarHBondContact O-CD 3.29Å; A410-P413 WeakPolarHBondContact O-CG 3.19Å; P413-L416 WeakPolarHBondContact O-CB 3.36Å; P413-L416 PolarHBondContact O-N 3.39Å; P413-L417 VanDerWaalsContact O-CG 3.28Å; P413-L417 WeakPolarHBondContact O-CG 3.41Å; P413-L417 PolarHBondContact O-N 2.71Å |
| 414 | V | 81.8 | Confident | 79.7 | Confident | 61 Ų | 61 | 37.3 Ų | 37.3 | 37% | 0.37 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.7 | -46.8 | 178.6 | 179.3 | 0 | 0 | 0 | 0 | 110.4 | V143 I411 T412 L416 L417 C418 | V143-V414 HydrophobicContact CG1-CG2 4.21Å; I411-V414 WeakPolarHBondContact O-CB 3.31Å; I411-V414 PolarHBondContact O-N 3.42Å; I411-V414 VanDerWaalsContact O-N 3.07Å; T412-V414 PolarHBondContact O-N 3.47Å; V414-L416 VanDerWaalsContact C-N 3.33Å; V414-L416 PolarHBondContact O-N 3.27Å; V414-L417 PolarHBondContact O-N 2.96Å; V414-C418 PolarHBondContact O-N 3.46Å; V414-C418 PolarHBondContact O-SG 3.16Å |
| 415 | L | 81.3 | Confident | 79.3 | Confident | 51 Ų | 51 | 43.9 Ų | 43.9 | 27% | 0.267 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -67.2 | -35.5 | 176.9 | -67.3 | 178.8 | 0 | 0 | 0 | 112 | V367 I411 T412 C418 I419 | V367-L415 HydrophobicContact CB-CD1 4.21Å; V367-L415 HydrophobicContact CG1-CB 3.87Å; V367-L415 HydrophobicContact CG1-CD1 3.39Å; V367-L415 HydrophobicContact CG1-CG 4.28Å; V367-L415 HydrophobicContact CG2-CB 4.03Å; V367-L415 HydrophobicContact CG2-CD1 3.82Å; V367-L415 HydrophobicContact CG2-CG 4.42Å; I411-L415 HydrophobicContact CG2-CD1 3.26Å; I411-L415 HydrophobicContact CG2-CG 3.61Å; I411-L415 PolarHBondContact O-N 2.66Å; T412-L415 PolarHBondContact O-N 3.08Å; L415-C418 PolarHBondContact O-N 3.47Å; L415-I419 WeakPolarHBondContact O-CB 3.19Å; L415-I419 VanDerWaalsContact O-CG1 3.24Å; L415-I419 WeakPolarHBondContact O-CG1 3.43Å; L415-I419 PolarHBondContact O-N 3.21Å |
| 416 | L | 78.1 | Confident | 78.8 | Confident | 7 Ų | 7 | 44.1 Ų | 44.1 | 4% | 0.037 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.8 | -45.2 | 172.1 | -80.3 | 171.6 | 0 | 0 | 0 | 111.8 | L169 L364 T412 P413 V414 I419 C420 | L169-L416 HydrophobicContact CD2-CD1 4.35Å; L169-L416 HydrophobicContact CD2-CD2 3.76Å; L364-L416 HydrophobicContact CD1-CD2 3.45Å; L364-L416 VanDerWaalsContact CD1-CD2 3.45Å; L364-L416 HydrophobicContact CD1-CG 4.25Å; L364-L416 HydrophobicContact CD2-CD2 4.31Å; L364-L416 HydrophobicContact CG-CD2 4.41Å; T412-L416 HydrophobicContact CG2-CD1 4Å; T412-L416 HydrophobicContact CG2-CG 4.49Å; T412-L416 WeakPolarHBondContact O-CB 3.27Å; T412-L416 VanDerWaalsContact O-CG 3.24Å; T412-L416 WeakPolarHBondContact O-CG 3.17Å; T412-L416 PolarHBondContact O-N 3.11Å; P413-L416 WeakPolarHBondContact O-CB 3.36Å; P413-L416 PolarHBondContact O-N 3.39Å; V414-L416 VanDerWaalsContact C-N 3.33Å; V414-L416 PolarHBondContact O-N 3.27Å; L416-I419 PolarHBondContact O-N 3.48Å; L416-C420 WeakPolarHBondContact O-CA 3.38Å; L416-C420 WeakPolarHBondContact O-CB 3.45Å; L416-C420 PolarHBondContact O-N 2.9Å; L416-C420 PolarHBondContact O-SG 3.34Å |
| 417 | L | 78.7 | Confident | 78.2 | Confident | 20 Ų | 20 | 46.8 Ų | 46.8 | 11% | 0.105 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.7 | -39.4 | 176.9 | -69.8 | 171.4 | 0 | 0 | 0 | 112 | V151 I154 P413 V414 L423 G424 F427 | V151-L417 HydrophobicContact CG2-CD1 4.31Å; V151-L417 HydrophobicContact CG2-CD2 4.06Å; V151-L417 HydrophobicContact CG2-CG 4.03Å; I154-L417 HydrophobicContact CD1-CD2 4.2Å; P413-L417 VanDerWaalsContact O-CG 3.28Å; P413-L417 WeakPolarHBondContact O-CG 3.41Å; P413-L417 PolarHBondContact O-N 2.71Å; V414-L417 PolarHBondContact O-N 2.96Å; L417-L423 HydrophobicContact CD2-CD2 3.84Å; L417-L423 HydrophobicContact CD2-CG 3.77Å; L417-G424 WeakPolarHBondContact O-CA 3.28Å; L417-F427 HydrophobicContact CD1-CD1 4.5Å; L417-F427 HydrophobicContact CD1-CD2 4.42Å; L417-F427 HydrophobicContact CD1-CG 4.33Å; L417-F427 HydrophobicContact CD2-CB 4.05Å; L417-F427 HydrophobicContact CD2-CG 4.41Å |
| 418 | C | 77.1 | Confident | 77.6 | Confident | 94 Ų | 94 | 46.3 Ų | 46.3 | 64% | 0.635 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -68.1 | -40.9 | 177.6 | -70.2 | 0 | 0 | 0 | 0 | 113.2 | V414 L415 | V414-C418 PolarHBondContact O-N 3.46Å; V414-C418 PolarHBondContact O-SG 3.16Å; L415-C418 PolarHBondContact O-N 3.47Å |
| 419 | I | 72.4 | Confident | 76.9 | Confident | 49 Ų | 49 | 50.7 Ų | 50.7 | 25% | 0.251 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -84 | -37.4 | -175.2 | -65 | 170.5 | 0 | 0 | 0 | 111 | T360 V367 L415 L416 R421 | T360-I419 HydrophobicContact CG2-CG2 4.08Å; V367-I419 HydrophobicContact CB-CD1 4.48Å; V367-I419 HydrophobicContact CG2-CD1 3.35Å; L415-I419 WeakPolarHBondContact O-CB 3.19Å; L415-I419 VanDerWaalsContact O-CG1 3.24Å; L415-I419 WeakPolarHBondContact O-CG1 3.43Å; L415-I419 PolarHBondContact O-N 3.21Å; L416-I419 PolarHBondContact O-N 3.48Å; I419-R421 PolarHBondContact O-N 3.23Å; I419-R421 VanDerWaalsContact O-N 3.12Å |
| 420 | C | 71.5 | Confident | 76.2 | Confident | 6 Ų | 6 | 53.3 Ų | 53.3 | 4% | 0.041 | 28% | 0.28 | C | S | . | . | trans | -85 | 79.5 | 176.7 | -57.9 | 0 | 0 | 0 | 0 | 110.1 | T360 L416 P422 L423 G424 | T360-C420 HydrophobicContact CG2-CB 4.39Å; T360-C420 WeakPolarHBondContact CG2-SG 3.32Å; L416-C420 WeakPolarHBondContact O-CA 3.38Å; L416-C420 WeakPolarHBondContact O-CB 3.45Å; L416-C420 PolarHBondContact O-N 2.9Å; L416-C420 PolarHBondContact O-SG 3.34Å; C420-P422 VanDerWaalsContact C-N 3.32Å; C420-P422 VanDerWaalsContact O-N 3.12Å; C420-L423 HydrophobicContact CB-CB 3.72Å; C420-L423 HydrophobicContact CB-CD2 4.37Å; C420-L423 WeakPolarHBondContact O-CA 3.5Å; C420-L423 WeakPolarHBondContact O-CB 3.37Å; C420-L423 PolarHBondContact O-N 3.49Å; C420-G424 PolarHBondContact O-N 2.88Å | ||
| 421 | R | 69.4 | Low | 75.4 | Confident | 163 Ų | 163 | 55.4 Ų | 55.4 | 62% | 0.615 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -44.6 | -41.8 | 176.8 | -68.4 | -161 | 175.5 | 178.5 | -1 | 116.2 | I419 L423 R425 | I419-R421 PolarHBondContact O-N 3.23Å; I419-R421 VanDerWaalsContact O-N 3.12Å; R421-L423 VanDerWaalsContact C-N 3.35Å; R421-R425 WeakPolarHBondContact O-CB 3.43Å; R421-R425 VanDerWaalsContact O-CG 3.3Å; R421-R425 WeakPolarHBondContact O-CG 3.27Å; R421-R425 PolarHBondContact O-N 3.27Å |
| 422 | P | 67.9 | Low | 74.2 | Confident | 74 Ų | 74 | 56.6 Ų | 56.6 | 48% | 0.481 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -67.1 | -34.6 | 176 | 24.4 | -33.5 | 0 | 0 | 0 | 113.1 | C420 A426 | C420-P422 VanDerWaalsContact C-N 3.32Å; C420-P422 VanDerWaalsContact O-N 3.12Å; P422-A426 PolarHBondContact O-N 2.78Å |
| 423 | L | 67.2 | Low | 72.9 | Confident | 4 Ų | 4 | 59.5 Ų | 59.5 | 2% | 0.021 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -73.7 | -43.2 | 177.5 | -168.1 | 72.3 | 0 | 0 | 0 | 111.1 | V151 I154 V155 L417 C420 R421 R425 A426 F427 | V151-L423 HydrophobicContact CG1-CD2 4.37Å; V151-L423 HydrophobicContact CG2-CD2 4.46Å; I154-L423 HydrophobicContact CB-CD1 4.19Å; I154-L423 HydrophobicContact CG2-CD1 3.58Å; V155-L423 HydrophobicContact CG2-CD1 4.2Å; L417-L423 HydrophobicContact CD2-CD2 3.84Å; L417-L423 HydrophobicContact CD2-CG 3.77Å; C420-L423 HydrophobicContact CB-CB 3.72Å; C420-L423 HydrophobicContact CB-CD2 4.37Å; C420-L423 WeakPolarHBondContact O-CA 3.5Å; C420-L423 WeakPolarHBondContact O-CB 3.37Å; C420-L423 PolarHBondContact O-N 3.49Å; R421-L423 VanDerWaalsContact C-N 3.35Å; L423-R425 VanDerWaalsContact C-N 3.35Å; L423-R425 PolarHBondContact O-N 2.63Å; L423-A426 PolarHBondContact O-N 3.02Å; L423-F427 PolarHBondContact O-N 2.8Å |
| 424 | G | 70.8 | Confident | 71.4 | Confident | 14 Ų | 14 | 63.8 Ų | 63.8 | 14% | 0.144 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.9 | -36.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L417 C420 F427 L428 | L417-G424 WeakPolarHBondContact O-CA 3.28Å; C420-G424 PolarHBondContact O-N 2.88Å; G424-F427 WeakPolarHBondContact O-CB 3.2Å; G424-F427 PolarHBondContact O-N 3.12Å; G424-L428 WeakPolarHBondContact O-CG 3.31Å; G424-L428 PolarHBondContact O-N 3.11Å |
| 425 | R | 73.6 | Confident | 69.8 | Low | 165 Ų | 165 | 65.1 Ų | 65.1 | 62% | 0.623 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -65.5 | -45.7 | 172.6 | -76 | 179.1 | -177 | -176.5 | -1.4 | 112 | R421 L423 F427 L428 D429 | R421-R425 WeakPolarHBondContact O-CB 3.43Å; R421-R425 VanDerWaalsContact O-CG 3.3Å; R421-R425 WeakPolarHBondContact O-CG 3.27Å; R421-R425 PolarHBondContact O-N 3.27Å; L423-R425 VanDerWaalsContact C-N 3.35Å; L423-R425 PolarHBondContact O-N 2.63Å; R425-F427 VanDerWaalsContact C-N 3.27Å; R425-F427 PolarHBondContact O-N 2.99Å; R425-L428 PolarHBondContact O-N 3.43Å; R425-L428 VanDerWaalsContact O-N 3.15Å; R425-D429 VanDerWaalsContact O-CG 3.23Å; R425-D429 PolarHBondContact O-N 3.03Å |
| 426 | A | 72.8 | Confident | 68 | Low | 22 Ų | 22 | 66.6 Ų | 66.6 | 18% | 0.182 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.4 | -34.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | I154 L161 P422 L423 C430 | I154-A426 HydrophobicContact CG2-CB 3.7Å; L161-A426 HydrophobicContact CD1-CB 4.29Å; P422-A426 PolarHBondContact O-N 2.78Å; L423-A426 PolarHBondContact O-N 3.02Å; A426-C430 PolarHBondContact O-N 3.23Å; A426-C430 PolarHBondContact O-SG 3.46Å; A426-C430 VanDerWaalsContact O-SG 3.37Å |
| 427 | F | 74.8 | Confident | 66.5 | Low | 57 Ų | 57 | 74.4 Ų | 74.4 | 25% | 0.25 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.2 | -49 | 171.1 | 178.1 | -107.6 | 0 | 0 | 0 | 111.7 | I154 L417 L423 G424 R425 D429 C430 C431 | I154-F427 HydrophobicContact CD1-CB 3.54Å; I154-F427 HydrophobicContact CD1-CD2 3.92Å; I154-F427 HydrophobicContact CD1-CG 4.2Å; L417-F427 HydrophobicContact CD1-CD1 4.5Å; L417-F427 HydrophobicContact CD1-CD2 4.42Å; L417-F427 HydrophobicContact CD1-CG 4.33Å; L417-F427 HydrophobicContact CD2-CB 4.05Å; L417-F427 HydrophobicContact CD2-CG 4.41Å; L423-F427 PolarHBondContact O-N 2.8Å; G424-F427 WeakPolarHBondContact O-CB 3.2Å; G424-F427 PolarHBondContact O-N 3.12Å; R425-F427 VanDerWaalsContact C-N 3.27Å; R425-F427 PolarHBondContact O-N 2.99Å; F427-D429 VanDerWaalsContact C-N 3.31Å; F427-D429 PolarHBondContact O-N 2.98Å; F427-C430 PolarHBondContact O-N 3.39Å; F427-C431 WeakPolarHBondContact CE2-SG 3.29Å; F427-C431 WeakPolarHBondContact CZ-SG 3.3Å; F427-C431 WeakPolarHBondContact O-CB 3.49Å; F427-C431 PolarHBondContact O-N 2.94Å; F427-C431 PolarHBondContact O-SG 3.12Å; F427-C431 VanDerWaalsContact O-SG 3.33Å |
| 428 | L | 75.1 | Confident | 64.5 | Low | 101 Ų | 101 | 82.1 Ų | 82.1 | 53% | 0.529 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.4 | -40.4 | 177.6 | -71.9 | 171.6 | 0 | 0 | 0 | 111.7 | G424 R425 C431 C432 | G424-L428 WeakPolarHBondContact O-CG 3.31Å; G424-L428 PolarHBondContact O-N 3.11Å; R425-L428 PolarHBondContact O-N 3.43Å; R425-L428 VanDerWaalsContact O-N 3.15Å; L428-C431 PolarHBondContact O-N 3.18Å; L428-C432 WeakPolarHBondContact O-CB 3.39Å; L428-C432 PolarHBondContact O-N 3.38Å; L428-C432 PolarHBondContact O-SG 2.96Å |
| 429 | D | 74.5 | Confident | 62.6 | Low | 105 Ų | 105 | 82.8 Ų | 82.8 | 56% | 0.561 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -64.4 | -41.7 | 177.5 | -64.6 | -25.1 | 0 | 0 | 0 | 111.4 | R425 F427 C433 | R425-D429 VanDerWaalsContact O-CG 3.23Å; R425-D429 PolarHBondContact O-N 3.03Å; F427-D429 VanDerWaalsContact C-N 3.31Å; F427-D429 PolarHBondContact O-N 2.98Å; D429-C433 WeakPolarHBondContact O-CB 3.21Å; D429-C433 PolarHBondContact O-N 3.48Å; D429-C433 PolarHBondContact O-SG 3.49Å |
| 430 | C | 70.6 | Confident | 60.9 | Low | 58 Ų | 58 | 84 Ų | 84 | 39% | 0.392 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.8 | -45.3 | 174.8 | -71.9 | 0 | 0 | 0 | 0 | 112.2 | A426 F427 C433 C434 | A426-C430 PolarHBondContact O-N 3.23Å; A426-C430 PolarHBondContact O-SG 3.46Å; A426-C430 VanDerWaalsContact O-SG 3.37Å; F427-C430 PolarHBondContact O-N 3.39Å; C430-C433 PolarHBondContact O-N 3.49Å; C430-C434 PolarHBondContact O-N 2.97Å; C430-C434 PolarHBondContact O-SG 2.95Å |
| 431 | C | 69.9 | Low | 59.1 | Low | 48 Ų | 48 | 87.3 Ų | 87.3 | 32% | 0.324 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.6 | -40.8 | 178.3 | -71.8 | 0 | 0 | 0 | 0 | 111.6 | F427 L428 C434 C435 | F427-C431 WeakPolarHBondContact CE2-SG 3.29Å; F427-C431 WeakPolarHBondContact CZ-SG 3.3Å; F427-C431 WeakPolarHBondContact O-CB 3.49Å; F427-C431 PolarHBondContact O-N 2.94Å; F427-C431 PolarHBondContact O-SG 3.12Å; F427-C431 VanDerWaalsContact O-SG 3.33Å; L428-C431 PolarHBondContact O-N 3.18Å; C431-C434 PolarHBondContact O-N 3Å; C431-C435 WeakPolarHBondContact O-CB 3.37Å; C431-C435 PolarHBondContact O-N 3.39Å; C431-C435 PolarHBondContact O-SG 2.85Å |
| 432 | C | 62.7 | Low | 57.5 | Low | 70 Ų | 70 | 83.7 Ų | 83.7 | 47% | 0.473 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.7 | -37.3 | 174.6 | -73.4 | 0 | 0 | 0 | 0 | 111.9 | L428 C435 C436 | L428-C432 WeakPolarHBondContact O-CB 3.39Å; L428-C432 PolarHBondContact O-N 3.38Å; L428-C432 PolarHBondContact O-SG 2.96Å; C432-C435 PolarHBondContact O-N 3.22Å; C432-C436 WeakPolarHBondContact O-CB 3.49Å; C432-C436 PolarHBondContact O-N 2.82Å; C432-C436 PolarHBondContact O-SG 3.21Å |
| 433 | C | 56.8 | Low | 55.8 | Low | 80 Ų | 80 | 86 Ų | 86 | 54% | 0.541 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.9 | -45.9 | 173.2 | -68.4 | 0 | 0 | 0 | 0 | 111.4 | D429 C430 C435 C436 E437 | D429-C433 WeakPolarHBondContact O-CB 3.21Å; D429-C433 PolarHBondContact O-N 3.48Å; D429-C433 PolarHBondContact O-SG 3.49Å; C430-C433 PolarHBondContact O-N 3.49Å; C433-C435 VanDerWaalsContact C-N 3.31Å; C433-C435 PolarHBondContact O-N 3.49Å; C433-C436 PolarHBondContact O-N 3.09Å; C433-E437 PolarHBondContact O-N 3.43Å |
| 434 | C | 52.4 | Low | 54.4 | Low | 91 Ų | 91 | 95.4 Ų | 95.4 | 62% | 0.615 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.1 | -33.1 | 176.4 | -64.1 | 0 | 0 | 0 | 0 | 113.1 | C430 C431 | C430-C434 PolarHBondContact O-N 2.97Å; C430-C434 PolarHBondContact O-SG 2.95Å; C431-C434 PolarHBondContact O-N 3Å |
| 435 | C | 48.2 | Very low | 52.6 | Low | 89 Ų | 89 | 99 Ų | 99 | 60% | 0.601 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -83.2 | -24 | 176 | -66 | 0 | 0 | 0 | 0 | 113.7 | C431 C432 C433 | C431-C435 WeakPolarHBondContact O-CB 3.37Å; C431-C435 PolarHBondContact O-N 3.39Å; C431-C435 PolarHBondContact O-SG 2.85Å; C432-C435 PolarHBondContact O-N 3.22Å; C433-C435 VanDerWaalsContact C-N 3.31Å; C433-C435 PolarHBondContact O-N 3.49Å |
| 436 | C | 44.2 | Very low | 50.4 | Low | 81 Ų | 81 | 97 Ų | 97 | 55% | 0.547 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -88.1 | -22.4 | 179.1 | -74.7 | 0 | 0 | 0 | 0 | 113 | C432 C433 E438 C439 G440 | C432-C436 WeakPolarHBondContact O-CB 3.49Å; C432-C436 PolarHBondContact O-N 2.82Å; C432-C436 PolarHBondContact O-SG 3.21Å; C433-C436 PolarHBondContact O-N 3.09Å; C436-E438 PolarHBondContact O-N 3.39Å; C436-C439 CarbonylContact O-C 3.55Å; C436-C439 PolarHBondContact O-N 3.13Å; C436-G440 PolarHBondContact O-N 3.31Å |
| 437 | E | 45.2 | Very low | 48.6 | Very low | 172 Ų | 172 | 101 Ų | 101 | 80% | 0.804 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | -26 | 173.9 | -129.9 | 168.2 | 118.5 | 0 | 0 | 112.2 | C433 | C433-E437 PolarHBondContact O-N 3.43Š|
| 438 | E | 38.7 | Very low | 46.6 | Very low | 181 Ų | 181 | 102.9 Ų | 102.9 | 85% | 0.846 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -7.1 | 170.2 | -83 | -179.9 | 117.3 | 0 | 0 | 114.3 | C436 | C436-E438 PolarHBondContact O-N 3.39Š|
| 439 | C | 35.8 | Very low | 44.4 | Very low | 108 Ų | 108 | 104.3 Ų | 104.3 | 73% | 0.73 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.3 | -1.2 | -179.7 | -102.3 | 0 | 0 | 0 | 0 | 114.2 | C436 G441 | C436-C439 CarbonylContact O-C 3.55Å; C436-C439 PolarHBondContact O-N 3.13Å; C439-G441 PolarHBondContact O-N 3.34Å; C439-G441 VanDerWaalsContact O-N 3.17Å |
| 440 | G | 36.5 | Very low | 42 | Very low | 74 Ų | 74 | 103 Ų | 103 | 76% | 0.763 | 71% | 0.711 | S | S | * | * | trans | -81.3 | 22.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | C436 | C436-G440 PolarHBondContact O-N 3.31Š| ||
| 441 | G | 34.9 | Very low | 40 | Very low | 77 Ų | 77 | 105.2 Ų | 105.2 | 79% | 0.794 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -117.3 | 25.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | C439 | C439-G441 PolarHBondContact O-N 3.34Å; C439-G441 VanDerWaalsContact O-N 3.17Å |
| 442 | A | 34.8 | Very low | 38.1 | Very low | 86 Ų | 86 | 109.6 Ų | 109.6 | 71% | 0.711 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -164.4 | 72.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 443 | S | 33.3 | Very low | 36.5 | Very low | 123 Ų | 123 | 114.2 Ų | 114.2 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | -169.8 | 70.2 | 151.8 | -92.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 444 | E | 37.3 | Very low | 35.3 | Very low | 201 Ų | 201 | 120 Ų | 120 | 94% | 0.939 | 78% | 0.783 | S | S | * | * | trans | -130.2 | 84.1 | 151.7 | -82.6 | -167.1 | 157.7 | 0 | 0 | 108.2 | ||||
| 445 | A | 32.5 | Very low | 34.1 | Very low | 89 Ų | 89 | 123.7 Ų | 123.7 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | trans | -162.6 | 130.9 | 154.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 446 | S | 28.6 | Very low | 33.3 | Very low | 124 Ų | 124 | 128.3 Ų | 128.3 | 87% | 0.867 | 81% | 0.806 | S | S | * | * | trans | 97.7 | 71.2 | 165.4 | -39.9 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 447 | A | 34.1 | Very low | 32.4 | Very low | 107 Ų | 107 | 130.2 Ų | 130.2 | 88% | 0.884 | 82% | 0.815 | S | S | * | * | trans | -82 | 114.8 | 146.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 448 | A | 32.1 | Very low | 31.6 | Very low | 96 Ų | 96 | 130.3 Ų | 130.3 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | trans | -165.8 | 121.9 | 152.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 449 | S | 28.9 | Very low | 31.1 | Very low | 131 Ų | 131 | 127.4 Ų | 127.4 | 92% | 0.916 | 81% | 0.81 | S | S | * | * | trans | 72.1 | 123.6 | 144 | -174.4 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 450 | G | 25.3 | Very low | 30.6 | Very low | 77 Ų | 77 | 127.1 Ų | 127.1 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | 146.2 | 128.3 | 145.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 451 | S | 28.3 | Very low | 30.3 | Very low | 104 Ų | 104 | 129 Ų | 129 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -77.9 | 157.8 | -164.4 | 65.4 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 452 | D | 30.5 | Very low | 29.9 | Very low | 140 Ų | 140 | 129.7 Ų | 129.7 | 75% | 0.749 | 80% | 0.803 | S | S | * | * | trans | 46.3 | 114.2 | 144.6 | -67.9 | -37 | 0 | 0 | 0 | 120 | ||||
| 453 | N | 28.3 | Very low | 29.6 | Very low | 167 Ų | 167 | 130.6 Ų | 130.6 | 89% | 0.893 | 80% | 0.795 | S | S | * | * | -167.6 | 136.6 | 110.8 | -91.1 | -37.1 | 0 | 0 | 0 | 113.6 | |||||
| 454 | K | 31.9 | Very low | 29.3 | Very low | 202 Ų | 202 | 133.4 Ų | 133.4 | 88% | 0.878 | 79% | 0.788 | S | S | * | * | trans | -53.4 | 120 | 177.4 | -176.3 | -174.8 | -174.4 | -168.1 | 0 | 113.6 | ||||
| 455 | L | 27.2 | Very low | 28.8 | Very low | 168 Ų | 168 | 134 Ų | 134 | 88% | 0.88 | 79% | 0.788 | S | S | * | * | trans | -145.2 | 124.4 | 149.6 | -155.4 | 74.9 | 0 | 0 | 0 | 111.4 | T457 | L455-T457 PolarHBondContact O-N 2.82Š| ||
| 456 | K | 31.8 | Very low | 28.5 | Very low | 186 Ų | 186 | 138.3 Ų | 138.3 | 81% | 0.809 | 79% | 0.792 | S | S | * | * | trans | -50.1 | 125.1 | 175.1 | -86.2 | 172.8 | 163.8 | -179.4 | 0 | 111.3 | ||||
| 457 | T | 25.4 | Very low | 28.3 | Very low | 121 Ų | 121 | 141.1 Ų | 141.1 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | trans | -142.5 | 97 | 141.8 | -53.7 | 0 | 0 | 0 | 0 | 107.1 | L455 V459 | L455-T457 PolarHBondContact O-N 2.82Å; T457-V459 VanDerWaalsContact C-N 3.3Å; T457-V459 HydrophobicContact CG2-CG2 4.04Å; T457-V459 PolarHBondContact O-N 3.28Å | ||
| 458 | E | 27.2 | Very low | 28.2 | Very low | 175 Ų | 175 | 141.6 Ų | 141.6 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -62.7 | 96.3 | 160.9 | -80.6 | 179.6 | 118.4 | 0 | 0 | 107.9 | ||||
| 459 | V | 28 | Very low | 28.1 | Very low | 120 Ų | 120 | 148.4 Ų | 148.4 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | trans | -103 | 90.4 | 149.3 | 172.8 | 0 | 0 | 0 | 0 | 105.3 | T457 S461 | T457-V459 VanDerWaalsContact C-N 3.3Å; T457-V459 HydrophobicContact CG2-CG2 4.04Å; T457-V459 PolarHBondContact O-N 3.28Å; V459-S461 VanDerWaalsContact C-N 3.26Å; V459-S461 PolarHBondContact O-N 3.43Å | ||
| 460 | S | 25.7 | Very low | 28.3 | Very low | 102 Ų | 102 | 151.5 Ų | 151.5 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | trans | -63.8 | 95.8 | 164.2 | -88.5 | 0 | 0 | 0 | 0 | 108.2 | S462 | S460-S462 PolarHBondContact O-N 3.36Å; S460-S462 VanDerWaalsContact O-N 3.11Å | ||
| 461 | S | 29.4 | Very low | 28.6 | Very low | 114 Ų | 114 | 152.9 Ų | 152.9 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -52.2 | 106 | 152.3 | 57 | 0 | 0 | 0 | 0 | 108.7 | V459 | V459-S461 VanDerWaalsContact C-N 3.26Å; V459-S461 PolarHBondContact O-N 3.43Å | ||
| 462 | S | 27.8 | Very low | 28.8 | Very low | 91 Ų | 91 | 153.8 Ų | 153.8 | 64% | 0.636 | 79% | 0.789 | S | S | * | * | trans | -146.8 | 120.4 | 153 | 73.9 | 0 | 0 | 0 | 0 | 107.9 | S460 | S460-S462 PolarHBondContact O-N 3.36Å; S460-S462 VanDerWaalsContact O-N 3.11Å | ||
| 463 | I | 28.4 | Very low | 29.1 | Very low | 105 Ų | 105 | 152.8 Ų | 152.8 | 54% | 0.538 | 79% | 0.79 | S | S | . | * | S | Bend | 164.3 | 116.3 | 118 | -81.1 | 155.1 | 0 | 0 | 0 | 110.2 | K349 | K349-I463 HydrophobicContact CD-CG2 4.43Å; K349-I463 VanDerWaalsContact NZ-CG2 3.31Å | |
| 464 | Y | 26.8 | Very low | 29.6 | Very low | 182 Ų | 182 | 152.8 Ų | 152.8 | 71% | 0.714 | 79% | 0.789 | S | S | * | * | trans | 78.6 | 78.4 | 163.2 | -63.3 | -57.4 | 0 | 0 | 0 | 120.4 | K349 | K349-Y464 HydrophobicContact CD-CE2 3.9Š| ||
| 465 | F | 26.1 | Very low | 29.5 | Very low | 214 Ų | 214 | 151 Ų | 151 | 94% | 0.939 | 79% | 0.789 | S | S | * | * | trans | -103.7 | 117.3 | 132 | -88.1 | -87.7 | 0 | 0 | 0 | 108.1 | K467 | F465-K467 PolarHBondContact O-N 3.39Š| ||
| 466 | H | 26.7 | Very low | 30.3 | Very low | 178 Ų | 178 | 148.4 Ų | 148.4 | 82% | 0.824 | 78% | 0.782 | S | S | * | * | trans | -80.6 | 115.6 | 165.9 | -163.5 | -72.6 | 0 | 0 | 0 | 107.4 | ||||
| 467 | K | 25.2 | Very low | 30.2 | Very low | 183 Ų | 183 | 147.7 Ų | 147.7 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 131.9 | 176.2 | -159.8 | 173.5 | -175 | 176.7 | 0 | 109.7 | F465 | F465-K467 PolarHBondContact O-N 3.39Š|
| 468 | P | 31.7 | Very low | 30.7 | Very low | 117 Ų | 117 | 145.2 Ų | 145.2 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 132.6 | 170.6 | 28.4 | -28.3 | 0 | 0 | 0 | 108.9 | ||
| 469 | R | 28.7 | Very low | 30.8 | Very low | 239 Ų | 239 | 143.1 Ų | 143.1 | 90% | 0.902 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -75 | 123.9 | 164.6 | -168.5 | 175 | -175.5 | 157.2 | -0.1 | 106.1 | S471 | R469-S471 PolarHBondContact O-N 3.33Š|
| 470 | E | 33.5 | Very low | 31.5 | Very low | 197 Ų | 197 | 143.8 Ų | 143.8 | 92% | 0.921 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 130.1 | 178.4 | -65.1 | 173.1 | 171 | 0 | 0 | 111 | ||
| 471 | S | 31.6 | Very low | 31.9 | Very low | 106 Ų | 106 | 144 Ų | 144 | 74% | 0.741 | 79% | 0.79 | S | S | * | * | trans | -129.2 | 141.8 | 167.4 | 53 | 0 | 0 | 0 | 0 | 109.6 | R469 | R469-S471 PolarHBondContact O-N 3.33Š| ||
| 472 | P | 34 | Very low | 32 | Very low | 123 Ų | 123 | 145.5 Ų | 145.5 | 80% | 0.799 | 79% | 0.79 | S | S | * | * | trans | -74.9 | 171.5 | -170.6 | 33.8 | -36.3 | 0 | 0 | 0 | 112.7 | ||||
| 473 | P | 36.6 | Very low | 32.3 | Very low | 118 Ų | 118 | 148.3 Ų | 148.3 | 77% | 0.766 | 80% | 0.798 | S | S | * | * | trans | -82.7 | 142.4 | -155.1 | 32.3 | -32.9 | 0 | 0 | 0 | 114.6 | ||||
| 474 | L | 37.1 | Very low | 32.5 | Very low | 168 Ų | 168 | 150.7 Ų | 150.7 | 88% | 0.88 | 81% | 0.813 | S | S | * | * | trans | 37.9 | 118 | 146.4 | -64.8 | 169.3 | 0 | 0 | 0 | 120.3 | ||||
| 475 | L | 29.8 | Very low | 32.8 | Very low | 164 Ų | 164 | 148.9 Ų | 148.9 | 86% | 0.859 | 82% | 0.818 | S | S | * | * | trans | -138.6 | 129.8 | 142.7 | -101.8 | 158 | 0 | 0 | 0 | 108.4 | ||||
| 476 | P | 44.6 | Very low | 33.2 | Very low | 114 Ų | 114 | 144.8 Ų | 144.8 | 74% | 0.74 | 81% | 0.811 | S | S | * | * | trans | -89.3 | 112.1 | -176.8 | 33 | -25.7 | 0 | 0 | 0 | 109 | ||||
| 477 | L | 29.8 | Very low | 33.7 | Very low | 171 Ų | 171 | 142.6 Ų | 142.6 | 90% | 0.895 | 81% | 0.81 | S | S | * | * | trans | -135 | 114.3 | 162.9 | -123.9 | 84.7 | 0 | 0 | 0 | 108.2 | ||||
| 478 | G | 35.9 | Very low | 34.3 | Very low | 68 Ų | 68 | 139.7 Ų | 139.7 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | trans | -65.2 | 147.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 479 | T | 29.8 | Very low | 34.5 | Very low | 131 Ų | 131 | 141.5 Ų | 141.5 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | -158.2 | 107.7 | 115.8 | 41.4 | 0 | 0 | 0 | 0 | 106.2 | |||||
| 480 | P | 43.2 | Very low | 35 | Very low | 134 Ų | 134 | 133.3 Ų | 133.3 | 87% | 0.87 | 81% | 0.808 | S | S | * | * | trans | -75.9 | 132.3 | 168.2 | 29.7 | -28.2 | 0 | 0 | 0 | 109.1 | ||||
| 481 | C | 33.5 | Very low | 35.1 | Very low | 106 Ų | 106 | 127.5 Ų | 127.5 | 72% | 0.716 | 80% | 0.797 | S | S | * | * | trans | -92.5 | 0 | 163.4 | -76.9 | 0 | 0 | 0 | 0 | 110.2 | K162 | K162-C481 PolarHBondContact NZ-O 3.48Å; K162-C481 PolarHBondContact NZ-OXT 3.27Å |
Retrieved 481 of 481 residues in 133.3 ms
(Link to these results)