| 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 | 53.4 | Low | 73.9 | Confident | 177 Ų | 177 | 137.4 Ų | 137.4 | 87% | 0.872 | 64% | 0.637 | S | S | * | * | 0 | -73.2 | 0 | -89.5 | -150.3 | -76.6 | 0 | 0 | 114.9 | E4 R5 | M1-E4 PolarHBondContact N-OE2 2.9Å; M1-E4 PolarHBondContact O-N 2.8Å; M1-R5 PolarHBondContact O-N 3.17Å; M1-R5 VanDerWaalsContact O-N 3.1Å | |||
| 2 | E | 65.1 | Low | 74.1 | Confident | 139 Ų | 139 | 134.5 Ų | 134.5 | 65% | 0.65 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -72.1 | -35.3 | -173.5 | -150.7 | -172 | 164.1 | 0 | 0 | 113.4 | R6 | E2-R6 WeakPolarHBondContact O-CG 3.29Å; E2-R6 PolarHBondContact O-N 3.36Å; E2-R6 VanDerWaalsContact O-N 3.15Å; E2-R6 IonicContact OE1-NH2 2.83Å |
| 3 | K | 71.3 | Confident | 74.1 | Confident | 186 Ų | 186 | 129.6 Ų | 129.6 | 81% | 0.809 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67.9 | -39.7 | 173.6 | -98 | -175.6 | 174.2 | -179 | 0 | 113.4 | R6 A7 | K3-R6 PolarHBondContact O-N 3.48Å; K3-A7 PolarHBondContact O-N 2.89Å |
| 4 | E | 75.2 | Confident | 74.2 | Confident | 129 Ų | 129 | 130 Ų | 130 | 60% | 0.603 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -66.8 | -43.7 | 176.7 | -78.7 | 157.2 | 142.1 | 0 | 0 | 111.4 | M1 R6 A7 E8 | M1-E4 PolarHBondContact N-OE2 2.9Å; M1-E4 PolarHBondContact O-N 2.8Å; E4-R6 VanDerWaalsContact C-N 3.28Å; E4-R6 PolarHBondContact O-N 3.12Å; E4-A7 WeakPolarHBondContact O-CB 3.3Å; E4-A7 PolarHBondContact O-N 3.38Å; E4-A7 VanDerWaalsContact O-N 3.09Å; E4-E8 PolarHBondContact O-N 3.4Å |
| 5 | R | 74.1 | Confident | 74.3 | Confident | 184 Ų | 184 | 132.9 Ų | 132.9 | 69% | 0.694 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -60.5 | -36.4 | 174.2 | -81.8 | -173.6 | 171.9 | 175.1 | -1.9 | 113 | M1 F9 | M1-R5 PolarHBondContact O-N 3.17Å; M1-R5 VanDerWaalsContact O-N 3.1Å; R5-F9 VanDerWaalsContact O-CB 3.3Å; R5-F9 WeakPolarHBondContact O-CB 3.21Å; R5-F9 PolarHBondContact O-N 3.19Å |
| 6 | R | 74.6 | Confident | 74 | Confident | 164 Ų | 164 | 131.1 Ų | 131.1 | 62% | 0.619 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.6 | -38.3 | 174.1 | -76.7 | -177.7 | -174.2 | -171.5 | 5.5 | 112.1 | E2 K3 E4 T10 | E2-R6 WeakPolarHBondContact O-CG 3.29Å; E2-R6 PolarHBondContact O-N 3.36Å; E2-R6 VanDerWaalsContact O-N 3.15Å; E2-R6 IonicContact OE1-NH2 2.83Å; K3-R6 PolarHBondContact O-N 3.48Å; E4-R6 VanDerWaalsContact C-N 3.28Å; E4-R6 PolarHBondContact O-N 3.12Å; R6-T10 WeakPolarHBondContact O-CB 3.36Å; R6-T10 PolarHBondContact O-N 3.01Å; R6-T10 PolarHBondContact O-OG1 3.38Å |
| 7 | A | 82.4 | Confident | 73.6 | Confident | 59 Ų | 59 | 128.1 Ų | 128.1 | 49% | 0.488 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -66.3 | -46.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | K3 E4 F9 T10 E11 | K3-A7 PolarHBondContact O-N 2.89Å; E4-A7 WeakPolarHBondContact O-CB 3.3Å; E4-A7 PolarHBondContact O-N 3.38Å; E4-A7 VanDerWaalsContact O-N 3.09Å; A7-F9 PolarHBondContact O-N 3.42Å; A7-T10 PolarHBondContact O-N 3.44Å; A7-E11 WeakPolarHBondContact O-CB 3.47Å; A7-E11 PolarHBondContact O-N 2.9Å |
| 8 | E | 80.3 | Confident | 73.1 | Confident | 132 Ų | 132 | 130.2 Ų | 130.2 | 62% | 0.617 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -59.7 | -43.5 | 175.3 | -76.9 | 179.4 | 158.8 | 0 | 0 | 112.2 | E4 E11 L12 | E4-E8 PolarHBondContact O-N 3.4Å; E8-E11 PolarHBondContact O-N 2.95Å; E8-L12 WeakPolarHBondContact O-CB 3.46Å; E8-L12 PolarHBondContact O-N 3.1Å |
| 9 | F | 78.1 | Confident | 73 | Confident | 136 Ų | 136 | 126.1 Ų | 126.1 | 60% | 0.596 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -65.4 | -41.1 | 176.8 | -176.3 | -101.1 | 0 | 0 | 0 | 111.9 | R5 A7 E11 L12 V13 | R5-F9 VanDerWaalsContact O-CB 3.3Å; R5-F9 WeakPolarHBondContact O-CB 3.21Å; R5-F9 PolarHBondContact O-N 3.19Å; A7-F9 PolarHBondContact O-N 3.42Å; F9-E11 VanDerWaalsContact C-N 3.34Å; F9-E11 PolarHBondContact O-N 3.38Å; F9-L12 WeakPolarHBondContact O-CB 3.3Å; F9-L12 PolarHBondContact O-N 3.49Å; F9-V13 HydrophobicContact CD1-CG2 4.24Å; F9-V13 HydrophobicContact CE1-CG2 3.87Å; F9-V13 HydrophobicContact CZ-CG2 4.03Å; F9-V13 VanDerWaalsContact O-CG2 3.3Å; F9-V13 WeakPolarHBondContact O-CG2 3.33Å; F9-V13 PolarHBondContact O-N 3.38Å |
| 10 | T | 79.1 | Confident | 72.8 | Confident | 71 Ų | 71 | 128.2 Ų | 128.2 | 44% | 0.436 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -64.8 | -39.9 | 177.8 | -56.8 | 0 | 0 | 0 | 0 | 111.1 | R6 A7 V13 H14 | R6-T10 WeakPolarHBondContact O-CB 3.36Å; R6-T10 PolarHBondContact O-N 3.01Å; R6-T10 PolarHBondContact O-OG1 3.38Å; A7-T10 PolarHBondContact O-N 3.44Å; T10-V13 PolarHBondContact O-N 2.87Å; T10-H14 PolarHBondContact O-CD2 3.33Å; T10-H14 PolarHBondContact O-N 3.09Å |
| 11 | E | 79.2 | Confident | 72.5 | Confident | 134 Ų | 134 | 128.3 Ų | 128.3 | 63% | 0.626 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -68.6 | -39.8 | 176 | -161 | -177.4 | -177 | 0 | 0 | 112.1 | A7 E8 F9 V13 H14 K15 | A7-E11 WeakPolarHBondContact O-CB 3.47Å; A7-E11 PolarHBondContact O-N 2.9Å; E8-E11 PolarHBondContact O-N 2.95Å; F9-E11 VanDerWaalsContact C-N 3.34Å; F9-E11 PolarHBondContact O-N 3.38Å; E11-V13 VanDerWaalsContact C-N 3.35Å; E11-V13 PolarHBondContact O-N 3.22Å; E11-H14 PolarHBondContact O-N 2.97Å; E11-K15 WeakPolarHBondContact O-CB 3.43Å; E11-K15 PolarHBondContact O-N 2.68Å |
| 12 | L | 76.4 | Confident | 72.9 | Confident | 103 Ų | 103 | 126.1 Ų | 126.1 | 54% | 0.539 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -58.2 | -46 | 172 | -173.4 | 91.6 | 0 | 0 | 0 | 111.4 | E8 F9 K16 | E8-L12 WeakPolarHBondContact O-CB 3.46Å; E8-L12 PolarHBondContact O-N 3.1Å; F9-L12 WeakPolarHBondContact O-CB 3.3Å; F9-L12 PolarHBondContact O-N 3.49Å; L12-K16 VanDerWaalsContact O-CB 3.3Å; L12-K16 WeakPolarHBondContact O-CB 3.49Å; L12-K16 VanDerWaalsContact O-CG 3.29Å; L12-K16 WeakPolarHBondContact O-CG 3.24Å; L12-K16 PolarHBondContact O-N 3Å |
| 13 | V | 73.9 | Confident | 73 | Confident | 71 Ų | 71 | 124.8 Ų | 124.8 | 43% | 0.43 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.5 | -50.5 | 177.6 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | F9 T10 E11 K15 K16 V17 | F9-V13 HydrophobicContact CD1-CG2 4.24Å; F9-V13 HydrophobicContact CE1-CG2 3.87Å; F9-V13 HydrophobicContact CZ-CG2 4.03Å; F9-V13 VanDerWaalsContact O-CG2 3.3Å; F9-V13 WeakPolarHBondContact O-CG2 3.33Å; F9-V13 PolarHBondContact O-N 3.38Å; T10-V13 PolarHBondContact O-N 2.87Å; E11-V13 VanDerWaalsContact C-N 3.35Å; E11-V13 PolarHBondContact O-N 3.22Å; V13-K15 VanDerWaalsContact C-N 3.34Å; V13-K15 PolarHBondContact O-N 3.15Å; V13-K16 CarbonylContact O-C 3.37Å; V13-K16 PolarHBondContact O-N 3.43Å; V13-K16 VanDerWaalsContact O-N 3.12Å; V13-V17 WeakPolarHBondContact O-CG2 3.3Å; V13-V17 PolarHBondContact O-N 3.15Å |
| 14 | H | 75.2 | Confident | 72.8 | Confident | 135 Ų | 135 | 121.4 Ų | 121.4 | 63% | 0.625 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -61.5 | -38.5 | 179.7 | -84 | -64 | 0 | 0 | 0 | 113.5 | T10 E11 K16 V17 | T10-H14 PolarHBondContact O-CD2 3.33Å; T10-H14 PolarHBondContact O-N 3.09Å; E11-H14 PolarHBondContact O-N 2.97Å; H14-K16 PolarHBondContact O-N 3.16Å; H14-V17 PolarHBondContact O-N 2.95Å |
| 15 | K | 75.6 | Confident | 72.3 | Confident | 174 Ų | 174 | 119.1 Ų | 119.1 | 76% | 0.757 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -73.1 | -16.5 | 178.6 | -164.3 | 173.2 | -175.8 | 174.8 | 0 | 113.3 | E11 V13 | E11-K15 WeakPolarHBondContact O-CB 3.43Å; E11-K15 PolarHBondContact O-N 2.68Å; V13-K15 VanDerWaalsContact C-N 3.34Å; V13-K15 PolarHBondContact O-N 3.15Å |
| 16 | K | 70.4 | Confident | 71.8 | Confident | 103 Ų | 103 | 117.3 Ų | 117.3 | 45% | 0.448 | 61% | 0.606 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -110 | 5.3 | 179.4 | -69.7 | -81.9 | -173.3 | 171.6 | 0 | 112.7 | L12 V13 H14 D18 S19 | L12-K16 VanDerWaalsContact O-CB 3.3Å; L12-K16 WeakPolarHBondContact O-CB 3.49Å; L12-K16 VanDerWaalsContact O-CG 3.29Å; L12-K16 WeakPolarHBondContact O-CG 3.24Å; L12-K16 PolarHBondContact O-N 3Å; V13-K16 CarbonylContact O-C 3.37Å; V13-K16 PolarHBondContact O-N 3.43Å; V13-K16 VanDerWaalsContact O-N 3.12Å; H14-K16 PolarHBondContact O-N 3.16Å; K16-D18 PolarHBondContact O-N 3.35Å; K16-S19 VanDerWaalsContact O-CB 3.24Å; K16-S19 WeakPolarHBondContact O-CB 3.38Å; K16-S19 PolarHBondContact O-N 3.01Å |
| 17 | V | 66.5 | Low | 71.6 | Confident | 80 Ų | 80 | 116.7 Ų | 116.7 | 49% | 0.485 | 61% | 0.614 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -56.6 | 132.9 | 168 | 175.9 | 0 | 0 | 0 | 0 | 107.6 | V13 H14 S19 | V13-V17 WeakPolarHBondContact O-CG2 3.3Å; V13-V17 PolarHBondContact O-N 3.15Å; H14-V17 PolarHBondContact O-N 2.95Å; V17-S19 PolarHBondContact O-N 3.44Å; V17-S19 VanDerWaalsContact O-N 3.15Å |
| 18 | D | 65.8 | Low | 70.8 | Confident | 167 Ų | 167 | 121.4 Ų | 121.4 | 89% | 0.893 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 63.1 | 10.2 | -173.6 | -51.3 | -36.6 | 0 | 0 | 0 | 116 | K16 | K16-D18 PolarHBondContact O-N 3.35Š|
| 19 | S | 71.4 | Confident | 70.5 | Confident | 52 Ų | 52 | 121 Ų | 121 | 36% | 0.364 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -93.4 | 137.7 | 171.3 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | K16 V17 L21 | K16-S19 VanDerWaalsContact O-CB 3.24Å; K16-S19 WeakPolarHBondContact O-CB 3.38Å; K16-S19 PolarHBondContact O-N 3.01Å; V17-S19 PolarHBondContact O-N 3.44Å; V17-S19 VanDerWaalsContact O-N 3.15Å; S19-L21 PolarHBondContact O-N 2.96Å; S19-L21 VanDerWaalsContact O-N 3.16Å |
| 20 | N | 68.1 | Low | 70.3 | Confident | 167 Ų | 167 | 121.9 Ų | 121.9 | 89% | 0.893 | 63% | 0.626 | S | S | * | * | trans | -65.9 | 116.4 | 172.4 | -67.4 | -41.1 | 0 | 0 | 0 | 110.1 | ||||
| 21 | L | 66.1 | Low | 69.7 | Low | 131 Ų | 131 | 127 Ų | 127 | 69% | 0.686 | 65% | 0.645 | S | S | * | * | trans | -88.8 | 114.8 | 171.2 | -79 | 157.6 | 0 | 0 | 0 | 108.8 | S19 V23 | S19-L21 PolarHBondContact O-N 2.96Å; S19-L21 VanDerWaalsContact O-N 3.16Å; L21-V23 PolarHBondContact O-N 3.49Å | ||
| 22 | L | 62.5 | Low | 69.2 | Low | 132 Ų | 132 | 124 Ų | 124 | 69% | 0.691 | 64% | 0.639 | S | S | * | * | trans | -83.4 | 108.1 | 168.9 | -176.2 | 69.8 | 0 | 0 | 0 | 108.4 | V24 | L22-V24 HydrophobicContact CD2-CG2 4.2Å; L22-V24 HydrophobicContact CG-CG2 4.1Å | ||
| 23 | V | 67.9 | Low | 68.8 | Low | 111 Ų | 111 | 124.9 Ų | 124.9 | 67% | 0.673 | 64% | 0.644 | S | S | * | * | trans | -98.6 | 113.6 | 172.8 | -177.5 | 0 | 0 | 0 | 0 | 107.9 | L21 V25 | L21-V23 PolarHBondContact O-N 3.49Å; V23-V25 HydrophobicContact CG1-CG2 3.94Å | ||
| 24 | V | 66.9 | Low | 68.7 | Low | 114 Ų | 114 | 126.5 Ų | 126.5 | 69% | 0.691 | 65% | 0.645 | S | S | * | * | trans | -98.8 | 119.2 | 174 | -175.8 | 0 | 0 | 0 | 0 | 107.8 | L22 | L22-V24 HydrophobicContact CD2-CG2 4.2Å; L22-V24 HydrophobicContact CG-CG2 4.1Å | ||
| 25 | V | 62.8 | Low | 68.9 | Low | 81 Ų | 81 | 124.3 Ų | 124.3 | 49% | 0.491 | 64% | 0.635 | S | S | . | * | trans | -113.8 | 121.2 | 175.6 | -174 | 0 | 0 | 0 | 0 | 107.7 | V23 I27 | V23-V25 HydrophobicContact CG1-CG2 3.94Å; V25-I27 HydrophobicContact CG1-CD1 4.4Å; V25-I27 HydrophobicContact CG1-CG1 3.77Å | ||
| 26 | E | 64.4 | Low | 69.2 | Low | 147 Ų | 147 | 116.8 Ų | 116.8 | 69% | 0.687 | 60% | 0.604 | S | S | * | * | trans | -91.4 | 108.7 | 169.6 | -169.5 | -176.6 | -157.2 | 0 | 0 | 108.1 | K28 | E26-K28 HydrophobicContact CG-CG 4.38Å; E26-K28 WeakPolarHBondContact OE1-CE 3.36Å; E26-K28 IonicContact OE1-NZ 3.06Å; E26-K28 PolarHBondContact OE1-NZ 3.43Å; E26-K28 IonicContact OE2-NZ 3.52Å; E26-K28 PolarHBondContact OE2-NZ 3.25Å | ||
| 27 | I | 70.3 | Confident | 69.9 | Low | 150 Ų | 150 | 113.7 Ų | 113.7 | 77% | 0.769 | 59% | 0.592 | S | S | * | * | trans | -99.7 | 116.6 | 175.6 | -56.4 | 178.5 | 0 | 0 | 0 | 107.7 | V25 | V25-I27 HydrophobicContact CG1-CD1 4.4Å; V25-I27 HydrophobicContact CG1-CG1 3.77Å | ||
| 28 | K | 66.8 | Low | 70.7 | Confident | 158 Ų | 158 | 115.2 Ų | 115.2 | 69% | 0.687 | 60% | 0.598 | S | S | * | * | trans | -109 | 125.4 | 173.5 | -70.5 | 177.8 | 172.2 | 146.7 | 0 | 109.3 | E26 | E26-K28 HydrophobicContact CG-CG 4.38Å; E26-K28 WeakPolarHBondContact OE1-CE 3.36Å; E26-K28 IonicContact OE1-NZ 3.06Å; E26-K28 PolarHBondContact OE1-NZ 3.43Å; E26-K28 IonicContact OE2-NZ 3.52Å; E26-K28 PolarHBondContact OE2-NZ 3.25Å | ||
| 29 | M | 72.2 | Confident | 71.5 | Confident | 123 Ų | 123 | 114.2 Ų | 114.2 | 61% | 0.606 | 58% | 0.583 | S | S | * | * | trans | -93.3 | 139.4 | 167.3 | -167.2 | 170.9 | 70 | 0 | 0 | 108.3 | E31 L33 F34 | M29-E31 PolarHBondContact O-N 3.23Å; M29-L33 HydrophobicContact CG-CB 3.89Å; M29-L33 HydrophobicContact CG-CD1 3.74Å; M29-L33 HydrophobicContact CG-CG 4.43Å; M29-L33 HydrophobicContact SD-CB 4.1Å; M29-F34 HydrophobicContact CE-CB 3.59Å; M29-F34 HydrophobicContact CE-CG 4.43Å | ||
| 30 | K | 74.9 | Confident | 72.2 | Confident | 156 Ų | 156 | 112 Ų | 112 | 68% | 0.678 | 57% | 0.566 | S | S | * | * | trans | -64.2 | 133.8 | 170.2 | -68.4 | -177 | 177.6 | -177.1 | 0 | 108.4 | S32 L33 | K30-S32 PolarHBondContact O-N 2.92Å; K30-L33 HydrophobicContact CB-CD1 4.06Å; K30-L33 HydrophobicContact CB-CG 4.09Å; K30-L33 VanDerWaalsContact O-CB 3.3Å; K30-L33 WeakPolarHBondContact O-CB 3.27Å; K30-L33 PolarHBondContact O-N 3.01Å | ||
| 31 | E | 67.1 | Low | 72.7 | Confident | 177 Ų | 177 | 106.1 Ų | 106.1 | 83% | 0.827 | 54% | 0.537 | S | S | * | . | G | 310 helix | trans | -54.8 | -36.4 | 176.7 | -71.2 | 173.1 | -175.6 | 0 | 0 | 111.8 | M29 L33 F34 | M29-E31 PolarHBondContact O-N 3.23Å; E31-L33 PolarHBondContact O-N 3.33Å; E31-F34 CarbonylContact O-C 3.6Å; E31-F34 PolarHBondContact O-N 2.99Å; E31-F34 VanDerWaalsContact O-O 3.12Å |
| 32 | S | 67.9 | Low | 72.9 | Confident | 72 Ų | 72 | 103.9 Ų | 103.9 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | G | 310 helix | trans | -61.1 | -11.1 | 174.8 | 71.8 | 0 | 0 | 0 | 0 | 114.9 | K30 E35 | K30-S32 PolarHBondContact O-N 2.92Å; S32-E35 WeakPolarHBondContact CA-OE1 2.91Å |
| 33 | L | 68.9 | Low | 73 | Confident | 121 Ų | 121 | 98 Ų | 98 | 63% | 0.634 | 50% | 0.496 | S | S | * | . | G | 310 helix | trans | -88.5 | -10.1 | 173.9 | -63.3 | 170.6 | 0 | 0 | 0 | 112.2 | M29 K30 E31 | M29-L33 HydrophobicContact CG-CB 3.89Å; M29-L33 HydrophobicContact CG-CD1 3.74Å; M29-L33 HydrophobicContact CG-CG 4.43Å; M29-L33 HydrophobicContact SD-CB 4.1Å; K30-L33 HydrophobicContact CB-CD1 4.06Å; K30-L33 HydrophobicContact CB-CG 4.09Å; K30-L33 VanDerWaalsContact O-CB 3.3Å; K30-L33 WeakPolarHBondContact O-CB 3.27Å; K30-L33 PolarHBondContact O-N 3.01Å; E31-L33 PolarHBondContact O-N 3.33Å |
| 34 | F | 70.9 | Confident | 72.6 | Confident | 105 Ų | 105 | 100.7 Ų | 100.7 | 46% | 0.461 | 50% | 0.501 | S | S | . | . | trans | -129.4 | 88.3 | 174.9 | -172.9 | -103.1 | 0 | 0 | 0 | 110 | M29 E31 P36 | M29-F34 HydrophobicContact CE-CB 3.59Å; M29-F34 HydrophobicContact CE-CG 4.43Å; E31-F34 CarbonylContact O-C 3.6Å; E31-F34 PolarHBondContact O-N 2.99Å; E31-F34 VanDerWaalsContact O-O 3.12Å; F34-P36 HydrophobicContact CD1-CG 4.14Å; F34-P36 HydrophobicContact CE1-CG 3.64Å; F34-P36 HydrophobicContact CZ-CG 4.06Å; F34-P36 WeakPolarHBondContact O-CD 3.38Å | ||
| 35 | E | 80.2 | Confident | 72 | Confident | 90 Ų | 90 | 97.4 Ų | 97.4 | 42% | 0.421 | 48% | 0.481 | S | S | . | . | trans | -116.3 | 94.6 | 177 | -72.8 | 175.7 | -175.2 | 0 | 0 | 107.8 | S32 L37 N38 | S32-E35 WeakPolarHBondContact CA-OE1 2.91Å; E35-L37 PolarHBondContact O-N 2.7Å; E35-N38 HydrophobicContact CB-CB 4.4Å; E35-N38 VanDerWaalsContact CB-ND2 3.32Å; E35-N38 WeakPolarHBondContact CB-ND2 3.21Å; E35-N38 WeakPolarHBondContact O-CB 3.32Å; E35-N38 PolarHBondContact O-N 3.15Å; E35-N38 PolarHBondContact OE2-ND2 3.49Å | ||
| 36 | P | 80.1 | Confident | 71.4 | Confident | 15 Ų | 15 | 93.6 Ų | 93.6 | 10% | 0.097 | 46% | 0.458 | C | S | . | . | G | 310 helix | trans | -55.2 | -29.4 | -175.7 | -28.6 | 35.3 | 0 | 0 | 0 | 113.9 | F34 N38 Y39 I166 I189 M192 V193 | F34-P36 HydrophobicContact CD1-CG 4.14Å; F34-P36 HydrophobicContact CE1-CG 3.64Å; F34-P36 HydrophobicContact CZ-CG 4.06Å; F34-P36 WeakPolarHBondContact O-CD 3.38Å; P36-N38 PolarHBondContact O-N 3Å; P36-Y39 WeakPolarHBondContact O-CD2 3.31Å; P36-Y39 PolarHBondContact O-N 3.06Å; P36-I166 HydrophobicContact CB-CD1 4.49Å; P36-I166 HydrophobicContact CG-CD1 4.37Å; P36-I189 HydrophobicContact CB-CG2 4.45Å; P36-I189 VanDerWaalsContact O-CG2 3.28Å; P36-I189 WeakPolarHBondContact O-CG2 3.49Å; P36-M192 HydrophobicContact CB-CE 4.01Å; P36-V193 HydrophobicContact CB-CG2 3.53Å; P36-V193 HydrophobicContact CG-CG2 3.95Å |
| 37 | L | 85.1 | Confident | 70.9 | Confident | 38 Ų | 38 | 89.9 Ų | 89.9 | 20% | 0.199 | 44% | 0.44 | C | S | . | . | G | 310 helix | trans | -69.5 | -18.2 | 179.6 | -55.5 | -179.4 | 0 | 0 | 0 | 113.1 | E35 Y39 L40 R159 C162 Q163 I166 | E35-L37 PolarHBondContact O-N 2.7Å; L37-Y39 PolarHBondContact O-N 3.44Å; L37-L40 HydrophobicContact CD2-CD1 4.44Å; L37-L40 WeakPolarHBondContact O-CB 3.33Å; L37-L40 PolarHBondContact O-N 3Å; L37-L40 VanDerWaalsContact O-N 3.12Å; L37-R159 HydrophobicContact CD2-CG 4.42Å; L37-C162 HydrophobicContact CD2-CB 3.58Å; L37-Q163 HydrophobicContact CD1-CG 3.47Å; L37-Q163 VanDerWaalsContact CD1-CG 3.47Å; L37-Q163 HydrophobicContact CD2-CG 4.22Å; L37-I166 HydrophobicContact CD2-CD1 4.41Å; L37-I166 HydrophobicContact CG-CD1 4.39Å |
| 38 | N | 83.9 | Confident | 70.3 | Confident | 113 Ų | 113 | 92.3 Ų | 92.3 | 60% | 0.604 | 44% | 0.439 | S | S | * | . | G | 310 helix | trans | -73.9 | -13.2 | 176.5 | -67.7 | -8.5 | 0 | 0 | 0 | 112.9 | E35 P36 L40 | E35-N38 HydrophobicContact CB-CB 4.4Å; E35-N38 VanDerWaalsContact CB-ND2 3.32Å; E35-N38 WeakPolarHBondContact CB-ND2 3.21Å; E35-N38 WeakPolarHBondContact O-CB 3.32Å; E35-N38 PolarHBondContact O-N 3.15Å; E35-N38 PolarHBondContact OE2-ND2 3.49Å; P36-N38 PolarHBondContact O-N 3Å; N38-L40 VanDerWaalsContact C-N 3.28Å |
| 39 | Y | 83.6 | Confident | 70.4 | Confident | 146 Ų | 146 | 86.5 Ų | 86.5 | 57% | 0.573 | 42% | 0.418 | S | S | * | . | G | 310 helix | trans | -79.7 | -12.8 | 170 | -64 | -80.3 | 0 | 0 | 0 | 112.7 | P36 L37 I189 M192 | P36-Y39 WeakPolarHBondContact O-CD2 3.31Å; P36-Y39 PolarHBondContact O-N 3.06Å; L37-Y39 PolarHBondContact O-N 3.44Å; Y39-I189 VanDerWaalsContact CB-CD1 3.41Å; Y39-I189 HydrophobicContact CG-CD1 4.23Å; Y39-M192 HydrophobicContact CD2-CE 3.8Å; Y39-M192 HydrophobicContact CE2-CE 3.93Å; Y39-M192 HydrophobicContact CE2-SD 4.48Å |
| 40 | L | 84.7 | Confident | 70.7 | Confident | 5 Ų | 5 | 87 Ų | 87 | 3% | 0.026 | 42% | 0.419 | C | S | . | . | S | Bend | trans | -90.5 | 158.4 | 171.7 | -62.7 | 171.6 | 0 | 0 | 0 | 109.9 | L37 N38 D42 K155 E158 R159 I189 | L37-L40 HydrophobicContact CD2-CD1 4.44Å; L37-L40 WeakPolarHBondContact O-CB 3.33Å; L37-L40 PolarHBondContact O-N 3Å; L37-L40 VanDerWaalsContact O-N 3.12Å; N38-L40 VanDerWaalsContact C-N 3.28Å; L40-D42 PolarHBondContact O-N 3.38Å; L40-K155 HydrophobicContact CD2-CD 3.59Å; L40-E158 HydrophobicContact CD1-CG 4.48Å; L40-E158 HydrophobicContact CD2-CG 4.25Å; L40-R159 VanDerWaalsContact CB-NH2 3.34Å; L40-R159 VanDerWaalsContact CD1-CA 3.49Å; L40-R159 HydrophobicContact CD1-CB 3.69Å; L40-R159 HydrophobicContact CD1-CG 4.31Å; L40-I189 HydrophobicContact CD1-CG2 4.41Å; L40-I189 HydrophobicContact CD2-CB 4.13Å; L40-I189 HydrophobicContact CD2-CG1 3.58Å; L40-I189 HydrophobicContact CG-CB 4.29Å; L40-I189 HydrophobicContact CG-CG1 3.94Å; L40-I189 HydrophobicContact CG-CG2 4.24Å |
| 41 | P | 79.4 | Confident | 71.2 | Confident | 43 Ų | 43 | 84.1 Ų | 84.1 | 28% | 0.279 | 40% | 0.404 | S | S | . | . | trans | -51.1 | 128 | -179.7 | -27.1 | 35 | 0 | 0 | 0 | 111.6 | V43 R159 | P41-V43 WeakPolarHBondContact O-CG2 3.47Å; P41-V43 PolarHBondContact O-N 3.12Å; P41-V43 VanDerWaalsContact O-N 3.11Å; P41-R159 PolarHBondContact O-NH2 2.97Å | ||
| 42 | D | 70.5 | Confident | 72.1 | Confident | 85 Ų | 85 | 75.9 Ų | 75.9 | 46% | 0.455 | 37% | 0.366 | S | S | . | . | trans | -65.6 | 115.9 | -176.4 | -176.3 | -7 | 0 | 0 | 0 | 110.6 | L40 E44 T45 | L40-D42 PolarHBondContact O-N 3.38Å; D42-E44 PolarHBondContact OD1-N 3.31Å; D42-T45 VanDerWaalsContact CG-CB 3.46Å; D42-T45 VanDerWaalsContact CG-OG1 3.31Å; D42-T45 PolarHBondContact OD1-N 3.04Å; D42-T45 WeakPolarHBondContact OD2-CB 3.32Å; D42-T45 PolarHBondContact OD2-OG1 3.43Å | ||
| 43 | V | 65 | Low | 73 | Confident | 9 Ų | 9 | 75.3 Ų | 75.3 | 6% | 0.055 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -92.8 | -30.7 | 178.2 | -167.3 | 0 | 0 | 0 | 0 | 110.9 | P41 T45 A46 F47 H121 E156 R159 | P41-V43 WeakPolarHBondContact O-CG2 3.47Å; P41-V43 PolarHBondContact O-N 3.12Å; P41-V43 VanDerWaalsContact O-N 3.11Å; V43-T45 VanDerWaalsContact C-N 3.29Å; V43-T45 PolarHBondContact O-N 3.3Å; V43-A46 CarbonylContact O-C 3.53Å; V43-A46 VanDerWaalsContact O-CA 3.31Å; V43-A46 WeakPolarHBondContact O-CA 3.23Å; V43-A46 WeakPolarHBondContact O-CB 3.11Å; V43-A46 PolarHBondContact O-N 2.91Å; V43-F47 HydrophobicContact CG1-CD2 4.1Å; V43-F47 HydrophobicContact CG1-CE2 3.62Å; V43-F47 HydrophobicContact CG1-CZ 4.46Å; V43-F47 WeakPolarHBondContact O-CD2 3.13Å; V43-F47 PolarHBondContact O-N 2.93Å; V43-H121 HydrophobicContact CG1-CB 3.63Å; V43-E156 WeakPolarHBondContact CG2-OE1 3.12Å; V43-R159 VanDerWaalsContact CG2-CZ 3.49Å |
| 44 | E | 58.7 | Low | 74.1 | Confident | 167 Ų | 167 | 76 Ų | 76 | 78% | 0.78 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -35.1 | 177.1 | -68.5 | -168.1 | 166.4 | 0 | 0 | 111.5 | D42 F47 | D42-E44 PolarHBondContact OD1-N 3.31Å; E44-F47 PolarHBondContact O-N 3.35Å |
| 45 | T | 55.3 | Low | 75 | Confident | 44 Ų | 44 | 71.2 Ų | 71.2 | 27% | 0.27 | 33% | 0.333 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -24.7 | 169.2 | -60.6 | 0 | 0 | 0 | 0 | 112.2 | D42 V43 F47 R48 | D42-T45 VanDerWaalsContact CG-CB 3.46Å; D42-T45 VanDerWaalsContact CG-OG1 3.31Å; D42-T45 PolarHBondContact OD1-N 3.04Å; D42-T45 WeakPolarHBondContact OD2-CB 3.32Å; D42-T45 PolarHBondContact OD2-OG1 3.43Å; V43-T45 VanDerWaalsContact C-N 3.29Å; V43-T45 PolarHBondContact O-N 3.3Å; T45-F47 VanDerWaalsContact C-N 3.29Å; T45-F47 PolarHBondContact O-N 2.89Å; T45-R48 HydrophobicContact CG2-CG 4.5Å; T45-R48 WeakPolarHBondContact O-CB 3.3Å; T45-R48 WeakPolarHBondContact O-CG 3.47Å; T45-R48 PolarHBondContact O-N 3.08Å; T45-R48 VanDerWaalsContact O-N 3.14Å; T45-R48 PolarHBondContact OG1-NH2 3.4Å |
| 46 | A | 50.5 | Low | 75.6 | Confident | 1 Ų | 1 | 67 Ų | 67 | 1% | 0.008 | 31% | 0.313 | C | S | . | . | G | 310 helix | trans | -67.9 | -26.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | V43 R48 L114 T118 | V43-A46 CarbonylContact O-C 3.53Å; V43-A46 VanDerWaalsContact O-CA 3.31Å; V43-A46 WeakPolarHBondContact O-CA 3.23Å; V43-A46 WeakPolarHBondContact O-CB 3.11Å; V43-A46 PolarHBondContact O-N 2.91Å; A46-R48 VanDerWaalsContact C-N 3.28Å; A46-R48 PolarHBondContact O-N 3.47Å; A46-L114 HydrophobicContact CB-CD1 3.94Å; A46-T118 WeakPolarHBondContact CB-OG1 3.46Å; A46-T118 PolarHBondContact O-OG1 3.22Å |
| 47 | F | 53 | Low | 76.3 | Confident | 70 Ų | 70 | 68.1 Ų | 68.1 | 31% | 0.307 | 32% | 0.319 | S | S | . | . | G | 310 helix | trans | -76 | -3 | 170.3 | -73.4 | -72.7 | 0 | 0 | 0 | 114.7 | V43 E44 T45 S49 E53 H121 | V43-F47 HydrophobicContact CG1-CD2 4.1Å; V43-F47 HydrophobicContact CG1-CE2 3.62Å; V43-F47 HydrophobicContact CG1-CZ 4.46Å; V43-F47 WeakPolarHBondContact O-CD2 3.13Å; V43-F47 PolarHBondContact O-N 2.93Å; E44-F47 PolarHBondContact O-N 3.35Å; T45-F47 VanDerWaalsContact C-N 3.29Å; T45-F47 PolarHBondContact O-N 2.89Å; F47-S49 PolarHBondContact O-N 2.74Å; F47-S49 VanDerWaalsContact O-N 3.15Å; F47-E53 VanDerWaalsContact CD1-CD 3.47Å; F47-E53 HydrophobicContact CD1-CG 3.89Å; F47-E53 HydrophobicContact CE1-CG 3.92Å; F47-H121 AromaticContact CE2-CD2 3.75Å; F47-H121 AromaticContact CE2-NE2 3.76Å; F47-H121 AromaticContact CZ-CD2 3.48Å; F47-H121 VanDerWaalsContact CZ-CD2 3.48Å; F47-H121 WeakPolarHBondContact CZ-CD2 3.13Å; F47-H121 AromaticContact CZ-NE2 3.68Å |
| 48 | R | 58.1 | Low | 76.7 | Confident | 201 Ų | 201 | 72 Ų | 72 | 76% | 0.758 | 33% | 0.334 | S | S | * | . | G | 310 helix | trans | -68.3 | -13.5 | 178.9 | -68.8 | -175 | -168.4 | 178 | 5.2 | 113.8 | T45 A46 | T45-R48 HydrophobicContact CG2-CG 4.5Å; T45-R48 WeakPolarHBondContact O-CB 3.3Å; T45-R48 WeakPolarHBondContact O-CG 3.47Å; T45-R48 PolarHBondContact O-N 3.08Å; T45-R48 VanDerWaalsContact O-N 3.14Å; T45-R48 PolarHBondContact OG1-NH2 3.4Å; A46-R48 VanDerWaalsContact C-N 3.28Å; A46-R48 PolarHBondContact O-N 3.47Å |
| 49 | S | 67.8 | Low | 77.3 | Confident | 35 Ų | 35 | 67.4 Ų | 67.4 | 25% | 0.245 | 31% | 0.309 | C | S | . | . | trans | -109 | 92.8 | 171.1 | -173.7 | 0 | 0 | 0 | 0 | 110.8 | F47 R51 I52 E53 | F47-S49 PolarHBondContact O-N 2.74Å; F47-S49 VanDerWaalsContact O-N 3.15Å; S49-R51 PolarHBondContact O-N 3.36Å; S49-I52 PolarHBondContact O-N 2.77Å; S49-I52 PolarHBondContact OG-N 3.22Å; S49-E53 PolarHBondContact O-N 2.93Å; S49-E53 VanDerWaalsContact O-N 3.12Å | ||
| 50 | Q | 79.8 | Confident | 77.8 | Confident | 134 Ų | 134 | 60.6 Ų | 60.6 | 63% | 0.626 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -50.6 | -25.1 | 169.7 | -71.5 | -175.1 | 0.7 | 0 | 0 | 112.5 | K54 | Q50-K54 VanDerWaalsContact O-CB 3.27Å; Q50-K54 WeakPolarHBondContact O-CB 3.5Å; Q50-K54 VanDerWaalsContact O-CD 3.32Å; Q50-K54 WeakPolarHBondContact O-CD 3.45Å; Q50-K54 WeakPolarHBondContact O-CG 3.41Å; Q50-K54 PolarHBondContact O-N 3.32Å; Q50-K54 VanDerWaalsContact O-N 3.12Å |
| 51 | R | 83.9 | Confident | 78.3 | Confident | 95 Ų | 95 | 62.8 Ų | 62.8 | 36% | 0.358 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -70.3 | -50.1 | 177.1 | -174.7 | -176.2 | 169.4 | -166.9 | -10.3 | 111.8 | S49 K54 A55 E100 I101 N104 | S49-R51 PolarHBondContact O-N 3.36Å; R51-K54 PolarHBondContact O-N 3.17Å; R51-A55 WeakPolarHBondContact O-CB 3.44Å; R51-A55 PolarHBondContact O-N 3.45Å; R51-E100 PolarHBondContact NH2-O 3.05Å; R51-I101 HydrophobicContact CG-CD1 3.75Å; R51-N104 VanDerWaalsContact CZ-ND2 3.26Å; R51-N104 PolarHBondContact NH1-ND2 2.85Å; R51-N104 VanDerWaalsContact NH1-ND2 3.12Å; R51-N104 PolarHBondContact NH2-ND2 3.34Å |
| 52 | I | 86.4 | Confident | 79.1 | Confident | 4 Ų | 4 | 62.1 Ų | 62.1 | 2% | 0.021 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.3 | -47.9 | 179.4 | -66.1 | 172.8 | 0 | 0 | 0 | 109.3 | S49 K54 A55 V56 I101 L114 V115 T118 | S49-I52 PolarHBondContact O-N 2.77Å; S49-I52 PolarHBondContact OG-N 3.22Å; I52-K54 VanDerWaalsContact C-N 3.31Å; I52-K54 PolarHBondContact O-N 3.31Å; I52-A55 PolarHBondContact O-N 3.47Å; I52-A55 VanDerWaalsContact O-N 3.14Å; I52-V56 HydrophobicContact CG2-CG2 4.11Å; I52-V56 WeakPolarHBondContact O-CG2 3.27Å; I52-V56 PolarHBondContact O-N 3.25Å; I52-I101 HydrophobicContact CG1-CD1 4.08Å; I52-I101 HydrophobicContact CG1-CG1 4.15Å; I52-I101 HydrophobicContact CG1-CG2 4.28Å; I52-L114 HydrophobicContact CD1-CB 4.4Å; I52-L114 HydrophobicContact CD1-CD2 3.56Å; I52-L114 HydrophobicContact CD1-CG 3.98Å; I52-V115 HydrophobicContact CD1-CG2 4.15Å; I52-V115 HydrophobicContact CG1-CG2 4.3Å; I52-V115 HydrophobicContact CG2-CB 4.5Å; I52-V115 HydrophobicContact CG2-CG2 3.95Å; I52-T118 HydrophobicContact CG2-CG2 4.03Å |
| 53 | E | 88.3 | Confident | 80.2 | Confident | 60 Ų | 60 | 59.4 Ų | 59.4 | 28% | 0.28 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -55.7 | -45.3 | 178.2 | -172 | -165.8 | 165.4 | 0 | 0 | 112.1 | F47 S49 N57 I122 | F47-E53 VanDerWaalsContact CD1-CD 3.47Å; F47-E53 HydrophobicContact CD1-CG 3.89Å; F47-E53 HydrophobicContact CE1-CG 3.92Å; S49-E53 PolarHBondContact O-N 2.93Å; S49-E53 VanDerWaalsContact O-N 3.12Å; E53-N57 WeakPolarHBondContact O-CB 3.38Å; E53-N57 PolarHBondContact O-N 2.95Å; E53-N57 PolarHBondContact O-ND2 3.13Å; E53-I122 HydrophobicContact CG-CD1 4.12Å |
| 54 | K | 90 | Very high | 81.4 | Confident | 135 Ų | 135 | 63.4 Ų | 63.4 | 59% | 0.587 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -64.1 | -43.1 | 176.4 | -77.7 | 171.8 | -174.1 | 174.4 | 0 | 112.5 | Q50 R51 I52 K58 | Q50-K54 VanDerWaalsContact O-CB 3.27Å; Q50-K54 WeakPolarHBondContact O-CB 3.5Å; Q50-K54 VanDerWaalsContact O-CD 3.32Å; Q50-K54 WeakPolarHBondContact O-CD 3.45Å; Q50-K54 WeakPolarHBondContact O-CG 3.41Å; Q50-K54 PolarHBondContact O-N 3.32Å; Q50-K54 VanDerWaalsContact O-N 3.12Å; R51-K54 PolarHBondContact O-N 3.17Å; I52-K54 VanDerWaalsContact C-N 3.31Å; I52-K54 PolarHBondContact O-N 3.31Å; K54-K58 VanDerWaalsContact O-CB 3.27Å; K54-K58 WeakPolarHBondContact O-CB 3.09Å; K54-K58 PolarHBondContact O-N 2.88Å |
| 55 | A | 91.3 | Very high | 83 | Confident | 6 Ų | 6 | 60.2 Ų | 60.2 | 5% | 0.05 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.9 | -44.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | R51 I52 K58 F59 V97 I101 | R51-A55 WeakPolarHBondContact O-CB 3.44Å; R51-A55 PolarHBondContact O-N 3.45Å; I52-A55 PolarHBondContact O-N 3.47Å; I52-A55 VanDerWaalsContact O-N 3.14Å; A55-K58 PolarHBondContact O-N 3.28Å; A55-F59 WeakPolarHBondContact O-CB 3.23Å; A55-F59 PolarHBondContact O-N 3.18Å; A55-V97 HydrophobicContact CB-CG1 3.95Å; A55-I101 HydrophobicContact CB-CD1 4.28Å |
| 56 | V | 92.8 | Very high | 84.6 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.5 | -48.9 | 175.4 | 173.8 | 0 | 0 | 0 | 0 | 111 | I52 K58 F59 V60 V97 T118 F119 I122 | I52-V56 HydrophobicContact CG2-CG2 4.11Å; I52-V56 WeakPolarHBondContact O-CG2 3.27Å; I52-V56 PolarHBondContact O-N 3.25Å; V56-K58 VanDerWaalsContact C-N 3.33Å; V56-K58 PolarHBondContact O-N 2.58Å; V56-F59 PolarHBondContact O-N 2.91Å; V56-V60 HydrophobicContact CG1-CG2 4.32Å; V56-V60 WeakPolarHBondContact O-CG2 3.49Å; V56-V60 PolarHBondContact O-N 3.14Å; V56-V97 HydrophobicContact CG2-CG1 3.96Å; V56-V97 HydrophobicContact CG2-CG2 4.37Å; V56-T118 HydrophobicContact CG2-CG2 4.19Å; V56-F119 HydrophobicContact CB-CD2 4.44Å; V56-F119 HydrophobicContact CG1-CB 4.21Å; V56-F119 HydrophobicContact CG1-CD2 3.81Å; V56-F119 HydrophobicContact CG1-CE2 4.39Å; V56-F119 HydrophobicContact CG1-CG 4.1Å; V56-F119 HydrophobicContact CG2-CB 4.37Å; V56-F119 HydrophobicContact CG2-CD2 4.06Å; V56-I122 HydrophobicContact CB-CD1 3.94Å; V56-I122 HydrophobicContact CG1-CB 3.88Å; V56-I122 HydrophobicContact CG1-CD1 3.6Å; V56-I122 HydrophobicContact CG1-CG1 4.29Å; V56-I122 HydrophobicContact CG1-CG2 4.06Å |
| 57 | N | 93.7 | Very high | 86.5 | Confident | 40 Ų | 40 | 67.8 Ų | 67.8 | 21% | 0.214 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -57.3 | -48.4 | 178 | -90.8 | -65.6 | 0 | 0 | 0 | 111.6 | E53 F59 V60 D61 R126 | E53-N57 WeakPolarHBondContact O-CB 3.38Å; E53-N57 PolarHBondContact O-N 2.95Å; E53-N57 PolarHBondContact O-ND2 3.13Å; N57-F59 VanDerWaalsContact C-N 3.33Å; N57-F59 PolarHBondContact O-N 2.95Å; N57-V60 PolarHBondContact O-N 3.3Å; N57-D61 WeakPolarHBondContact O-CB 3.3Å; N57-D61 PolarHBondContact O-N 3.09Å; N57-D61 VanDerWaalsContact O-OD2 3.08Å; N57-R126 PolarHBondContact OD1-NH1 2.88Å |
| 58 | K | 94.8 | Very high | 88.3 | Confident | 120 Ų | 120 | 66.7 Ų | 66.7 | 52% | 0.522 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -57.6 | -46.3 | 176.9 | -178.6 | -172.9 | 172.1 | -163 | 0 | 111.4 | K54 A55 V56 D61 D62 | K54-K58 VanDerWaalsContact O-CB 3.27Å; K54-K58 WeakPolarHBondContact O-CB 3.09Å; K54-K58 PolarHBondContact O-N 2.88Å; A55-K58 PolarHBondContact O-N 3.28Å; V56-K58 VanDerWaalsContact C-N 3.33Å; V56-K58 PolarHBondContact O-N 2.58Å; K58-D61 PolarHBondContact O-N 3.17Å; K58-D62 WeakPolarHBondContact O-CB 3.49Å; K58-D62 VanDerWaalsContact O-CG 3.26Å; K58-D62 PolarHBondContact O-N 3.22Å |
| 59 | F | 95.5 | Very high | 89.7 | Confident | 16 Ų | 16 | 66 Ų | 66 | 7% | 0.07 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.9 | -49.8 | 178.2 | -177.9 | -82.7 | 0 | 0 | 0 | 111.4 | A55 V56 N57 D61 D62 V63 I68 I70 Y92 V97 F119 | A55-F59 WeakPolarHBondContact O-CB 3.23Å; A55-F59 PolarHBondContact O-N 3.18Å; V56-F59 PolarHBondContact O-N 2.91Å; N57-F59 VanDerWaalsContact C-N 3.33Å; N57-F59 PolarHBondContact O-N 2.95Å; F59-D61 VanDerWaalsContact C-N 3.32Å; F59-D61 PolarHBondContact O-N 3.09Å; F59-D62 PolarHBondContact O-N 2.95Å; F59-V63 HydrophobicContact CD1-CG2 4.02Å; F59-V63 HydrophobicContact CE1-CG2 3.47Å; F59-V63 VanDerWaalsContact CE1-CG2 3.47Å; F59-V63 HydrophobicContact CZ-CG2 3.8Å; F59-V63 WeakPolarHBondContact O-CG2 3.41Å; F59-V63 PolarHBondContact O-N 3.13Å; F59-I68 HydrophobicContact CD2-CD1 3.72Å; F59-I68 HydrophobicContact CE2-CD1 3.77Å; F59-I68 HydrophobicContact CE2-CG2 4.4Å; F59-I68 HydrophobicContact CG-CD1 4.31Å; F59-I68 HydrophobicContact CZ-CD1 4.38Å; F59-I70 HydrophobicContact CZ-CD1 4.1Å; F59-Y92 HydrophobicContact CE2-CD1 4.05Å; F59-Y92 AromaticContact CE2-CE1 4Å; F59-Y92 HydrophobicContact CE2-CE1 4Å; F59-Y92 AromaticContact CZ-CD1 3.75Å; F59-Y92 HydrophobicContact CZ-CD1 3.75Å; F59-Y92 HydrophobicContact CZ-CE1 4.12Å; F59-V97 HydrophobicContact CB-CG2 4.04Å; F59-V97 HydrophobicContact CG-CG2 4.31Å; F59-F119 AromaticContact CD1-CE2 3.51Å; F59-F119 HydrophobicContact CD1-CE2 3.51Å; F59-F119 AromaticContact CD1-CZ 3.56Å; F59-F119 HydrophobicContact CD1-CZ 3.56Å; F59-F119 AromaticContact CE1-CE2 4Å; F59-F119 HydrophobicContact CE1-CE2 4Å; F59-F119 AromaticContact CE1-CZ 3.72Å; F59-F119 HydrophobicContact CE1-CZ 3.72Å; F59-F119 HydrophobicContact CG-CE2 4.18Å |
| 60 | V | 95 | Very high | 90.8 | Very high | 2 Ų | 2 | 64.8 Ų | 64.8 | 1% | 0.012 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.3 | -42 | 179.3 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | V56 N57 V63 I64 F119 I122 Y123 R126 V127 | V56-V60 HydrophobicContact CG1-CG2 4.32Å; V56-V60 WeakPolarHBondContact O-CG2 3.49Å; V56-V60 PolarHBondContact O-N 3.14Å; N57-V60 PolarHBondContact O-N 3.3Å; V60-V63 PolarHBondContact O-N 3.35Å; V60-I64 HydrophobicContact CG1-CD1 3.78Å; V60-I64 HydrophobicContact CG1-CG1 4.46Å; V60-I64 VanDerWaalsContact O-CG1 3.28Å; V60-I64 WeakPolarHBondContact O-CG1 3.47Å; V60-I64 PolarHBondContact O-N 3.38Å; V60-F119 HydrophobicContact CG2-CE1 4.48Å; V60-F119 HydrophobicContact CG2-CE2 4.49Å; V60-F119 HydrophobicContact CG2-CZ 4.13Å; V60-I122 HydrophobicContact CG2-CG2 4.28Å; V60-Y123 HydrophobicContact CG2-CD2 4.21Å; V60-R126 HydrophobicContact CG1-CB 4.47Å; V60-V127 HydrophobicContact CG1-CG2 4.25Å |
| 61 | D | 95.6 | Very high | 91.2 | Very high | 51 Ų | 51 | 61.4 Ų | 61.4 | 27% | 0.273 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.5 | -45.8 | 174.1 | -83.5 | -50.5 | 0 | 0 | 0 | 112.4 | N57 K58 F59 V63 I64 N65 R126 | N57-D61 WeakPolarHBondContact O-CB 3.3Å; N57-D61 PolarHBondContact O-N 3.09Å; N57-D61 VanDerWaalsContact O-OD2 3.08Å; K58-D61 PolarHBondContact O-N 3.17Å; F59-D61 VanDerWaalsContact C-N 3.32Å; F59-D61 PolarHBondContact O-N 3.09Å; D61-V63 VanDerWaalsContact C-N 3.29Å; D61-V63 PolarHBondContact O-N 3.19Å; D61-I64 PolarHBondContact O-N 3.42Å; D61-N65 VanDerWaalsContact O-CB 3.3Å; D61-N65 WeakPolarHBondContact O-CB 3.35Å; D61-N65 VanDerWaalsContact O-CG 3.27Å; D61-N65 PolarHBondContact O-N 3.2Å; D61-N65 PolarHBondContact O-ND2 3.22Å; D61-R126 VanDerWaalsContact CG-NH1 3.33Å; D61-R126 IonicContact OD1-CZ 2.64Å; D61-R126 IonicContact OD1-NH1 3.57Å; D61-R126 PolarHBondContact OD1-NH1 3.42Å; D61-R126 IonicContact OD1-NH2 2.79Å; D61-R126 PolarHBondContact OD1-NH2 3.23Å; D61-R126 IonicContact OD2-CZ 3.27Å; D61-R126 IonicContact OD2-NH1 2.6Å; D61-R126 PolarHBondContact OD2-NH1 3.34Å; D61-R126 IonicContact OD2-NH2 3.25Å |
| 62 | D | 94.9 | Very high | 91.3 | Very high | 29 Ų | 29 | 61.6 Ų | 61.6 | 16% | 0.155 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.3 | -29.6 | -178.7 | -72.2 | -20.8 | 0 | 0 | 0 | 111.7 | K58 F59 G66 K67 I68 | K58-D62 WeakPolarHBondContact O-CB 3.49Å; K58-D62 VanDerWaalsContact O-CG 3.26Å; K58-D62 PolarHBondContact O-N 3.22Å; F59-D62 PolarHBondContact O-N 2.95Å; D62-G66 PolarHBondContact O-N 2.96Å; D62-K67 HydrophobicContact CB-CB 4.13Å; D62-K67 HydrophobicContact CB-CD 4.31Å; D62-K67 WeakPolarHBondContact O-CB 3.34Å; D62-K67 PolarHBondContact O-N 3.4Å; D62-K67 VanDerWaalsContact OD1-CD 3.23Å; D62-K67 WeakPolarHBondContact OD1-CD 3.34Å; D62-K67 IonicContact OD1-NZ 2.59Å; D62-K67 PolarHBondContact OD1-NZ 3.47Å; D62-I68 HydrophobicContact CB-CD1 3.5Å; D62-I68 HydrophobicContact CB-CG1 3.8Å; D62-I68 PolarHBondContact O-N 2.67Å |
| 63 | V | 93.3 | Very high | 91.3 | Very high | 28 Ų | 28 | 63.9 Ų | 63.9 | 17% | 0.17 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -68.6 | -50.2 | 169.6 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | F59 V60 D61 N65 G66 I68 I70 I89 | F59-V63 HydrophobicContact CD1-CG2 4.02Å; F59-V63 HydrophobicContact CE1-CG2 3.47Å; F59-V63 VanDerWaalsContact CE1-CG2 3.47Å; F59-V63 HydrophobicContact CZ-CG2 3.8Å; F59-V63 WeakPolarHBondContact O-CG2 3.41Å; F59-V63 PolarHBondContact O-N 3.13Å; V60-V63 PolarHBondContact O-N 3.35Å; D61-V63 VanDerWaalsContact C-N 3.29Å; D61-V63 PolarHBondContact O-N 3.19Å; V63-N65 PolarHBondContact O-N 3.07Å; V63-G66 PolarHBondContact O-N 3.5Å; V63-I68 HydrophobicContact CG2-CB 4.23Å; V63-I68 HydrophobicContact CG2-CD1 4.31Å; V63-I68 HydrophobicContact CG2-CG2 4.45Å; V63-I70 HydrophobicContact CG2-CD1 3.99Å; V63-I89 HydrophobicContact CG1-CD1 4.26Å; V63-I89 HydrophobicContact CG1-CG1 4.45Å; V63-I89 HydrophobicContact CG1-CG2 4.14Å |
| 64 | I | 90.3 | Very high | 91.1 | Very high | 93 Ų | 93 | 67 Ų | 67 | 48% | 0.477 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -59.5 | -37.3 | 179.6 | -69.3 | 166.9 | 0 | 0 | 0 | 111 | V60 D61 G66 V127 | V60-I64 HydrophobicContact CG1-CD1 3.78Å; V60-I64 HydrophobicContact CG1-CG1 4.46Å; V60-I64 VanDerWaalsContact O-CG1 3.28Å; V60-I64 WeakPolarHBondContact O-CG1 3.47Å; V60-I64 PolarHBondContact O-N 3.38Å; D61-I64 PolarHBondContact O-N 3.42Å; I64-G66 VanDerWaalsContact C-N 3.28Å; I64-G66 PolarHBondContact O-N 3.49Å; I64-V127 HydrophobicContact CD1-CG2 4.26Å |
| 65 | N | 92.8 | Very high | 90.9 | Very high | 100 Ų | 100 | 67.2 Ų | 67.2 | 54% | 0.535 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.2 | 4.1 | 178.6 | -66.5 | -55.7 | 0 | 0 | 0 | 113.8 | D61 V63 K67 | D61-N65 VanDerWaalsContact O-CB 3.3Å; D61-N65 WeakPolarHBondContact O-CB 3.35Å; D61-N65 VanDerWaalsContact O-CG 3.27Å; D61-N65 PolarHBondContact O-N 3.2Å; D61-N65 PolarHBondContact O-ND2 3.22Å; V63-N65 PolarHBondContact O-N 3.07Å; N65-K67 VanDerWaalsContact C-N 3.27Å; N65-K67 HydrophobicContact CB-CD 4.39Å; N65-K67 HydrophobicContact CB-CG 4.21Å; N65-K67 PolarHBondContact O-N 2.97Å |
| 66 | G | 88.3 | Confident | 90.6 | Very high | 62 Ų | 62 | 68.8 Ų | 68.8 | 64% | 0.639 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.1 | 22 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115 | D62 V63 I64 | D62-G66 PolarHBondContact O-N 2.96Å; V63-G66 PolarHBondContact O-N 3.5Å; I64-G66 VanDerWaalsContact C-N 3.28Å; I64-G66 PolarHBondContact O-N 3.49Å |
| 67 | K | 91.6 | Very high | 90.1 | Very high | 142 Ų | 142 | 73.5 Ų | 73.5 | 62% | 0.617 | 38% | 0.375 | S | S | * | . | trans | -85 | -20.3 | 179.6 | -61.6 | 174.6 | -168.5 | 164.5 | 0 | 113.1 | D62 N65 | D62-K67 HydrophobicContact CB-CB 4.13Å; D62-K67 HydrophobicContact CB-CD 4.31Å; D62-K67 WeakPolarHBondContact O-CB 3.34Å; D62-K67 PolarHBondContact O-N 3.4Å; D62-K67 VanDerWaalsContact OD1-CD 3.23Å; D62-K67 WeakPolarHBondContact OD1-CD 3.34Å; D62-K67 IonicContact OD1-NZ 2.59Å; D62-K67 PolarHBondContact OD1-NZ 3.47Å; N65-K67 VanDerWaalsContact C-N 3.27Å; N65-K67 HydrophobicContact CB-CD 4.39Å; N65-K67 HydrophobicContact CB-CG 4.21Å; N65-K67 PolarHBondContact O-N 2.97Å | ||
| 68 | I | 89.3 | Confident | 89.5 | Confident | 47 Ų | 47 | 78 Ų | 78 | 24% | 0.241 | 40% | 0.395 | C | S | . | . | S | Bend | trans | -107.5 | 128.5 | 177.3 | -67.3 | 170.9 | 0 | 0 | 0 | 108.8 | F59 D62 V63 I70 Y92 | F59-I68 HydrophobicContact CD2-CD1 3.72Å; F59-I68 HydrophobicContact CE2-CD1 3.77Å; F59-I68 HydrophobicContact CE2-CG2 4.4Å; F59-I68 HydrophobicContact CG-CD1 4.31Å; F59-I68 HydrophobicContact CZ-CD1 4.38Å; D62-I68 HydrophobicContact CB-CD1 3.5Å; D62-I68 HydrophobicContact CB-CG1 3.8Å; D62-I68 PolarHBondContact O-N 2.67Å; V63-I68 HydrophobicContact CG2-CB 4.23Å; V63-I68 HydrophobicContact CG2-CD1 4.31Å; V63-I68 HydrophobicContact CG2-CG2 4.45Å; I68-I70 HydrophobicContact CG2-CD1 3.88Å; I68-Y92 HydrophobicContact CG2-CE1 3.86Å |
| 69 | R | 88.5 | Confident | 88.7 | Confident | 187 Ų | 187 | 82 Ų | 82 | 71% | 0.706 | 41% | 0.412 | S | S | * | . | trans | -88 | 114.1 | 168.9 | -172.5 | 177.9 | -179.3 | -165.4 | -1.1 | 109 | E74 | R69-E74 IonicContact CZ-OE2 3.03Å; R69-E74 IonicContact NE-OE2 3.92Å; R69-E74 VanDerWaalsContact NH2-CD 3.33Å; R69-E74 IonicContact NH2-OE1 2.8Å; R69-E74 PolarHBondContact NH2-OE1 3.23Å; R69-E74 IonicContact NH2-OE2 3.17Å; R69-E74 PolarHBondContact NH2-OE2 3.03Å | ||
| 70 | I | 90.5 | Very high | 88 | Confident | 10 Ų | 10 | 85 Ų | 85 | 5% | 0.051 | 44% | 0.441 | C | S | . | . | trans | -79.9 | 127.2 | 175.6 | -54.4 | -66.1 | 0 | 0 | 0 | 108.6 | F59 V63 I68 L73 L88 I89 Y92 | F59-I70 HydrophobicContact CZ-CD1 4.1Å; V63-I70 HydrophobicContact CG2-CD1 3.99Å; I68-I70 HydrophobicContact CG2-CD1 3.88Å; I70-L73 HydrophobicContact CB-CB 3.97Å; I70-L73 HydrophobicContact CB-CD2 3.99Å; I70-L73 HydrophobicContact CB-CG 4.49Å; I70-L73 HydrophobicContact CG1-CD2 4.26Å; I70-L73 HydrophobicContact CG2-CB 4.18Å; I70-L73 WeakPolarHBondContact O-CB 3.39Å; I70-L88 HydrophobicContact CG2-CB 4.14Å; I70-I89 HydrophobicContact CD1-CG1 4.45Å; I70-I89 HydrophobicContact CG1-CG1 4.07Å; I70-I89 HydrophobicContact CG2-CG1 4.48Å; I70-Y92 HydrophobicContact CD1-CD1 3.47Å; I70-Y92 VanDerWaalsContact CD1-CD1 3.47Å; I70-Y92 HydrophobicContact CD1-CE1 4.03Å; I70-Y92 HydrophobicContact CD1-CG 4.36Å | ||
| 71 | P | 89 | Confident | 87.5 | Confident | 62 Ų | 62 | 88.2 Ų | 88.2 | 40% | 0.403 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | 144.5 | 175.1 | -25.2 | 34.9 | 0 | 0 | 0 | 112.2 | L73 Y92 | P71-L73 PolarHBondContact O-N 3.48Å; P71-Y92 HydrophobicContact CG-CD2 3.79Å; P71-Y92 HydrophobicContact CG-CE2 3.73Å |
| 72 | D | 86.1 | Confident | 87.2 | Confident | 100 Ų | 100 | 89.2 Ų | 89.2 | 54% | 0.535 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61 | -2.7 | 176.3 | -54.6 | -44.9 | 0 | 0 | 0 | 116.9 | E74 H75 L88 | D72-E74 PolarHBondContact O-N 2.92Å; D72-H75 PolarHBondContact O-N 3.07Å; D72-H75 VanDerWaalsContact O-N 3.09Å; D72-H75 IonicContact OD1-ND1 2.63Å; D72-L88 HydrophobicContact CB-CD1 4.42Å |
| 73 | L | 86.6 | Confident | 87.1 | Confident | 52 Ų | 52 | 88.9 Ų | 88.9 | 27% | 0.272 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | -63.3 | -30.8 | -178.3 | -169.5 | 69.7 | 0 | 0 | 0 | 112.6 | I70 P71 H75 V76 V85 L88 | I70-L73 HydrophobicContact CB-CB 3.97Å; I70-L73 HydrophobicContact CB-CD2 3.99Å; I70-L73 HydrophobicContact CB-CG 4.49Å; I70-L73 HydrophobicContact CG1-CD2 4.26Å; I70-L73 HydrophobicContact CG2-CB 4.18Å; I70-L73 WeakPolarHBondContact O-CB 3.39Å; P71-L73 PolarHBondContact O-N 3.48Å; L73-H75 PolarHBondContact O-N 2.97Å; L73-V76 PolarHBondContact O-N 3.46Å; L73-V85 HydrophobicContact CD1-CB 4.01Å; L73-V85 HydrophobicContact CD1-CG1 3.73Å; L73-V85 HydrophobicContact CD1-CG2 3.92Å; L73-L88 HydrophobicContact CD1-CD1 4.27Å |
| 74 | E | 83.8 | Confident | 87 | Confident | 126 Ų | 126 | 89.2 Ų | 89.2 | 59% | 0.589 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -67.4 | -15.1 | 177.4 | 64.7 | -161 | -172 | 0 | 0 | 114.5 | R69 D72 | R69-E74 IonicContact CZ-OE2 3.03Å; R69-E74 IonicContact NE-OE2 3.92Å; R69-E74 VanDerWaalsContact NH2-CD 3.33Å; R69-E74 IonicContact NH2-OE1 2.8Å; R69-E74 PolarHBondContact NH2-OE1 3.23Å; R69-E74 IonicContact NH2-OE2 3.17Å; R69-E74 PolarHBondContact NH2-OE2 3.03Å; D72-E74 PolarHBondContact O-N 2.92Å |
| 75 | H | 84.8 | Confident | 87.1 | Confident | 139 Ų | 139 | 85.7 Ų | 85.7 | 64% | 0.644 | 44% | 0.443 | S | S | * | . | G | 310 helix | trans | -94.3 | -4.3 | 177.8 | -54.3 | 112.1 | 0 | 0 | 0 | 112.8 | D72 L73 | D72-H75 PolarHBondContact O-N 3.07Å; D72-H75 VanDerWaalsContact O-N 3.09Å; D72-H75 IonicContact OD1-ND1 2.63Å; L73-H75 PolarHBondContact O-N 2.97Å |
| 76 | V | 84.8 | Confident | 87.1 | Confident | 39 Ų | 39 | 81.6 Ų | 81.6 | 24% | 0.236 | 42% | 0.421 | C | S | . | . | trans | -95.4 | 123.8 | -178.7 | -176.9 | 0 | 0 | 0 | 0 | 109.7 | L73 E78 V85 L88 | L73-V76 PolarHBondContact O-N 3.46Å; V76-E78 PolarHBondContact O-N 3.25Å; V76-V85 HydrophobicContact CB-CG2 4.3Å; V76-V85 HydrophobicContact CG1-CG2 3.77Å; V76-L88 HydrophobicContact CG2-CD1 3.61Å | ||
| 77 | D | 83 | Confident | 87.4 | Confident | 98 Ų | 98 | 83.4 Ų | 83.4 | 52% | 0.524 | 41% | 0.409 | S | S | . | . | trans | -79.3 | 98.9 | 166.6 | -177.3 | 5.2 | 0 | 0 | 0 | 109.3 | K79 A80 D81 | D77-K79 PolarHBondContact O-N 3.17Å; D77-K79 VanDerWaalsContact O-N 3.13Å; D77-K79 WeakPolarHBondContact OD1-CB 3.49Å; D77-K79 PolarHBondContact OD1-N 3.48Å; D77-A80 HydrophobicContact CB-CB 4.03Å; D77-A80 PolarHBondContact O-N 3.05Å; D77-D81 PolarHBondContact O-N 2.92Å | ||
| 78 | E | 80.9 | Confident | 87.6 | Confident | 134 Ų | 134 | 78.4 Ų | 78.4 | 63% | 0.626 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | -29.6 | 178.2 | -174.4 | -179.7 | -179.6 | 0 | 0 | 112.7 | V76 A80 K82 V85 | V76-E78 PolarHBondContact O-N 3.25Å; E78-A80 VanDerWaalsContact C-N 3.34Å; E78-K82 PolarHBondContact O-N 3.2Å; E78-V85 HydrophobicContact CB-CG2 4.22Å; E78-V85 HydrophobicContact CG-CG2 4.26Å |
| 79 | K | 79.3 | Confident | 87.8 | Confident | 204 Ų | 204 | 76.8 Ų | 76.8 | 89% | 0.887 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -28.5 | 179.2 | -63.8 | -177.5 | 178.8 | 178.4 | 0 | 112.5 | D77 | D77-K79 PolarHBondContact O-N 3.17Å; D77-K79 VanDerWaalsContact O-N 3.13Å; D77-K79 WeakPolarHBondContact OD1-CB 3.49Å; D77-K79 PolarHBondContact OD1-N 3.48Å |
| 80 | A | 79.8 | Confident | 88.1 | Confident | 81 Ų | 81 | 68.5 Ų | 68.5 | 67% | 0.669 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.7 | -39.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | D77 E78 | D77-A80 HydrophobicContact CB-CB 4.03Å; D77-A80 PolarHBondContact O-N 3.05Å; E78-A80 VanDerWaalsContact C-N 3.34Å |
| 81 | D | 84.3 | Confident | 88.3 | Confident | 69 Ų | 69 | 72 Ų | 72 | 37% | 0.369 | 37% | 0.367 | S | S | . | . | trans | -147.2 | 82.5 | -179.2 | -175.3 | 2.1 | 0 | 0 | 0 | 112.3 | D77 F83 S84 | D77-D81 PolarHBondContact O-N 2.92Å; D81-F83 PolarHBondContact O-N 3.26Å; D81-F83 PolarHBondContact OD1-N 2.84Å; D81-F83 VanDerWaalsContact OD1-N 3.1Å; D81-S84 VanDerWaalsContact CG-OG 3.31Å; D81-S84 PolarHBondContact O-N 3.17Å; D81-S84 PolarHBondContact OD1-N 2.98Å; D81-S84 VanDerWaalsContact OD2-CB 3.23Å; D81-S84 WeakPolarHBondContact OD2-CB 3.47Å; D81-S84 PolarHBondContact OD2-OG 3.04Å | ||
| 82 | K | 89.9 | Confident | 88.6 | Confident | 71 Ų | 71 | 72.5 Ų | 72.5 | 31% | 0.309 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.5 | -26.6 | 175.1 | 73 | 171.3 | -171.4 | 165.7 | 0 | 113.3 | E78 V85 H86 E131 | E78-K82 PolarHBondContact O-N 3.2Å; K82-V85 WeakPolarHBondContact O-CB 3.46Å; K82-V85 PolarHBondContact O-N 2.87Å; K82-H86 PolarHBondContact O-CD2 3.21Å; K82-H86 PolarHBondContact O-N 2.89Å; K82-E131 IonicContact NZ-OE2 2.94Å; K82-E131 PolarHBondContact NZ-OE2 3.45Å |
| 83 | F | 92.3 | Very high | 89 | Confident | 22 Ų | 22 | 67.7 Ų | 67.7 | 10% | 0.096 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -78.6 | -26 | -175.8 | -65.6 | -76.3 | 0 | 0 | 0 | 112.4 | D81 V85 H86 R87 T140 L141 G144 L145 A148 | D81-F83 PolarHBondContact O-N 3.26Å; D81-F83 PolarHBondContact OD1-N 2.84Å; D81-F83 VanDerWaalsContact OD1-N 3.1Å; F83-V85 VanDerWaalsContact C-N 3.3Å; F83-V85 PolarHBondContact O-N 3.31Å; F83-H86 PolarHBondContact O-N 3.12Å; F83-R87 WeakPolarHBondContact O-CB 3.49Å; F83-R87 PolarHBondContact O-N 3.22Å; F83-T140 HydrophobicContact CE2-CG2 4.39Å; F83-T140 HydrophobicContact CZ-CG2 4.33Å; F83-T140 WeakPolarHBondContact CZ-O 3.3Å; F83-L141 HydrophobicContact CE1-CD1 3.85Å; F83-G144 VanDerWaalsContact CE2-CA 3.47Å; F83-L145 HydrophobicContact CD1-CD2 4.38Å; F83-A148 HydrophobicContact CB-CB 3.97Å |
| 84 | S | 91.3 | Very high | 89.3 | Confident | 35 Ų | 35 | 65.6 Ų | 65.6 | 25% | 0.245 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.1 | -36.5 | 167.4 | -84.2 | 0 | 0 | 0 | 0 | 112.9 | D81 R87 L88 | D81-S84 VanDerWaalsContact CG-OG 3.31Å; D81-S84 PolarHBondContact O-N 3.17Å; D81-S84 PolarHBondContact OD1-N 2.98Å; D81-S84 VanDerWaalsContact OD2-CB 3.23Å; D81-S84 WeakPolarHBondContact OD2-CB 3.47Å; D81-S84 PolarHBondContact OD2-OG 3.04Å; S84-R87 WeakPolarHBondContact O-CB 3.29Å; S84-R87 PolarHBondContact O-N 3.34Å; S84-L88 WeakPolarHBondContact O-CG 3.36Å; S84-L88 PolarHBondContact O-N 3.26Å |
| 85 | V | 92.1 | Very high | 89.7 | Confident | 19 Ų | 19 | 62.9 Ų | 62.9 | 12% | 0.115 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.5 | -52.6 | 173.5 | 167.6 | 0 | 0 | 0 | 0 | 110.7 | L73 V76 E78 K82 F83 R87 L88 I89 | L73-V85 HydrophobicContact CD1-CB 4.01Å; L73-V85 HydrophobicContact CD1-CG1 3.73Å; L73-V85 HydrophobicContact CD1-CG2 3.92Å; V76-V85 HydrophobicContact CB-CG2 4.3Å; V76-V85 HydrophobicContact CG1-CG2 3.77Å; E78-V85 HydrophobicContact CB-CG2 4.22Å; E78-V85 HydrophobicContact CG-CG2 4.26Å; K82-V85 WeakPolarHBondContact O-CB 3.46Å; K82-V85 PolarHBondContact O-N 2.87Å; F83-V85 VanDerWaalsContact C-N 3.3Å; F83-V85 PolarHBondContact O-N 3.31Å; V85-R87 VanDerWaalsContact C-N 3.26Å; V85-R87 PolarHBondContact O-N 3.4Å; V85-L88 PolarHBondContact O-N 3.43Å; V85-I89 HydrophobicContact CG1-CD1 3.71Å; V85-I89 WeakPolarHBondContact O-CG1 3.48Å; V85-I89 PolarHBondContact O-N 2.81Å |
| 86 | H | 94.3 | Very high | 90 | Very high | 15 Ų | 15 | 57.4 Ų | 57.4 | 7% | 0.069 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.5 | -38.4 | 177.7 | -62.4 | -58 | 0 | 0 | 0 | 112.1 | K82 F83 I89 F90 Y123 | K82-H86 PolarHBondContact O-CD2 3.21Å; K82-H86 PolarHBondContact O-N 2.89Å; F83-H86 PolarHBondContact O-N 3.12Å; H86-I89 PolarHBondContact O-N 3.39Å; H86-F90 WeakPolarHBondContact O-CB 3.35Å; H86-F90 PolarHBondContact O-N 3.03Å; H86-Y123 HydrophobicContact CB-CE1 4.36Å; H86-Y123 AromaticContact ND1-CE1 3.88Å; H86-Y123 AromaticContact ND1-CZ 3.83Å; H86-Y123 PolarHBondContact ND1-OH 3.48Å |
| 87 | R | 94.5 | Very high | 90.3 | Very high | 100 Ų | 100 | 55.6 Ų | 55.6 | 38% | 0.377 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.3 | -48.2 | 177.3 | -173.5 | -176.6 | 176.4 | -89.1 | -3.9 | 112.2 | F83 S84 V85 F90 I91 A148 L150 | F83-R87 WeakPolarHBondContact O-CB 3.49Å; F83-R87 PolarHBondContact O-N 3.22Å; S84-R87 WeakPolarHBondContact O-CB 3.29Å; S84-R87 PolarHBondContact O-N 3.34Å; V85-R87 VanDerWaalsContact C-N 3.26Å; V85-R87 PolarHBondContact O-N 3.4Å; R87-F90 PolarHBondContact O-N 3.32Å; R87-I91 HydrophobicContact CG-CD1 3.84Å; R87-I91 WeakPolarHBondContact O-CB 3.44Å; R87-I91 VanDerWaalsContact O-CG1 3.31Å; R87-I91 WeakPolarHBondContact O-CG1 3.43Å; R87-I91 PolarHBondContact O-N 2.87Å; R87-A148 HydrophobicContact CB-CB 4.37Å; R87-A148 WeakPolarHBondContact CD-O 3.21Å; R87-A148 PolarHBondContact NE-O 2.88Å; R87-L150 HydrophobicContact CB-CD1 3.96Å; R87-L150 HydrophobicContact CB-CD2 4.4Å; R87-L150 HydrophobicContact CB-CG 4.4Å; R87-L150 HydrophobicContact CG-CD1 4.45Å; R87-L150 HydrophobicContact CG-CD2 4.12Å; R87-L150 HydrophobicContact CG-CG 4.36Å |
| 88 | L | 93.9 | Very high | 90.6 | Very high | 36 Ų | 36 | 51.5 Ų | 51.5 | 19% | 0.188 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 179 | -71.5 | 175.6 | 0 | 0 | 0 | 111.5 | I70 D72 L73 V76 S84 V85 F90 Y92 | I70-L88 HydrophobicContact CG2-CB 4.14Å; D72-L88 HydrophobicContact CB-CD1 4.42Å; L73-L88 HydrophobicContact CD1-CD1 4.27Å; V76-L88 HydrophobicContact CG2-CD1 3.61Å; S84-L88 WeakPolarHBondContact O-CG 3.36Å; S84-L88 PolarHBondContact O-N 3.26Å; V85-L88 PolarHBondContact O-N 3.43Å; L88-F90 VanDerWaalsContact C-N 3.33Å; L88-F90 PolarHBondContact O-N 2.91Å; L88-Y92 VanDerWaalsContact O-CB 3.26Å; L88-Y92 WeakPolarHBondContact O-CB 3.46Å; L88-Y92 PolarHBondContact O-N 3.46Å |
| 89 | I | 94.8 | Very high | 90.9 | Very high | 13 Ų | 13 | 50.9 Ų | 50.9 | 7% | 0.067 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.1 | -46.4 | 176.6 | -66.7 | 165 | 0 | 0 | 0 | 110.6 | V63 I70 V85 H86 G93 Y123 | V63-I89 HydrophobicContact CG1-CD1 4.26Å; V63-I89 HydrophobicContact CG1-CG1 4.45Å; V63-I89 HydrophobicContact CG1-CG2 4.14Å; I70-I89 HydrophobicContact CD1-CG1 4.45Å; I70-I89 HydrophobicContact CG1-CG1 4.07Å; I70-I89 HydrophobicContact CG2-CG1 4.48Å; V85-I89 HydrophobicContact CG1-CD1 3.71Å; V85-I89 WeakPolarHBondContact O-CG1 3.48Å; V85-I89 PolarHBondContact O-N 2.81Å; H86-I89 PolarHBondContact O-N 3.39Å; I89-G93 PolarHBondContact O-N 3.04Å; I89-Y123 HydrophobicContact CG2-CD2 4.47Å; I89-Y123 HydrophobicContact CG2-CE2 3.61Å |
| 90 | F | 95.3 | Very high | 91.2 | Very high | 13 Ų | 13 | 45.7 Ų | 45.7 | 6% | 0.057 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.4 | -49.5 | -177.4 | -172.3 | -91 | 0 | 0 | 0 | 112 | H86 R87 L88 G93 V94 R116 F119 A120 L150 A152 L153 | H86-F90 WeakPolarHBondContact O-CB 3.35Å; H86-F90 PolarHBondContact O-N 3.03Å; R87-F90 PolarHBondContact O-N 3.32Å; L88-F90 VanDerWaalsContact C-N 3.33Å; L88-F90 PolarHBondContact O-N 2.91Å; F90-G93 PolarHBondContact O-N 3.22Å; F90-V94 HydrophobicContact CD1-CG2 4.2Å; F90-V94 HydrophobicContact CE1-CG2 3.83Å; F90-V94 HydrophobicContact CE2-CG2 4.37Å; F90-V94 HydrophobicContact CZ-CG2 3.92Å; F90-V94 WeakPolarHBondContact O-CB 3.48Å; F90-V94 VanDerWaalsContact O-CG2 3.32Å; F90-V94 WeakPolarHBondContact O-CG2 3.35Å; F90-V94 PolarHBondContact O-N 3.29Å; F90-R116 HydrophobicContact CE1-CG 4.3Å; F90-R116 HydrophobicContact CZ-CG 4.11Å; F90-F119 AromaticContact CD2-CD1 3.63Å; F90-F119 HydrophobicContact CD2-CD1 3.63Å; F90-F119 AromaticContact CD2-CE1 3.98Å; F90-F119 HydrophobicContact CD2-CE1 3.98Å; F90-F119 HydrophobicContact CE2-CB 4.45Å; F90-F119 AromaticContact CE2-CD1 3.68Å; F90-F119 HydrophobicContact CE2-CD1 3.68Å; F90-F119 HydrophobicContact CE2-CE1 4.48Å; F90-F119 HydrophobicContact CE2-CG 4.46Å; F90-A120 HydrophobicContact CE2-CB 3.93Å; F90-A120 HydrophobicContact CZ-CB 4.12Å; F90-L150 HydrophobicContact CB-CD2 4.18Å; F90-L150 HydrophobicContact CD1-CD2 3.82Å; F90-L150 HydrophobicContact CG-CD2 4.13Å; F90-A152 HydrophobicContact CZ-CB 3.99Å; F90-L153 HydrophobicContact CB-CD1 4.49Å; F90-L153 HydrophobicContact CD2-CD1 3.67Å; F90-L153 HydrophobicContact CD2-CD2 4.22Å; F90-L153 HydrophobicContact CD2-CG 3.91Å; F90-L153 HydrophobicContact CE2-CD1 4.14Å; F90-L153 HydrophobicContact CE2-CD2 4.08Å; F90-L153 HydrophobicContact CE2-CG 3.84Å; F90-L153 HydrophobicContact CG-CD1 4.13Å |
| 91 | I | 94.1 | Very high | 91.3 | Very high | 85 Ų | 85 | 42.5 Ų | 42.5 | 44% | 0.436 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -61.8 | -49 | 180 | -68.6 | 170.5 | 0 | 0 | 0 | 110.3 | R87 G93 D95 | R87-I91 HydrophobicContact CG-CD1 3.84Å; R87-I91 WeakPolarHBondContact O-CB 3.44Å; R87-I91 VanDerWaalsContact O-CG1 3.31Å; R87-I91 WeakPolarHBondContact O-CG1 3.43Å; R87-I91 PolarHBondContact O-N 2.87Å; I91-G93 VanDerWaalsContact C-N 3.34Å; I91-G93 PolarHBondContact O-N 2.88Å; I91-D95 WeakPolarHBondContact O-CB 3.29Å; I91-D95 PolarHBondContact O-N 3.31Å; I91-D95 VanDerWaalsContact O-N 3.11Å |
| 92 | Y | 94.9 | Very high | 90.9 | Very high | 71 Ų | 71 | 41.1 Ų | 41.1 | 28% | 0.278 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -65.8 | -37.7 | -179.1 | -179 | -102.3 | 0 | 0 | 0 | 112.3 | F59 I68 I70 P71 L88 S96 | F59-Y92 HydrophobicContact CE2-CD1 4.05Å; F59-Y92 AromaticContact CE2-CE1 4Å; F59-Y92 HydrophobicContact CE2-CE1 4Å; F59-Y92 AromaticContact CZ-CD1 3.75Å; F59-Y92 HydrophobicContact CZ-CD1 3.75Å; F59-Y92 HydrophobicContact CZ-CE1 4.12Å; I68-Y92 HydrophobicContact CG2-CE1 3.86Å; I70-Y92 HydrophobicContact CD1-CD1 3.47Å; I70-Y92 VanDerWaalsContact CD1-CD1 3.47Å; I70-Y92 HydrophobicContact CD1-CE1 4.03Å; I70-Y92 HydrophobicContact CD1-CG 4.36Å; P71-Y92 HydrophobicContact CG-CD2 3.79Å; P71-Y92 HydrophobicContact CG-CE2 3.73Å; L88-Y92 VanDerWaalsContact O-CB 3.26Å; L88-Y92 WeakPolarHBondContact O-CB 3.46Å; L88-Y92 PolarHBondContact O-N 3.46Å; Y92-S96 VanDerWaalsContact O-CB 3.24Å; Y92-S96 WeakPolarHBondContact O-CB 3.43Å; Y92-S96 PolarHBondContact O-N 3.41Å; Y92-S96 PolarHBondContact O-OG 3.44Å |
| 93 | G | 94 | Very high | 89.7 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.2 | -46.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | I89 F90 I91 D95 S96 V97 | I89-G93 PolarHBondContact O-N 3.04Å; F90-G93 PolarHBondContact O-N 3.22Å; I91-G93 VanDerWaalsContact C-N 3.34Å; I91-G93 PolarHBondContact O-N 2.88Å; G93-D95 PolarHBondContact O-N 2.76Å; G93-S96 PolarHBondContact O-N 2.9Å; G93-V97 WeakPolarHBondContact O-CB 3.49Å; G93-V97 WeakPolarHBondContact O-CG2 3.27Å; G93-V97 PolarHBondContact O-N 3.36Å |
| 94 | V | 93.3 | Very high | 88.2 | Confident | 8 Ų | 8 | 48.4 Ų | 48.4 | 5% | 0.048 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.3 | -45.4 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | F90 S98 V115 R116 F119 | F90-V94 HydrophobicContact CD1-CG2 4.2Å; F90-V94 HydrophobicContact CE1-CG2 3.83Å; F90-V94 HydrophobicContact CE2-CG2 4.37Å; F90-V94 HydrophobicContact CZ-CG2 3.92Å; F90-V94 WeakPolarHBondContact O-CB 3.48Å; F90-V94 VanDerWaalsContact O-CG2 3.32Å; F90-V94 WeakPolarHBondContact O-CG2 3.35Å; F90-V94 PolarHBondContact O-N 3.29Å; V94-S98 WeakPolarHBondContact O-CB 3.2Å; V94-S98 PolarHBondContact O-N 3.33Å; V94-S98 PolarHBondContact O-OG 2.91Å; V94-V115 HydrophobicContact CG1-CG1 4.44Å; V94-R116 HydrophobicContact CG1-CB 4.24Å; V94-F119 HydrophobicContact CG2-CB 3.94Å; V94-F119 HydrophobicContact CG2-CD1 4.32Å; V94-F119 HydrophobicContact CG2-CD2 4.32Å; V94-F119 HydrophobicContact CG2-CG 3.93Å |
| 95 | D | 92.2 | Very high | 86.4 | Confident | 69 Ų | 69 | 53.7 Ų | 53.7 | 37% | 0.369 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63.4 | -46.2 | 177.7 | 176.6 | 50.4 | 0 | 0 | 0 | 112.3 | I91 G93 S98 R99 | I91-D95 WeakPolarHBondContact O-CB 3.29Å; I91-D95 PolarHBondContact O-N 3.31Å; I91-D95 VanDerWaalsContact O-N 3.11Å; G93-D95 PolarHBondContact O-N 2.76Å; D95-S98 PolarHBondContact O-N 2.89Å; D95-R99 VanDerWaalsContact CG-NH1 3.33Å; D95-R99 PolarHBondContact O-N 3.27Å; D95-R99 IonicContact OD1-CZ 2.88Å; D95-R99 IonicContact OD1-NH1 3.39Å; D95-R99 PolarHBondContact OD1-NH1 3Å; D95-R99 IonicContact OD2-CZ 2.68Å; D95-R99 IonicContact OD2-NH1 3.29Å; D95-R99 PolarHBondContact OD2-NH1 3.46Å; D95-R99 IonicContact OD2-NH2 3.75Å; D95-R99 PolarHBondContact OD2-NH2 3.08Å |
| 96 | S | 91.3 | Very high | 84.6 | Confident | 23 Ų | 23 | 62.5 Ų | 62.5 | 16% | 0.161 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.7 | -46.6 | -179.6 | -61.7 | 0 | 0 | 0 | 0 | 112.6 | Y92 G93 R99 E100 | Y92-S96 VanDerWaalsContact O-CB 3.24Å; Y92-S96 WeakPolarHBondContact O-CB 3.43Å; Y92-S96 PolarHBondContact O-N 3.41Å; Y92-S96 PolarHBondContact O-OG 3.44Å; G93-S96 PolarHBondContact O-N 2.9Å; S96-R99 PolarHBondContact O-N 3.31Å; S96-E100 PolarHBondContact O-N 2.88Å; S96-E100 VanDerWaalsContact O-N 3.16Å |
| 97 | V | 90.9 | Very high | 82.8 | Confident | 1 Ų | 1 | 68.1 Ų | 68.1 | 1% | 0.006 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -67.4 | -41.2 | 176.8 | 175.5 | 0 | 0 | 0 | 0 | 110.2 | A55 V56 F59 G93 R99 E100 I101 V115 F119 | A55-V97 HydrophobicContact CB-CG1 3.95Å; V56-V97 HydrophobicContact CG2-CG1 3.96Å; V56-V97 HydrophobicContact CG2-CG2 4.37Å; F59-V97 HydrophobicContact CB-CG2 4.04Å; F59-V97 HydrophobicContact CG-CG2 4.31Å; G93-V97 WeakPolarHBondContact O-CB 3.49Å; G93-V97 WeakPolarHBondContact O-CG2 3.27Å; G93-V97 PolarHBondContact O-N 3.36Å; V97-R99 VanDerWaalsContact C-N 3.3Å; V97-R99 PolarHBondContact O-N 3.47Å; V97-E100 PolarHBondContact O-N 3.32Å; V97-I101 HydrophobicContact CG1-CG1 4.11Å; V97-I101 VanDerWaalsContact O-CG1 3.25Å; V97-I101 WeakPolarHBondContact O-CG1 3.23Å; V97-I101 PolarHBondContact O-N 2.89Å; V97-V115 HydrophobicContact CB-CG1 3.91Å; V97-V115 HydrophobicContact CG1-CG1 3.68Å; V97-V115 HydrophobicContact CG1-CG2 4.28Å; V97-F119 HydrophobicContact CG2-CD2 4.46Å; V97-F119 HydrophobicContact CG2-CE2 4.42Å |
| 98 | S | 89.4 | Confident | 81.4 | Confident | 12 Ų | 12 | 66.8 Ų | 66.8 | 8% | 0.084 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.7 | -39.9 | 179.2 | -61.8 | 0 | 0 | 0 | 0 | 111.6 | V94 D95 I101 S102 | V94-S98 WeakPolarHBondContact O-CB 3.2Å; V94-S98 PolarHBondContact O-N 3.33Å; V94-S98 PolarHBondContact O-OG 2.91Å; D95-S98 PolarHBondContact O-N 2.89Å; S98-I101 PolarHBondContact O-N 3.49Å; S98-S102 WeakPolarHBondContact O-CB 3.46Å; S98-S102 PolarHBondContact O-N 3.46Å; S98-S102 PolarHBondContact O-OG 2.92Å |
| 99 | R | 87.4 | Confident | 80.1 | Confident | 122 Ų | 122 | 73 Ų | 73 | 46% | 0.46 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.8 | -49.6 | 173.2 | -75.7 | -167 | -69.2 | -106.3 | -9.7 | 112.5 | D95 S96 V97 I101 S102 D103 | D95-R99 VanDerWaalsContact CG-NH1 3.33Å; D95-R99 PolarHBondContact O-N 3.27Å; D95-R99 IonicContact OD1-CZ 2.88Å; D95-R99 IonicContact OD1-NH1 3.39Å; D95-R99 PolarHBondContact OD1-NH1 3Å; D95-R99 IonicContact OD2-CZ 2.68Å; D95-R99 IonicContact OD2-NH1 3.29Å; D95-R99 PolarHBondContact OD2-NH1 3.46Å; D95-R99 IonicContact OD2-NH2 3.75Å; D95-R99 PolarHBondContact OD2-NH2 3.08Å; S96-R99 PolarHBondContact O-N 3.31Å; V97-R99 VanDerWaalsContact C-N 3.3Å; V97-R99 PolarHBondContact O-N 3.47Å; R99-I101 PolarHBondContact O-N 3.07Å; R99-S102 PolarHBondContact O-N 3.28Å; R99-D103 PolarHBondContact O-N 3.16Å; R99-D103 VanDerWaalsContact O-N 3.11Å |
| 100 | E | 85.8 | Confident | 78.8 | Confident | 95 Ų | 95 | 78.6 Ų | 78.6 | 44% | 0.444 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -57.6 | -33 | 178.6 | -176.9 | -178.6 | 167.2 | 0 | 0 | 112.5 | R51 S96 V97 | R51-E100 PolarHBondContact NH2-O 3.05Å; S96-E100 PolarHBondContact O-N 2.88Å; S96-E100 VanDerWaalsContact O-N 3.16Å; V97-E100 PolarHBondContact O-N 3.32Å |
| 101 | I | 82.3 | Confident | 77.9 | Confident | 13 Ų | 13 | 79.1 Ų | 79.1 | 7% | 0.067 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -82.7 | -43.8 | 178.2 | -58.5 | -64.6 | 0 | 0 | 0 | 111.9 | R51 I52 A55 V97 S98 R99 D103 N104 C111 | R51-I101 HydrophobicContact CG-CD1 3.75Å; I52-I101 HydrophobicContact CG1-CD1 4.08Å; I52-I101 HydrophobicContact CG1-CG1 4.15Å; I52-I101 HydrophobicContact CG1-CG2 4.28Å; A55-I101 HydrophobicContact CB-CD1 4.28Å; V97-I101 HydrophobicContact CG1-CG1 4.11Å; V97-I101 VanDerWaalsContact O-CG1 3.25Å; V97-I101 WeakPolarHBondContact O-CG1 3.23Å; V97-I101 PolarHBondContact O-N 2.89Å; S98-I101 PolarHBondContact O-N 3.49Å; R99-I101 PolarHBondContact O-N 3.07Å; I101-D103 VanDerWaalsContact C-N 3.32Å; I101-D103 PolarHBondContact O-N 3.34Å; I101-N104 PolarHBondContact O-N 2.86Å; I101-C111 WeakPolarHBondContact CG2-SG 3.17Å |
| 102 | S | 75.6 | Confident | 77.3 | Confident | 40 Ų | 40 | 78.5 Ų | 78.5 | 28% | 0.28 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -69.6 | -24.5 | -174.4 | -59.7 | 0 | 0 | 0 | 0 | 114.1 | S98 R99 N104 E105 | S98-S102 WeakPolarHBondContact O-CB 3.46Å; S98-S102 PolarHBondContact O-N 3.46Å; S98-S102 PolarHBondContact O-OG 2.92Å; R99-S102 PolarHBondContact O-N 3.28Å; S102-N104 PolarHBondContact O-N 3.22Å; S102-E105 PolarHBondContact O-N 2.88Å |
| 103 | D | 63.8 | Low | 76.9 | Confident | 137 Ų | 137 | 79.1 Ų | 79.1 | 73% | 0.733 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | -8.7 | 173.5 | -76.7 | -16.4 | 0 | 0 | 0 | 113.2 | R99 I101 | R99-D103 PolarHBondContact O-N 3.16Å; R99-D103 VanDerWaalsContact O-N 3.11Å; I101-D103 VanDerWaalsContact C-N 3.32Å; I101-D103 PolarHBondContact O-N 3.34Å |
| 104 | N | 60.3 | Low | 76.4 | Confident | 109 Ų | 109 | 81.6 Ų | 81.6 | 58% | 0.583 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.6 | -8.9 | -178.1 | -74.7 | -15.6 | 0 | 0 | 0 | 117 | R51 I101 S102 | R51-N104 VanDerWaalsContact CZ-ND2 3.26Å; R51-N104 PolarHBondContact NH1-ND2 2.85Å; R51-N104 VanDerWaalsContact NH1-ND2 3.12Å; R51-N104 PolarHBondContact NH2-ND2 3.34Å; I101-N104 PolarHBondContact O-N 2.86Å; S102-N104 PolarHBondContact O-N 3.22Å |
| 105 | E | 54.7 | Low | 76.2 | Confident | 146 Ų | 146 | 81.2 Ų | 81.2 | 68% | 0.682 | 41% | 0.407 | S | S | * | . | trans | -151.9 | 151.7 | -177.4 | -70.4 | -170.7 | 171.7 | 0 | 0 | 116.3 | S102 Q107 | S102-E105 PolarHBondContact O-N 2.88Å; E105-Q107 VanDerWaalsContact C-N 3.33Å; E105-Q107 PolarHBondContact O-N 3.01Å | ||
| 106 | Q | 53.1 | Low | 76.1 | Confident | 204 Ų | 204 | 81.1 Ų | 81.1 | 95% | 0.953 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -78.9 | 10.8 | -177.4 | -74.9 | -173.5 | -16.5 | 0 | 0 | 116.1 | ||
| 107 | Q | 56.4 | Low | 76.1 | Confident | 133 Ų | 133 | 81.3 Ų | 81.3 | 62% | 0.621 | 40% | 0.401 | S | S | * | . | trans | -114.2 | 81.2 | -177.8 | -76 | 179.6 | -11.8 | 0 | 0 | 112 | E105 C111 | E105-Q107 VanDerWaalsContact C-N 3.33Å; E105-Q107 PolarHBondContact O-N 3.01Å; Q107-C111 WeakPolarHBondContact O-CB 3.21Å | ||
| 108 | S | 65.9 | Low | 76 | Confident | 73 Ų | 73 | 81.4 Ų | 81.4 | 51% | 0.51 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -71.2 | -49.8 | -169.3 | -166.7 | 0 | 0 | 0 | 0 | 114.6 | E112 | S108-E112 PolarHBondContact O-N 3.42Å |
| 109 | E | 66.6 | Low | 76.2 | Confident | 166 Ų | 166 | 80.8 Ų | 80.8 | 78% | 0.776 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -76.3 | -41.5 | -166.8 | -68.4 | -179.9 | 178.9 | 0 | 0 | 113.9 | C111 E112 Q113 | E109-C111 VanDerWaalsContact C-N 3.27Å; E109-C111 PolarHBondContact O-N 2.94Å; E109-E112 PolarHBondContact O-N 2.96Å; E109-Q113 PolarHBondContact O-N 3.05Å; E109-Q113 VanDerWaalsContact O-N 3.13Å |
| 110 | I | 67.8 | Low | 76.5 | Confident | 131 Ų | 131 | 75 Ų | 75 | 67% | 0.672 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -65.5 | -37.9 | 177.6 | -63.3 | 173.8 | 0 | 0 | 0 | 109.8 | L114 | I110-L114 WeakPolarHBondContact O-CB 3.44Å; I110-L114 PolarHBondContact O-N 3.25Å; I110-L114 VanDerWaalsContact O-N 3.08Å |
| 111 | C | 75.6 | Confident | 76.8 | Confident | 23 Ų | 23 | 72.2 Ų | 72.2 | 16% | 0.155 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65 | -44.1 | 176.6 | -171.8 | 0 | 0 | 0 | 0 | 111.5 | I101 Q107 E109 Q113 L114 V115 | I101-C111 WeakPolarHBondContact CG2-SG 3.17Å; Q107-C111 WeakPolarHBondContact O-CB 3.21Å; E109-C111 VanDerWaalsContact C-N 3.27Å; E109-C111 PolarHBondContact O-N 2.94Å; C111-Q113 PolarHBondContact O-N 3.33Å; C111-L114 WeakPolarHBondContact O-CB 3.3Å; C111-L114 PolarHBondContact O-N 2.74Å; C111-V115 VanDerWaalsContact O-CG2 3.31Å; C111-V115 WeakPolarHBondContact O-CG2 3.48Å; C111-V115 PolarHBondContact O-N 3.14Å |
| 112 | E | 82.8 | Confident | 77.3 | Confident | 73 Ų | 73 | 71.8 Ų | 71.8 | 34% | 0.341 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.6 | -43.1 | 179.4 | -167.3 | -169.5 | 144.9 | 0 | 0 | 112.3 | S108 E109 L114 V115 R116 | S108-E112 PolarHBondContact O-N 3.42Å; E109-E112 PolarHBondContact O-N 2.96Å; E112-L114 VanDerWaalsContact C-N 3.3Å; E112-L114 PolarHBondContact O-N 3.38Å; E112-V115 PolarHBondContact O-N 3.26Å; E112-R116 WeakPolarHBondContact O-CB 3.21Å; E112-R116 PolarHBondContact O-N 3.4Å; E112-R116 IonicContact OE1-CZ 3.41Å; E112-R116 IonicContact OE1-NH1 3.67Å; E112-R116 IonicContact OE1-NH2 3.56Å; E112-R116 PolarHBondContact OE1-NH2 3.06Å |
| 113 | Q | 85.1 | Confident | 78.2 | Confident | 84 Ų | 84 | 70.1 Ų | 70.1 | 39% | 0.393 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.9 | -36.6 | 176.6 | -172.2 | 58.7 | 38.4 | 0 | 0 | 111.8 | E109 C111 R116 N117 | E109-Q113 PolarHBondContact O-N 3.05Å; E109-Q113 VanDerWaalsContact O-N 3.13Å; C111-Q113 PolarHBondContact O-N 3.33Å; Q113-R116 PolarHBondContact O-N 3.41Å; Q113-N117 PolarHBondContact NE2-OD1 3.16Å; Q113-N117 WeakPolarHBondContact O-CB 3.43Å; Q113-N117 VanDerWaalsContact O-CG 3.26Å; Q113-N117 PolarHBondContact O-N 3.01Å |
| 114 | L | 84.2 | Confident | 79.7 | Confident | 51 Ų | 51 | 64.1 Ų | 64.1 | 27% | 0.267 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -62.9 | -49.9 | 174.7 | -166.3 | 65.2 | 0 | 0 | 0 | 110.8 | A46 I52 I110 C111 E112 R116 N117 T118 | A46-L114 HydrophobicContact CB-CD1 3.94Å; I52-L114 HydrophobicContact CD1-CB 4.4Å; I52-L114 HydrophobicContact CD1-CD2 3.56Å; I52-L114 HydrophobicContact CD1-CG 3.98Å; I110-L114 WeakPolarHBondContact O-CB 3.44Å; I110-L114 PolarHBondContact O-N 3.25Å; I110-L114 VanDerWaalsContact O-N 3.08Å; C111-L114 WeakPolarHBondContact O-CB 3.3Å; C111-L114 PolarHBondContact O-N 2.74Å; E112-L114 VanDerWaalsContact C-N 3.3Å; E112-L114 PolarHBondContact O-N 3.38Å; L114-R116 VanDerWaalsContact C-N 3.32Å; L114-R116 PolarHBondContact O-N 2.87Å; L114-N117 PolarHBondContact O-N 3.35Å; L114-T118 WeakPolarHBondContact O-CB 3.33Å; L114-T118 PolarHBondContact O-N 3.28Å; L114-T118 PolarHBondContact O-OG1 3.23Å |
| 115 | V | 88.7 | Confident | 81.3 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -56.2 | -47.1 | 174.9 | 171.8 | 0 | 0 | 0 | 0 | 110.4 | I52 V94 V97 C111 E112 N117 T118 F119 | I52-V115 HydrophobicContact CD1-CG2 4.15Å; I52-V115 HydrophobicContact CG1-CG2 4.3Å; I52-V115 HydrophobicContact CG2-CB 4.5Å; I52-V115 HydrophobicContact CG2-CG2 3.95Å; V94-V115 HydrophobicContact CG1-CG1 4.44Å; V97-V115 HydrophobicContact CB-CG1 3.91Å; V97-V115 HydrophobicContact CG1-CG1 3.68Å; V97-V115 HydrophobicContact CG1-CG2 4.28Å; C111-V115 VanDerWaalsContact O-CG2 3.31Å; C111-V115 WeakPolarHBondContact O-CG2 3.48Å; C111-V115 PolarHBondContact O-N 3.14Å; E112-V115 PolarHBondContact O-N 3.26Å; V115-N117 PolarHBondContact O-N 3.21Å; V115-T118 PolarHBondContact O-N 3.4Å; V115-F119 WeakPolarHBondContact O-CB 3.22Å; V115-F119 PolarHBondContact O-N 3.38Å |
| 116 | R | 91.3 | Very high | 83.1 | Confident | 68 Ų | 68 | 59.8 Ų | 59.8 | 26% | 0.257 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.4 | -44.8 | 179.4 | -177.7 | -179.1 | -69.7 | 114.8 | 6.3 | 112.5 | F90 V94 E112 Q113 L114 A120 A152 | F90-R116 HydrophobicContact CE1-CG 4.3Å; F90-R116 HydrophobicContact CZ-CG 4.11Å; V94-R116 HydrophobicContact CG1-CB 4.24Å; E112-R116 WeakPolarHBondContact O-CB 3.21Å; E112-R116 PolarHBondContact O-N 3.4Å; E112-R116 IonicContact OE1-CZ 3.41Å; E112-R116 IonicContact OE1-NH1 3.67Å; E112-R116 IonicContact OE1-NH2 3.56Å; E112-R116 PolarHBondContact OE1-NH2 3.06Å; Q113-R116 PolarHBondContact O-N 3.41Å; L114-R116 VanDerWaalsContact C-N 3.32Å; L114-R116 PolarHBondContact O-N 2.87Å; R116-A120 WeakPolarHBondContact O-CB 3.21Å; R116-A120 PolarHBondContact O-N 3.35Å; R116-A152 HydrophobicContact CG-CB 4.08Å |
| 117 | N | 89.5 | Confident | 85 | Confident | 26 Ų | 26 | 51.5 Ų | 51.5 | 14% | 0.139 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -67.4 | -46.8 | 178.8 | -70.2 | -8.8 | 0 | 0 | 0 | 111.3 | Q113 L114 V115 F119 A120 H121 | Q113-N117 PolarHBondContact NE2-OD1 3.16Å; Q113-N117 WeakPolarHBondContact O-CB 3.43Å; Q113-N117 VanDerWaalsContact O-CG 3.26Å; Q113-N117 PolarHBondContact O-N 3.01Å; L114-N117 PolarHBondContact O-N 3.35Å; V115-N117 PolarHBondContact O-N 3.21Å; N117-F119 VanDerWaalsContact C-N 3.31Å; N117-F119 PolarHBondContact O-N 2.98Å; N117-A120 PolarHBondContact O-N 3.03Å; N117-H121 PolarHBondContact O-N 3.14Å |
| 118 | T | 89.9 | Confident | 86.7 | Confident | 3 Ų | 3 | 45.2 Ų | 45.2 | 2% | 0.018 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.9 | -41.6 | 176.4 | -55 | 0 | 0 | 0 | 0 | 111.4 | A46 I52 V56 L114 V115 H121 I122 | A46-T118 WeakPolarHBondContact CB-OG1 3.46Å; A46-T118 PolarHBondContact O-OG1 3.22Å; I52-T118 HydrophobicContact CG2-CG2 4.03Å; V56-T118 HydrophobicContact CG2-CG2 4.19Å; L114-T118 WeakPolarHBondContact O-CB 3.33Å; L114-T118 PolarHBondContact O-N 3.28Å; L114-T118 PolarHBondContact O-OG1 3.23Å; V115-T118 PolarHBondContact O-N 3.4Å; T118-H121 PolarHBondContact O-N 3.21Å; T118-I122 HydrophobicContact CG2-CD1 3.78Å; T118-I122 WeakPolarHBondContact O-CG1 3.3Å; T118-I122 PolarHBondContact O-N 2.8Å |
| 119 | F | 93.1 | Very high | 88 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64 | -46.4 | 176.7 | -158.6 | -70 | 0 | 0 | 0 | 111.5 | V56 F59 V60 F90 V94 V97 V115 N117 H121 Y123 | V56-F119 HydrophobicContact CB-CD2 4.44Å; V56-F119 HydrophobicContact CG1-CB 4.21Å; V56-F119 HydrophobicContact CG1-CD2 3.81Å; V56-F119 HydrophobicContact CG1-CE2 4.39Å; V56-F119 HydrophobicContact CG1-CG 4.1Å; V56-F119 HydrophobicContact CG2-CB 4.37Å; V56-F119 HydrophobicContact CG2-CD2 4.06Å; F59-F119 AromaticContact CD1-CE2 3.51Å; F59-F119 HydrophobicContact CD1-CE2 3.51Å; F59-F119 AromaticContact CD1-CZ 3.56Å; F59-F119 HydrophobicContact CD1-CZ 3.56Å; F59-F119 AromaticContact CE1-CE2 4Å; F59-F119 HydrophobicContact CE1-CE2 4Å; F59-F119 AromaticContact CE1-CZ 3.72Å; F59-F119 HydrophobicContact CE1-CZ 3.72Å; F59-F119 HydrophobicContact CG-CE2 4.18Å; V60-F119 HydrophobicContact CG2-CE1 4.48Å; V60-F119 HydrophobicContact CG2-CE2 4.49Å; V60-F119 HydrophobicContact CG2-CZ 4.13Å; F90-F119 AromaticContact CD2-CD1 3.63Å; F90-F119 HydrophobicContact CD2-CD1 3.63Å; F90-F119 AromaticContact CD2-CE1 3.98Å; F90-F119 HydrophobicContact CD2-CE1 3.98Å; F90-F119 HydrophobicContact CE2-CB 4.45Å; F90-F119 AromaticContact CE2-CD1 3.68Å; F90-F119 HydrophobicContact CE2-CD1 3.68Å; F90-F119 HydrophobicContact CE2-CE1 4.48Å; F90-F119 HydrophobicContact CE2-CG 4.46Å; V94-F119 HydrophobicContact CG2-CB 3.94Å; V94-F119 HydrophobicContact CG2-CD1 4.32Å; V94-F119 HydrophobicContact CG2-CD2 4.32Å; V94-F119 HydrophobicContact CG2-CG 3.93Å; V97-F119 HydrophobicContact CG2-CD2 4.46Å; V97-F119 HydrophobicContact CG2-CE2 4.42Å; V115-F119 WeakPolarHBondContact O-CB 3.22Å; V115-F119 PolarHBondContact O-N 3.38Å; N117-F119 VanDerWaalsContact C-N 3.31Å; N117-F119 PolarHBondContact O-N 2.98Å; F119-H121 VanDerWaalsContact C-N 3.3Å; F119-H121 PolarHBondContact O-N 3.3Å; F119-Y123 AromaticContact CE1-CD2 3.92Å; F119-Y123 HydrophobicContact CE1-CD2 3.92Å; F119-Y123 HydrophobicContact CE1-CG 4.06Å; F119-Y123 WeakPolarHBondContact O-CB 3.47Å; F119-Y123 PolarHBondContact O-N 3.49Å |
| 120 | A | 93.9 | Very high | 89.1 | Confident | 1 Ų | 1 | 43.9 Ų | 43.9 | 1% | 0.008 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -57.3 | -45.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F90 R116 N117 F124 A152 L153 E156 | F90-A120 HydrophobicContact CE2-CB 3.93Å; F90-A120 HydrophobicContact CZ-CB 4.12Å; R116-A120 WeakPolarHBondContact O-CB 3.21Å; R116-A120 PolarHBondContact O-N 3.35Å; N117-A120 PolarHBondContact O-N 3.03Å; A120-F124 WeakPolarHBondContact O-CB 3.41Å; A120-F124 PolarHBondContact O-N 3.1Å; A120-A152 HydrophobicContact CB-CB 3.8Å; A120-L153 HydrophobicContact CB-CD2 4.08Å; A120-L153 HydrophobicContact CB-CG 4.46Å; A120-L153 WeakPolarHBondContact O-CD2 3.34Å; A120-E156 HydrophobicContact CB-CG 4.05Å |
| 121 | H | 92.4 | Very high | 90 | Very high | 35 Ų | 35 | 41.2 Ų | 41.2 | 16% | 0.162 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63 | -55.9 | 179.6 | -176.2 | 70.7 | 0 | 0 | 0 | 112.5 | V43 F47 N117 T118 F119 Y123 F124 E125 E156 | V43-H121 HydrophobicContact CG1-CB 3.63Å; F47-H121 AromaticContact CE2-CD2 3.75Å; F47-H121 AromaticContact CE2-NE2 3.76Å; F47-H121 AromaticContact CZ-CD2 3.48Å; F47-H121 VanDerWaalsContact CZ-CD2 3.48Å; F47-H121 WeakPolarHBondContact CZ-CD2 3.13Å; F47-H121 AromaticContact CZ-NE2 3.68Å; N117-H121 PolarHBondContact O-N 3.14Å; T118-H121 PolarHBondContact O-N 3.21Å; F119-H121 VanDerWaalsContact C-N 3.3Å; F119-H121 PolarHBondContact O-N 3.3Å; H121-Y123 PolarHBondContact O-N 3.35Å; H121-F124 PolarHBondContact O-N 3.29Å; H121-E125 IonicContact NE2-OE2 2.79Å; H121-E125 WeakPolarHBondContact O-CB 3.37Å; H121-E125 PolarHBondContact O-N 3.05Å; H121-E156 HydrophobicContact CB-CG 4.46Å; H121-E156 IonicContact CE1-OE2 2.68Å; H121-E156 IonicContact CG-OE2 3.66Å; H121-E156 IonicContact ND1-OE2 3.83Å; H121-E156 PolarHBondContact ND1-OE2 3.03Å |
| 122 | I | 92.7 | Very high | 90.7 | Very high | 4 Ų | 4 | 41.6 Ų | 41.6 | 2% | 0.021 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.5 | -42.7 | -177.6 | -68.1 | 170.3 | 0 | 0 | 0 | 110.9 | E53 V56 V60 T118 E125 R126 | E53-I122 HydrophobicContact CG-CD1 4.12Å; V56-I122 HydrophobicContact CB-CD1 3.94Å; V56-I122 HydrophobicContact CG1-CB 3.88Å; V56-I122 HydrophobicContact CG1-CD1 3.6Å; V56-I122 HydrophobicContact CG1-CG1 4.29Å; V56-I122 HydrophobicContact CG1-CG2 4.06Å; V60-I122 HydrophobicContact CG2-CG2 4.28Å; T118-I122 HydrophobicContact CG2-CD1 3.78Å; T118-I122 WeakPolarHBondContact O-CG1 3.3Å; T118-I122 PolarHBondContact O-N 2.8Å; I122-E125 PolarHBondContact O-N 2.69Å; I122-R126 HydrophobicContact CG2-CG 4.24Å; I122-R126 VanDerWaalsContact O-CB 3.28Å; I122-R126 WeakPolarHBondContact O-CB 3.46Å; I122-R126 VanDerWaalsContact O-CG 3.29Å; I122-R126 WeakPolarHBondContact O-CG 3.45Å; I122-R126 PolarHBondContact O-N 3.38Å |
| 123 | Y | 95.3 | Very high | 91 | Very high | 6 Ų | 6 | 42.9 Ų | 42.9 | 2% | 0.024 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.8 | -43.1 | 179.2 | -169.9 | -98.5 | 0 | 0 | 0 | 111.3 | V60 H86 I89 F119 H121 V127 L128 L153 | V60-Y123 HydrophobicContact CG2-CD2 4.21Å; H86-Y123 HydrophobicContact CB-CE1 4.36Å; H86-Y123 AromaticContact ND1-CE1 3.88Å; H86-Y123 AromaticContact ND1-CZ 3.83Å; H86-Y123 PolarHBondContact ND1-OH 3.48Å; I89-Y123 HydrophobicContact CG2-CD2 4.47Å; I89-Y123 HydrophobicContact CG2-CE2 3.61Å; F119-Y123 AromaticContact CE1-CD2 3.92Å; F119-Y123 HydrophobicContact CE1-CD2 3.92Å; F119-Y123 HydrophobicContact CE1-CG 4.06Å; F119-Y123 WeakPolarHBondContact O-CB 3.47Å; F119-Y123 PolarHBondContact O-N 3.49Å; H121-Y123 PolarHBondContact O-N 3.35Å; Y123-V127 HydrophobicContact CD2-CB 4.44Å; Y123-V127 HydrophobicContact CD2-CG2 3.87Å; Y123-V127 HydrophobicContact CE1-CB 4.39Å; Y123-V127 HydrophobicContact CE1-CG1 4.44Å; Y123-V127 HydrophobicContact CE2-CB 4.25Å; Y123-V127 HydrophobicContact CE2-CG1 4.39Å; Y123-V127 HydrophobicContact CE2-CG2 3.78Å; Y123-V127 HydrophobicContact CG-CG2 4.4Å; Y123-V127 WeakPolarHBondContact O-CA 3.32Å; Y123-V127 WeakPolarHBondContact O-CB 3.42Å; Y123-V127 PolarHBondContact O-N 3.43Å; Y123-L128 HydrophobicContact CD1-CD1 4.19Å; Y123-L128 HydrophobicContact CD1-CG 4.26Å; Y123-L128 HydrophobicContact CE1-CD1 4.24Å; Y123-L128 HydrophobicContact CE1-CD2 4.33Å; Y123-L128 HydrophobicContact CE1-CG 4.12Å; Y123-L128 PolarHBondContact O-N 2.71Å; Y123-L153 HydrophobicContact CD1-CD1 4.2Å; Y123-L153 HydrophobicContact CD1-CD2 3.99Å |
| 124 | F | 95 | Very high | 91.1 | Very high | 10 Ų | 10 | 47 Ų | 47 | 4% | 0.044 | 22% | 0.215 | C | C | . | . | I | π-helix | trans | -59.9 | -53 | 174.5 | 173.9 | -96 | 0 | 0 | 0 | 111 | A120 H121 R126 L128 S129 I132 L141 L153 E156 V157 F160 | A120-F124 WeakPolarHBondContact O-CB 3.41Å; A120-F124 PolarHBondContact O-N 3.1Å; H121-F124 PolarHBondContact O-N 3.29Å; F124-R126 PolarHBondContact O-N 3.37Å; F124-L128 HydrophobicContact CD2-CB 3.88Å; F124-L128 HydrophobicContact CD2-CD1 4.33Å; F124-L128 HydrophobicContact CE2-CB 4.33Å; F124-L128 PolarHBondContact O-N 2.98Å; F124-L128 VanDerWaalsContact O-N 3.08Å; F124-S129 WeakPolarHBondContact O-CB 3.48Å; F124-S129 PolarHBondContact O-N 3.1Å; F124-I132 HydrophobicContact CE2-CD1 4.01Å; F124-I132 HydrophobicContact CZ-CD1 3.92Å; F124-L141 HydrophobicContact CE2-CD2 4.11Å; F124-L153 HydrophobicContact CB-CD2 4.16Å; F124-E156 HydrophobicContact CB-CB 3.93Å; F124-E156 HydrophobicContact CD1-CB 4.19Å; F124-E156 HydrophobicContact CG-CB 3.93Å; F124-V157 HydrophobicContact CD2-CG2 3.81Å; F124-V157 HydrophobicContact CE2-CB 4.27Å; F124-V157 HydrophobicContact CE2-CG2 3.5Å; F124-V157 HydrophobicContact CZ-CG2 4.46Å; F124-F160 HydrophobicContact CE1-CB 3.53Å; F124-F160 HydrophobicContact CE1-CD2 4Å; F124-F160 AromaticContact CE1-CG 3.84Å; F124-F160 HydrophobicContact CE1-CG 3.84Å; F124-F160 HydrophobicContact CZ-CB 3.54Å; F124-F160 HydrophobicContact CZ-CD1 4.09Å; F124-F160 HydrophobicContact CZ-CD2 4.16Å; F124-F160 AromaticContact CZ-CG 3.67Å; F124-F160 HydrophobicContact CZ-CG 3.67Å |
| 125 | E | 92.3 | Very high | 91.3 | Very high | 108 Ų | 108 | 46.4 Ų | 46.4 | 51% | 0.505 | 21% | 0.211 | S | C | . | . | I | π-helix | trans | -60.9 | -45.2 | -176.9 | -170.7 | -174.4 | 177.1 | 0 | 0 | 112.1 | H121 I122 S129 | H121-E125 IonicContact NE2-OE2 2.79Å; H121-E125 WeakPolarHBondContact O-CB 3.37Å; H121-E125 PolarHBondContact O-N 3.05Å; I122-E125 PolarHBondContact O-N 2.69Å; E125-S129 PolarHBondContact O-OG 3.12Å |
| 126 | R | 92.5 | Very high | 91.4 | Very high | 56 Ų | 56 | 51.8 Ų | 51.8 | 21% | 0.211 | 24% | 0.24 | C | C | . | . | I | π-helix | trans | -85.6 | -26 | -172 | -62.4 | -173 | 66.3 | -175.3 | -5.6 | 114.1 | N57 V60 D61 I122 F124 R130 | N57-R126 PolarHBondContact OD1-NH1 2.88Å; V60-R126 HydrophobicContact CG1-CB 4.47Å; D61-R126 VanDerWaalsContact CG-NH1 3.33Å; D61-R126 IonicContact OD1-CZ 2.64Å; D61-R126 IonicContact OD1-NH1 3.57Å; D61-R126 PolarHBondContact OD1-NH1 3.42Å; D61-R126 IonicContact OD1-NH2 2.79Å; D61-R126 PolarHBondContact OD1-NH2 3.23Å; D61-R126 IonicContact OD2-CZ 3.27Å; D61-R126 IonicContact OD2-NH1 2.6Å; D61-R126 PolarHBondContact OD2-NH1 3.34Å; D61-R126 IonicContact OD2-NH2 3.25Å; I122-R126 HydrophobicContact CG2-CG 4.24Å; I122-R126 VanDerWaalsContact O-CB 3.28Å; I122-R126 WeakPolarHBondContact O-CB 3.46Å; I122-R126 VanDerWaalsContact O-CG 3.29Å; I122-R126 WeakPolarHBondContact O-CG 3.45Å; I122-R126 PolarHBondContact O-N 3.38Å; F124-R126 PolarHBondContact O-N 3.37Å; R126-R130 WeakPolarHBondContact O-CD 3.27Å; R126-R130 VanDerWaalsContact O-CZ 3.23Å; R126-R130 PolarHBondContact O-NE 3.36Å; R126-R130 VanDerWaalsContact O-NE 3.1Å |
| 127 | V | 93 | Very high | 91.4 | Very high | 31 Ų | 31 | 51.2 Ų | 51.2 | 19% | 0.188 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -114 | -64.4 | -174 | -172.6 | 0 | 0 | 0 | 0 | 110.6 | V60 I64 Y123 | V60-V127 HydrophobicContact CG1-CG2 4.25Å; I64-V127 HydrophobicContact CD1-CG2 4.26Å; Y123-V127 HydrophobicContact CD2-CB 4.44Å; Y123-V127 HydrophobicContact CD2-CG2 3.87Å; Y123-V127 HydrophobicContact CE1-CB 4.39Å; Y123-V127 HydrophobicContact CE1-CG1 4.44Å; Y123-V127 HydrophobicContact CE2-CB 4.25Å; Y123-V127 HydrophobicContact CE2-CG1 4.39Å; Y123-V127 HydrophobicContact CE2-CG2 3.78Å; Y123-V127 HydrophobicContact CG-CG2 4.4Å; Y123-V127 WeakPolarHBondContact O-CA 3.32Å; Y123-V127 WeakPolarHBondContact O-CB 3.42Å; Y123-V127 PolarHBondContact O-N 3.43Å |
| 128 | L | 93.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -78 | -36.1 | -167.2 | -59.6 | 177.2 | 0 | 0 | 0 | 114.1 | Y123 F124 R130 E131 L141 L145 L153 | Y123-L128 HydrophobicContact CD1-CD1 4.19Å; Y123-L128 HydrophobicContact CD1-CG 4.26Å; Y123-L128 HydrophobicContact CE1-CD1 4.24Å; Y123-L128 HydrophobicContact CE1-CD2 4.33Å; Y123-L128 HydrophobicContact CE1-CG 4.12Å; Y123-L128 PolarHBondContact O-N 2.71Å; F124-L128 HydrophobicContact CD2-CB 3.88Å; F124-L128 HydrophobicContact CD2-CD1 4.33Å; F124-L128 HydrophobicContact CE2-CB 4.33Å; F124-L128 PolarHBondContact O-N 2.98Å; F124-L128 VanDerWaalsContact O-N 3.08Å; L128-R130 PolarHBondContact O-N 3.46Å; L128-R130 VanDerWaalsContact O-N 3.14Å; L128-E131 WeakPolarHBondContact O-CB 3.44Å; L128-E131 PolarHBondContact O-N 2.87Å; L128-L141 HydrophobicContact CB-CD1 4.43Å; L128-L141 HydrophobicContact CB-CD2 4.49Å; L128-L141 HydrophobicContact CD1-CD1 4.35Å; L128-L141 HydrophobicContact CD2-CD1 4.35Å; L128-L145 HydrophobicContact CD1-CD2 4.34Å; L128-L153 HydrophobicContact CD1-CD1 4.12Å; L128-L153 HydrophobicContact CD1-CD2 4.06Å; L128-L153 HydrophobicContact CD1-CG 4.5Å |
| 129 | S | 92.5 | Very high | 91.7 | Very high | 28 Ų | 28 | 51 Ų | 51 | 20% | 0.196 | 24% | 0.241 | C | C | . | . | G | 310 helix | trans | -61.3 | -28.3 | -175 | 78.5 | 0 | 0 | 0 | 0 | 112.5 | F124 E125 E131 I132 | F124-S129 WeakPolarHBondContact O-CB 3.48Å; F124-S129 PolarHBondContact O-N 3.1Å; E125-S129 PolarHBondContact O-OG 3.12Å; S129-E131 PolarHBondContact O-N 3.01Å; S129-I132 PolarHBondContact O-N 2.69Å |
| 130 | R | 89.5 | Confident | 91.6 | Very high | 184 Ų | 184 | 54.3 Ų | 54.3 | 69% | 0.694 | 26% | 0.261 | S | S | * | . | G | 310 helix | trans | -69.6 | -20.1 | 179.3 | -60.6 | 179.1 | 178.9 | -176.6 | 1 | 113 | R126 L128 I132 | R126-R130 WeakPolarHBondContact O-CD 3.27Å; R126-R130 VanDerWaalsContact O-CZ 3.23Å; R126-R130 PolarHBondContact O-NE 3.36Å; R126-R130 VanDerWaalsContact O-NE 3.1Å; L128-R130 PolarHBondContact O-N 3.46Å; L128-R130 VanDerWaalsContact O-N 3.14Å; R130-I132 VanDerWaalsContact C-N 3.32Å |
| 131 | E | 86.7 | Confident | 91.7 | Very high | 75 Ų | 75 | 54.4 Ų | 54.4 | 35% | 0.35 | 26% | 0.261 | S | S | . | . | G | 310 helix | trans | -82.2 | -12.5 | 177 | -61.2 | -175.2 | -160.4 | 0 | 0 | 112.3 | K82 L128 S129 T133 D137 | K82-E131 IonicContact NZ-OE2 2.94Å; K82-E131 PolarHBondContact NZ-OE2 3.45Å; L128-E131 WeakPolarHBondContact O-CB 3.44Å; L128-E131 PolarHBondContact O-N 2.87Å; S129-E131 PolarHBondContact O-N 3.01Å; E131-T133 PolarHBondContact O-N 3.35Å; E131-D137 WeakPolarHBondContact O-CB 3.47Å |
| 132 | I | 90.9 | Very high | 91.8 | Very high | 31 Ų | 31 | 52.8 Ų | 52.8 | 16% | 0.159 | 25% | 0.254 | C | S | . | . | trans | -91.2 | 97.8 | -174.9 | -48.8 | 172.7 | 0 | 0 | 0 | 109.4 | F124 S129 R130 F138 L141 F160 | F124-I132 HydrophobicContact CE2-CD1 4.01Å; F124-I132 HydrophobicContact CZ-CD1 3.92Å; S129-I132 PolarHBondContact O-N 2.69Å; R130-I132 VanDerWaalsContact C-N 3.32Å; I132-F138 HydrophobicContact CG2-CB 4.1Å; I132-L141 HydrophobicContact CD1-CD2 3.48Å; I132-L141 VanDerWaalsContact CD1-CD2 3.48Å; I132-L141 HydrophobicContact CG1-CD2 3.68Å; I132-F160 HydrophobicContact CB-CE1 4.5Å; I132-F160 HydrophobicContact CD1-CD1 3.99Å; I132-F160 HydrophobicContact CD1-CE1 3.83Å; I132-F160 HydrophobicContact CG2-CE1 4.18Å | ||
| 133 | T | 88.2 | Confident | 91.7 | Very high | 99 Ų | 99 | 55.8 Ų | 55.8 | 61% | 0.607 | 27% | 0.268 | S | S | * | . | S | Bend | trans | -108.3 | -40.4 | 174.4 | -51.6 | 0 | 0 | 0 | 0 | 111.4 | E131 D137 | E131-T133 PolarHBondContact O-N 3.35Å; T133-D137 WeakPolarHBondContact CB-OD2 3.46Å; T133-D137 PolarHBondContact N-OD2 3.01Å |
| 134 | Y | 88.6 | Confident | 91.6 | Very high | 170 Ų | 170 | 55.8 Ų | 55.8 | 67% | 0.667 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -122.4 | 169.9 | -176.6 | -54.4 | -74.8 | 0 | 0 | 0 | 111.7 | D136 D137 F138 | Y134-D136 VanDerWaalsContact C-N 3.28Å; Y134-D136 PolarHBondContact O-N 3.26Å; Y134-D137 PolarHBondContact N-OD2 3.09Å; Y134-D137 WeakPolarHBondContact O-CB 3.46Å; Y134-D137 PolarHBondContact O-N 2.92Å; Y134-F138 PolarHBondContact O-N 2.9Å |
| 135 | F | 88.1 | Confident | 91.6 | Very high | 39 Ų | 39 | 55.3 Ų | 55.3 | 17% | 0.171 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.7 | -39.8 | 177.1 | -179.8 | -103 | 0 | 0 | 0 | 112.6 | D137 F138 V139 F174 K177 L178 V181 | F135-D137 VanDerWaalsContact C-N 3.29Å; F135-D137 PolarHBondContact O-N 3.27Å; F135-F138 WeakPolarHBondContact O-CB 3.44Å; F135-F138 PolarHBondContact O-N 3.29Å; F135-F138 VanDerWaalsContact O-N 3.16Å; F135-V139 HydrophobicContact CD1-CG2 4.05Å; F135-V139 HydrophobicContact CE1-CG2 3.68Å; F135-V139 HydrophobicContact CE2-CG2 4.45Å; F135-V139 HydrophobicContact CZ-CG2 3.93Å; F135-V139 WeakPolarHBondContact O-CG2 3.36Å; F135-V139 PolarHBondContact O-N 3.47Å; F135-F174 HydrophobicContact CB-CE2 4.2Å; F135-F174 HydrophobicContact CD2-CD2 4.27Å; F135-F174 AromaticContact CD2-CE2 3.49Å; F135-F174 HydrophobicContact CD2-CE2 3.49Å; F135-F174 VanDerWaalsContact CD2-CE2 3.49Å; F135-F174 HydrophobicContact CD2-CZ 4.16Å; F135-F174 HydrophobicContact CE2-CE2 4.23Å; F135-F174 HydrophobicContact CG-CE2 4.19Å; F135-K177 HydrophobicContact CE1-CB 4.34Å; F135-K177 HydrophobicContact CE2-CB 4.16Å; F135-K177 HydrophobicContact CZ-CB 3.74Å; F135-L178 HydrophobicContact CD2-CD2 4.43Å; F135-L178 HydrophobicContact CE2-CD2 3.87Å; F135-L178 HydrophobicContact CE2-CG 4.15Å; F135-V181 HydrophobicContact CE1-CG2 4.3Å; F135-V181 HydrophobicContact CE2-CG2 4.36Å; F135-V181 HydrophobicContact CZ-CG2 3.58Å |
| 136 | D | 89.8 | Confident | 91.6 | Very high | 114 Ų | 114 | 52.3 Ų | 52.3 | 61% | 0.61 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -67.4 | -31.4 | -179.5 | -62.8 | -22.8 | 0 | 0 | 0 | 112 | Y134 V139 T140 | Y134-D136 VanDerWaalsContact C-N 3.28Å; Y134-D136 PolarHBondContact O-N 3.26Å; D136-V139 PolarHBondContact O-N 2.9Å; D136-T140 VanDerWaalsContact O-CB 3.29Å; D136-T140 WeakPolarHBondContact O-CB 3.47Å; D136-T140 PolarHBondContact O-N 3.29Å; D136-T140 PolarHBondContact O-OG1 3.32Å |
| 137 | D | 92.1 | Very high | 91.5 | Very high | 56 Ų | 56 | 56.7 Ų | 56.7 | 30% | 0.299 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 173.3 | -56.6 | -34.8 | 0 | 0 | 0 | 110.5 | E131 T133 Y134 F135 T140 L141 | E131-D137 WeakPolarHBondContact O-CB 3.47Å; T133-D137 WeakPolarHBondContact CB-OD2 3.46Å; T133-D137 PolarHBondContact N-OD2 3.01Å; Y134-D137 PolarHBondContact N-OD2 3.09Å; Y134-D137 WeakPolarHBondContact O-CB 3.46Å; Y134-D137 PolarHBondContact O-N 2.92Å; F135-D137 VanDerWaalsContact C-N 3.29Å; F135-D137 PolarHBondContact O-N 3.27Å; D137-T140 PolarHBondContact O-N 2.96Å; D137-L141 VanDerWaalsContact O-CB 3.27Å; D137-L141 WeakPolarHBondContact O-CB 3.15Å; D137-L141 PolarHBondContact O-N 2.97Å |
| 138 | F | 92.8 | Very high | 91.4 | Very high | 5 Ų | 5 | 55.7 Ų | 55.7 | 2% | 0.022 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.3 | -47.4 | 174.8 | 166 | -100.4 | 0 | 0 | 0 | 111.7 | I132 Y134 F135 L141 V142 V157 I161 L178 V181 L187 L190 | I132-F138 HydrophobicContact CG2-CB 4.1Å; Y134-F138 PolarHBondContact O-N 2.9Å; F135-F138 WeakPolarHBondContact O-CB 3.44Å; F135-F138 PolarHBondContact O-N 3.29Å; F135-F138 VanDerWaalsContact O-N 3.16Å; F138-L141 PolarHBondContact O-N 3.12Å; F138-V142 HydrophobicContact CD2-CG2 4.15Å; F138-V142 HydrophobicContact CE1-CG2 4.28Å; F138-V142 HydrophobicContact CE2-CG2 3.73Å; F138-V142 HydrophobicContact CZ-CG2 3.79Å; F138-V142 WeakPolarHBondContact O-CG2 3.28Å; F138-V142 PolarHBondContact O-N 3.07Å; F138-V157 HydrophobicContact CD2-CG1 3.85Å; F138-V157 HydrophobicContact CE2-CG1 3.5Å; F138-I161 HydrophobicContact CD2-CB 4.42Å; F138-I161 HydrophobicContact CE2-CB 3.77Å; F138-I161 HydrophobicContact CE2-CG1 4.08Å; F138-I161 HydrophobicContact CE2-CG2 3.7Å; F138-I161 HydrophobicContact CZ-CB 4.2Å; F138-I161 HydrophobicContact CZ-CG1 4.16Å; F138-I161 HydrophobicContact CZ-CG2 3.87Å; F138-L178 HydrophobicContact CD1-CD2 4.31Å; F138-L178 HydrophobicContact CE1-CD2 3.78Å; F138-L178 HydrophobicContact CZ-CD2 4.35Å; F138-V181 HydrophobicContact CE1-CG1 3.78Å; F138-L187 HydrophobicContact CZ-CD1 4.03Å; F138-L190 HydrophobicContact CZ-CD2 4.2Å |
| 139 | V | 92.3 | Very high | 91.3 | Very high | 19 Ų | 19 | 62.9 Ų | 62.9 | 12% | 0.115 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.2 | -47.1 | 177.9 | 175.8 | 0 | 0 | 0 | 0 | 110.6 | F135 D136 L141 V142 E143 V181 Y185 | F135-V139 HydrophobicContact CD1-CG2 4.05Å; F135-V139 HydrophobicContact CE1-CG2 3.68Å; F135-V139 HydrophobicContact CE2-CG2 4.45Å; F135-V139 HydrophobicContact CZ-CG2 3.93Å; F135-V139 WeakPolarHBondContact O-CG2 3.36Å; F135-V139 PolarHBondContact O-N 3.47Å; D136-V139 PolarHBondContact O-N 2.9Å; V139-L141 VanDerWaalsContact C-N 3.29Å; V139-L141 PolarHBondContact O-N 3.38Å; V139-V142 PolarHBondContact O-N 3.09Å; V139-E143 VanDerWaalsContact O-CB 3.28Å; V139-E143 WeakPolarHBondContact O-CB 3.38Å; V139-E143 PolarHBondContact O-N 3.31Å; V139-V181 HydrophobicContact CG2-CG1 4.26Å; V139-V181 HydrophobicContact CG2-CG2 3.89Å; V139-Y185 HydrophobicContact CG1-CE2 4.26Å |
| 140 | T | 92.5 | Very high | 91.3 | Very high | 69 Ų | 69 | 62 Ų | 62 | 42% | 0.423 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58.5 | -42.3 | 177.7 | -59 | 0 | 0 | 0 | 0 | 111.4 | F83 D136 D137 G144 | F83-T140 HydrophobicContact CE2-CG2 4.39Å; F83-T140 HydrophobicContact CZ-CG2 4.33Å; F83-T140 WeakPolarHBondContact CZ-O 3.3Å; D136-T140 VanDerWaalsContact O-CB 3.29Å; D136-T140 WeakPolarHBondContact O-CB 3.47Å; D136-T140 PolarHBondContact O-N 3.29Å; D136-T140 PolarHBondContact O-OG1 3.32Å; D137-T140 PolarHBondContact O-N 2.96Å; T140-G144 PolarHBondContact O-N 3.18Å |
| 141 | L | 94.5 | Very high | 91.4 | Very high | 4 Ų | 4 | 57.1 Ų | 57.1 | 2% | 0.021 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -65.3 | -48.2 | 178 | -179.8 | 59.1 | 0 | 0 | 0 | 112.1 | F83 F124 L128 I132 D137 F138 V139 E143 G144 L145 V157 | F83-L141 HydrophobicContact CE1-CD1 3.85Å; F124-L141 HydrophobicContact CE2-CD2 4.11Å; L128-L141 HydrophobicContact CB-CD1 4.43Å; L128-L141 HydrophobicContact CB-CD2 4.49Å; L128-L141 HydrophobicContact CD1-CD1 4.35Å; L128-L141 HydrophobicContact CD2-CD1 4.35Å; I132-L141 HydrophobicContact CD1-CD2 3.48Å; I132-L141 VanDerWaalsContact CD1-CD2 3.48Å; I132-L141 HydrophobicContact CG1-CD2 3.68Å; D137-L141 VanDerWaalsContact O-CB 3.27Å; D137-L141 WeakPolarHBondContact O-CB 3.15Å; D137-L141 PolarHBondContact O-N 2.97Å; F138-L141 PolarHBondContact O-N 3.12Å; V139-L141 VanDerWaalsContact C-N 3.29Å; V139-L141 PolarHBondContact O-N 3.38Å; L141-E143 VanDerWaalsContact C-N 3.32Å; L141-E143 PolarHBondContact O-N 3.31Å; L141-G144 PolarHBondContact O-N 3.25Å; L141-L145 HydrophobicContact CD1-CD1 3.83Å; L141-L145 HydrophobicContact CD1-CG 4.02Å; L141-L145 HydrophobicContact CG-CD1 4.05Å; L141-L145 WeakPolarHBondContact O-CB 3.35Å; L141-L145 VanDerWaalsContact O-CG 3.23Å; L141-L145 WeakPolarHBondContact O-CG 3.32Å; L141-L145 PolarHBondContact O-N 2.93Å; L141-V157 HydrophobicContact CD2-CG2 3.8Å; L141-V157 HydrophobicContact CG-CG2 4.01Å |
| 142 | V | 94.1 | Very high | 91.7 | Very high | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 178.3 | 173.8 | 0 | 0 | 0 | 0 | 111 | F138 V139 T146 V157 Y185 L187 | F138-V142 HydrophobicContact CD2-CG2 4.15Å; F138-V142 HydrophobicContact CE1-CG2 4.28Å; F138-V142 HydrophobicContact CE2-CG2 3.73Å; F138-V142 HydrophobicContact CZ-CG2 3.79Å; F138-V142 WeakPolarHBondContact O-CG2 3.28Å; F138-V142 PolarHBondContact O-N 3.07Å; V139-V142 PolarHBondContact O-N 3.09Å; V142-T146 WeakPolarHBondContact O-CB 3.47Å; V142-T146 PolarHBondContact O-N 3.43Å; V142-T146 PolarHBondContact O-OG1 3.26Å; V142-V157 HydrophobicContact CG2-CG1 3.51Å; V142-Y185 VanDerWaalsContact CG1-CB 3.45Å; V142-Y185 HydrophobicContact CG1-CD1 3.93Å; V142-Y185 HydrophobicContact CG1-CD2 3.82Å; V142-Y185 HydrophobicContact CG1-CG 3.47Å; V142-Y185 VanDerWaalsContact CG1-CG 3.47Å; V142-L187 HydrophobicContact CG1-CD1 4.24Å; V142-L187 HydrophobicContact CG1-CD2 4.36Å; V142-L187 HydrophobicContact CG2-CD1 4.27Å |
| 143 | E | 92.5 | Very high | 91.8 | Very high | 67 Ų | 67 | 52.9 Ų | 52.9 | 31% | 0.313 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.6 | -50.3 | 178.8 | -176.9 | 158 | -177.3 | 0 | 0 | 111.7 | V139 L141 L145 T146 F147 Y185 | V139-E143 VanDerWaalsContact O-CB 3.28Å; V139-E143 WeakPolarHBondContact O-CB 3.38Å; V139-E143 PolarHBondContact O-N 3.31Å; L141-E143 VanDerWaalsContact C-N 3.32Å; L141-E143 PolarHBondContact O-N 3.31Å; E143-L145 PolarHBondContact O-N 2.95Å; E143-T146 WeakPolarHBondContact O-CB 3.48Å; E143-T146 PolarHBondContact O-N 2.79Å; E143-T146 VanDerWaalsContact O-N 3.1Å; E143-F147 HydrophobicContact CG-CD2 3.66Å; E143-F147 HydrophobicContact CG-CE2 3.3Å; E143-F147 HydrophobicContact CG-CZ 4.38Å; E143-F147 VanDerWaalsContact O-CD2 3.23Å; E143-F147 WeakPolarHBondContact O-CD2 3.38Å; E143-F147 PolarHBondContact O-N 2.64Å; E143-F147 WeakPolarHBondContact OE1-CE2 3.22Å; E143-Y185 HydrophobicContact CB-CE1 3.7Å; E143-Y185 HydrophobicContact CG-CE1 3.98Å; E143-Y185 PolarHBondContact OE2-OH 3.42Å |
| 144 | G | 92.8 | Very high | 92.1 | Very high | 7 Ų | 7 | 50.7 Ų | 50.7 | 7% | 0.072 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.4 | -44.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | F83 T140 L141 T146 F147 A148 | F83-G144 VanDerWaalsContact CE2-CA 3.47Å; T140-G144 PolarHBondContact O-N 3.18Å; L141-G144 PolarHBondContact O-N 3.25Å; G144-T146 VanDerWaalsContact C-N 3.28Å; G144-T146 PolarHBondContact O-N 3.37Å; G144-F147 PolarHBondContact O-N 3.29Å; G144-A148 VanDerWaalsContact O-CB 3.24Å; G144-A148 WeakPolarHBondContact O-CB 3.42Å; G144-A148 PolarHBondContact O-N 3.44Å |
| 145 | L | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -67.6 | -29.9 | 176.1 | -66.9 | 175 | 0 | 0 | 0 | 112.8 | F83 L128 L141 E143 H149 L150 L153 V157 | F83-L145 HydrophobicContact CD1-CD2 4.38Å; L128-L145 HydrophobicContact CD1-CD2 4.34Å; L141-L145 HydrophobicContact CD1-CD1 3.83Å; L141-L145 HydrophobicContact CD1-CG 4.02Å; L141-L145 HydrophobicContact CG-CD1 4.05Å; L141-L145 WeakPolarHBondContact O-CB 3.35Å; L141-L145 VanDerWaalsContact O-CG 3.23Å; L141-L145 WeakPolarHBondContact O-CG 3.32Å; L141-L145 PolarHBondContact O-N 2.93Å; E143-L145 PolarHBondContact O-N 2.95Å; L145-H149 PolarHBondContact O-N 2.92Å; L145-L150 HydrophobicContact CD2-CB 4.12Å; L145-L150 HydrophobicContact CD2-CD1 3.79Å; L145-L150 PolarHBondContact O-N 3.4Å; L145-L153 HydrophobicContact CD1-CB 3.97Å; L145-L153 HydrophobicContact CD2-CB 4.05Å; L145-L153 HydrophobicContact CD2-CD1 4.07Å; L145-V157 HydrophobicContact CD1-CG2 3.58Å |
| 146 | T | 91.7 | Very high | 92.5 | Very high | 45 Ų | 45 | 43.3 Ų | 43.3 | 28% | 0.276 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -67.9 | -47.7 | 174.7 | -61.1 | 0 | 0 | 0 | 0 | 110.5 | V142 E143 G144 H149 | V142-T146 WeakPolarHBondContact O-CB 3.47Å; V142-T146 PolarHBondContact O-N 3.43Å; V142-T146 PolarHBondContact O-OG1 3.26Å; E143-T146 WeakPolarHBondContact O-CB 3.48Å; E143-T146 PolarHBondContact O-N 2.79Å; E143-T146 VanDerWaalsContact O-N 3.1Å; G144-T146 VanDerWaalsContact C-N 3.28Å; G144-T146 PolarHBondContact O-N 3.37Å; T146-H149 PolarHBondContact O-N 2.89Å |
| 147 | F | 91.3 | Very high | 92.7 | Very high | 148 Ų | 148 | 37.9 Ų | 37.9 | 65% | 0.649 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -68.3 | -35.6 | 177 | -71.8 | -57 | 0 | 0 | 0 | 113.3 | E143 G144 H149 | E143-F147 HydrophobicContact CG-CD2 3.66Å; E143-F147 HydrophobicContact CG-CE2 3.3Å; E143-F147 HydrophobicContact CG-CZ 4.38Å; E143-F147 VanDerWaalsContact O-CD2 3.23Å; E143-F147 WeakPolarHBondContact O-CD2 3.38Å; E143-F147 PolarHBondContact O-N 2.64Å; E143-F147 WeakPolarHBondContact OE1-CE2 3.22Å; G144-F147 PolarHBondContact O-N 3.29Å; F147-H149 PolarHBondContact O-CD2 3.3Å; F147-H149 PolarHBondContact O-N 2.74Å |
| 148 | A | 91.9 | Very high | 92.8 | Very high | 9 Ų | 9 | 35.2 Ų | 35.2 | 7% | 0.074 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74 | -3.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | F83 R87 G144 L150 | F83-A148 HydrophobicContact CB-CB 3.97Å; R87-A148 HydrophobicContact CB-CB 4.37Å; R87-A148 WeakPolarHBondContact CD-O 3.21Å; R87-A148 PolarHBondContact NE-O 2.88Å; G144-A148 VanDerWaalsContact O-CB 3.24Å; G144-A148 WeakPolarHBondContact O-CB 3.42Å; G144-A148 PolarHBondContact O-N 3.44Å; A148-L150 HydrophobicContact CB-CD1 3.9Å; A148-L150 HydrophobicContact CB-CG 4.17Å |
| 149 | H | 91.8 | Very high | 92.7 | Very high | 152 Ų | 152 | 35.9 Ų | 35.9 | 70% | 0.704 | 19% | 0.185 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56 | 49.8 | -178.3 | -59.1 | -67.7 | 0 | 0 | 0 | 113.4 | L145 T146 F147 P151 | L145-H149 PolarHBondContact O-N 2.92Å; T146-H149 PolarHBondContact O-N 2.89Å; F147-H149 PolarHBondContact O-CD2 3.3Å; F147-H149 PolarHBondContact O-N 2.74Å; H149-P151 WeakPolarHBondContact O-CD 3.42Å |
| 150 | L | 92.1 | Very high | 92.7 | Very high | 8 Ų | 8 | 37.2 Ų | 37.2 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | trans | -110.8 | 70.7 | 179.5 | -67.3 | 168.4 | 0 | 0 | 0 | 111.7 | R87 F90 L145 A148 A152 L153 R154 | R87-L150 HydrophobicContact CB-CD1 3.96Å; R87-L150 HydrophobicContact CB-CD2 4.4Å; R87-L150 HydrophobicContact CB-CG 4.4Å; R87-L150 HydrophobicContact CG-CD1 4.45Å; R87-L150 HydrophobicContact CG-CD2 4.12Å; R87-L150 HydrophobicContact CG-CG 4.36Å; F90-L150 HydrophobicContact CB-CD2 4.18Å; F90-L150 HydrophobicContact CD1-CD2 3.82Å; F90-L150 HydrophobicContact CG-CD2 4.13Å; L145-L150 HydrophobicContact CD2-CB 4.12Å; L145-L150 HydrophobicContact CD2-CD1 3.79Å; L145-L150 PolarHBondContact O-N 3.4Å; A148-L150 HydrophobicContact CB-CD1 3.9Å; A148-L150 HydrophobicContact CB-CG 4.17Å; L150-A152 VanDerWaalsContact C-N 3.31Å; L150-A152 PolarHBondContact O-N 2.64Å; L150-L153 HydrophobicContact CB-CB 4.35Å; L150-L153 HydrophobicContact CB-CD1 4.24Å; L150-L153 HydrophobicContact CD1-CD1 4Å; L150-L153 PolarHBondContact O-N 2.92Å; L150-R154 PolarHBondContact O-N 3.39Å | ||
| 151 | P | 91.7 | Very high | 92.7 | Very high | 83 Ų | 83 | 34.6 Ų | 34.6 | 54% | 0.539 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -64.6 | -31.7 | -171.8 | 25.9 | -35.4 | 0 | 0 | 0 | 113.7 | H149 R154 K155 | H149-P151 WeakPolarHBondContact O-CD 3.42Å; P151-R154 PolarHBondContact O-N 3.35Å; P151-K155 WeakPolarHBondContact O-CG 3.4Å; P151-K155 PolarHBondContact O-N 2.83Å |
| 152 | A | 91.3 | Very high | 92.6 | Very high | 17 Ų | 17 | 34.4 Ų | 34.4 | 14% | 0.14 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.4 | -44.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | F90 R116 A120 L150 K155 E156 | F90-A152 HydrophobicContact CZ-CB 3.99Å; R116-A152 HydrophobicContact CG-CB 4.08Å; A120-A152 HydrophobicContact CB-CB 3.8Å; L150-A152 VanDerWaalsContact C-N 3.31Å; L150-A152 PolarHBondContact O-N 2.64Å; A152-K155 PolarHBondContact O-N 3.42Å; A152-E156 PolarHBondContact O-N 2.96Å |
| 153 | L | 93.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -67.8 | -37.1 | 174.8 | -71.1 | 170.2 | 0 | 0 | 0 | 111.7 | F90 A120 Y123 F124 L128 L145 L150 K155 E156 V157 | F90-L153 HydrophobicContact CB-CD1 4.49Å; F90-L153 HydrophobicContact CD2-CD1 3.67Å; F90-L153 HydrophobicContact CD2-CD2 4.22Å; F90-L153 HydrophobicContact CD2-CG 3.91Å; F90-L153 HydrophobicContact CE2-CD1 4.14Å; F90-L153 HydrophobicContact CE2-CD2 4.08Å; F90-L153 HydrophobicContact CE2-CG 3.84Å; F90-L153 HydrophobicContact CG-CD1 4.13Å; A120-L153 HydrophobicContact CB-CD2 4.08Å; A120-L153 HydrophobicContact CB-CG 4.46Å; A120-L153 WeakPolarHBondContact O-CD2 3.34Å; Y123-L153 HydrophobicContact CD1-CD1 4.2Å; Y123-L153 HydrophobicContact CD1-CD2 3.99Å; F124-L153 HydrophobicContact CB-CD2 4.16Å; L128-L153 HydrophobicContact CD1-CD1 4.12Å; L128-L153 HydrophobicContact CD1-CD2 4.06Å; L128-L153 HydrophobicContact CD1-CG 4.5Å; L145-L153 HydrophobicContact CD1-CB 3.97Å; L145-L153 HydrophobicContact CD2-CB 4.05Å; L145-L153 HydrophobicContact CD2-CD1 4.07Å; L150-L153 HydrophobicContact CB-CB 4.35Å; L150-L153 HydrophobicContact CB-CD1 4.24Å; L150-L153 HydrophobicContact CD1-CD1 4Å; L150-L153 PolarHBondContact O-N 2.92Å; L153-K155 VanDerWaalsContact C-N 3.25Å; L153-K155 PolarHBondContact O-N 3.25Å; L153-E156 PolarHBondContact O-N 3.1Å; L153-E156 VanDerWaalsContact O-N 3.09Å; L153-V157 WeakPolarHBondContact O-CG2 3Å; L153-V157 PolarHBondContact O-N 3.01Å |
| 154 | R | 94.1 | Very high | 92.1 | Very high | 52 Ų | 52 | 39.7 Ų | 39.7 | 20% | 0.196 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.9 | -37.8 | 174 | -168.7 | -178.8 | 68.5 | 160.2 | 3.8 | 112.1 | L150 P151 E156 V157 E158 Y185 L187 | L150-R154 PolarHBondContact O-N 3.39Å; P151-R154 PolarHBondContact O-N 3.35Å; R154-E156 VanDerWaalsContact C-N 3.34Å; R154-V157 PolarHBondContact O-N 3.32Å; R154-E158 WeakPolarHBondContact O-CB 3.34Å; R154-E158 PolarHBondContact O-N 3.49Å; R154-Y185 PolarHBondContact NH1-O 3.28Å; R154-L187 HydrophobicContact CG-CD2 3.96Å |
| 155 | K | 92.9 | Very high | 91.9 | Very high | 46 Ų | 46 | 40 Ų | 40 | 20% | 0.2 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -67.6 | -32.7 | 175.8 | -72.5 | -74.4 | 164 | -161.9 | 0 | 112.7 | L40 P151 A152 L153 E158 R159 | L40-K155 HydrophobicContact CD2-CD 3.59Å; P151-K155 WeakPolarHBondContact O-CG 3.4Å; P151-K155 PolarHBondContact O-N 2.83Å; A152-K155 PolarHBondContact O-N 3.42Å; L153-K155 VanDerWaalsContact C-N 3.25Å; L153-K155 PolarHBondContact O-N 3.25Å; K155-E158 IonicContact NZ-OE2 3.63Å; K155-E158 PolarHBondContact NZ-OE2 3.08Å; K155-E158 WeakPolarHBondContact O-CB 3.38Å; K155-E158 PolarHBondContact O-N 3.44Å; K155-R159 PolarHBondContact O-N 3.45Å |
| 156 | E | 92.4 | Very high | 91.4 | Very high | 9 Ų | 9 | 44.3 Ų | 44.3 | 4% | 0.042 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -75.2 | -34.7 | 174.3 | -68.4 | -57.9 | 116.7 | 0 | 0 | 112.6 | V43 A120 H121 F124 A152 L153 R154 E158 R159 F160 | V43-E156 WeakPolarHBondContact CG2-OE1 3.12Å; A120-E156 HydrophobicContact CB-CG 4.05Å; H121-E156 HydrophobicContact CB-CG 4.46Å; H121-E156 IonicContact CE1-OE2 2.68Å; H121-E156 IonicContact CG-OE2 3.66Å; H121-E156 IonicContact ND1-OE2 3.83Å; H121-E156 PolarHBondContact ND1-OE2 3.03Å; F124-E156 HydrophobicContact CB-CB 3.93Å; F124-E156 HydrophobicContact CD1-CB 4.19Å; F124-E156 HydrophobicContact CG-CB 3.93Å; A152-E156 PolarHBondContact O-N 2.96Å; L153-E156 PolarHBondContact O-N 3.1Å; L153-E156 VanDerWaalsContact O-N 3.09Å; R154-E156 VanDerWaalsContact C-N 3.34Å; E156-E158 VanDerWaalsContact C-N 3.32Å; E156-E158 PolarHBondContact O-N 2.98Å; E156-R159 WeakPolarHBondContact O-CB 3.42Å; E156-R159 PolarHBondContact O-N 3.41Å; E156-R159 IonicContact OE1-CZ 2.7Å; E156-R159 IonicContact OE1-NE 2.58Å; E156-R159 PolarHBondContact OE1-NE 2.93Å; E156-R159 IonicContact OE1-NH2 3.55Å; E156-R159 PolarHBondContact OE1-NH2 3.32Å; E156-R159 VanDerWaalsContact OE1-NH2 3.12Å; E156-R159 IonicContact OE2-NE 2.68Å; E156-R159 PolarHBondContact OE2-NE 3.26Å; E156-F160 WeakPolarHBondContact O-CB 3.44Å; E156-F160 PolarHBondContact O-N 3.49Å |
| 157 | V | 93.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.4 | -44.6 | 168.3 | 175.6 | 0 | 0 | 0 | 0 | 110.9 | F124 F138 L141 V142 L145 L153 R154 F160 I161 | F124-V157 HydrophobicContact CD2-CG2 3.81Å; F124-V157 HydrophobicContact CE2-CB 4.27Å; F124-V157 HydrophobicContact CE2-CG2 3.5Å; F124-V157 HydrophobicContact CZ-CG2 4.46Å; F138-V157 HydrophobicContact CD2-CG1 3.85Å; F138-V157 HydrophobicContact CE2-CG1 3.5Å; L141-V157 HydrophobicContact CD2-CG2 3.8Å; L141-V157 HydrophobicContact CG-CG2 4.01Å; V142-V157 HydrophobicContact CG2-CG1 3.51Å; L145-V157 HydrophobicContact CD1-CG2 3.58Å; L153-V157 WeakPolarHBondContact O-CG2 3Å; L153-V157 PolarHBondContact O-N 3.01Å; R154-V157 PolarHBondContact O-N 3.32Å; V157-F160 PolarHBondContact O-N 3.4Å; V157-I161 WeakPolarHBondContact O-CG2 3.47Å; V157-I161 PolarHBondContact O-N 2.93Å; V157-I161 VanDerWaalsContact O-N 3.12Å |
| 158 | E | 94.4 | Very high | 90.1 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.8 | -43.5 | 175.4 | -173.1 | 173.2 | -162.1 | 0 | 0 | 111.7 | L40 R154 K155 E156 I161 C162 L187 E188 I189 L190 | L40-E158 HydrophobicContact CD1-CG 4.48Å; L40-E158 HydrophobicContact CD2-CG 4.25Å; R154-E158 WeakPolarHBondContact O-CB 3.34Å; R154-E158 PolarHBondContact O-N 3.49Å; K155-E158 IonicContact NZ-OE2 3.63Å; K155-E158 PolarHBondContact NZ-OE2 3.08Å; K155-E158 WeakPolarHBondContact O-CB 3.38Å; K155-E158 PolarHBondContact O-N 3.44Å; E156-E158 VanDerWaalsContact C-N 3.32Å; E156-E158 PolarHBondContact O-N 2.98Å; E158-I161 WeakPolarHBondContact O-CG2 3.4Å; E158-C162 WeakPolarHBondContact O-CB 3.45Å; E158-C162 PolarHBondContact O-N 3.33Å; E158-C162 PolarHBondContact O-SG 3.46Å; E158-L187 HydrophobicContact CB-CD2 4.34Å; E158-L187 HydrophobicContact CG-CB 4.19Å; E158-L187 VanDerWaalsContact OE1-CA 3.24Å; E158-L187 WeakPolarHBondContact OE1-CA 3.21Å; E158-E188 PolarHBondContact OE1-N 2.95Å; E158-E188 VanDerWaalsContact OE1-N 3.08Å; E158-I189 HydrophobicContact CG-CB 4.42Å; E158-I189 WeakPolarHBondContact OE1-CA 3.29Å; E158-I189 WeakPolarHBondContact OE1-CB 3.1Å; E158-I189 PolarHBondContact OE1-N 2.78Å; E158-L190 HydrophobicContact CG-CB 4.17Å; E158-L190 PolarHBondContact OE1-N 3.36Å |
| 159 | R | 92.3 | Very high | 89.4 | Confident | 19 Ų | 19 | 52.1 Ų | 52.1 | 7% | 0.072 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58 | -50.5 | 174.3 | -177.2 | -174.3 | -54.3 | -68.5 | -12.5 | 111.8 | L37 L40 P41 V43 K155 E156 I161 C162 Q163 | L37-R159 HydrophobicContact CD2-CG 4.42Å; L40-R159 VanDerWaalsContact CB-NH2 3.34Å; L40-R159 VanDerWaalsContact CD1-CA 3.49Å; L40-R159 HydrophobicContact CD1-CB 3.69Å; L40-R159 HydrophobicContact CD1-CG 4.31Å; P41-R159 PolarHBondContact O-NH2 2.97Å; V43-R159 VanDerWaalsContact CG2-CZ 3.49Å; K155-R159 PolarHBondContact O-N 3.45Å; E156-R159 WeakPolarHBondContact O-CB 3.42Å; E156-R159 PolarHBondContact O-N 3.41Å; E156-R159 IonicContact OE1-CZ 2.7Å; E156-R159 IonicContact OE1-NE 2.58Å; E156-R159 PolarHBondContact OE1-NE 2.93Å; E156-R159 IonicContact OE1-NH2 3.55Å; E156-R159 PolarHBondContact OE1-NH2 3.32Å; E156-R159 VanDerWaalsContact OE1-NH2 3.12Å; E156-R159 IonicContact OE2-NE 2.68Å; E156-R159 PolarHBondContact OE2-NE 3.26Å; R159-I161 PolarHBondContact O-N 3.33Å; R159-C162 PolarHBondContact O-N 2.81Å; R159-Q163 WeakPolarHBondContact O-CG 3.48Å; R159-Q163 PolarHBondContact O-N 3.09Å |
| 160 | F | 91.9 | Very high | 88.9 | Confident | 46 Ų | 46 | 45.4 Ų | 45.4 | 20% | 0.202 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.3 | -50.5 | -177.1 | 168.5 | -99.5 | 0 | 0 | 0 | 111.7 | F124 I132 E156 V157 Q163 K164 | F124-F160 HydrophobicContact CE1-CB 3.53Å; F124-F160 HydrophobicContact CE1-CD2 4Å; F124-F160 AromaticContact CE1-CG 3.84Å; F124-F160 HydrophobicContact CE1-CG 3.84Å; F124-F160 HydrophobicContact CZ-CB 3.54Å; F124-F160 HydrophobicContact CZ-CD1 4.09Å; F124-F160 HydrophobicContact CZ-CD2 4.16Å; F124-F160 AromaticContact CZ-CG 3.67Å; F124-F160 HydrophobicContact CZ-CG 3.67Å; I132-F160 HydrophobicContact CB-CE1 4.5Å; I132-F160 HydrophobicContact CD1-CD1 3.99Å; I132-F160 HydrophobicContact CD1-CE1 3.83Å; I132-F160 HydrophobicContact CG2-CE1 4.18Å; E156-F160 WeakPolarHBondContact O-CB 3.44Å; E156-F160 PolarHBondContact O-N 3.49Å; V157-F160 PolarHBondContact O-N 3.4Å; F160-Q163 PolarHBondContact O-N 3.45Å; F160-K164 HydrophobicContact CE1-CG 4.38Å; F160-K164 HydrophobicContact CE2-CG 4.38Å; F160-K164 HydrophobicContact CZ-CG 4.2Å; F160-K164 WeakPolarHBondContact O-CG 3.44Å; F160-K164 PolarHBondContact O-N 3.41Å; F160-K164 VanDerWaalsContact O-N 3.08Å |
| 161 | I | 91.8 | Very high | 88.7 | Confident | 15 Ų | 15 | 49.5 Ų | 49.5 | 8% | 0.077 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -70 | -35.3 | -179 | -167.7 | 63.4 | 0 | 0 | 0 | 111.5 | F138 V157 E158 R159 Q163 K164 V165 L178 L190 | F138-I161 HydrophobicContact CD2-CB 4.42Å; F138-I161 HydrophobicContact CE2-CB 3.77Å; F138-I161 HydrophobicContact CE2-CG1 4.08Å; F138-I161 HydrophobicContact CE2-CG2 3.7Å; F138-I161 HydrophobicContact CZ-CB 4.2Å; F138-I161 HydrophobicContact CZ-CG1 4.16Å; F138-I161 HydrophobicContact CZ-CG2 3.87Å; V157-I161 WeakPolarHBondContact O-CG2 3.47Å; V157-I161 PolarHBondContact O-N 2.93Å; V157-I161 VanDerWaalsContact O-N 3.12Å; E158-I161 WeakPolarHBondContact O-CG2 3.4Å; R159-I161 PolarHBondContact O-N 3.33Å; I161-Q163 VanDerWaalsContact C-N 3.35Å; I161-Q163 PolarHBondContact O-N 3.09Å; I161-K164 PolarHBondContact O-N 3.36Å; I161-V165 HydrophobicContact CG1-CG2 4.44Å; I161-V165 WeakPolarHBondContact O-CB 3.36Å; I161-V165 WeakPolarHBondContact O-CG2 3.37Å; I161-V165 PolarHBondContact O-N 2.6Å; I161-L178 HydrophobicContact CD1-CD1 4.44Å; I161-L178 HydrophobicContact CD1-CD2 4.29Å; I161-L178 HydrophobicContact CG1-CD1 4.29Å; I161-L178 HydrophobicContact CG1-CD2 3.9Å; I161-L190 HydrophobicContact CG1-CD1 4.42Å; I161-L190 HydrophobicContact CG2-CD1 3.92Å; I161-L190 HydrophobicContact CG2-CD2 3.66Å; I161-L190 HydrophobicContact CG2-CG 4.28Å |
| 162 | C | 91.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.1 | -43.8 | 172.8 | -71.4 | 0 | 0 | 0 | 0 | 111.8 | L37 E158 R159 V165 I166 L190 | L37-C162 HydrophobicContact CD2-CB 3.58Å; E158-C162 WeakPolarHBondContact O-CB 3.45Å; E158-C162 PolarHBondContact O-N 3.33Å; E158-C162 PolarHBondContact O-SG 3.46Å; R159-C162 PolarHBondContact O-N 2.81Å; C162-V165 WeakPolarHBondContact O-CB 3.28Å; C162-V165 PolarHBondContact O-N 2.59Å; C162-I166 WeakPolarHBondContact O-CB 3.37Å; C162-I166 WeakPolarHBondContact O-CD1 3.42Å; C162-I166 WeakPolarHBondContact O-CG1 3.05Å; C162-I166 PolarHBondContact O-N 2.88Å; C162-L190 VanDerWaalsContact SG-CA 3.53Å |
| 163 | Q | 88.8 | Confident | 88.4 | Confident | 74 Ų | 74 | 48.9 Ų | 48.9 | 35% | 0.346 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.4 | -47.2 | 175.6 | -77.6 | 173.4 | -20.6 | 0 | 0 | 111.2 | L37 R159 F160 I161 V165 I166 E167 | L37-Q163 HydrophobicContact CD1-CG 3.47Å; L37-Q163 VanDerWaalsContact CD1-CG 3.47Å; L37-Q163 HydrophobicContact CD2-CG 4.22Å; R159-Q163 WeakPolarHBondContact O-CG 3.48Å; R159-Q163 PolarHBondContact O-N 3.09Å; F160-Q163 PolarHBondContact O-N 3.45Å; I161-Q163 VanDerWaalsContact C-N 3.35Å; I161-Q163 PolarHBondContact O-N 3.09Å; Q163-V165 VanDerWaalsContact C-N 3.3Å; Q163-V165 PolarHBondContact O-N 2.63Å; Q163-I166 PolarHBondContact O-N 3.39Å; Q163-E167 WeakPolarHBondContact O-CB 3.33Å; Q163-E167 VanDerWaalsContact O-CG 3.3Å; Q163-E167 WeakPolarHBondContact O-CG 3.29Å; Q163-E167 PolarHBondContact O-N 3.05Å |
| 164 | K | 87.8 | Confident | 88.2 | Confident | 103 Ų | 103 | 52.5 Ų | 52.5 | 45% | 0.448 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.2 | -40.1 | 177 | -66.7 | -60.4 | 176.4 | -162.6 | 0 | 112.9 | F160 I161 A168 | F160-K164 HydrophobicContact CE1-CG 4.38Å; F160-K164 HydrophobicContact CE2-CG 4.38Å; F160-K164 HydrophobicContact CZ-CG 4.2Å; F160-K164 WeakPolarHBondContact O-CG 3.44Å; F160-K164 PolarHBondContact O-N 3.41Å; F160-K164 VanDerWaalsContact O-N 3.08Å; I161-K164 PolarHBondContact O-N 3.36Å; K164-A168 WeakPolarHBondContact O-CB 3.29Å; K164-A168 PolarHBondContact O-N 3.48Å; K164-A168 VanDerWaalsContact O-N 3.07Å |
| 165 | V | 88.3 | Confident | 88.1 | Confident | 13 Ų | 13 | 50 Ų | 50 | 8% | 0.079 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.3 | -42.8 | 177.2 | 154 | 0 | 0 | 0 | 0 | 111.9 | I161 C162 Q163 M170 L178 L190 V193 I194 | I161-V165 HydrophobicContact CG1-CG2 4.44Å; I161-V165 WeakPolarHBondContact O-CB 3.36Å; I161-V165 WeakPolarHBondContact O-CG2 3.37Å; I161-V165 PolarHBondContact O-N 2.6Å; C162-V165 WeakPolarHBondContact O-CB 3.28Å; C162-V165 PolarHBondContact O-N 2.59Å; Q163-V165 VanDerWaalsContact C-N 3.3Å; Q163-V165 PolarHBondContact O-N 2.63Å; V165-M170 HydrophobicContact CB-CE 3.59Å; V165-M170 HydrophobicContact CG1-CE 3.18Å; V165-M170 HydrophobicContact CG2-CE 3.43Å; V165-M170 VanDerWaalsContact CG2-CE 3.43Å; V165-M170 HydrophobicContact CG2-SD 4.13Å; V165-L178 HydrophobicContact CG2-CD1 3.8Å; V165-L190 HydrophobicContact CG2-CD1 4.28Å; V165-V193 HydrophobicContact CG1-CG1 3.44Å; V165-V193 VanDerWaalsContact CG1-CG1 3.44Å; V165-I194 HydrophobicContact CG1-CD1 3.92Å; V165-I194 HydrophobicContact CG2-CD1 3.91Å |
| 166 | I | 84.4 | Confident | 88.1 | Confident | 92 Ų | 92 | 48.3 Ų | 48.3 | 47% | 0.472 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -71 | -36.1 | -178.7 | -68.7 | 163.8 | 0 | 0 | 0 | 111 | P36 L37 C162 Q163 V193 | P36-I166 HydrophobicContact CB-CD1 4.49Å; P36-I166 HydrophobicContact CG-CD1 4.37Å; L37-I166 HydrophobicContact CD2-CD1 4.41Å; L37-I166 HydrophobicContact CG-CD1 4.39Å; C162-I166 WeakPolarHBondContact O-CB 3.37Å; C162-I166 WeakPolarHBondContact O-CD1 3.42Å; C162-I166 WeakPolarHBondContact O-CG1 3.05Å; C162-I166 PolarHBondContact O-N 2.88Å; Q163-I166 PolarHBondContact O-N 3.39Å; I166-V193 HydrophobicContact CG1-CG1 4.12Å |
| 167 | E | 81.7 | Confident | 88 | Confident | 143 Ų | 143 | 50.6 Ų | 50.6 | 67% | 0.668 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -79.5 | -25.6 | -179.2 | -70.6 | 171.9 | -178 | 0 | 0 | 113.7 | Q163 | Q163-E167 WeakPolarHBondContact O-CB 3.33Å; Q163-E167 VanDerWaalsContact O-CG 3.3Å; Q163-E167 WeakPolarHBondContact O-CG 3.29Å; Q163-E167 PolarHBondContact O-N 3.05Å |
| 168 | A | 74.1 | Confident | 88 | Confident | 55 Ų | 55 | 50.6 Ų | 50.6 | 46% | 0.455 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -99.6 | 145.4 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | K164 M170 | K164-A168 WeakPolarHBondContact O-CB 3.29Å; K164-A168 PolarHBondContact O-N 3.48Å; K164-A168 VanDerWaalsContact O-N 3.07Å; A168-M170 PolarHBondContact O-N 2.88Å |
| 169 | D | 76.8 | Confident | 88 | Confident | 167 Ų | 167 | 50.6 Ų | 50.6 | 89% | 0.893 | 26% | 0.261 | S | S | * | . | trans | -72.7 | 94.1 | 159.9 | -172 | 20.7 | 0 | 0 | 0 | 108.2 | ||||
| 170 | M | 82.3 | Confident | 88 | Confident | 12 Ų | 12 | 49.7 Ų | 49.7 | 6% | 0.059 | 26% | 0.258 | C | S | . | . | trans | -79.4 | 135.1 | -168.5 | -164.5 | -172.6 | -27.5 | 0 | 0 | 111.9 | V165 A168 F174 A175 L178 I194 F197 | V165-M170 HydrophobicContact CB-CE 3.59Å; V165-M170 HydrophobicContact CG1-CE 3.18Å; V165-M170 HydrophobicContact CG2-CE 3.43Å; V165-M170 VanDerWaalsContact CG2-CE 3.43Å; V165-M170 HydrophobicContact CG2-SD 4.13Å; A168-M170 PolarHBondContact O-N 2.88Å; M170-F174 HydrophobicContact CG-CD1 3.72Å; M170-F174 HydrophobicContact SD-CD1 3.83Å; M170-F174 HydrophobicContact SD-CE1 4.44Å; M170-A175 HydrophobicContact CG-CB 4.45Å; M170-A175 VanDerWaalsContact SD-CA 3.57Å; M170-A175 HydrophobicContact SD-CB 3.55Å; M170-A175 VanDerWaalsContact SD-CB 3.55Å; M170-L178 HydrophobicContact SD-CD1 4.04Å; M170-I194 HydrophobicContact CE-CD1 3.57Å; M170-I194 HydrophobicContact SD-CD1 3.84Å; M170-F197 HydrophobicContact CB-CE1 4.22Å; M170-F197 HydrophobicContact CB-CE2 4.26Å; M170-F197 HydrophobicContact CB-CZ 3.85Å; M170-F197 WeakPolarHBondContact O-CZ 3.28Å | ||
| 171 | D | 87.3 | Confident | 88 | Confident | 93 Ų | 93 | 47.6 Ų | 47.6 | 50% | 0.497 | 25% | 0.248 | S | C | . | . | trans | -63.1 | 132.4 | 170.1 | 173.8 | 72.2 | 0 | 0 | 0 | 111.5 | S173 F174 A175 | D171-S173 VanDerWaalsContact C-N 3.28Å; D171-S173 PolarHBondContact O-N 2.89Å; D171-S173 VanDerWaalsContact OD2-CA 3.3Å; D171-S173 WeakPolarHBondContact OD2-CA 3.44Å; D171-S173 WeakPolarHBondContact OD2-CB 3.43Å; D171-S173 PolarHBondContact OD2-N 3.42Å; D171-F174 HydrophobicContact CB-CB 4.1Å; D171-F174 WeakPolarHBondContact O-CB 3.32Å; D171-F174 PolarHBondContact O-N 3.04Å; D171-F174 VanDerWaalsContact O-N 3.13Å; D171-F174 PolarHBondContact OD2-N 3.39Å; D171-A175 PolarHBondContact O-N 3.43Å | ||
| 172 | P | 86.9 | Confident | 88.1 | Confident | 45 Ų | 45 | 46.9 Ų | 46.9 | 29% | 0.292 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.6 | -32.5 | 179.5 | -23.7 | 31.5 | 0 | 0 | 0 | 114.4 | K176 | P172-K176 VanDerWaalsContact O-CG 3.27Å; P172-K176 WeakPolarHBondContact O-CG 3.27Å; P172-K176 PolarHBondContact O-N 3.3Å; P172-K176 VanDerWaalsContact O-N 3.13Å |
| 173 | S | 88.8 | Confident | 88.2 | Confident | 42 Ų | 42 | 49 Ų | 49 | 29% | 0.294 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -70.2 | -41 | 176.3 | 179.9 | 0 | 0 | 0 | 0 | 110.6 | D171 K176 K177 M222 | D171-S173 VanDerWaalsContact C-N 3.28Å; D171-S173 PolarHBondContact O-N 2.89Å; D171-S173 VanDerWaalsContact OD2-CA 3.3Å; D171-S173 WeakPolarHBondContact OD2-CA 3.44Å; D171-S173 WeakPolarHBondContact OD2-CB 3.43Å; D171-S173 PolarHBondContact OD2-N 3.42Å; S173-K176 PolarHBondContact O-N 2.86Å; S173-K177 WeakPolarHBondContact O-CG 3.22Å; S173-K177 PolarHBondContact O-N 2.79Å; S173-K177 VanDerWaalsContact O-N 3.12Å; S173-M222 WeakPolarHBondContact OG-CE 3.36Å |
| 174 | F | 89.5 | Confident | 88.2 | Confident | 76 Ų | 76 | 48.4 Ų | 48.4 | 33% | 0.333 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 174 | -174 | -110.6 | 0 | 0 | 0 | 112 | F135 M170 D171 K176 K177 L178 | F135-F174 HydrophobicContact CB-CE2 4.2Å; F135-F174 HydrophobicContact CD2-CD2 4.27Å; F135-F174 AromaticContact CD2-CE2 3.49Å; F135-F174 HydrophobicContact CD2-CE2 3.49Å; F135-F174 VanDerWaalsContact CD2-CE2 3.49Å; F135-F174 HydrophobicContact CD2-CZ 4.16Å; F135-F174 HydrophobicContact CE2-CE2 4.23Å; F135-F174 HydrophobicContact CG-CE2 4.19Å; M170-F174 HydrophobicContact CG-CD1 3.72Å; M170-F174 HydrophobicContact SD-CD1 3.83Å; M170-F174 HydrophobicContact SD-CE1 4.44Å; D171-F174 HydrophobicContact CB-CB 4.1Å; D171-F174 WeakPolarHBondContact O-CB 3.32Å; D171-F174 PolarHBondContact O-N 3.04Å; D171-F174 VanDerWaalsContact O-N 3.13Å; D171-F174 PolarHBondContact OD2-N 3.39Å; F174-K176 VanDerWaalsContact C-N 3.35Å; F174-K176 PolarHBondContact O-N 2.83Å; F174-K177 PolarHBondContact O-N 2.74Å; F174-L178 HydrophobicContact CD1-CD1 3.75Å; F174-L178 HydrophobicContact CD1-CG 4.36Å; F174-L178 HydrophobicContact CE1-CD1 3.3Å; F174-L178 HydrophobicContact CE1-CG 3.98Å; F174-L178 HydrophobicContact CZ-CD1 3.83Å; F174-L178 HydrophobicContact CZ-CD2 4.42Å; F174-L178 HydrophobicContact CZ-CG 4.08Å; F174-L178 PolarHBondContact O-N 2.97Å |
| 175 | A | 91.8 | Very high | 88.4 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57.9 | -44.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | M170 D171 K177 L178 L179 I194 F197 L198 | M170-A175 HydrophobicContact CG-CB 4.45Å; M170-A175 VanDerWaalsContact SD-CA 3.57Å; M170-A175 HydrophobicContact SD-CB 3.55Å; M170-A175 VanDerWaalsContact SD-CB 3.55Å; D171-A175 PolarHBondContact O-N 3.43Å; A175-K177 PolarHBondContact O-N 3.08Å; A175-L178 PolarHBondContact O-N 3.12Å; A175-L179 WeakPolarHBondContact O-CB 3.4Å; A175-L179 PolarHBondContact O-N 3.02Å; A175-I194 HydrophobicContact CB-CG2 4.31Å; A175-I194 VanDerWaalsContact O-CG2 3.29Å; A175-I194 WeakPolarHBondContact O-CG2 3.45Å; A175-F197 HydrophobicContact CB-CD1 3.77Å; A175-F197 HydrophobicContact CB-CE1 3.72Å; A175-L198 HydrophobicContact CB-CD2 3.91Å; A175-L198 HydrophobicContact CB-CG 4.36Å |
| 176 | K | 92.8 | Very high | 88.6 | Confident | 10 Ų | 10 | 48.2 Ų | 48.2 | 4% | 0.043 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.1 | -42 | 177 | -70.2 | 167.7 | -155.9 | -179 | 0 | 112 | P172 S173 F174 L179 L180 L198 E218 L219 M222 | P172-K176 VanDerWaalsContact O-CG 3.27Å; P172-K176 WeakPolarHBondContact O-CG 3.27Å; P172-K176 PolarHBondContact O-N 3.3Å; P172-K176 VanDerWaalsContact O-N 3.13Å; S173-K176 PolarHBondContact O-N 2.86Å; F174-K176 VanDerWaalsContact C-N 3.35Å; F174-K176 PolarHBondContact O-N 2.83Å; K176-L179 WeakPolarHBondContact O-CB 3.34Å; K176-L179 PolarHBondContact O-N 3.27Å; K176-L180 PolarHBondContact O-N 3.28Å; K176-L198 HydrophobicContact CG-CD1 4.3Å; K176-L198 HydrophobicContact CG-CD2 4.38Å; K176-E218 HydrophobicContact CD-CB 4.27Å; K176-E218 WeakPolarHBondContact CD-OE2 3.33Å; K176-E218 IonicContact NZ-OE1 3.9Å; K176-E218 PolarHBondContact NZ-OE1 3.01Å; K176-E218 IonicContact NZ-OE2 3.66Å; K176-E218 PolarHBondContact NZ-OE2 2.95Å; K176-L219 HydrophobicContact CB-CD2 3.8Å; K176-L219 HydrophobicContact CG-CD2 4.23Å; K176-M222 HydrophobicContact CB-CE 4.36Å; K176-M222 HydrophobicContact CB-SD 3.71Å; K176-M222 HydrophobicContact CD-CE 4.22Å |
| 177 | K | 92.1 | Very high | 89 | Confident | 57 Ų | 57 | 43.8 Ų | 43.8 | 25% | 0.248 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.4 | -45.9 | 174.9 | -67.7 | -172.7 | 177.4 | -168 | 0 | 111.8 | F135 S173 F174 A175 L179 L180 V181 M222 E225 I226 | F135-K177 HydrophobicContact CE1-CB 4.34Å; F135-K177 HydrophobicContact CE2-CB 4.16Å; F135-K177 HydrophobicContact CZ-CB 3.74Å; S173-K177 WeakPolarHBondContact O-CG 3.22Å; S173-K177 PolarHBondContact O-N 2.79Å; S173-K177 VanDerWaalsContact O-N 3.12Å; F174-K177 PolarHBondContact O-N 2.74Å; A175-K177 PolarHBondContact O-N 3.08Å; K177-L179 VanDerWaalsContact C-N 3.27Å; K177-L179 PolarHBondContact O-N 3.11Å; K177-L180 PolarHBondContact O-N 3.5Å; K177-V181 WeakPolarHBondContact O-CG2 3.42Å; K177-V181 PolarHBondContact O-N 3.02Å; K177-V181 VanDerWaalsContact O-N 3.1Å; K177-M222 HydrophobicContact CG-CB 4.46Å; K177-M222 HydrophobicContact CG-CG 4.37Å; K177-M222 HydrophobicContact CG-SD 3.72Å; K177-E225 IonicContact NZ-OE2 3.27Å; K177-I226 HydrophobicContact CB-CD1 4.2Å; K177-I226 HydrophobicContact CG-CD1 4.21Å |
| 178 | L | 92.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.3 | -37.3 | 175.2 | -82.1 | 176.4 | 0 | 0 | 0 | 112.3 | F135 F138 I161 V165 M170 F174 A175 V181 S182 L190 I194 | F135-L178 HydrophobicContact CD2-CD2 4.43Å; F135-L178 HydrophobicContact CE2-CD2 3.87Å; F135-L178 HydrophobicContact CE2-CG 4.15Å; F138-L178 HydrophobicContact CD1-CD2 4.31Å; F138-L178 HydrophobicContact CE1-CD2 3.78Å; F138-L178 HydrophobicContact CZ-CD2 4.35Å; I161-L178 HydrophobicContact CD1-CD1 4.44Å; I161-L178 HydrophobicContact CD1-CD2 4.29Å; I161-L178 HydrophobicContact CG1-CD1 4.29Å; I161-L178 HydrophobicContact CG1-CD2 3.9Å; V165-L178 HydrophobicContact CG2-CD1 3.8Å; M170-L178 HydrophobicContact SD-CD1 4.04Å; F174-L178 HydrophobicContact CD1-CD1 3.75Å; F174-L178 HydrophobicContact CD1-CG 4.36Å; F174-L178 HydrophobicContact CE1-CD1 3.3Å; F174-L178 HydrophobicContact CE1-CG 3.98Å; F174-L178 HydrophobicContact CZ-CD1 3.83Å; F174-L178 HydrophobicContact CZ-CD2 4.42Å; F174-L178 HydrophobicContact CZ-CG 4.08Å; F174-L178 PolarHBondContact O-N 2.97Å; A175-L178 PolarHBondContact O-N 3.12Å; L178-V181 PolarHBondContact O-N 3.39Å; L178-S182 VanDerWaalsContact O-CB 3.28Å; L178-S182 WeakPolarHBondContact O-CB 3.47Å; L178-S182 PolarHBondContact O-N 2.93Å; L178-S182 PolarHBondContact O-OG 2.64Å; L178-L190 HydrophobicContact CD2-CD2 4.33Å; L178-I194 HydrophobicContact CB-CD1 4.19Å; L178-I194 HydrophobicContact CB-CG1 4.29Å; L178-I194 HydrophobicContact CD1-CD1 4.06Å |
| 179 | L | 93.9 | Very high | 90.5 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.7 | -46.1 | 177.7 | -170.5 | 52.8 | 0 | 0 | 0 | 111.8 | A175 K176 K177 V181 S182 E183 K191 I194 N195 L198 V239 L243 | A175-L179 WeakPolarHBondContact O-CB 3.4Å; A175-L179 PolarHBondContact O-N 3.02Å; K176-L179 WeakPolarHBondContact O-CB 3.34Å; K176-L179 PolarHBondContact O-N 3.27Å; K177-L179 VanDerWaalsContact C-N 3.27Å; K177-L179 PolarHBondContact O-N 3.11Å; L179-V181 PolarHBondContact O-N 3.43Å; L179-S182 WeakPolarHBondContact CA-OG 3.28Å; L179-S182 PolarHBondContact O-N 3.4Å; L179-S182 PolarHBondContact O-OG 3.12Å; L179-E183 PolarHBondContact O-N 3.46Å; L179-K191 HydrophobicContact CD1-CG 3.85Å; L179-I194 HydrophobicContact CB-CG2 3.74Å; L179-I194 HydrophobicContact CD1-CB 4.32Å; L179-I194 HydrophobicContact CD1-CG2 4.07Å; L179-I194 HydrophobicContact CD2-CG2 4.39Å; L179-I194 HydrophobicContact CG-CG2 4.29Å; L179-N195 WeakPolarHBondContact CD1-OD1 3.05Å; L179-L198 HydrophobicContact CD2-CD1 3.62Å; L179-V239 HydrophobicContact CD1-CG1 4.32Å; L179-V239 HydrophobicContact CD2-CG1 3.25Å; L179-V239 HydrophobicContact CG-CB 4.49Å; L179-V239 HydrophobicContact CG-CG1 3.45Å; L179-V239 VanDerWaalsContact CG-CG1 3.45Å; L179-V239 HydrophobicContact CG-CG2 4.22Å; L179-L243 HydrophobicContact CD2-CD1 3.84Å; L179-L243 HydrophobicContact CD2-CD2 4.42Å; L179-L243 HydrophobicContact CD2-CG 4.23Å |
| 180 | L | 92.7 | Very high | 91.3 | Very high | 1 Ų | 1 | 33.5 Ų | 33.5 | 1% | 0.005 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62.6 | -42.7 | 177 | -67 | 170.7 | 0 | 0 | 0 | 112.1 | K176 K177 E183 K184 L219 M222 A223 I226 L235 V236 | K176-L180 PolarHBondContact O-N 3.28Å; K177-L180 PolarHBondContact O-N 3.5Å; L180-E183 PolarHBondContact O-N 3.22Å; L180-K184 WeakPolarHBondContact O-CB 3.24Å; L180-K184 PolarHBondContact O-N 3.25Å; L180-L219 HydrophobicContact CD1-CD2 4.01Å; L180-L219 HydrophobicContact CD2-CD2 3.97Å; L180-L219 HydrophobicContact CG-CD2 3.77Å; L180-M222 HydrophobicContact CD1-CB 3.95Å; L180-A223 HydrophobicContact CD1-CB 3.93Å; L180-A223 HydrophobicContact CD2-CB 4.31Å; L180-I226 HydrophobicContact CB-CD1 4.22Å; L180-I226 HydrophobicContact CD1-CD1 3.9Å; L180-L235 HydrophobicContact CD2-CD2 4.34Å; L180-L235 HydrophobicContact CD2-CG 4.29Å; L180-V236 HydrophobicContact CD2-CG2 4.04Å |
| 181 | V | 92.2 | Very high | 91.9 | Very high | 1 Ų | 1 | 34.3 Ų | 34.3 | 1% | 0.006 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.4 | -42.1 | 176.5 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | F135 F138 V139 K177 L178 L179 E183 K184 Y185 | F135-V181 HydrophobicContact CE1-CG2 4.3Å; F135-V181 HydrophobicContact CE2-CG2 4.36Å; F135-V181 HydrophobicContact CZ-CG2 3.58Å; F138-V181 HydrophobicContact CE1-CG1 3.78Å; V139-V181 HydrophobicContact CG2-CG1 4.26Å; V139-V181 HydrophobicContact CG2-CG2 3.89Å; K177-V181 WeakPolarHBondContact O-CG2 3.42Å; K177-V181 PolarHBondContact O-N 3.02Å; K177-V181 VanDerWaalsContact O-N 3.1Å; L178-V181 PolarHBondContact O-N 3.39Å; L179-V181 PolarHBondContact O-N 3.43Å; V181-E183 VanDerWaalsContact C-N 3.32Å; V181-E183 PolarHBondContact O-N 3.15Å; V181-K184 PolarHBondContact O-N 2.51Å; V181-Y185 HydrophobicContact CG1-CD2 3.72Å; V181-Y185 HydrophobicContact CG1-CE2 3.97Å; V181-Y185 WeakPolarHBondContact O-CD2 3.44Å; V181-Y185 PolarHBondContact O-N 3.09Å |
| 182 | S | 94.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.7 | -40.4 | 179.4 | 73.5 | 0 | 0 | 0 | 0 | 112.1 | L178 L179 N186 L187 K191 | L178-S182 VanDerWaalsContact O-CB 3.28Å; L178-S182 WeakPolarHBondContact O-CB 3.47Å; L178-S182 PolarHBondContact O-N 2.93Å; L178-S182 PolarHBondContact O-OG 2.64Å; L179-S182 WeakPolarHBondContact CA-OG 3.28Å; L179-S182 PolarHBondContact O-N 3.4Å; L179-S182 PolarHBondContact O-OG 3.12Å; S182-N186 CarbonylContact O-C 3.59Å; S182-N186 WeakPolarHBondContact O-CA 3.47Å; S182-N186 PolarHBondContact O-N 2.88Å; S182-N186 VanDerWaalsContact O-N 3.09Å; S182-L187 PolarHBondContact O-N 3.35Å; S182-K191 WeakPolarHBondContact OG-CA 3.33Å; S182-K191 WeakPolarHBondContact OG-CB 3.46Å |
| 183 | E | 92.9 | Very high | 92.3 | Very high | 44 Ų | 44 | 31.6 Ų | 31.6 | 21% | 0.206 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -68.6 | -45.9 | 175 | -178.8 | 66.8 | 172.1 | 0 | 0 | 111.5 | L179 L180 V181 Y185 N186 K191 L235 A238 V239 | L179-E183 PolarHBondContact O-N 3.46Å; L180-E183 PolarHBondContact O-N 3.22Å; V181-E183 VanDerWaalsContact C-N 3.32Å; V181-E183 PolarHBondContact O-N 3.15Å; E183-Y185 VanDerWaalsContact C-N 3.33Å; E183-Y185 PolarHBondContact O-N 3.5Å; E183-N186 PolarHBondContact O-N 3.14Å; E183-K191 IonicContact OE1-NZ 3.53Å; E183-K191 WeakPolarHBondContact OE2-CD 3.44Å; E183-K191 WeakPolarHBondContact OE2-CE 3.32Å; E183-K191 IonicContact OE2-NZ 3.71Å; E183-K191 PolarHBondContact OE2-NZ 2.92Å; E183-L235 HydrophobicContact CB-CD1 3.68Å; E183-L235 HydrophobicContact CG-CD1 3.4Å; E183-L235 VanDerWaalsContact CG-CD1 3.4Å; E183-A238 WeakPolarHBondContact OE1-CB 3.48Å; E183-V239 HydrophobicContact CB-CG2 3.73Å; E183-V239 HydrophobicContact CG-CG2 3.96Å |
| 184 | K | 90.1 | Very high | 92.6 | Very high | 62 Ų | 62 | 29.6 Ų | 29.6 | 27% | 0.27 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -57.5 | -44 | -178.5 | -179.5 | -177.7 | 174.4 | -165.5 | 0 | 112.4 | L180 V181 L235 | L180-K184 WeakPolarHBondContact O-CB 3.24Å; L180-K184 PolarHBondContact O-N 3.25Å; V181-K184 PolarHBondContact O-N 2.51Å; K184-L235 HydrophobicContact CB-CD1 4.25Å |
| 185 | Y | 91.1 | Very high | 92.7 | Very high | 14 Ų | 14 | 26.6 Ų | 26.6 | 6% | 0.055 | 13% | 0.127 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.5 | 10 | -175.4 | -59.7 | -80.1 | 0 | 0 | 0 | 113.8 | V139 V142 E143 R154 V181 E183 | V139-Y185 HydrophobicContact CG1-CE2 4.26Å; V142-Y185 VanDerWaalsContact CG1-CB 3.45Å; V142-Y185 HydrophobicContact CG1-CD1 3.93Å; V142-Y185 HydrophobicContact CG1-CD2 3.82Å; V142-Y185 HydrophobicContact CG1-CG 3.47Å; V142-Y185 VanDerWaalsContact CG1-CG 3.47Å; E143-Y185 HydrophobicContact CB-CE1 3.7Å; E143-Y185 HydrophobicContact CG-CE1 3.98Å; E143-Y185 PolarHBondContact OE2-OH 3.42Å; R154-Y185 PolarHBondContact NH1-O 3.28Å; V181-Y185 HydrophobicContact CG1-CD2 3.72Å; V181-Y185 HydrophobicContact CG1-CE2 3.97Å; V181-Y185 WeakPolarHBondContact O-CD2 3.44Å; V181-Y185 PolarHBondContact O-N 3.09Å; E183-Y185 VanDerWaalsContact C-N 3.33Å; E183-Y185 PolarHBondContact O-N 3.5Å |
| 186 | N | 91.8 | Very high | 92.5 | Very high | 98 Ų | 98 | 27.9 Ų | 27.9 | 52% | 0.524 | 14% | 0.141 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.8 | 49.4 | -179.5 | -55.8 | -70.4 | 0 | 0 | 0 | 113.2 | S182 E183 E188 | S182-N186 CarbonylContact O-C 3.59Å; S182-N186 WeakPolarHBondContact O-CA 3.47Å; S182-N186 PolarHBondContact O-N 2.88Å; S182-N186 VanDerWaalsContact O-N 3.09Å; E183-N186 PolarHBondContact O-N 3.14Å; N186-E188 PolarHBondContact O-N 2.74Å |
| 187 | L | 93.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 15% | 0.149 | C | C | . | . | trans | -90.2 | 74.8 | 171.2 | -50.7 | 179.9 | 0 | 0 | 0 | 108.9 | F138 V142 R154 E158 S182 I189 L190 K191 | F138-L187 HydrophobicContact CZ-CD1 4.03Å; V142-L187 HydrophobicContact CG1-CD1 4.24Å; V142-L187 HydrophobicContact CG1-CD2 4.36Å; V142-L187 HydrophobicContact CG2-CD1 4.27Å; R154-L187 HydrophobicContact CG-CD2 3.96Å; E158-L187 HydrophobicContact CB-CD2 4.34Å; E158-L187 HydrophobicContact CG-CB 4.19Å; E158-L187 VanDerWaalsContact OE1-CA 3.24Å; E158-L187 WeakPolarHBondContact OE1-CA 3.21Å; S182-L187 PolarHBondContact O-N 3.35Å; L187-I189 VanDerWaalsContact C-N 3.35Å; L187-I189 PolarHBondContact O-N 2.74Å; L187-L190 HydrophobicContact CB-CB 3.99Å; L187-L190 HydrophobicContact CB-CD2 4.36Å; L187-L190 HydrophobicContact CD1-CD2 3.88Å; L187-L190 PolarHBondContact O-N 2.9Å; L187-K191 WeakPolarHBondContact O-CB 3.49Å; L187-K191 PolarHBondContact O-N 3.45Å | ||
| 188 | E | 92.9 | Very high | 92.3 | Very high | 132 Ų | 132 | 27 Ų | 27 | 62% | 0.617 | 14% | 0.137 | S | C | * | . | H | α-helix | trans | -58.2 | -39.7 | -171.3 | -63.6 | 177.6 | 171.5 | 0 | 0 | 114.3 | E158 N186 M192 | E158-E188 PolarHBondContact OE1-N 2.95Å; E158-E188 VanDerWaalsContact OE1-N 3.08Å; N186-E188 PolarHBondContact O-N 2.74Å; E188-M192 WeakPolarHBondContact O-CB 3.27Å; E188-M192 PolarHBondContact O-N 3Å |
| 189 | I | 93.4 | Very high | 92.2 | Very high | 17 Ų | 17 | 27.1 Ų | 27.1 | 9% | 0.087 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -74.2 | -41.9 | -177.4 | -52.1 | -46.3 | 0 | 0 | 0 | 109.4 | P36 Y39 L40 E158 L187 M192 V193 | P36-I189 HydrophobicContact CB-CG2 4.45Å; P36-I189 VanDerWaalsContact O-CG2 3.28Å; P36-I189 WeakPolarHBondContact O-CG2 3.49Å; Y39-I189 VanDerWaalsContact CB-CD1 3.41Å; Y39-I189 HydrophobicContact CG-CD1 4.23Å; L40-I189 HydrophobicContact CD1-CG2 4.41Å; L40-I189 HydrophobicContact CD2-CB 4.13Å; L40-I189 HydrophobicContact CD2-CG1 3.58Å; L40-I189 HydrophobicContact CG-CB 4.29Å; L40-I189 HydrophobicContact CG-CG1 3.94Å; L40-I189 HydrophobicContact CG-CG2 4.24Å; E158-I189 HydrophobicContact CG-CB 4.42Å; E158-I189 WeakPolarHBondContact OE1-CA 3.29Å; E158-I189 WeakPolarHBondContact OE1-CB 3.1Å; E158-I189 PolarHBondContact OE1-N 2.78Å; L187-I189 VanDerWaalsContact C-N 3.35Å; L187-I189 PolarHBondContact O-N 2.74Å; I189-M192 HydrophobicContact CG2-CE 4.24Å; I189-M192 WeakPolarHBondContact O-CB 3.22Å; I189-M192 PolarHBondContact O-N 3.42Å; I189-V193 WeakPolarHBondContact O-CG2 3.44Å; I189-V193 PolarHBondContact O-N 3.46Å |
| 190 | L | 94.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60.4 | -47.7 | 172.7 | 179.3 | 60.4 | 0 | 0 | 0 | 111 | F138 E158 I161 C162 V165 L178 L187 M192 V193 I194 | F138-L190 HydrophobicContact CZ-CD2 4.2Å; E158-L190 HydrophobicContact CG-CB 4.17Å; E158-L190 PolarHBondContact OE1-N 3.36Å; I161-L190 HydrophobicContact CG1-CD1 4.42Å; I161-L190 HydrophobicContact CG2-CD1 3.92Å; I161-L190 HydrophobicContact CG2-CD2 3.66Å; I161-L190 HydrophobicContact CG2-CG 4.28Å; C162-L190 VanDerWaalsContact SG-CA 3.53Å; V165-L190 HydrophobicContact CG2-CD1 4.28Å; L178-L190 HydrophobicContact CD2-CD2 4.33Å; L187-L190 HydrophobicContact CB-CB 3.99Å; L187-L190 HydrophobicContact CB-CD2 4.36Å; L187-L190 HydrophobicContact CD1-CD2 3.88Å; L187-L190 PolarHBondContact O-N 2.9Å; L190-M192 VanDerWaalsContact C-N 3.27Å; L190-M192 PolarHBondContact O-N 3.43Å; L190-V193 PolarHBondContact O-N 2.95Å; L190-V193 VanDerWaalsContact O-N 3.16Å; L190-I194 HydrophobicContact CD1-CD1 4.22Å; L190-I194 HydrophobicContact CD1-CG1 3.82Å; L190-I194 HydrophobicContact CG-CG1 4.19Å; L190-I194 VanDerWaalsContact O-CG1 3.27Å; L190-I194 WeakPolarHBondContact O-CG1 3.31Å; L190-I194 PolarHBondContact O-N 2.7Å |
| 191 | K | 94.8 | Very high | 91.4 | Very high | 29 Ų | 29 | 35.5 Ų | 35.5 | 13% | 0.126 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -55.2 | -44.5 | 177 | -176.1 | 179 | 175 | -169.9 | 0 | 111.4 | L179 S182 E183 L187 N195 D242 | L179-K191 HydrophobicContact CD1-CG 3.85Å; S182-K191 WeakPolarHBondContact OG-CA 3.33Å; S182-K191 WeakPolarHBondContact OG-CB 3.46Å; E183-K191 IonicContact OE1-NZ 3.53Å; E183-K191 WeakPolarHBondContact OE2-CD 3.44Å; E183-K191 WeakPolarHBondContact OE2-CE 3.32Å; E183-K191 IonicContact OE2-NZ 3.71Å; E183-K191 PolarHBondContact OE2-NZ 2.92Å; L187-K191 WeakPolarHBondContact O-CB 3.49Å; L187-K191 PolarHBondContact O-N 3.45Å; K191-N195 WeakPolarHBondContact O-CB 3.43Å; K191-N195 VanDerWaalsContact O-CG 3.27Å; K191-N195 PolarHBondContact O-N 2.76Å; K191-N195 PolarHBondContact O-ND2 3.28Å; K191-D242 WeakPolarHBondContact CE-OD2 3.1Å; K191-D242 IonicContact NZ-OD2 2.97Å; K191-D242 PolarHBondContact NZ-OD2 3.1Å |
| 192 | M | 91.8 | Very high | 91.1 | Very high | 61 Ų | 61 | 35.4 Ų | 35.4 | 30% | 0.3 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -60.9 | -47.8 | 177.1 | -179.9 | -175.5 | 67.5 | 0 | 0 | 112.1 | P36 Y39 E188 I189 L190 N195 G196 | P36-M192 HydrophobicContact CB-CE 4.01Å; Y39-M192 HydrophobicContact CD2-CE 3.8Å; Y39-M192 HydrophobicContact CE2-CE 3.93Å; Y39-M192 HydrophobicContact CE2-SD 4.48Å; E188-M192 WeakPolarHBondContact O-CB 3.27Å; E188-M192 PolarHBondContact O-N 3Å; I189-M192 HydrophobicContact CG2-CE 4.24Å; I189-M192 WeakPolarHBondContact O-CB 3.22Å; I189-M192 PolarHBondContact O-N 3.42Å; L190-M192 VanDerWaalsContact C-N 3.27Å; L190-M192 PolarHBondContact O-N 3.43Å; M192-N195 PolarHBondContact O-N 3.3Å; M192-G196 PolarHBondContact O-N 2.97Å |
| 193 | V | 91.4 | Very high | 90.6 | Very high | 20 Ų | 20 | 37.6 Ų | 37.6 | 12% | 0.121 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.2 | -46.2 | 180 | 175.4 | 0 | 0 | 0 | 0 | 111 | P36 V165 I166 I189 L190 G196 F197 | P36-V193 HydrophobicContact CB-CG2 3.53Å; P36-V193 HydrophobicContact CG-CG2 3.95Å; V165-V193 HydrophobicContact CG1-CG1 3.44Å; V165-V193 VanDerWaalsContact CG1-CG1 3.44Å; I166-V193 HydrophobicContact CG1-CG1 4.12Å; I189-V193 WeakPolarHBondContact O-CG2 3.44Å; I189-V193 PolarHBondContact O-N 3.46Å; L190-V193 PolarHBondContact O-N 2.95Å; L190-V193 VanDerWaalsContact O-N 3.16Å; V193-G196 PolarHBondContact O-N 3.45Å; V193-F197 PolarHBondContact O-N 2.92Å; V193-F197 VanDerWaalsContact O-N 3.07Å |
| 194 | I | 93.6 | Very high | 90 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.6 | -39.4 | 179.3 | -61.6 | -63.1 | 0 | 0 | 0 | 111.9 | V165 M170 A175 L178 L179 L190 G196 F197 L198 | V165-I194 HydrophobicContact CG1-CD1 3.92Å; V165-I194 HydrophobicContact CG2-CD1 3.91Å; M170-I194 HydrophobicContact CE-CD1 3.57Å; M170-I194 HydrophobicContact SD-CD1 3.84Å; A175-I194 HydrophobicContact CB-CG2 4.31Å; A175-I194 VanDerWaalsContact O-CG2 3.29Å; A175-I194 WeakPolarHBondContact O-CG2 3.45Å; L178-I194 HydrophobicContact CB-CD1 4.19Å; L178-I194 HydrophobicContact CB-CG1 4.29Å; L178-I194 HydrophobicContact CD1-CD1 4.06Å; L179-I194 HydrophobicContact CB-CG2 3.74Å; L179-I194 HydrophobicContact CD1-CB 4.32Å; L179-I194 HydrophobicContact CD1-CG2 4.07Å; L179-I194 HydrophobicContact CD2-CG2 4.39Å; L179-I194 HydrophobicContact CG-CG2 4.29Å; L190-I194 HydrophobicContact CD1-CD1 4.22Å; L190-I194 HydrophobicContact CD1-CG1 3.82Å; L190-I194 HydrophobicContact CG-CG1 4.19Å; L190-I194 VanDerWaalsContact O-CG1 3.27Å; L190-I194 WeakPolarHBondContact O-CG1 3.31Å; L190-I194 PolarHBondContact O-N 2.7Å; I194-G196 VanDerWaalsContact C-N 3.33Å; I194-G196 PolarHBondContact O-N 3.27Å; I194-F197 PolarHBondContact O-N 2.99Å; I194-L198 HydrophobicContact CG2-CD1 4.18Å; I194-L198 HydrophobicContact CG2-CG 4.39Å; I194-L198 PolarHBondContact O-N 2.95Å |
| 195 | N | 91.4 | Very high | 89.6 | Confident | 12 Ų | 12 | 39 Ų | 39 | 6% | 0.064 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60 | -43.9 | 174.1 | -85.9 | -26.7 | 0 | 0 | 0 | 111.5 | L179 K191 M192 L198 V199 L243 L246 | L179-N195 WeakPolarHBondContact CD1-OD1 3.05Å; K191-N195 WeakPolarHBondContact O-CB 3.43Å; K191-N195 VanDerWaalsContact O-CG 3.27Å; K191-N195 PolarHBondContact O-N 2.76Å; K191-N195 PolarHBondContact O-ND2 3.28Å; M192-N195 PolarHBondContact O-N 3.3Å; N195-L198 PolarHBondContact O-N 3.44Å; N195-V199 WeakPolarHBondContact O-CB 3.23Å; N195-V199 WeakPolarHBondContact O-CG2 3.32Å; N195-V199 PolarHBondContact O-N 2.94Å; N195-L243 HydrophobicContact CB-CD2 4.43Å; N195-L243 VanDerWaalsContact OD1-CD2 3.23Å; N195-L243 WeakPolarHBondContact OD1-CD2 3.4Å; N195-L246 HydrophobicContact CB-CD2 3.91Å |
| 196 | G | 89 | Confident | 88.4 | Confident | 27 Ų | 27 | 44.2 Ų | 44.2 | 28% | 0.278 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -57.1 | -52 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | M192 V193 I194 L198 V199 D200 | M192-G196 PolarHBondContact O-N 2.97Å; V193-G196 PolarHBondContact O-N 3.45Å; I194-G196 VanDerWaalsContact C-N 3.33Å; I194-G196 PolarHBondContact O-N 3.27Å; G196-L198 PolarHBondContact O-N 3.36Å; G196-V199 PolarHBondContact O-N 3.05Å; G196-D200 PolarHBondContact O-N 3.38Å |
| 197 | F | 89.6 | Confident | 88 | Confident | 49 Ų | 49 | 43.6 Ų | 43.6 | 22% | 0.215 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -55.3 | -48.8 | 178.9 | 176.3 | -99.5 | 0 | 0 | 0 | 113.2 | M170 A175 V193 I194 D200 Q201 | M170-F197 HydrophobicContact CB-CE1 4.22Å; M170-F197 HydrophobicContact CB-CE2 4.26Å; M170-F197 HydrophobicContact CB-CZ 3.85Å; M170-F197 WeakPolarHBondContact O-CZ 3.28Å; A175-F197 HydrophobicContact CB-CD1 3.77Å; A175-F197 HydrophobicContact CB-CE1 3.72Å; V193-F197 PolarHBondContact O-N 2.92Å; V193-F197 VanDerWaalsContact O-N 3.07Å; I194-F197 PolarHBondContact O-N 2.99Å; F197-D200 PolarHBondContact O-N 3.35Å; F197-Q201 PolarHBondContact O-N 3.28Å |
| 198 | L | 90.5 | Very high | 87.3 | Confident | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -69.8 | -35.3 | 179.8 | -69.8 | 179.3 | 0 | 0 | 0 | 112.6 | A175 K176 L179 I194 N195 G196 D200 Q201 I202 L243 | A175-L198 HydrophobicContact CB-CD2 3.91Å; A175-L198 HydrophobicContact CB-CG 4.36Å; K176-L198 HydrophobicContact CG-CD1 4.3Å; K176-L198 HydrophobicContact CG-CD2 4.38Å; L179-L198 HydrophobicContact CD2-CD1 3.62Å; I194-L198 HydrophobicContact CG2-CD1 4.18Å; I194-L198 HydrophobicContact CG2-CG 4.39Å; I194-L198 PolarHBondContact O-N 2.95Å; N195-L198 PolarHBondContact O-N 3.44Å; G196-L198 PolarHBondContact O-N 3.36Å; L198-D200 VanDerWaalsContact C-N 3.34Å; L198-Q201 PolarHBondContact O-N 2.97Å; L198-I202 WeakPolarHBondContact O-CD1 3.38Å; L198-I202 VanDerWaalsContact O-CG1 3.23Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 3.21Å; L198-L243 HydrophobicContact CB-CD2 4.03Å; L198-L243 HydrophobicContact CD1-CD1 4.36Å; L198-L243 HydrophobicContact CD1-CD2 4.39Å |
| 199 | V | 89.7 | Confident | 86.9 | Confident | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.012 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65 | -39.9 | 177.1 | 167.7 | 0 | 0 | 0 | 0 | 111.3 | N195 G196 Q201 I202 I203 L243 L246 T247 V250 | N195-V199 WeakPolarHBondContact O-CB 3.23Å; N195-V199 WeakPolarHBondContact O-CG2 3.32Å; N195-V199 PolarHBondContact O-N 2.94Å; G196-V199 PolarHBondContact O-N 3.05Å; V199-Q201 VanDerWaalsContact C-N 3.3Å; V199-Q201 PolarHBondContact O-N 3.34Å; V199-I202 PolarHBondContact O-N 2.86Å; V199-I203 HydrophobicContact CG1-CD1 3.59Å; V199-I203 HydrophobicContact CG1-CG1 4.23Å; V199-I203 WeakPolarHBondContact O-CB 3.33Å; V199-I203 VanDerWaalsContact O-CG1 3.32Å; V199-I203 WeakPolarHBondContact O-CG1 3.23Å; V199-I203 PolarHBondContact O-N 3.42Å; V199-L243 HydrophobicContact CG2-CD2 4.06Å; V199-L246 HydrophobicContact CB-CD2 4.42Å; V199-L246 HydrophobicContact CG1-CG 4.49Å; V199-L246 HydrophobicContact CG2-CB 4.09Å; V199-L246 HydrophobicContact CG2-CD2 3.81Å; V199-L246 HydrophobicContact CG2-CG 3.9Å; V199-T247 WeakPolarHBondContact CG2-OG1 3.23Å; V199-V250 HydrophobicContact CG1-CB 4.22Å; V199-V250 HydrophobicContact CG1-CG2 4.04Å |
| 200 | D | 85.2 | Confident | 86.5 | Confident | 110 Ų | 110 | 47.2 Ų | 47.2 | 59% | 0.588 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -60.7 | -41.1 | 175.5 | -72 | -20.3 | 0 | 0 | 0 | 111.3 | G196 F197 L198 I203 G204 | G196-D200 PolarHBondContact O-N 3.38Å; F197-D200 PolarHBondContact O-N 3.35Å; L198-D200 VanDerWaalsContact C-N 3.34Å; D200-I203 PolarHBondContact O-N 3.37Å; D200-G204 PolarHBondContact O-N 3.28Å |
| 201 | Q | 84.6 | Confident | 86.1 | Confident | 67 Ų | 67 | 49 Ų | 49 | 31% | 0.313 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 173.3 | -66.8 | -168.8 | 9.1 | 0 | 0 | 112.9 | F197 L198 V199 I203 G204 N205 | F197-Q201 PolarHBondContact O-N 3.28Å; L198-Q201 PolarHBondContact O-N 2.97Å; V199-Q201 VanDerWaalsContact C-N 3.3Å; V199-Q201 PolarHBondContact O-N 3.34Å; Q201-I203 VanDerWaalsContact C-N 3.3Å; Q201-I203 PolarHBondContact O-N 2.85Å; Q201-G204 PolarHBondContact O-N 2.94Å; Q201-N205 PolarHBondContact O-N 3.28Å |
| 202 | I | 86.4 | Confident | 85.7 | Confident | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.3 | -42.4 | 179 | -69.8 | 162.4 | 0 | 0 | 0 | 110.7 | L198 V199 N205 P208 E211 L212 I215 T247 | L198-I202 WeakPolarHBondContact O-CD1 3.38Å; L198-I202 VanDerWaalsContact O-CG1 3.23Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 3.21Å; V199-I202 PolarHBondContact O-N 2.86Å; I202-N205 PolarHBondContact O-N 2.9Å; I202-P208 HydrophobicContact CG2-CB 3.97Å; I202-P208 WeakPolarHBondContact O-CB 3.42Å; I202-P208 WeakPolarHBondContact O-CG 3.38Å; I202-E211 HydrophobicContact CG1-CG 4.09Å; I202-L212 HydrophobicContact CD1-CD1 4.21Å; I202-I215 HydrophobicContact CD1-CD1 3.57Å; I202-I215 HydrophobicContact CG1-CD1 3.41Å; I202-I215 VanDerWaalsContact CG1-CD1 3.41Å; I202-T247 HydrophobicContact CG2-CG2 3.83Å |
| 203 | I | 84.4 | Confident | 85.5 | Confident | 46 Ų | 46 | 49.6 Ų | 49.6 | 24% | 0.236 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -75.8 | -34.9 | -178.2 | -67.2 | 175.5 | 0 | 0 | 0 | 111.4 | V199 D200 Q201 N205 T247 V250 R251 | V199-I203 HydrophobicContact CG1-CD1 3.59Å; V199-I203 HydrophobicContact CG1-CG1 4.23Å; V199-I203 WeakPolarHBondContact O-CB 3.33Å; V199-I203 VanDerWaalsContact O-CG1 3.32Å; V199-I203 WeakPolarHBondContact O-CG1 3.23Å; V199-I203 PolarHBondContact O-N 3.42Å; D200-I203 PolarHBondContact O-N 3.37Å; Q201-I203 VanDerWaalsContact C-N 3.3Å; Q201-I203 PolarHBondContact O-N 2.85Å; I203-N205 PolarHBondContact O-N 3.41Å; I203-T247 HydrophobicContact CG1-CG2 4.23Å; I203-V250 HydrophobicContact CD1-CB 3.59Å; I203-V250 HydrophobicContact CD1-CG1 3.3Å; I203-R251 HydrophobicContact CD1-CG 4Å; I203-R251 HydrophobicContact CG1-CG 3.95Å |
| 204 | G | 80.2 | Confident | 85.3 | Confident | 70 Ų | 70 | 51.6 Ų | 51.6 | 72% | 0.722 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -63.1 | -18.3 | 173 | 0 | 0 | 0 | 0 | 0 | 113.6 | D200 Q201 | D200-G204 PolarHBondContact O-N 3.28Å; Q201-G204 PolarHBondContact O-N 2.94Å |
| 205 | N | 80.3 | Confident | 85 | Confident | 64 Ų | 64 | 51.7 Ų | 51.7 | 34% | 0.342 | 31% | 0.305 | S | S | . | . | S | Bend | trans | -81.9 | 148.7 | 179.8 | -157.4 | -34.4 | 0 | 0 | 0 | 112.6 | Q201 I202 I203 N207 P208 E211 | Q201-N205 PolarHBondContact O-N 3.28Å; I202-N205 PolarHBondContact O-N 2.9Å; I203-N205 PolarHBondContact O-N 3.41Å; N205-N207 VanDerWaalsContact C-N 3.29Å; N205-N207 PolarHBondContact O-N 2.91Å; N205-P208 WeakPolarHBondContact O-CD 3.28Å; N205-P208 VanDerWaalsContact O-CG 3.27Å; N205-P208 WeakPolarHBondContact O-CG 3.3Å; N205-E211 PolarHBondContact ND2-OE2 3.04Å |
| 206 | S | 66.9 | Low | 84.8 | Confident | 125 Ų | 125 | 52.5 Ų | 52.5 | 87% | 0.874 | 31% | 0.31 | S | S | * | . | S | Bend | trans | -68.3 | -24.5 | -177.2 | -39.1 | 0 | 0 | 0 | 0 | 113.8 | ||
| 207 | N | 82.7 | Confident | 84.8 | Confident | 84 Ų | 84 | 56.4 Ų | 56.4 | 45% | 0.449 | 32% | 0.321 | S | S | . | . | trans | -131.4 | 79.8 | 175.6 | -168.6 | -18 | 0 | 0 | 0 | 111.9 | N205 P209 K210 E211 | N205-N207 VanDerWaalsContact C-N 3.29Å; N205-N207 PolarHBondContact O-N 2.91Å; N207-P209 VanDerWaalsContact OD1-CD 3.31Å; N207-P209 WeakPolarHBondContact OD1-CD 3.36Å; N207-K210 HydrophobicContact CB-CB 4.15Å; N207-K210 PolarHBondContact O-N 3.2Å; N207-K210 VanDerWaalsContact O-N 3.12Å; N207-K210 PolarHBondContact OD1-N 3.29Å; N207-E211 PolarHBondContact O-N 2.92Å; N207-E211 VanDerWaalsContact O-N 3.15Å | ||
| 208 | P | 80.4 | Confident | 84.8 | Confident | 22 Ų | 22 | 57 Ų | 57 | 14% | 0.143 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.6 | -32.3 | -174.3 | -29 | 39.6 | 0 | 0 | 0 | 116.1 | I202 N205 L212 R251 | I202-P208 HydrophobicContact CG2-CB 3.97Å; I202-P208 WeakPolarHBondContact O-CB 3.42Å; I202-P208 WeakPolarHBondContact O-CG 3.38Å; N205-P208 WeakPolarHBondContact O-CD 3.28Å; N205-P208 VanDerWaalsContact O-CG 3.27Å; N205-P208 WeakPolarHBondContact O-CG 3.3Å; P208-L212 PolarHBondContact O-N 3.45Å; P208-R251 PolarHBondContact O-NH2 3.24Å |
| 209 | P | 82.9 | Confident | 84.8 | Confident | 73 Ų | 73 | 57 Ų | 57 | 47% | 0.474 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61.4 | -40.3 | 169.8 | -25.9 | 34.4 | 0 | 0 | 0 | 114.3 | N207 E211 L212 V213 | N207-P209 VanDerWaalsContact OD1-CD 3.31Å; N207-P209 WeakPolarHBondContact OD1-CD 3.36Å; P209-E211 VanDerWaalsContact C-N 3.35Å; P209-L212 PolarHBondContact O-N 2.93Å; P209-V213 PolarHBondContact O-N 2.91Å |
| 210 | K | 85.6 | Confident | 84.6 | Confident | 130 Ų | 130 | 60.9 Ų | 60.9 | 57% | 0.565 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -66.2 | -41.4 | 177.8 | -174.3 | -177.6 | 178.5 | -173.5 | 0 | 110.8 | N207 L212 V213 N214 | N207-K210 HydrophobicContact CB-CB 4.15Å; N207-K210 PolarHBondContact O-N 3.2Å; N207-K210 VanDerWaalsContact O-N 3.12Å; N207-K210 PolarHBondContact OD1-N 3.29Å; K210-L212 VanDerWaalsContact C-N 3.31Å; K210-L212 PolarHBondContact O-N 3.41Å; K210-V213 PolarHBondContact O-N 2.86Å; K210-N214 PolarHBondContact O-N 3.39Å; K210-N214 VanDerWaalsContact O-N 3.09Å |
| 211 | E | 86.1 | Confident | 84.7 | Confident | 38 Ų | 38 | 61.6 Ų | 61.6 | 18% | 0.178 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61 | -41.6 | 179 | -169.1 | 57.2 | -157.2 | 0 | 0 | 112.3 | I202 N205 N207 P209 V213 N214 I215 | I202-E211 HydrophobicContact CG1-CG 4.09Å; N205-E211 PolarHBondContact ND2-OE2 3.04Å; N207-E211 PolarHBondContact O-N 2.92Å; N207-E211 VanDerWaalsContact O-N 3.15Å; P209-E211 VanDerWaalsContact C-N 3.35Å; E211-V213 VanDerWaalsContact C-N 3.29Å; E211-V213 PolarHBondContact O-N 3.29Å; E211-N214 WeakPolarHBondContact O-CB 3.36Å; E211-N214 PolarHBondContact O-N 2.92Å; E211-N214 VanDerWaalsContact O-N 3.17Å; E211-I215 HydrophobicContact CG-CD1 4.12Å; E211-I215 WeakPolarHBondContact O-CG1 3.37Å; E211-I215 PolarHBondContact O-N 3.26Å |
| 212 | L | 86 | Confident | 84.9 | Confident | 24 Ų | 24 | 59.1 Ų | 59.1 | 13% | 0.126 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62 | -35.9 | 177.1 | -172.4 | 68 | 0 | 0 | 0 | 113 | I202 P208 P209 K210 T216 L243 Q244 | I202-L212 HydrophobicContact CD1-CD1 4.21Å; P208-L212 PolarHBondContact O-N 3.45Å; P209-L212 PolarHBondContact O-N 2.93Å; K210-L212 VanDerWaalsContact C-N 3.31Å; K210-L212 PolarHBondContact O-N 3.41Å; L212-T216 WeakPolarHBondContact O-CB 3.06Å; L212-T216 PolarHBondContact O-N 2.99Å; L212-T216 PolarHBondContact O-OG1 3.39Å; L212-L243 HydrophobicContact CD1-CB 4.33Å; L212-Q244 HydrophobicContact CD1-CG 4.04Å; L212-Q244 HydrophobicContact CD2-CB 4.41Å; L212-Q244 HydrophobicContact CD2-CG 3.36Å; L212-Q244 HydrophobicContact CG-CG 4.04Å |
| 213 | V | 87.5 | Confident | 84.8 | Confident | 78 Ų | 78 | 59.2 Ų | 59.2 | 47% | 0.473 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.7 | -43.5 | 174.4 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | P209 K210 E211 T216 H217 | P209-V213 PolarHBondContact O-N 2.91Å; K210-V213 PolarHBondContact O-N 2.86Å; E211-V213 VanDerWaalsContact C-N 3.29Å; E211-V213 PolarHBondContact O-N 3.29Å; V213-T216 WeakPolarHBondContact O-CB 3.37Å; V213-T216 PolarHBondContact O-N 2.79Å; V213-H217 PolarHBondContact O-CD2 3.12Å; V213-H217 VanDerWaalsContact O-CD2 3.25Å; V213-H217 PolarHBondContact O-N 3.43Å; V213-H217 VanDerWaalsContact O-N 3.09Å |
| 214 | N | 88.1 | Confident | 84.6 | Confident | 63 Ų | 63 | 62.9 Ų | 62.9 | 34% | 0.337 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -59.4 | -49.5 | 176 | -65.7 | -14.8 | 0 | 0 | 0 | 111.2 | K210 E211 T216 H217 E218 | K210-N214 PolarHBondContact O-N 3.39Å; K210-N214 VanDerWaalsContact O-N 3.09Å; E211-N214 WeakPolarHBondContact O-CB 3.36Å; E211-N214 PolarHBondContact O-N 2.92Å; E211-N214 VanDerWaalsContact O-N 3.17Å; N214-T216 VanDerWaalsContact C-N 3.25Å; N214-T216 PolarHBondContact O-N 3.44Å; N214-H217 PolarHBondContact O-N 2.84Å; N214-H217 VanDerWaalsContact O-N 3.14Å; N214-E218 WeakPolarHBondContact O-CG 3.27Å; N214-E218 PolarHBondContact O-N 2.98Å |
| 215 | I | 87.8 | Confident | 84.5 | Confident | 2 Ų | 2 | 65.1 Ų | 65.1 | 1% | 0.01 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -58.5 | -39.6 | 177.3 | -68.4 | 171.2 | 0 | 0 | 0 | 111 | I202 E211 E218 L219 L243 | I202-I215 HydrophobicContact CD1-CD1 3.57Å; I202-I215 HydrophobicContact CG1-CD1 3.41Å; I202-I215 VanDerWaalsContact CG1-CD1 3.41Å; E211-I215 HydrophobicContact CG-CD1 4.12Å; E211-I215 WeakPolarHBondContact O-CG1 3.37Å; E211-I215 PolarHBondContact O-N 3.26Å; I215-E218 PolarHBondContact O-N 3.41Å; I215-L219 HydrophobicContact CG2-CD1 3.73Å; I215-L219 HydrophobicContact CG2-CG 4.15Å; I215-L219 WeakPolarHBondContact O-CB 3.18Å; I215-L219 WeakPolarHBondContact O-CG 3.5Å; I215-L219 PolarHBondContact O-N 3.45Å; I215-L243 HydrophobicContact CG2-CD1 4.13Å |
| 216 | T | 87.5 | Confident | 84.2 | Confident | 28 Ų | 28 | 64.1 Ų | 64.1 | 17% | 0.172 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.2 | -47.2 | 176.7 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | L212 V213 N214 L219 Q220 V240 | L212-T216 WeakPolarHBondContact O-CB 3.06Å; L212-T216 PolarHBondContact O-N 2.99Å; L212-T216 PolarHBondContact O-OG1 3.39Å; V213-T216 WeakPolarHBondContact O-CB 3.37Å; V213-T216 PolarHBondContact O-N 2.79Å; N214-T216 VanDerWaalsContact C-N 3.25Å; N214-T216 PolarHBondContact O-N 3.44Å; T216-L219 PolarHBondContact O-N 3.43Å; T216-Q220 WeakPolarHBondContact O-CG 3.36Å; T216-Q220 PolarHBondContact O-N 3.14Å; T216-V240 HydrophobicContact CG2-CG1 4.39Å; T216-V240 HydrophobicContact CG2-CG2 4Å |
| 217 | H | 88.7 | Confident | 84.1 | Confident | 110 Ų | 110 | 61.9 Ų | 61.9 | 51% | 0.509 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 178.2 | -72.3 | -53.2 | 0 | 0 | 0 | 112.7 | V213 N214 Q220 Q221 | V213-H217 PolarHBondContact O-CD2 3.12Å; V213-H217 VanDerWaalsContact O-CD2 3.25Å; V213-H217 PolarHBondContact O-N 3.43Å; V213-H217 VanDerWaalsContact O-N 3.09Å; N214-H217 PolarHBondContact O-N 2.84Å; N214-H217 VanDerWaalsContact O-N 3.14Å; H217-Q220 PolarHBondContact ND1-OE1 3.03Å; H217-Q220 WeakPolarHBondContact O-CB 3.38Å; H217-Q220 PolarHBondContact O-N 3.33Å; H217-Q221 PolarHBondContact O-N 3.26Å |
| 218 | E | 89.8 | Confident | 82.8 | Confident | 61 Ų | 61 | 66.6 Ų | 66.6 | 29% | 0.285 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -64.2 | -41.4 | 176.1 | -73.7 | -179.6 | -126.3 | 0 | 0 | 112.2 | K176 N214 I215 Q220 Q221 M222 | K176-E218 HydrophobicContact CD-CB 4.27Å; K176-E218 WeakPolarHBondContact CD-OE2 3.33Å; K176-E218 IonicContact NZ-OE1 3.9Å; K176-E218 PolarHBondContact NZ-OE1 3.01Å; K176-E218 IonicContact NZ-OE2 3.66Å; K176-E218 PolarHBondContact NZ-OE2 2.95Å; N214-E218 WeakPolarHBondContact O-CG 3.27Å; N214-E218 PolarHBondContact O-N 2.98Å; I215-E218 PolarHBondContact O-N 3.41Å; E218-Q220 VanDerWaalsContact C-N 3.32Å; E218-Q220 PolarHBondContact O-N 3.02Å; E218-Q221 PolarHBondContact O-N 3.19Å; E218-M222 HydrophobicContact CB-CE 4.23Å; E218-M222 WeakPolarHBondContact O-CB 3.5Å; E218-M222 VanDerWaalsContact O-CG 3.29Å; E218-M222 WeakPolarHBondContact O-CG 3.35Å; E218-M222 PolarHBondContact O-N 3.42Å |
| 219 | L | 89.3 | Confident | 81.5 | Confident | 0 Ų | 0 | 71.9 Ų | 71.9 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.9 | -39 | 175.4 | -74.1 | 169.4 | 0 | 0 | 0 | 111.7 | K176 L180 I215 T216 A223 V236 V239 V240 L243 | K176-L219 HydrophobicContact CB-CD2 3.8Å; K176-L219 HydrophobicContact CG-CD2 4.23Å; L180-L219 HydrophobicContact CD1-CD2 4.01Å; L180-L219 HydrophobicContact CD2-CD2 3.97Å; L180-L219 HydrophobicContact CG-CD2 3.77Å; I215-L219 HydrophobicContact CG2-CD1 3.73Å; I215-L219 HydrophobicContact CG2-CG 4.15Å; I215-L219 WeakPolarHBondContact O-CB 3.18Å; I215-L219 WeakPolarHBondContact O-CG 3.5Å; I215-L219 PolarHBondContact O-N 3.45Å; T216-L219 PolarHBondContact O-N 3.43Å; L219-A223 WeakPolarHBondContact O-CB 3.4Å; L219-A223 PolarHBondContact O-N 3.26Å; L219-V236 HydrophobicContact CB-CG1 4Å; L219-V239 HydrophobicContact CD1-CG1 3.84Å; L219-V240 HydrophobicContact CD1-CG2 3.97Å; L219-L243 HydrophobicContact CD1-CD1 4.31Å |
| 220 | Q | 86.9 | Confident | 80.5 | Confident | 84 Ų | 84 | 75.8 Ų | 75.8 | 39% | 0.393 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.2 | -48.9 | 173.6 | -72.2 | 174.3 | -27 | 0 | 0 | 111 | T216 H217 E218 A223 H224 V236 | T216-Q220 WeakPolarHBondContact O-CG 3.36Å; T216-Q220 PolarHBondContact O-N 3.14Å; H217-Q220 PolarHBondContact ND1-OE1 3.03Å; H217-Q220 WeakPolarHBondContact O-CB 3.38Å; H217-Q220 PolarHBondContact O-N 3.33Å; E218-Q220 VanDerWaalsContact C-N 3.32Å; E218-Q220 PolarHBondContact O-N 3.02Å; Q220-A223 PolarHBondContact O-N 3.47Å; Q220-H224 PolarHBondContact O-CD2 3.24Å; Q220-H224 PolarHBondContact O-N 3.13Å; Q220-V236 HydrophobicContact CG-CG1 3.91Å |
| 221 | Q | 86.9 | Confident | 80 | Confident | 124 Ų | 124 | 74.8 Ų | 74.8 | 58% | 0.579 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.1 | -49.2 | 178.8 | -175.4 | 179.4 | -9.7 | 0 | 0 | 111.8 | H217 E218 A223 H224 E225 | H217-Q221 PolarHBondContact O-N 3.26Å; E218-Q221 PolarHBondContact O-N 3.19Å; Q221-A223 VanDerWaalsContact C-N 3.31Å; Q221-A223 PolarHBondContact O-N 2.99Å; Q221-H224 WeakPolarHBondContact O-CB 3.38Å; Q221-H224 PolarHBondContact O-N 3.23Å; Q221-H224 VanDerWaalsContact O-N 3.14Å; Q221-E225 PolarHBondContact O-N 3.23Å |
| 222 | M | 88.4 | Confident | 79.8 | Confident | 16 Ų | 16 | 74 Ų | 74 | 8% | 0.079 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.2 | -34.5 | 179.9 | -68.7 | 179.2 | -162.4 | 0 | 0 | 112.2 | S173 K176 K177 L180 E218 H224 E225 I226 | S173-M222 WeakPolarHBondContact OG-CE 3.36Å; K176-M222 HydrophobicContact CB-CE 4.36Å; K176-M222 HydrophobicContact CB-SD 3.71Å; K176-M222 HydrophobicContact CD-CE 4.22Å; K177-M222 HydrophobicContact CG-CB 4.46Å; K177-M222 HydrophobicContact CG-CG 4.37Å; K177-M222 HydrophobicContact CG-SD 3.72Å; L180-M222 HydrophobicContact CD1-CB 3.95Å; E218-M222 HydrophobicContact CB-CE 4.23Å; E218-M222 WeakPolarHBondContact O-CB 3.5Å; E218-M222 VanDerWaalsContact O-CG 3.29Å; E218-M222 WeakPolarHBondContact O-CG 3.35Å; E218-M222 PolarHBondContact O-N 3.42Å; M222-H224 PolarHBondContact O-N 3.14Å; M222-E225 WeakPolarHBondContact O-CB 3.38Å; M222-E225 PolarHBondContact O-N 2.93Å; M222-I226 VanDerWaalsContact O-CG1 3.27Å; M222-I226 WeakPolarHBondContact O-CG1 3.47Å; M222-I226 PolarHBondContact O-N 3.43Å |
| 223 | A | 83.4 | Confident | 79.7 | Confident | 2 Ų | 2 | 81 Ų | 81 | 2% | 0.017 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.6 | -31.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | L180 L219 Q220 Q221 R227 I232 V236 | L180-A223 HydrophobicContact CD1-CB 3.93Å; L180-A223 HydrophobicContact CD2-CB 4.31Å; L219-A223 WeakPolarHBondContact O-CB 3.4Å; L219-A223 PolarHBondContact O-N 3.26Å; Q220-A223 PolarHBondContact O-N 3.47Å; Q221-A223 VanDerWaalsContact C-N 3.31Å; Q221-A223 PolarHBondContact O-N 2.99Å; A223-R227 WeakPolarHBondContact O-CB 3.41Å; A223-R227 PolarHBondContact O-N 3.05Å; A223-I232 HydrophobicContact CB-CG2 3.62Å; A223-V236 HydrophobicContact CB-CG2 3.65Å |
| 224 | H | 81.8 | Confident | 79.7 | Confident | 123 Ų | 123 | 82.4 Ų | 82.4 | 57% | 0.569 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -71.3 | -27.2 | 170.7 | -72.7 | -64.2 | 0 | 0 | 0 | 113.3 | Q220 Q221 M222 I232 | Q220-H224 PolarHBondContact O-CD2 3.24Å; Q220-H224 PolarHBondContact O-N 3.13Å; Q221-H224 WeakPolarHBondContact O-CB 3.38Å; Q221-H224 PolarHBondContact O-N 3.23Å; Q221-H224 VanDerWaalsContact O-N 3.14Å; M222-H224 PolarHBondContact O-N 3.14Å; H224-I232 VanDerWaalsContact ND1-CD1 3.29Å; H224-I232 WeakPolarHBondContact ND1-CD1 3.23Å |
| 225 | E | 77.8 | Confident | 79.7 | Confident | 117 Ų | 117 | 80.7 Ų | 80.7 | 55% | 0.547 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -77.3 | -31.5 | 174.3 | -65.9 | 172.7 | -170.2 | 0 | 0 | 112 | K177 Q221 M222 | K177-E225 IonicContact NZ-OE2 3.27Å; Q221-E225 PolarHBondContact O-N 3.23Å; M222-E225 WeakPolarHBondContact O-CB 3.38Å; M222-E225 PolarHBondContact O-N 2.93Å |
| 226 | I | 73.1 | Confident | 79.7 | Confident | 42 Ų | 42 | 80.8 Ų | 80.8 | 22% | 0.215 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -83.6 | -12.2 | -179.8 | -63 | 165 | 0 | 0 | 0 | 111.7 | K177 L180 M222 | K177-I226 HydrophobicContact CB-CD1 4.2Å; K177-I226 HydrophobicContact CG-CD1 4.21Å; L180-I226 HydrophobicContact CB-CD1 4.22Å; L180-I226 HydrophobicContact CD1-CD1 3.9Å; M222-I226 VanDerWaalsContact O-CG1 3.27Å; M222-I226 WeakPolarHBondContact O-CG1 3.47Å; M222-I226 PolarHBondContact O-N 3.43Å |
| 227 | R | 64.8 | Low | 79.7 | Confident | 78 Ų | 78 | 81 Ų | 81 | 29% | 0.294 | 40% | 0.397 | S | S | . | . | trans | -138.2 | 147.3 | -175.8 | -98.7 | -177.1 | 170.9 | -94.1 | 10 | 114 | A223 N229 E230 I232 | A223-R227 WeakPolarHBondContact O-CB 3.41Å; A223-R227 PolarHBondContact O-N 3.05Å; R227-N229 PolarHBondContact NH1-O 3.3Å; R227-E230 PolarHBondContact NH1-O 3.18Å; R227-E230 PolarHBondContact NH2-O 3.38Å; R227-I232 HydrophobicContact CB-CD1 4.06Å; R227-I232 HydrophobicContact CB-CG1 4.26Å | ||
| 228 | E | 55.9 | Low | 79.8 | Confident | 183 Ų | 183 | 77.3 Ų | 77.3 | 86% | 0.855 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -93.9 | -35.3 | 164.2 | -77.8 | -167.8 | 152.5 | 0 | 0 | 115.7 | ||
| 229 | N | 53.4 | Low | 79.9 | Confident | 134 Ų | 134 | 74.4 Ų | 74.4 | 72% | 0.717 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -162.3 | 138 | 180 | -86.1 | -51.7 | 0 | 0 | 0 | 114.3 | R227 | R227-N229 PolarHBondContact NH1-O 3.3Š|
| 230 | E | 60.8 | Low | 80 | Confident | 154 Ų | 154 | 75 Ų | 75 | 72% | 0.72 | 38% | 0.376 | S | S | * | . | S | Bend | trans | 90.8 | 123.9 | 168.1 | -54.1 | -172 | 174.2 | 0 | 0 | 120 | R227 | R227-E230 PolarHBondContact NH1-O 3.18Å; R227-E230 PolarHBondContact NH2-O 3.38Å |
| 231 | N | 76.4 | Confident | 80.2 | Confident | 109 Ų | 109 | 74.7 Ų | 74.7 | 58% | 0.583 | 38% | 0.38 | S | S | * | . | trans | 68.1 | 25.4 | 172.6 | -69.5 | -24.1 | 0 | 0 | 0 | 118.8 | E233 N234 L235 | N231-E233 VanDerWaalsContact C-N 3.33Å; N231-E233 PolarHBondContact O-N 3.26Å; N231-N234 HydrophobicContact CB-CB 4.44Å; N231-N234 PolarHBondContact O-N 3.01Å; N231-N234 PolarHBondContact OD1-ND2 3.34Å; N231-L235 PolarHBondContact O-N 2.92Å; N231-L235 VanDerWaalsContact O-N 3.1Å | ||
| 232 | I | 81.7 | Confident | 80.4 | Confident | 22 Ų | 22 | 71.4 Ų | 71.4 | 11% | 0.113 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -57.9 | -44 | 173.2 | -68.6 | 172.5 | 0 | 0 | 0 | 111.9 | A223 H224 R227 N234 L235 V236 | A223-I232 HydrophobicContact CB-CG2 3.62Å; H224-I232 VanDerWaalsContact ND1-CD1 3.29Å; H224-I232 WeakPolarHBondContact ND1-CD1 3.23Å; R227-I232 HydrophobicContact CB-CD1 4.06Å; R227-I232 HydrophobicContact CB-CG1 4.26Å; I232-N234 VanDerWaalsContact C-N 3.33Å; I232-N234 PolarHBondContact O-N 3.31Å; I232-L235 PolarHBondContact O-N 3.35Å; I232-V236 HydrophobicContact CG2-CG2 4.14Å; I232-V236 WeakPolarHBondContact O-CG2 3.37Å; I232-V236 PolarHBondContact O-N 3.25Å |
| 233 | E | 83.8 | Confident | 80.6 | Confident | 170 Ų | 170 | 70.7 Ų | 70.7 | 79% | 0.794 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -61.3 | -41.1 | -179.2 | -66.6 | -175.5 | 170.4 | 0 | 0 | 112.4 | N231 G237 | N231-E233 VanDerWaalsContact C-N 3.33Å; N231-E233 PolarHBondContact O-N 3.26Å; E233-G237 WeakPolarHBondContact O-CA 3.24Å; E233-G237 PolarHBondContact O-N 3.1Å |
| 234 | N | 86.7 | Confident | 80.9 | Confident | 109 Ų | 109 | 73.6 Ų | 73.6 | 58% | 0.583 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -66.9 | -43.1 | 177.5 | -69.9 | -22.7 | 0 | 0 | 0 | 111.3 | N231 I232 G237 A238 | N231-N234 HydrophobicContact CB-CB 4.44Å; N231-N234 PolarHBondContact O-N 3.01Å; N231-N234 PolarHBondContact OD1-ND2 3.34Å; I232-N234 VanDerWaalsContact C-N 3.33Å; I232-N234 PolarHBondContact O-N 3.31Å; N234-G237 PolarHBondContact O-N 3.47Å; N234-A238 WeakPolarHBondContact O-CB 3.4Å; N234-A238 PolarHBondContact O-N 3.19Å |
| 235 | L | 88.3 | Confident | 81.3 | Confident | 27 Ų | 27 | 71.7 Ų | 71.7 | 14% | 0.141 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.5 | -53.1 | 178.1 | 179 | 66.9 | 0 | 0 | 0 | 111.4 | L180 E183 K184 N231 I232 G237 A238 V239 | L180-L235 HydrophobicContact CD2-CD2 4.34Å; L180-L235 HydrophobicContact CD2-CG 4.29Å; E183-L235 HydrophobicContact CB-CD1 3.68Å; E183-L235 HydrophobicContact CG-CD1 3.4Å; E183-L235 VanDerWaalsContact CG-CD1 3.4Å; K184-L235 HydrophobicContact CB-CD1 4.25Å; N231-L235 PolarHBondContact O-N 2.92Å; N231-L235 VanDerWaalsContact O-N 3.1Å; I232-L235 PolarHBondContact O-N 3.35Å; L235-G237 VanDerWaalsContact C-N 3.34Å; L235-A238 PolarHBondContact O-N 3.39Å; L235-V239 WeakPolarHBondContact O-CG2 3.18Å; L235-V239 PolarHBondContact O-N 2.85Å |
| 236 | V | 88.5 | Confident | 81.9 | Confident | 4 Ų | 4 | 68.8 Ų | 68.8 | 2% | 0.024 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -66.1 | -40.6 | 180 | 177.3 | 0 | 0 | 0 | 0 | 110.3 | L180 L219 Q220 A223 I232 A238 V239 V240 | L180-V236 HydrophobicContact CD2-CG2 4.04Å; L219-V236 HydrophobicContact CB-CG1 4Å; Q220-V236 HydrophobicContact CG-CG1 3.91Å; A223-V236 HydrophobicContact CB-CG2 3.65Å; I232-V236 HydrophobicContact CG2-CG2 4.14Å; I232-V236 WeakPolarHBondContact O-CG2 3.37Å; I232-V236 PolarHBondContact O-N 3.25Å; V236-A238 PolarHBondContact O-N 3.05Å; V236-V239 PolarHBondContact O-N 2.88Å; V236-V240 HydrophobicContact CG1-CG2 3.92Å; V236-V240 WeakPolarHBondContact O-CB 3.07Å; V236-V240 WeakPolarHBondContact O-CG2 3.4Å; V236-V240 PolarHBondContact O-N 3.4Å |
| 237 | G | 88.3 | Confident | 82.5 | Confident | 32 Ų | 32 | 66.9 Ų | 66.9 | 33% | 0.33 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -58.9 | -43.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | E233 N234 L235 T241 | E233-G237 WeakPolarHBondContact O-CA 3.24Å; E233-G237 PolarHBondContact O-N 3.1Å; N234-G237 PolarHBondContact O-N 3.47Å; L235-G237 VanDerWaalsContact C-N 3.34Å; G237-T241 WeakPolarHBondContact O-CB 3.47Å; G237-T241 PolarHBondContact O-N 2.86Å; G237-T241 PolarHBondContact O-OG1 3.37Å |
| 238 | A | 89.4 | Confident | 83.6 | Confident | 32 Ų | 32 | 70.4 Ų | 70.4 | 26% | 0.264 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.7 | -50.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | E183 N234 L235 V236 V240 T241 D242 | E183-A238 WeakPolarHBondContact OE1-CB 3.48Å; N234-A238 WeakPolarHBondContact O-CB 3.4Å; N234-A238 PolarHBondContact O-N 3.19Å; L235-A238 PolarHBondContact O-N 3.39Å; V236-A238 PolarHBondContact O-N 3.05Å; A238-V240 PolarHBondContact O-N 3.49Å; A238-T241 PolarHBondContact O-N 2.8Å; A238-D242 PolarHBondContact O-N 3.24Å; A238-D242 VanDerWaalsContact O-N 3.09Å |
| 239 | V | 91.7 | Very high | 85 | Confident | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.4 | -47.1 | 178 | 168.6 | 0 | 0 | 0 | 0 | 112.2 | L179 E183 L219 L235 V236 T241 D242 L243 | L179-V239 HydrophobicContact CD1-CG1 4.32Å; L179-V239 HydrophobicContact CD2-CG1 3.25Å; L179-V239 HydrophobicContact CG-CB 4.49Å; L179-V239 HydrophobicContact CG-CG1 3.45Å; L179-V239 VanDerWaalsContact CG-CG1 3.45Å; L179-V239 HydrophobicContact CG-CG2 4.22Å; E183-V239 HydrophobicContact CB-CG2 3.73Å; E183-V239 HydrophobicContact CG-CG2 3.96Å; L219-V239 HydrophobicContact CD1-CG1 3.84Å; L235-V239 WeakPolarHBondContact O-CG2 3.18Å; L235-V239 PolarHBondContact O-N 2.85Å; V236-V239 PolarHBondContact O-N 2.88Å; V239-T241 VanDerWaalsContact C-N 3.32Å; V239-T241 PolarHBondContact O-N 3.44Å; V239-D242 PolarHBondContact O-N 3.32Å; V239-L243 HydrophobicContact CG1-CD1 4.19Å; V239-L243 PolarHBondContact O-N 2.95Å |
| 240 | V | 91.4 | Very high | 86.4 | Confident | 12 Ų | 12 | 63.9 Ų | 63.9 | 7% | 0.073 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -66.4 | -37.4 | -178.8 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | T216 L219 V236 A238 L243 Q244 | T216-V240 HydrophobicContact CG2-CG1 4.39Å; T216-V240 HydrophobicContact CG2-CG2 4Å; L219-V240 HydrophobicContact CD1-CG2 3.97Å; V236-V240 HydrophobicContact CG1-CG2 3.92Å; V236-V240 WeakPolarHBondContact O-CB 3.07Å; V236-V240 WeakPolarHBondContact O-CG2 3.4Å; V236-V240 PolarHBondContact O-N 3.4Å; A238-V240 PolarHBondContact O-N 3.49Å; V240-L243 PolarHBondContact O-N 3.4Å; V240-Q244 HydrophobicContact CG1-CG 4.32Å; V240-Q244 VanDerWaalsContact O-CB 3.3Å; V240-Q244 WeakPolarHBondContact O-CB 3.32Å; V240-Q244 WeakPolarHBondContact O-CG 3.25Å; V240-Q244 PolarHBondContact O-N 3.39Å |
| 241 | T | 92.2 | Very high | 87.2 | Confident | 78 Ų | 78 | 59.2 Ų | 59.2 | 48% | 0.479 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | 176.5 | -61 | 0 | 0 | 0 | 0 | 111 | G237 A238 V239 Q244 E245 | G237-T241 WeakPolarHBondContact O-CB 3.47Å; G237-T241 PolarHBondContact O-N 2.86Å; G237-T241 PolarHBondContact O-OG1 3.37Å; A238-T241 PolarHBondContact O-N 2.8Å; V239-T241 VanDerWaalsContact C-N 3.32Å; V239-T241 PolarHBondContact O-N 3.44Å; T241-Q244 WeakPolarHBondContact O-CB 3.44Å; T241-Q244 PolarHBondContact O-N 3.47Å; T241-E245 WeakPolarHBondContact O-CB 3.32Å; T241-E245 PolarHBondContact O-N 2.98Å |
| 242 | D | 91.4 | Very high | 87.2 | Confident | 55 Ų | 55 | 61.8 Ų | 61.8 | 29% | 0.294 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65 | -44.2 | 178.2 | -72.1 | -8.1 | 0 | 0 | 0 | 112.1 | K191 A238 V239 Q244 E245 L246 | K191-D242 WeakPolarHBondContact CE-OD2 3.1Å; K191-D242 IonicContact NZ-OD2 2.97Å; K191-D242 PolarHBondContact NZ-OD2 3.1Å; A238-D242 PolarHBondContact O-N 3.24Å; A238-D242 VanDerWaalsContact O-N 3.09Å; V239-D242 PolarHBondContact O-N 3.32Å; D242-Q244 VanDerWaalsContact C-N 3.34Å; D242-Q244 PolarHBondContact O-N 3.4Å; D242-E245 PolarHBondContact O-N 3.42Å; D242-L246 VanDerWaalsContact O-CB 3.3Å; D242-L246 WeakPolarHBondContact O-CB 3.42Å; D242-L246 PolarHBondContact O-N 2.98Å |
| 243 | L | 91.5 | Very high | 86.5 | Confident | 1 Ų | 1 | 65.6 Ų | 65.6 | 1% | 0.005 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 175 | -77.7 | 175.1 | 0 | 0 | 0 | 111.7 | L179 N195 L198 V199 L212 I215 L219 V239 V240 T247 | L179-L243 HydrophobicContact CD2-CD1 3.84Å; L179-L243 HydrophobicContact CD2-CD2 4.42Å; L179-L243 HydrophobicContact CD2-CG 4.23Å; N195-L243 HydrophobicContact CB-CD2 4.43Å; N195-L243 VanDerWaalsContact OD1-CD2 3.23Å; N195-L243 WeakPolarHBondContact OD1-CD2 3.4Å; L198-L243 HydrophobicContact CB-CD2 4.03Å; L198-L243 HydrophobicContact CD1-CD1 4.36Å; L198-L243 HydrophobicContact CD1-CD2 4.39Å; V199-L243 HydrophobicContact CG2-CD2 4.06Å; L212-L243 HydrophobicContact CD1-CB 4.33Å; I215-L243 HydrophobicContact CG2-CD1 4.13Å; L219-L243 HydrophobicContact CD1-CD1 4.31Å; V239-L243 HydrophobicContact CG1-CD1 4.19Å; V239-L243 PolarHBondContact O-N 2.95Å; V240-L243 PolarHBondContact O-N 3.4Å; L243-T247 WeakPolarHBondContact O-CB 3.5Å; L243-T247 PolarHBondContact O-N 2.95Å; L243-T247 PolarHBondContact O-OG1 3.46Å |
| 244 | Q | 90.1 | Very high | 85.3 | Confident | 64 Ų | 64 | 60.1 Ų | 60.1 | 30% | 0.299 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 176.7 | -82.7 | 179.4 | 16.7 | 0 | 0 | 112 | L212 V240 T241 D242 R248 | L212-Q244 HydrophobicContact CD1-CG 4.04Å; L212-Q244 HydrophobicContact CD2-CB 4.41Å; L212-Q244 HydrophobicContact CD2-CG 3.36Å; L212-Q244 HydrophobicContact CG-CG 4.04Å; V240-Q244 HydrophobicContact CG1-CG 4.32Å; V240-Q244 VanDerWaalsContact O-CB 3.3Å; V240-Q244 WeakPolarHBondContact O-CB 3.32Å; V240-Q244 WeakPolarHBondContact O-CG 3.25Å; V240-Q244 PolarHBondContact O-N 3.39Å; T241-Q244 WeakPolarHBondContact O-CB 3.44Å; T241-Q244 PolarHBondContact O-N 3.47Å; D242-Q244 VanDerWaalsContact C-N 3.34Å; D242-Q244 PolarHBondContact O-N 3.4Å; Q244-R248 WeakPolarHBondContact O-CB 3.45Å; Q244-R248 WeakPolarHBondContact O-CG 3.34Å; Q244-R248 PolarHBondContact O-N 3.08Å |
| 245 | E | 90.8 | Very high | 83.7 | Confident | 83 Ų | 83 | 59.9 Ų | 59.9 | 39% | 0.388 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66.3 | -48.7 | -179.1 | 179.2 | 161.5 | -153.4 | 0 | 0 | 111.3 | T241 D242 T247 R248 R249 | T241-E245 WeakPolarHBondContact O-CB 3.32Å; T241-E245 PolarHBondContact O-N 2.98Å; D242-E245 PolarHBondContact O-N 3.42Å; E245-T247 PolarHBondContact O-N 3.38Å; E245-R248 PolarHBondContact O-N 3.13Å; E245-R249 HydrophobicContact CG-CG 4.48Å; E245-R249 WeakPolarHBondContact O-CG 3.31Å; E245-R249 PolarHBondContact O-N 2.86Å; E245-R249 IonicContact OE1-CZ 3.18Å; E245-R249 VanDerWaalsContact OE1-CZ 3.27Å; E245-R249 IonicContact OE1-NE 3.88Å; E245-R249 PolarHBondContact OE1-NE 2.87Å; E245-R249 IonicContact OE1-NH2 3.7Å; E245-R249 PolarHBondContact OE1-NH2 3.12Å; E245-R249 IonicContact OE2-NH2 3.12Å |
| 246 | L | 89 | Confident | 81.8 | Confident | 55 Ų | 55 | 62.9 Ų | 62.9 | 29% | 0.288 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 179.3 | -174.6 | 59.6 | 0 | 0 | 0 | 110.9 | N195 V199 D242 R248 R249 V250 | N195-L246 HydrophobicContact CB-CD2 3.91Å; V199-L246 HydrophobicContact CB-CD2 4.42Å; V199-L246 HydrophobicContact CG1-CG 4.49Å; V199-L246 HydrophobicContact CG2-CB 4.09Å; V199-L246 HydrophobicContact CG2-CD2 3.81Å; V199-L246 HydrophobicContact CG2-CG 3.9Å; D242-L246 VanDerWaalsContact O-CB 3.3Å; D242-L246 WeakPolarHBondContact O-CB 3.42Å; D242-L246 PolarHBondContact O-N 2.98Å; L246-R248 VanDerWaalsContact C-N 3.32Å; L246-R248 PolarHBondContact O-N 3.22Å; L246-R249 PolarHBondContact O-N 3.35Å; L246-V250 HydrophobicContact CD1-CG2 4.18Å; L246-V250 HydrophobicContact CG-CG2 4.39Å; L246-V250 WeakPolarHBondContact O-CG2 3.17Å; L246-V250 PolarHBondContact O-N 2.86Å |
| 247 | T | 86.9 | Confident | 79.7 | Confident | 2 Ų | 2 | 67.8 Ų | 67.8 | 1% | 0.012 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57.1 | -44.4 | 175.3 | -58.2 | 0 | 0 | 0 | 0 | 111.7 | V199 I202 I203 L243 E245 R249 R251 | V199-T247 WeakPolarHBondContact CG2-OG1 3.23Å; I202-T247 HydrophobicContact CG2-CG2 3.83Å; I203-T247 HydrophobicContact CG1-CG2 4.23Å; L243-T247 WeakPolarHBondContact O-CB 3.5Å; L243-T247 PolarHBondContact O-N 2.95Å; L243-T247 PolarHBondContact O-OG1 3.46Å; E245-T247 PolarHBondContact O-N 3.38Å; T247-R249 VanDerWaalsContact C-N 3.33Å; T247-R249 PolarHBondContact O-N 3.23Å; T247-R251 HydrophobicContact CG2-CG 4.37Å; T247-R251 WeakPolarHBondContact O-CB 3.26Å; T247-R251 WeakPolarHBondContact O-CG 3.5Å; T247-R251 PolarHBondContact O-N 3.48Å |
| 248 | R | 86.6 | Confident | 77.3 | Confident | 153 Ų | 153 | 69.8 Ų | 69.8 | 58% | 0.577 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -63.9 | -36.6 | 176.3 | -83.3 | -165.8 | -167.8 | 99.9 | -3.4 | 112.6 | Q244 E245 L246 R252 | Q244-R248 WeakPolarHBondContact O-CB 3.45Å; Q244-R248 WeakPolarHBondContact O-CG 3.34Å; Q244-R248 PolarHBondContact O-N 3.08Å; E245-R248 PolarHBondContact O-N 3.13Å; L246-R248 VanDerWaalsContact C-N 3.32Å; L246-R248 PolarHBondContact O-N 3.22Å; R248-R252 WeakPolarHBondContact O-CB 3.44Å; R248-R252 WeakPolarHBondContact O-CG 3.18Å; R248-R252 PolarHBondContact O-N 2.53Å; R248-R252 PolarHBondContact O-NE 3.35Å |
| 249 | R | 85.9 | Confident | 74.9 | Confident | 134 Ų | 134 | 73 Ų | 73 | 51% | 0.506 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -69.5 | -49.8 | 178.8 | -72.1 | 176.2 | -174.8 | -175.7 | 2.1 | 110.4 | E245 L246 T247 R252 V253 | E245-R249 HydrophobicContact CG-CG 4.48Å; E245-R249 WeakPolarHBondContact O-CG 3.31Å; E245-R249 PolarHBondContact O-N 2.86Å; E245-R249 IonicContact OE1-CZ 3.18Å; E245-R249 VanDerWaalsContact OE1-CZ 3.27Å; E245-R249 IonicContact OE1-NE 3.88Å; E245-R249 PolarHBondContact OE1-NE 2.87Å; E245-R249 IonicContact OE1-NH2 3.7Å; E245-R249 PolarHBondContact OE1-NH2 3.12Å; E245-R249 IonicContact OE2-NH2 3.12Å; L246-R249 PolarHBondContact O-N 3.35Å; T247-R249 VanDerWaalsContact C-N 3.33Å; T247-R249 PolarHBondContact O-N 3.23Å; R249-R252 PolarHBondContact O-N 2.89Å; R249-V253 PolarHBondContact O-N 3.06Å |
| 250 | V | 83.1 | Confident | 72.2 | Confident | 46 Ų | 46 | 78.2 Ų | 78.2 | 28% | 0.279 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.2 | -47.5 | 178.9 | -179.9 | 0 | 0 | 0 | 0 | 110.5 | V199 I203 L246 R252 V253 S254 | V199-V250 HydrophobicContact CG1-CB 4.22Å; V199-V250 HydrophobicContact CG1-CG2 4.04Å; I203-V250 HydrophobicContact CD1-CB 3.59Å; I203-V250 HydrophobicContact CD1-CG1 3.3Å; L246-V250 HydrophobicContact CD1-CG2 4.18Å; L246-V250 HydrophobicContact CG-CG2 4.39Å; L246-V250 WeakPolarHBondContact O-CG2 3.17Å; L246-V250 PolarHBondContact O-N 2.86Å; V250-R252 VanDerWaalsContact C-N 3.29Å; V250-R252 PolarHBondContact O-N 3.01Å; V250-V253 CarbonylContact O-C 3.46Å; V250-V253 PolarHBondContact O-N 3.2Å; V250-S254 PolarHBondContact O-N 3.37Å; V250-S254 PolarHBondContact O-OG 2.98Å; V250-S254 VanDerWaalsContact O-OG 3.08Å |
| 251 | R | 78.2 | Confident | 69.9 | Low | 55 Ų | 55 | 86.7 Ų | 86.7 | 21% | 0.208 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -59.8 | -34.9 | 176.2 | -74.2 | -165.8 | -147.1 | 153 | 18.7 | 113.7 | I203 P208 T247 V253 S254 L255 | I203-R251 HydrophobicContact CD1-CG 4Å; I203-R251 HydrophobicContact CG1-CG 3.95Å; P208-R251 PolarHBondContact O-NH2 3.24Å; T247-R251 HydrophobicContact CG2-CG 4.37Å; T247-R251 WeakPolarHBondContact O-CB 3.26Å; T247-R251 WeakPolarHBondContact O-CG 3.5Å; T247-R251 PolarHBondContact O-N 3.48Å; R251-V253 VanDerWaalsContact C-N 3.29Å; R251-V253 PolarHBondContact O-N 3.25Å; R251-S254 PolarHBondContact O-N 3.25Å; R251-L255 HydrophobicContact CB-CD1 4.15Å; R251-L255 WeakPolarHBondContact O-CA 3.24Å; R251-L255 WeakPolarHBondContact O-CB 3.43Å; R251-L255 VanDerWaalsContact O-CG 3.23Å; R251-L255 WeakPolarHBondContact O-CG 3.14Å; R251-L255 PolarHBondContact O-N 2.76Å |
| 252 | R | 76.5 | Confident | 67 | Low | 164 Ų | 164 | 88.4 Ų | 88.4 | 62% | 0.619 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.2 | -39 | 175.9 | -87.2 | -178.2 | -81.5 | 166.5 | -9.4 | 111.7 | R248 R249 V250 S256 | R248-R252 WeakPolarHBondContact O-CB 3.44Å; R248-R252 WeakPolarHBondContact O-CG 3.18Å; R248-R252 PolarHBondContact O-N 2.53Å; R248-R252 PolarHBondContact O-NE 3.35Å; R249-R252 PolarHBondContact O-N 2.89Å; V250-R252 VanDerWaalsContact C-N 3.29Å; V250-R252 PolarHBondContact O-N 3.01Å; R252-S256 PolarHBondContact O-N 3.47Å; R252-S256 PolarHBondContact O-OG 2.91Å |
| 253 | V | 67 | Low | 64.2 | Low | 101 Ų | 101 | 90.9 Ų | 90.9 | 61% | 0.612 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -72.7 | -37.1 | 176.1 | 179.6 | 0 | 0 | 0 | 0 | 111.3 | R249 V250 R251 S256 H257 | R249-V253 PolarHBondContact O-N 3.06Å; V250-V253 CarbonylContact O-C 3.46Å; V250-V253 PolarHBondContact O-N 3.2Å; R251-V253 VanDerWaalsContact C-N 3.29Å; R251-V253 PolarHBondContact O-N 3.25Å; V253-S256 PolarHBondContact O-OG 3.11Å; V253-H257 PolarHBondContact O-CD2 2.89Å |
| 254 | S | 58.8 | Low | 61.5 | Low | 55 Ų | 55 | 99.8 Ų | 99.8 | 39% | 0.385 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -75.8 | -36.5 | 177.4 | -51.2 | 0 | 0 | 0 | 0 | 113.1 | V250 R251 H257 | V250-S254 PolarHBondContact O-N 3.37Å; V250-S254 PolarHBondContact O-OG 2.98Å; V250-S254 VanDerWaalsContact O-OG 3.08Å; R251-S254 PolarHBondContact O-N 3.25Å; S254-H257 WeakPolarHBondContact O-CB 3.31Å; S254-H257 PolarHBondContact O-N 3Å |
| 255 | L | 52.8 | Low | 58.6 | Low | 104 Ų | 104 | 102.1 Ų | 102.1 | 55% | 0.545 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -86.3 | -12.8 | -177.3 | -67.5 | 171.4 | 0 | 0 | 0 | 113.7 | R251 H257 S258 | R251-L255 HydrophobicContact CB-CD1 4.15Å; R251-L255 WeakPolarHBondContact O-CA 3.24Å; R251-L255 WeakPolarHBondContact O-CB 3.43Å; R251-L255 VanDerWaalsContact O-CG 3.23Å; R251-L255 WeakPolarHBondContact O-CG 3.14Å; R251-L255 PolarHBondContact O-N 2.76Å; L255-H257 PolarHBondContact O-N 3.34Å; L255-S258 PolarHBondContact O-N 3.16Å |
| 256 | S | 47.4 | Very low | 56 | Low | 91 Ų | 91 | 103.6 Ų | 103.6 | 64% | 0.636 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.2 | -6.8 | 160 | 41.5 | 0 | 0 | 0 | 0 | 112.8 | R252 V253 | R252-S256 PolarHBondContact O-N 3.47Å; R252-S256 PolarHBondContact O-OG 2.91Å; V253-S256 PolarHBondContact O-OG 3.11Å |
| 257 | H | 45.1 | Very low | 53.2 | Low | 106 Ų | 106 | 105.9 Ų | 105.9 | 49% | 0.491 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.8 | 12.1 | 173.2 | -60.9 | -74 | 0 | 0 | 0 | 115.6 | V253 S254 L255 | V253-H257 PolarHBondContact O-CD2 2.89Å; S254-H257 WeakPolarHBondContact O-CB 3.31Å; S254-H257 PolarHBondContact O-N 3Å; L255-H257 PolarHBondContact O-N 3.34Å |
| 258 | S | 36.6 | Very low | 50.8 | Low | 75 Ų | 75 | 111.9 Ų | 111.9 | 52% | 0.524 | 63% | 0.63 | S | S | . | * | trans | -127.5 | 114.8 | 176.7 | -72.1 | 0 | 0 | 0 | 0 | 112.7 | L255 S260 | L255-S258 PolarHBondContact O-N 3.16Å; S258-S260 PolarHBondContact O-N 3.46Å | ||
| 259 | P | 40.8 | Very low | 48.2 | Very low | 99 Ų | 99 | 112.6 Ų | 112.6 | 64% | 0.643 | 65% | 0.645 | S | S | * | * | trans | -75.7 | 93.6 | 172.5 | 30.8 | -28.9 | 0 | 0 | 0 | 108.2 | Q261 | P259-Q261 VanDerWaalsContact C-N 3.35Å; P259-Q261 PolarHBondContact O-N 2.64Å | ||
| 260 | S | 34.8 | Very low | 45.7 | Very low | 110 Ų | 110 | 110.7 Ų | 110.7 | 77% | 0.769 | 66% | 0.658 | S | S | * | * | trans | -65.4 | 102.9 | 159.8 | 39.7 | 0 | 0 | 0 | 0 | 107.6 | S258 S262 | S258-S260 PolarHBondContact O-N 3.46Å; S260-S262 VanDerWaalsContact C-N 3.34Å; S260-S262 PolarHBondContact O-N 2.97Å | ||
| 261 | Q | 42 | Very low | 43.6 | Very low | 190 Ų | 190 | 114.4 Ų | 114.4 | 89% | 0.888 | 68% | 0.681 | S | S | * | * | trans | -53.7 | 97.6 | 162.3 | -70.3 | -179.8 | -10.3 | 0 | 0 | 108.3 | P259 S263 | P259-Q261 VanDerWaalsContact C-N 3.35Å; P259-Q261 PolarHBondContact O-N 2.64Å; Q261-S263 PolarHBondContact O-N 2.68Å | ||
| 262 | S | 31.6 | Very low | 41.4 | Very low | 113 Ų | 113 | 117.8 Ų | 117.8 | 79% | 0.79 | 71% | 0.709 | S | S | * | * | trans | -85.8 | 101.4 | 159.1 | 58.6 | 0 | 0 | 0 | 0 | 107.4 | S260 | S260-S262 VanDerWaalsContact C-N 3.34Å; S260-S262 PolarHBondContact O-N 2.97Å | ||
| 263 | S | 33.8 | Very low | 39.3 | Very low | 108 Ų | 108 | 116.6 Ų | 116.6 | 76% | 0.755 | 72% | 0.721 | S | S | * | * | trans | -41.2 | 137 | 163.6 | 40.6 | 0 | 0 | 0 | 0 | 112.6 | Q261 | Q261-S263 PolarHBondContact O-N 2.68Š| ||
| 264 | H | 34.6 | Very low | 37.8 | Very low | 187 Ų | 187 | 120.1 Ų | 120.1 | 87% | 0.866 | 74% | 0.736 | S | S | * | * | trans | -41.3 | 135 | 176 | -62.1 | -80.8 | 0 | 0 | 0 | 114.9 | ||||
| 265 | S | 28.2 | Very low | 36.4 | Very low | 113 Ų | 113 | 120.8 Ų | 120.8 | 79% | 0.79 | 75% | 0.752 | S | S | * | * | trans | -137.2 | 98 | 144.5 | 176.6 | 0 | 0 | 0 | 0 | 107.4 | S267 | S265-S267 PolarHBondContact O-N 2.88Š| ||
| 266 | S | 37.2 | Very low | 35.8 | Very low | 114 Ų | 114 | 122.5 Ų | 122.5 | 80% | 0.797 | 77% | 0.772 | S | S | * | * | trans | -68.4 | 120.1 | 170.1 | 7.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 267 | S | 30.2 | Very low | 35 | Very low | 103 Ų | 103 | 121.1 Ų | 121.1 | 72% | 0.72 | 77% | 0.773 | S | S | * | * | trans | -135.1 | 138.3 | 157.9 | -77.2 | 0 | 0 | 0 | 0 | 108.8 | S265 | S265-S267 PolarHBondContact O-N 2.88Š| ||
| 268 | P | 36.1 | Very low | 34.6 | Very low | 129 Ų | 129 | 121.7 Ų | 121.7 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | trans | -78.4 | 148.9 | -160.4 | 29.8 | -31.3 | 0 | 0 | 0 | 112.6 | A270 | P268-A270 PolarHBondContact O-N 3.18Š| ||
| 269 | L | 31.8 | Very low | 34.6 | Very low | 168 Ų | 168 | 124 Ų | 124 | 88% | 0.88 | 80% | 0.802 | S | S | * | * | trans | -45 | 116.8 | 172.6 | -139.8 | 78.1 | 0 | 0 | 0 | 111.7 | T271 | L269-T271 PolarHBondContact O-N 3.42Š| ||
| 270 | A | 33.7 | Very low | 34.3 | Very low | 94 Ų | 94 | 124.5 Ų | 124.5 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | trans | -80.5 | 110.9 | 162.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | P268 | P268-A270 PolarHBondContact O-N 3.18Š| ||
| 271 | T | 38.8 | Very low | 34.4 | Very low | 124 Ų | 124 | 125.7 Ų | 125.7 | 76% | 0.761 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 129 | 166.7 | 28.1 | 0 | 0 | 0 | 0 | 110.5 | L269 | L269-T271 PolarHBondContact O-N 3.42Š|
| 272 | P | 32.3 | Very low | 34.1 | Very low | 125 Ų | 125 | 122.1 Ų | 122.1 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 122.2 | 160.4 | 14.7 | 1.6 | 0 | 0 | 0 | 109.4 | ||
| 273 | T | 32.7 | Very low | 34.3 | Very low | 139 Ų | 139 | 120.7 Ų | 120.7 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 143.3 | 166.8 | 35.2 | 0 | 0 | 0 | 0 | 112.7 | G275 | T273-G275 PolarHBondContact O-N 3.11Š|
| 274 | N | 34.7 | Very low | 34.3 | Very low | 175 Ų | 175 | 121.4 Ų | 121.4 | 94% | 0.936 | 80% | 0.801 | S | S | * | * | trans | -39.3 | 124.6 | 170.1 | -80.4 | -21.7 | 0 | 0 | 0 | 114.1 | ||||
| 275 | G | 30.1 | Very low | 34.3 | Very low | 70 Ų | 70 | 122.1 Ų | 122.1 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | trans | -147.8 | 111.5 | 162.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | T273 G277 | T273-G275 PolarHBondContact O-N 3.11Å; G275-G277 PolarHBondContact O-N 3.23Å | ||
| 276 | S | 39.9 | Very low | 34.4 | Very low | 139 Ų | 139 | 124.5 Ų | 124.5 | 97% | 0.972 | 81% | 0.805 | S | S | * | * | trans | -55.9 | 125.8 | 178.4 | -172.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 277 | G | 30.8 | Very low | 34.2 | Very low | 63 Ų | 63 | 123.9 Ų | 123.9 | 65% | 0.649 | 80% | 0.801 | S | S | * | * | trans | 174.7 | 108.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | G275 | G275-G277 PolarHBondContact O-N 3.23Š| ||
| 278 | S | 36.9 | Very low | 34.5 | Very low | 118 Ų | 118 | 125 Ų | 125 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -49 | 135.8 | 179.6 | -52.3 | 0 | 0 | 0 | 0 | 112.4 | S280 | S278-S280 PolarHBondContact O-N 2.84Š|
| 279 | P | 34.9 | Very low | 34.5 | Very low | 123 Ų | 123 | 125.6 Ų | 125.6 | 80% | 0.799 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 118.2 | 172.6 | -3.6 | 19.2 | 0 | 0 | 0 | 109.4 | V281 | P279-V281 PolarHBondContact O-N 2.67Š|
| 280 | S | 34.6 | Very low | 34.6 | Very low | 110 Ų | 110 | 122.4 Ų | 122.4 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 124.9 | 159.4 | 34.8 | 0 | 0 | 0 | 0 | 109.1 | S278 P282 | S278-S280 PolarHBondContact O-N 2.84Å; S280-P282 WeakPolarHBondContact O-CD 3.16Å |
| 281 | V | 36.9 | Very low | 34.8 | Very low | 134 Ų | 134 | 129.8 Ų | 129.8 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 122.5 | 170.5 | 178.9 | 0 | 0 | 0 | 0 | 108.3 | P279 A283 | P279-V281 PolarHBondContact O-N 2.67Å; V281-A283 PolarHBondContact O-N 3.46Å |
| 282 | P | 35.6 | Very low | 34.5 | Very low | 116 Ų | 116 | 133 Ų | 133 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 127.5 | 166.5 | -11 | 26.6 | 0 | 0 | 0 | 108.2 | S280 | S280-P282 WeakPolarHBondContact O-CD 3.16Š|
| 283 | A | 35.8 | Very low | 34.5 | Very low | 83 Ų | 83 | 136.6 Ų | 136.6 | 69% | 0.686 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 147.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | V281 F285 | V281-A283 PolarHBondContact O-N 3.46Å; A283-F285 PolarHBondContact O-N 2.84Å |
| 284 | P | 35 | Very low | 34.6 | Very low | 123 Ų | 123 | 141.6 Ų | 141.6 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -64 | 138.2 | 173.5 | 0.8 | 12 | 0 | 0 | 0 | 109.4 | D286 | P284-D286 PolarHBondContact O-N 3.41Š|
| 285 | F | 33.5 | Very low | 34.6 | Very low | 201 Ų | 201 | 139.2 Ų | 139.2 | 88% | 0.882 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 119.8 | 171.7 | -86 | -99.2 | 0 | 0 | 0 | 111.1 | A283 S287 | A283-F285 PolarHBondContact O-N 2.84Å; F285-S287 PolarHBondContact O-N 3.31Å; F285-S287 VanDerWaalsContact O-N 3.09Å |
| 286 | D | 30.5 | Very low | 34.7 | Very low | 163 Ų | 163 | 141.1 Ų | 141.1 | 87% | 0.872 | 81% | 0.811 | S | S | * | * | trans | -58.6 | 112.5 | 164.6 | -88.3 | -38.4 | 0 | 0 | 0 | 108.7 | P284 | P284-D286 PolarHBondContact O-N 3.41Š| ||
| 287 | S | 34.5 | Very low | 34.5 | Very low | 101 Ų | 101 | 142.3 Ų | 142.3 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -74.3 | 129.6 | 172.1 | -59.2 | 0 | 0 | 0 | 0 | 108.6 | F285 T289 | F285-S287 PolarHBondContact O-N 3.31Å; F285-S287 VanDerWaalsContact O-N 3.09Å; S287-T289 PolarHBondContact O-N 3.29Å | ||
| 288 | P | 34.9 | Very low | 35 | Very low | 127 Ų | 127 | 147.6 Ų | 147.6 | 83% | 0.825 | 84% | 0.843 | S | S | * | * | trans | -63.2 | 128.4 | 168.9 | 24.8 | -29.1 | 0 | 0 | 0 | 108.6 | S290 | P288-S290 PolarHBondContact O-N 3.3Š| ||
| 289 | T | 35.6 | Very low | 34.9 | Very low | 141 Ų | 141 | 149.1 Ų | 149.1 | 87% | 0.865 | 84% | 0.844 | S | S | * | * | trans | -52.7 | 106 | -176.8 | 29.5 | 0 | 0 | 0 | 0 | 111.8 | S287 R291 | S287-T289 PolarHBondContact O-N 3.29Å; T289-R291 PolarHBondContact O-N 2.68Å | ||
| 290 | S | 34.5 | Very low | 34.9 | Very low | 102 Ų | 102 | 150.4 Ų | 150.4 | 71% | 0.713 | 85% | 0.846 | S | S | * | * | trans | -59.4 | 117.3 | 167.6 | 177 | 0 | 0 | 0 | 0 | 109.8 | P288 F292 | P288-S290 PolarHBondContact O-N 3.3Å; S290-F292 VanDerWaalsContact C-N 3.28Å; S290-F292 PolarHBondContact O-N 3.09Å | ||
| 291 | R | 38.3 | Very low | 34.9 | Very low | 248 Ų | 248 | 152.7 Ų | 152.7 | 94% | 0.936 | 85% | 0.85 | S | S | * | * | trans | -88.9 | 18.6 | -179.8 | -136.1 | -176.4 | -159.1 | -169.7 | 6.1 | 113.5 | T289 K293 | T289-R291 PolarHBondContact O-N 2.68Å; R291-K293 PolarHBondContact O-N 3.17Å | ||
| 292 | F | 33.1 | Very low | 34.8 | Very low | 191 Ų | 191 | 153.8 Ų | 153.8 | 84% | 0.838 | 85% | 0.853 | S | S | * | * | trans | -92 | 98.4 | 174.5 | -77.4 | -81.1 | 0 | 0 | 0 | 110.5 | S290 R294 | S290-F292 VanDerWaalsContact C-N 3.28Å; S290-F292 PolarHBondContact O-N 3.09Å; F292-R294 PolarHBondContact O-N 2.68Å; F292-R294 VanDerWaalsContact O-N 3.14Å | ||
| 293 | K | 32.6 | Very low | 34.7 | Very low | 202 Ų | 202 | 156.1 Ų | 156.1 | 88% | 0.878 | 86% | 0.859 | S | S | * | * | trans | -62.1 | 111.4 | 164.4 | -86.7 | -176.4 | 173.8 | 177.5 | 0 | 108.6 | R291 V295 | R291-K293 PolarHBondContact O-N 3.17Å; K293-V295 PolarHBondContact O-N 2.8Å | ||
| 294 | R | 33.2 | Very low | 34.7 | Very low | 243 Ų | 243 | 161 Ų | 161 | 92% | 0.917 | 87% | 0.87 | S | S | * | * | trans | -69 | 109.4 | 168.4 | -150.4 | -178.8 | -147.1 | 175.5 | 5.6 | 107.8 | F292 S296 | F292-R294 PolarHBondContact O-N 2.68Å; F292-R294 VanDerWaalsContact O-N 3.14Å; R294-S296 PolarHBondContact O-N 3.29Å | ||
| 295 | V | 35.3 | Very low | 34.7 | Very low | 125 Ų | 125 | 163.7 Ų | 163.7 | 76% | 0.758 | 88% | 0.875 | S | S | * | * | trans | -78 | 115.2 | 168.3 | 178.7 | 0 | 0 | 0 | 0 | 107.2 | K293 | K293-V295 PolarHBondContact O-N 2.8Š| ||
| 296 | S | 31.8 | Very low | 34.7 | Very low | 110 Ų | 110 | 160.8 Ų | 160.8 | 77% | 0.769 | 88% | 0.875 | S | S | * | * | trans | -83.4 | 118.5 | 167.7 | 52.5 | 0 | 0 | 0 | 0 | 108.6 | R294 | R294-S296 PolarHBondContact O-N 3.29Š| ||
| 297 | L | 35.7 | Very low | 35.1 | Very low | 164 Ų | 164 | 160.7 Ų | 160.7 | 86% | 0.859 | 88% | 0.875 | S | S | * | * | trans | -77.9 | 122.7 | 165.7 | -70.3 | 165.2 | 0 | 0 | 0 | 108 | ||||
| 298 | A | 41.8 | Very low | 35.2 | Very low | 174 Ų | 174 | 166.1 Ų | 166.1 | 100% | 1.438 | 89% | 0.89 | S | S | * | * | trans | -81.3 | 0 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109.5 |
Retrieved 298 of 298 residues in 362 ms
(Link to these results)