| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 44.5 | Very low | 38.5 | Very low | 239 Ų | 239 | 133.4 Ų | 133.4 | 100% | 1.177 | 83% | 0.832 | S | S | * | * | 0 | 105.7 | 0 | -84.3 | 173.7 | 156 | 0 | 0 | 108.3 | |||||
| 2 | T | 37.5 | Very low | 38.9 | Very low | 151 Ų | 151 | 131.8 Ų | 131.8 | 93% | 0.926 | 82% | 0.821 | S | S | * | * | trans | -166.7 | 136.8 | 141.7 | 31.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 3 | N | 35.9 | Very low | 39.2 | Very low | 165 Ų | 165 | 130.9 Ų | 130.9 | 88% | 0.882 | 82% | 0.815 | S | S | * | * | trans | -80.7 | 151.1 | -153.5 | -88.9 | -19.8 | 0 | 0 | 0 | 115.6 | ||||
| 4 | S | 41.4 | Very low | 39.4 | Very low | 118 Ų | 118 | 125.6 Ų | 125.6 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | trans | -60.7 | 140.3 | 155.9 | -41.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 5 | S | 35.5 | Very low | 39.6 | Very low | 107 Ų | 107 | 120.5 Ų | 120.5 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | trans | -154.9 | 89.4 | 147.7 | 57.2 | 0 | 0 | 0 | 0 | 109.3 | T7 | S5-T7 PolarHBondContact O-N 3.44Š| ||
| 6 | S | 40.1 | Very low | 39.9 | Very low | 114 Ų | 114 | 117.4 Ų | 117.4 | 80% | 0.797 | 76% | 0.761 | S | S | * | * | trans | -72.5 | 104.6 | 162.5 | 46.8 | 0 | 0 | 0 | 0 | 108.6 | S8 | S6-S8 PolarHBondContact O-N 2.9Š| ||
| 7 | T | 35.7 | Very low | 40.1 | Very low | 124 Ų | 124 | 117.1 Ų | 117.1 | 76% | 0.761 | 75% | 0.751 | S | S | * | * | trans | -80.4 | 97.7 | 171.1 | -43.9 | 0 | 0 | 0 | 0 | 108.4 | S5 T9 | S5-T7 PolarHBondContact O-N 3.44Å; T7-T9 PolarHBondContact O-N 2.99Å | ||
| 8 | S | 35.1 | Very low | 40.2 | Very low | 108 Ų | 108 | 116.6 Ų | 116.6 | 76% | 0.755 | 74% | 0.74 | S | S | * | * | trans | -66.6 | 106.9 | 167.4 | 27.3 | 0 | 0 | 0 | 0 | 110 | S6 S10 | S6-S8 PolarHBondContact O-N 2.9Å; S8-S10 PolarHBondContact O-N 3.33Å | ||
| 9 | T | 35.7 | Very low | 40.6 | Very low | 124 Ų | 124 | 115.8 Ų | 115.8 | 76% | 0.761 | 73% | 0.73 | S | S | * | * | trans | -74.8 | 96.7 | 166.8 | 24.3 | 0 | 0 | 0 | 0 | 109.8 | T7 | T7-T9 PolarHBondContact O-N 2.99Š| ||
| 10 | S | 41.3 | Very low | 41.1 | Very low | 117 Ų | 117 | 115.1 Ų | 115.1 | 82% | 0.818 | 72% | 0.719 | S | S | * | * | trans | -95.9 | 87.1 | 166.5 | 57 | 0 | 0 | 0 | 0 | 109.7 | S8 | S8-S10 PolarHBondContact O-N 3.33Š| ||
| 11 | S | 41.3 | Very low | 41.6 | Very low | 100 Ų | 100 | 112.5 Ų | 112.5 | 70% | 0.699 | 71% | 0.705 | S | S | * | * | trans | -150.9 | 47.1 | 175.6 | 67.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 12 | T | 42.3 | Very low | 41.9 | Very low | 115 Ų | 115 | 107.3 Ų | 107.3 | 71% | 0.706 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -128.4 | 11.2 | -177.5 | -21.4 | 0 | 0 | 0 | 0 | 114.6 | ||
| 13 | T | 43.9 | Very low | 42.7 | Very low | 120 Ų | 120 | 105 Ų | 105 | 74% | 0.736 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -101.2 | -27.6 | 178.2 | 4.9 | 0 | 0 | 0 | 0 | 113.3 | ||
| 14 | G | 40.9 | Very low | 43.6 | Very low | 56 Ų | 56 | 101.2 Ų | 101.2 | 58% | 0.577 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -74.3 | -36.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L18 | G14-L18 WeakPolarHBondContact O-CB 3.41Å; G14-L18 PolarHBondContact O-N 2.84Å |
| 15 | G | 43.4 | Very low | 44.4 | Very low | 50 Ų | 50 | 102.7 Ų | 102.7 | 52% | 0.515 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -72.7 | -37.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114 | L19 | G15-L19 WeakPolarHBondContact O-CB 3.5Å; G15-L19 PolarHBondContact O-N 3.07Å |
| 16 | S | 43.4 | Very low | 45.6 | Very low | 70 Ų | 70 | 100.9 Ų | 100.9 | 49% | 0.49 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -72 | -35.4 | 178.4 | -63.8 | 0 | 0 | 0 | 0 | 112.8 | L20 | S16-L20 WeakPolarHBondContact O-CB 3.39Å; S16-L20 WeakPolarHBondContact O-CG 3.47Å; S16-L20 PolarHBondContact O-N 3.21Å |
| 17 | L | 43.5 | Very low | 46.7 | Very low | 112 Ų | 112 | 99.2 Ų | 99.2 | 59% | 0.586 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -72.9 | -36.3 | 177.7 | -159 | 149.9 | 0 | 0 | 0 | 111.2 | L20 C21 | L17-L20 PolarHBondContact O-N 3.49Å; L17-C21 VanDerWaalsContact O-CB 3.3Å; L17-C21 WeakPolarHBondContact O-CB 3.25Å; L17-C21 PolarHBondContact O-N 2.85Å; L17-C21 PolarHBondContact O-SG 2.94Å |
| 18 | L | 42.8 | Very low | 48 | Very low | 108 Ų | 108 | 94.7 Ų | 94.7 | 57% | 0.565 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.5 | -39.3 | 175.1 | -150.3 | 162.3 | 0 | 0 | 0 | 111.5 | G14 C21 E22 | G14-L18 WeakPolarHBondContact O-CB 3.41Å; G14-L18 PolarHBondContact O-N 2.84Å; L18-C21 PolarHBondContact O-N 3.11Å; L18-E22 HydrophobicContact CD2-CG 4.12Å; L18-E22 WeakPolarHBondContact O-CB 3.36Å; L18-E22 PolarHBondContact O-N 3.16Å |
| 19 | L | 46.8 | Very low | 49.8 | Very low | 103 Ų | 103 | 91.9 Ų | 91.9 | 54% | 0.539 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.4 | -44.2 | 172 | -105 | 163.1 | 0 | 0 | 0 | 112.5 | G15 C21 E22 E23 | G15-L19 WeakPolarHBondContact O-CB 3.5Å; G15-L19 PolarHBondContact O-N 3.07Å; L19-C21 VanDerWaalsContact C-N 3.32Å; L19-C21 PolarHBondContact O-N 3.39Å; L19-E22 PolarHBondContact O-N 3.11Å; L19-E23 WeakPolarHBondContact O-CB 3.48Å; L19-E23 WeakPolarHBondContact O-CG 3.01Å; L19-E23 PolarHBondContact O-N 3.22Å |
| 20 | L | 51 | Low | 51.8 | Low | 100 Ų | 100 | 92.4 Ų | 92.4 | 52% | 0.524 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.4 | -39 | 174.7 | -73.2 | 168.3 | 0 | 0 | 0 | 111.3 | S16 L17 E24 | S16-L20 WeakPolarHBondContact O-CB 3.39Å; S16-L20 WeakPolarHBondContact O-CG 3.47Å; S16-L20 PolarHBondContact O-N 3.21Å; L17-L20 PolarHBondContact O-N 3.49Å; L20-E24 WeakPolarHBondContact O-CA 3.34Å; L20-E24 WeakPolarHBondContact O-CB 3.41Å; L20-E24 WeakPolarHBondContact O-CG 3.25Å; L20-E24 PolarHBondContact O-N 3.09Å |
| 21 | C | 51 | Low | 53.8 | Low | 61 Ų | 61 | 92.5 Ų | 92.5 | 41% | 0.412 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.7 | -42.9 | 173.5 | -81.8 | 0 | 0 | 0 | 0 | 112.5 | L17 L18 L19 E24 E25 | L17-C21 VanDerWaalsContact O-CB 3.3Å; L17-C21 WeakPolarHBondContact O-CB 3.25Å; L17-C21 PolarHBondContact O-N 2.85Å; L17-C21 PolarHBondContact O-SG 2.94Å; L18-C21 PolarHBondContact O-N 3.11Å; L19-C21 VanDerWaalsContact C-N 3.32Å; L19-C21 PolarHBondContact O-N 3.39Å; C21-E24 WeakPolarHBondContact O-CA 3.2Å; C21-E24 WeakPolarHBondContact O-CB 3.47Å; C21-E24 PolarHBondContact O-N 2.97Å; C21-E25 WeakPolarHBondContact O-CB 3.49Å; C21-E25 WeakPolarHBondContact O-CG 3.27Å; C21-E25 PolarHBondContact O-N 3.2Å |
| 22 | E | 52.4 | Low | 55.9 | Low | 130 Ų | 130 | 91.6 Ų | 91.6 | 61% | 0.607 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.9 | -41.3 | 177.7 | -99 | -162.8 | 124.4 | 0 | 0 | 111.8 | L18 L19 S26 | L18-E22 HydrophobicContact CD2-CG 4.12Å; L18-E22 WeakPolarHBondContact O-CB 3.36Å; L18-E22 PolarHBondContact O-N 3.16Å; L19-E22 PolarHBondContact O-N 3.11Å; E22-S26 WeakPolarHBondContact O-CB 3.05Å; E22-S26 PolarHBondContact O-N 3.32Å; E22-S26 VanDerWaalsContact O-N 3.13Å |
| 23 | E | 52.8 | Low | 58.2 | Low | 104 Ų | 104 | 89 Ų | 89 | 49% | 0.486 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.8 | -41.9 | 172.2 | -59 | -172.2 | 120.8 | 0 | 0 | 110 | L19 E25 S26 W27 | L19-E23 WeakPolarHBondContact O-CB 3.48Å; L19-E23 WeakPolarHBondContact O-CG 3.01Å; L19-E23 PolarHBondContact O-N 3.22Å; E23-E25 PolarHBondContact O-N 2.87Å; E23-S26 WeakPolarHBondContact O-CB 3.47Å; E23-S26 PolarHBondContact O-N 3.18Å; E23-W27 HydrophobicContact CB-CE3 3.59Å; E23-W27 HydrophobicContact CB-CH2 3.5Å; E23-W27 VanDerWaalsContact CB-CH2 3.5Å; E23-W27 HydrophobicContact CB-CZ3 2.91Å; E23-W27 HydrophobicContact CG-CZ3 4.11Å; E23-W27 WeakPolarHBondContact O-CZ3 3.39Å; E23-W27 PolarHBondContact O-N 3.48Å |
| 24 | E | 55.1 | Low | 60.4 | Low | 85 Ų | 85 | 84.6 Ų | 84.6 | 40% | 0.397 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -48.3 | -52.4 | 171.9 | -78.2 | -76.4 | 164.1 | 0 | 0 | 113.3 | L20 C21 S26 W27 A28 | L20-E24 WeakPolarHBondContact O-CA 3.34Å; L20-E24 WeakPolarHBondContact O-CB 3.41Å; L20-E24 WeakPolarHBondContact O-CG 3.25Å; L20-E24 PolarHBondContact O-N 3.09Å; C21-E24 WeakPolarHBondContact O-CA 3.2Å; C21-E24 WeakPolarHBondContact O-CB 3.47Å; C21-E24 PolarHBondContact O-N 2.97Å; E24-S26 VanDerWaalsContact C-N 3.33Å; E24-S26 PolarHBondContact O-N 3.44Å; E24-W27 HydrophobicContact CB-CH2 4.25Å; E24-W27 HydrophobicContact CB-CZ2 3.62Å; E24-W27 VanDerWaalsContact CD-CE2 3.44Å; E24-W27 VanDerWaalsContact CD-NE1 3.25Å; E24-W27 HydrophobicContact CG-CH2 3.9Å; E24-W27 HydrophobicContact CG-CZ2 3.13Å; E24-W27 VanDerWaalsContact N-CZ2 3.32Å; E24-W27 VanDerWaalsContact O-CD1 3.23Å; E24-W27 PolarHBondContact O-N 3.09Å; E24-W27 PolarHBondContact O-NE1 2.84Å; E24-W27 VanDerWaalsContact OE1-CZ2 3.24Å; E24-W27 WeakPolarHBondContact OE1-CZ2 3.39Å; E24-W27 PolarHBondContact OE2-NE1 3.26Å; E24-A28 WeakPolarHBondContact O-CB 3.33Å; E24-A28 PolarHBondContact O-N 3.49Å |
| 25 | E | 58.5 | Low | 62.8 | Low | 149 Ų | 149 | 82 Ų | 82 | 70% | 0.696 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -64.9 | -37.6 | 179.2 | -67.8 | -66.2 | 143.8 | 0 | 0 | 111.8 | C21 E23 G29 | C21-E25 WeakPolarHBondContact O-CB 3.49Å; C21-E25 WeakPolarHBondContact O-CG 3.27Å; C21-E25 PolarHBondContact O-N 3.2Å; E23-E25 PolarHBondContact O-N 2.87Å; E25-G29 PolarHBondContact O-N 3.39Å |
| 26 | S | 60.9 | Low | 65.1 | Low | 69 Ų | 69 | 85.1 Ų | 85.1 | 48% | 0.483 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69.7 | -38 | -179.6 | -173.4 | 0 | 0 | 0 | 0 | 113.2 | E22 E23 E24 | E22-S26 WeakPolarHBondContact O-CB 3.05Å; E22-S26 PolarHBondContact O-N 3.32Å; E22-S26 VanDerWaalsContact O-N 3.13Å; E23-S26 WeakPolarHBondContact O-CB 3.47Å; E23-S26 PolarHBondContact O-N 3.18Å; E24-S26 VanDerWaalsContact C-N 3.33Å; E24-S26 PolarHBondContact O-N 3.44Å |
| 27 | W | 62.7 | Low | 67.5 | Low | 79 Ų | 79 | 86.4 Ų | 86.4 | 30% | 0.299 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -81.7 | -39.7 | 175.8 | 60 | 69.7 | 0 | 0 | 0 | 113.4 | E23 E24 R30 R31 | E23-W27 HydrophobicContact CB-CE3 3.59Å; E23-W27 HydrophobicContact CB-CH2 3.5Å; E23-W27 VanDerWaalsContact CB-CH2 3.5Å; E23-W27 HydrophobicContact CB-CZ3 2.91Å; E23-W27 HydrophobicContact CG-CZ3 4.11Å; E23-W27 WeakPolarHBondContact O-CZ3 3.39Å; E23-W27 PolarHBondContact O-N 3.48Å; E24-W27 HydrophobicContact CB-CH2 4.25Å; E24-W27 HydrophobicContact CB-CZ2 3.62Å; E24-W27 VanDerWaalsContact CD-CE2 3.44Å; E24-W27 VanDerWaalsContact CD-NE1 3.25Å; E24-W27 HydrophobicContact CG-CH2 3.9Å; E24-W27 HydrophobicContact CG-CZ2 3.13Å; E24-W27 VanDerWaalsContact N-CZ2 3.32Å; E24-W27 VanDerWaalsContact O-CD1 3.23Å; E24-W27 PolarHBondContact O-N 3.09Å; E24-W27 PolarHBondContact O-NE1 2.84Å; E24-W27 VanDerWaalsContact OE1-CZ2 3.24Å; E24-W27 WeakPolarHBondContact OE1-CZ2 3.39Å; E24-W27 PolarHBondContact OE2-NE1 3.26Å; W27-R30 PolarHBondContact O-N 3.33Å; W27-R31 WeakPolarHBondContact O-CG 3.22Å; W27-R31 PolarHBondContact O-N 3.42Å |
| 28 | A | 62.7 | Low | 69.9 | Low | 28 Ų | 28 | 81.9 Ų | 81.9 | 23% | 0.231 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | E24 R30 R31 I32 | E24-A28 WeakPolarHBondContact O-CB 3.33Å; E24-A28 PolarHBondContact O-N 3.49Å; A28-R30 PolarHBondContact O-N 2.94Å; A28-R30 VanDerWaalsContact O-N 3.1Å; A28-R31 PolarHBondContact O-N 2.94Å; A28-I32 HydrophobicContact CB-CD1 4.06Å; A28-I32 WeakPolarHBondContact O-CB 3.46Å; A28-I32 WeakPolarHBondContact O-CD1 3.21Å; A28-I32 WeakPolarHBondContact O-CG1 3.41Å; A28-I32 PolarHBondContact O-N 3.36Å |
| 29 | G | 72.7 | Confident | 72.4 | Confident | 50 Ų | 50 | 78.8 Ų | 78.8 | 52% | 0.515 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -58.2 | -27.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | E25 P33 | E25-G29 PolarHBondContact O-N 3.39Å; G29-P33 VanDerWaalsContact O-CD 3.26Å; G29-P33 WeakPolarHBondContact O-CD 3.25Å; G29-P33 WeakPolarHBondContact O-CG 3.43Å |
| 30 | R | 78.7 | Confident | 74.7 | Confident | 134 Ų | 134 | 76 Ų | 76 | 51% | 0.506 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -94.2 | -31 | 178.9 | -68.8 | 170.1 | 178.9 | 177.8 | 8 | 113.7 | W27 A28 P33 V34 W315 | W27-R30 PolarHBondContact O-N 3.33Å; A28-R30 PolarHBondContact O-N 2.94Å; A28-R30 VanDerWaalsContact O-N 3.1Å; R30-P33 WeakPolarHBondContact O-CG 3.48Å; R30-V34 WeakPolarHBondContact O-CG2 3.43Å; R30-W315 HydrophobicContact CB-CH2 3.8Å; R30-W315 HydrophobicContact CB-CZ2 3.89Å; R30-W315 HydrophobicContact CB-CZ3 4.45Å; R30-W315 VanDerWaalsContact CD-CZ2 3.48Å; R30-W315 HydrophobicContact CG-CH2 4.07Å; R30-W315 HydrophobicContact CG-CZ2 3.71Å |
| 31 | R | 82.4 | Confident | 76.8 | Confident | 120 Ų | 120 | 73 Ų | 73 | 45% | 0.453 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -86.4 | -33.4 | -175.4 | -69.4 | -174.8 | 170.6 | -146.5 | 0.1 | 113.8 | W27 A28 V34 S35 G92 | W27-R31 WeakPolarHBondContact O-CG 3.22Å; W27-R31 PolarHBondContact O-N 3.42Å; A28-R31 PolarHBondContact O-N 2.94Å; R31-V34 PolarHBondContact O-N 3.5Å; R31-S35 WeakPolarHBondContact O-CB 3.33Å; R31-S35 PolarHBondContact O-N 2.97Å; R31-S35 PolarHBondContact O-OG 2.89Å; R31-G92 WeakPolarHBondContact CB-O 3.03Å |
| 32 | I | 87 | Confident | 78.9 | Confident | 80 Ų | 80 | 70.4 Ų | 70.4 | 41% | 0.41 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -55.1 | -53.7 | 175.1 | -66 | 165.1 | 0 | 0 | 0 | 111.8 | A28 V34 S35 L36 L93 | A28-I32 HydrophobicContact CB-CD1 4.06Å; A28-I32 WeakPolarHBondContact O-CB 3.46Å; A28-I32 WeakPolarHBondContact O-CD1 3.21Å; A28-I32 WeakPolarHBondContact O-CG1 3.41Å; A28-I32 PolarHBondContact O-N 3.36Å; I32-V34 VanDerWaalsContact C-N 3.34Å; I32-V34 PolarHBondContact O-N 2.63Å; I32-S35 PolarHBondContact O-N 3.06Å; I32-L36 HydrophobicContact CG2-CD1 4.07Å; I32-L36 HydrophobicContact CG2-CG 4.45Å; I32-L36 WeakPolarHBondContact O-CG 3.45Å; I32-L36 PolarHBondContact O-N 3.35Å; I32-L93 HydrophobicContact CG1-CD2 4.15Å |
| 33 | P | 90.2 | Very high | 81 | Confident | 60 Ų | 60 | 69.5 Ų | 69.5 | 39% | 0.39 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.5 | -37.9 | -178.9 | 23.4 | -34.1 | 0 | 0 | 0 | 112.7 | G29 R30 S35 L36 L37 | G29-P33 VanDerWaalsContact O-CD 3.26Å; G29-P33 WeakPolarHBondContact O-CD 3.25Å; G29-P33 WeakPolarHBondContact O-CG 3.43Å; R30-P33 WeakPolarHBondContact O-CG 3.48Å; P33-S35 VanDerWaalsContact C-N 3.33Å; P33-S35 PolarHBondContact O-N 3.07Å; P33-L36 PolarHBondContact O-N 3.49Å; P33-L37 VanDerWaalsContact O-CG 3.26Å; P33-L37 WeakPolarHBondContact O-CG 3.24Å; P33-L37 PolarHBondContact O-N 2.85Å |
| 34 | V | 88.9 | Confident | 83 | Confident | 29 Ų | 29 | 66.3 Ų | 66.3 | 18% | 0.176 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.1 | -41.3 | 176.3 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | R30 R31 I32 L37 Y38 W315 A319 L323 | R30-V34 WeakPolarHBondContact O-CG2 3.43Å; R31-V34 PolarHBondContact O-N 3.5Å; I32-V34 VanDerWaalsContact C-N 3.34Å; I32-V34 PolarHBondContact O-N 2.63Å; V34-L37 PolarHBondContact O-N 3.36Å; V34-Y38 HydrophobicContact CG1-CD2 3.75Å; V34-Y38 HydrophobicContact CG1-CE2 3.52Å; V34-Y38 VanDerWaalsContact O-CD2 3.23Å; V34-Y38 WeakPolarHBondContact O-CD2 3.43Å; V34-Y38 PolarHBondContact O-N 3.33Å; V34-W315 HydrophobicContact CG2-CZ3 4.26Å; V34-A319 HydrophobicContact CG2-CB 4.5Å; V34-L323 HydrophobicContact CG1-CD1 4.37Å |
| 35 | S | 91.1 | Very high | 84.8 | Confident | 2 Ų | 2 | 62.3 Ų | 62.3 | 1% | 0.014 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -67.2 | -38.9 | 178.4 | -54.8 | 0 | 0 | 0 | 0 | 112.4 | R31 I32 P33 Y38 S39 A89 G92 | R31-S35 WeakPolarHBondContact O-CB 3.33Å; R31-S35 PolarHBondContact O-N 2.97Å; R31-S35 PolarHBondContact O-OG 2.89Å; I32-S35 PolarHBondContact O-N 3.06Å; P33-S35 VanDerWaalsContact C-N 3.33Å; P33-S35 PolarHBondContact O-N 3.07Å; S35-Y38 PolarHBondContact O-N 3.08Å; S35-S39 PolarHBondContact O-N 2.86Å; S35-S39 PolarHBondContact O-OG 3.01Å; S35-A89 WeakPolarHBondContact CB-O 3.26Å; S35-A89 WeakPolarHBondContact O-CB 3.28Å; S35-A89 PolarHBondContact OG-O 2.84Å; S35-G92 WeakPolarHBondContact OG-CA 3.48Å |
| 36 | L | 92.6 | Very high | 86.6 | Confident | 114 Ų | 114 | 57.4 Ų | 57.4 | 60% | 0.597 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -64.1 | -41.3 | 172.9 | -69.4 | 174.7 | 0 | 0 | 0 | 111.6 | I32 P33 S39 G40 | I32-L36 HydrophobicContact CG2-CD1 4.07Å; I32-L36 HydrophobicContact CG2-CG 4.45Å; I32-L36 WeakPolarHBondContact O-CG 3.45Å; I32-L36 PolarHBondContact O-N 3.35Å; P33-L36 PolarHBondContact O-N 3.49Å; L36-S39 PolarHBondContact O-N 3.23Å; L36-G40 PolarHBondContact O-N 2.77Å |
| 37 | L | 93.9 | Very high | 88.2 | Confident | 97 Ų | 97 | 60 Ų | 60 | 51% | 0.508 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.3 | -44.9 | 175.2 | -71.5 | 170.5 | 0 | 0 | 0 | 111.6 | P33 V34 S39 G40 L41 L323 | P33-L37 VanDerWaalsContact O-CG 3.26Å; P33-L37 WeakPolarHBondContact O-CG 3.24Å; P33-L37 PolarHBondContact O-N 2.85Å; V34-L37 PolarHBondContact O-N 3.36Å; L37-S39 VanDerWaalsContact C-N 3.32Å; L37-S39 PolarHBondContact O-N 3.28Å; L37-G40 PolarHBondContact O-N 2.81Å; L37-L41 WeakPolarHBondContact O-CB 3.16Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.21Å; L37-L41 PolarHBondContact O-N 2.91Å; L37-L323 HydrophobicContact CB-CD2 3.86Å; L37-L323 HydrophobicContact CD1-CD1 3.91Å |
| 38 | Y | 93.7 | Very high | 89.6 | Confident | 18 Ų | 18 | 57.1 Ų | 57.1 | 7% | 0.071 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59 | -42.5 | 173.6 | -83.4 | -63.4 | 0 | 0 | 0 | 112.2 | V34 S35 L41 A42 W84 M85 E88 W322 L323 C326 | V34-Y38 HydrophobicContact CG1-CD2 3.75Å; V34-Y38 HydrophobicContact CG1-CE2 3.52Å; V34-Y38 VanDerWaalsContact O-CD2 3.23Å; V34-Y38 WeakPolarHBondContact O-CD2 3.43Å; V34-Y38 PolarHBondContact O-N 3.33Å; S35-Y38 PolarHBondContact O-N 3.08Å; Y38-L41 PolarHBondContact O-N 3.4Å; Y38-A42 VanDerWaalsContact O-CB 3.23Å; Y38-A42 WeakPolarHBondContact O-CB 3.34Å; Y38-A42 PolarHBondContact O-N 2.87Å; Y38-W84 HydrophobicContact CE1-CH2 4.39Å; Y38-W84 HydrophobicContact CE1-CZ3 4.09Å; Y38-M85 HydrophobicContact CD1-CB 4.45Å; Y38-M85 HydrophobicContact CD1-CG 4.34Å; Y38-E88 HydrophobicContact CD1-CB 4.38Å; Y38-E88 HydrophobicContact CD2-CB 4.24Å; Y38-E88 HydrophobicContact CE1-CB 4.47Å; Y38-E88 HydrophobicContact CE2-CB 4.34Å; Y38-E88 HydrophobicContact CG-CB 4.27Å; Y38-W322 WeakPolarHBondContact OH-CB 3.28Å; Y38-L323 HydrophobicContact CD1-CD2 4.15Å; Y38-L323 HydrophobicContact CD2-CD2 4.13Å; Y38-L323 HydrophobicContact CE1-CD2 4.07Å; Y38-L323 HydrophobicContact CE2-CD2 4.07Å; Y38-L323 HydrophobicContact CG-CD2 4.17Å; Y38-C326 HydrophobicContact CE1-CB 4.37Å; Y38-C326 VanDerWaalsContact CE1-SG 3.56Å |
| 39 | S | 94.9 | Very high | 91.1 | Very high | 43 Ų | 43 | 55.8 Ų | 55.8 | 30% | 0.301 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.9 | -45.6 | 177.4 | -58.8 | 0 | 0 | 0 | 0 | 112.1 | S35 L36 L37 A42 I43 A89 | S35-S39 PolarHBondContact O-N 2.86Å; S35-S39 PolarHBondContact O-OG 3.01Å; L36-S39 PolarHBondContact O-N 3.23Å; L37-S39 VanDerWaalsContact C-N 3.32Å; L37-S39 PolarHBondContact O-N 3.28Å; S39-A42 WeakPolarHBondContact O-CB 3.32Å; S39-A42 PolarHBondContact O-N 3.48Å; S39-I43 WeakPolarHBondContact O-CG1 3.41Å; S39-I43 PolarHBondContact O-N 2.99Å; S39-A89 WeakPolarHBondContact OG-CB 3.48Å |
| 40 | G | 95.3 | Very high | 92.1 | Very high | 45 Ų | 45 | 54.7 Ų | 54.7 | 46% | 0.464 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L36 L37 G44 | L36-G40 PolarHBondContact O-N 2.77Å; L37-G40 PolarHBondContact O-N 2.81Å; G40-G44 PolarHBondContact O-N 3.46Å |
| 41 | L | 95.1 | Very high | 92.8 | Very high | 37 Ų | 37 | 51.7 Ų | 51.7 | 19% | 0.194 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.2 | -37.6 | 175.6 | -71.1 | 175.8 | 0 | 0 | 0 | 112.4 | L37 Y38 G45 M85 L323 C326 A327 A330 | L37-L41 WeakPolarHBondContact O-CB 3.16Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.21Å; L37-L41 PolarHBondContact O-N 2.91Å; Y38-L41 PolarHBondContact O-N 3.4Å; L41-G45 WeakPolarHBondContact O-CA 3.28Å; L41-G45 PolarHBondContact O-N 2.73Å; L41-M85 HydrophobicContact CB-SD 3.97Å; L41-L323 HydrophobicContact CD1-CD2 4.19Å; L41-C326 HydrophobicContact CD1-CB 3.81Å; L41-A327 HydrophobicContact CD1-CB 4.42Å; L41-A327 HydrophobicContact CD2-CB 4.09Å; L41-A330 HydrophobicContact CD2-CB 4.2Å |
| 42 | A | 96.1 | Very high | 93.3 | Very high | 6 Ų | 6 | 46 Ų | 46 | 5% | 0.05 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.7 | -50.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y38 S39 T46 C81 M85 P86 | Y38-A42 VanDerWaalsContact O-CB 3.23Å; Y38-A42 WeakPolarHBondContact O-CB 3.34Å; Y38-A42 PolarHBondContact O-N 2.87Å; S39-A42 WeakPolarHBondContact O-CB 3.32Å; S39-A42 PolarHBondContact O-N 3.48Å; A42-T46 WeakPolarHBondContact O-CB 3.4Å; A42-T46 PolarHBondContact O-N 3.38Å; A42-T46 PolarHBondContact O-OG1 3.44Å; A42-C81 WeakPolarHBondContact CA-O 3.31Å; A42-C81 VanDerWaalsContact CB-O 3.24Å; A42-C81 WeakPolarHBondContact CB-O 3.33Å; A42-M85 HydrophobicContact CB-CB 3.82Å; A42-P86 HydrophobicContact CB-CG 4.02Å |
| 43 | I | 95.8 | Very high | 93.7 | Very high | 111 Ų | 111 | 44.4 Ų | 44.4 | 57% | 0.569 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -64.4 | -54.4 | 179.6 | -64 | 165.3 | 0 | 0 | 0 | 110.1 | S39 G45 T46 L47 | S39-I43 WeakPolarHBondContact O-CG1 3.41Å; S39-I43 PolarHBondContact O-N 2.99Å; I43-G45 PolarHBondContact O-N 2.82Å; I43-T46 PolarHBondContact O-N 3.05Å; I43-L47 HydrophobicContact CG2-CD1 4.03Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 2.85Å |
| 44 | G | 94.2 | Very high | 93.8 | Very high | 37 Ų | 37 | 47.4 Ų | 47.4 | 38% | 0.381 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.2 | -44.3 | -178 | 0 | 0 | 0 | 0 | 0 | 112.4 | G40 L47 A48 | G40-G44 PolarHBondContact O-N 3.46Å; G44-L47 PolarHBondContact O-N 2.92Å; G44-A48 VanDerWaalsContact O-CB 3.24Å; G44-A48 WeakPolarHBondContact O-CB 3.35Å; G44-A48 PolarHBondContact O-N 2.91Å |
| 45 | G | 94.1 | Very high | 94 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.6 | -38.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L41 I43 N49 | L41-G45 WeakPolarHBondContact O-CA 3.28Å; L41-G45 PolarHBondContact O-N 2.73Å; I43-G45 PolarHBondContact O-N 2.82Å; G45-N49 VanDerWaalsContact O-CB 3.27Å; G45-N49 WeakPolarHBondContact O-CB 3.44Å; G45-N49 PolarHBondContact O-N 3.42Å; G45-N49 PolarHBondContact O-ND2 3.44Å |
| 46 | T | 95.7 | Very high | 94.1 | Very high | 46 Ų | 46 | 46.6 Ų | 46.6 | 28% | 0.282 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.5 | -47 | 176 | -59.9 | 0 | 0 | 0 | 0 | 111.1 | A42 I43 G50 L78 A82 | A42-T46 WeakPolarHBondContact O-CB 3.4Å; A42-T46 PolarHBondContact O-N 3.38Å; A42-T46 PolarHBondContact O-OG1 3.44Å; I43-T46 PolarHBondContact O-N 3.05Å; T46-G50 PolarHBondContact O-N 3.45Å; T46-L78 HydrophobicContact CG2-CD2 4.02Å; T46-L78 WeakPolarHBondContact O-CD2 3.25Å; T46-A82 HydrophobicContact CG2-CB 3.97Å; T46-A82 WeakPolarHBondContact OG1-CA 3.46Å; T46-A82 WeakPolarHBondContact OG1-CB 3.39Å; T46-A82 PolarHBondContact OG1-N 2.89Å |
| 47 | L | 94.1 | Very high | 94.1 | Very high | 123 Ų | 123 | 44.6 Ų | 44.6 | 64% | 0.644 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -63.5 | -46.4 | 177.5 | -67.1 | 173.4 | 0 | 0 | 0 | 111.7 | I43 G44 M51 | I43-L47 HydrophobicContact CG2-CD1 4.03Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 2.85Å; G44-L47 PolarHBondContact O-N 2.92Å; L47-M51 VanDerWaalsContact O-CB 3.26Å; L47-M51 WeakPolarHBondContact O-CB 3.29Å; L47-M51 PolarHBondContact O-N 3.28Å |
| 48 | A | 91.9 | Very high | 94 | Very high | 19 Ų | 19 | 42.6 Ų | 42.6 | 16% | 0.157 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.4 | -47.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G44 M51 V52 P333 | G44-A48 VanDerWaalsContact O-CB 3.24Å; G44-A48 WeakPolarHBondContact O-CB 3.35Å; G44-A48 PolarHBondContact O-N 2.91Å; A48-M51 PolarHBondContact O-N 2.93Å; A48-V52 PolarHBondContact O-N 3.4Å; A48-P333 HydrophobicContact CB-CB 4.15Å; A48-P333 HydrophobicContact CB-CG 4.06Å |
| 49 | N | 94.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -67.8 | -43.2 | 178.6 | -75.4 | -65.8 | 0 | 0 | 0 | 111.3 | G45 M51 V52 I53 C74 L78 S329 P333 | G45-N49 VanDerWaalsContact O-CB 3.27Å; G45-N49 WeakPolarHBondContact O-CB 3.44Å; G45-N49 PolarHBondContact O-N 3.42Å; G45-N49 PolarHBondContact O-ND2 3.44Å; N49-M51 VanDerWaalsContact C-N 3.34Å; N49-M51 PolarHBondContact O-N 3.16Å; N49-V52 PolarHBondContact O-N 3.3Å; N49-I53 WeakPolarHBondContact O-CG1 3.42Å; N49-I53 PolarHBondContact O-N 3Å; N49-I53 VanDerWaalsContact O-N 3.15Å; N49-C74 HydrophobicContact CB-CB 4.12Å; N49-C74 WeakPolarHBondContact OD1-CA 3.45Å; N49-C74 PolarHBondContact OD1-SG 2.87Å; N49-C74 VanDerWaalsContact OD1-SG 3.34Å; N49-L78 HydrophobicContact CB-CD2 3.78Å; N49-L78 HydrophobicContact CB-CG 3.77Å; N49-S329 PolarHBondContact ND2-O 3.38Å; N49-P333 HydrophobicContact CB-CG 4.23Å; N49-P333 WeakPolarHBondContact OD1-CD 3.32Å; N49-P333 WeakPolarHBondContact OD1-CG 3.43Å |
| 50 | G | 94.5 | Very high | 93.7 | Very high | 28 Ų | 28 | 52.9 Ų | 52.9 | 29% | 0.289 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -58.8 | -42.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T46 V52 I53 Y54 | T46-G50 PolarHBondContact O-N 3.45Å; G50-V52 PolarHBondContact O-N 3.46Å; G50-I53 PolarHBondContact O-N 2.96Å; G50-Y54 WeakPolarHBondContact O-CB 3.47Å; G50-Y54 PolarHBondContact O-N 3.02Å |
| 51 | M | 92.3 | Very high | 93.4 | Very high | 70 Ų | 70 | 58.9 Ų | 58.9 | 35% | 0.345 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 177.2 | -177.4 | 171.6 | 66.4 | 0 | 0 | 112.1 | L47 A48 N49 Y54 L55 L351 | L47-M51 VanDerWaalsContact O-CB 3.26Å; L47-M51 WeakPolarHBondContact O-CB 3.29Å; L47-M51 PolarHBondContact O-N 3.28Å; A48-M51 PolarHBondContact O-N 2.93Å; N49-M51 VanDerWaalsContact C-N 3.34Å; N49-M51 PolarHBondContact O-N 3.16Å; M51-Y54 PolarHBondContact O-N 3.26Å; M51-L55 HydrophobicContact CG-CD1 3.96Å; M51-L55 HydrophobicContact CG-CG 4.3Å; M51-L55 WeakPolarHBondContact O-CB 3.32Å; M51-L55 VanDerWaalsContact O-CG 3.23Å; M51-L55 WeakPolarHBondContact O-CG 3.17Å; M51-L55 PolarHBondContact O-N 2.89Å; M51-L351 HydrophobicContact SD-CD1 4.1Å |
| 52 | V | 92.8 | Very high | 93 | Very high | 2 Ų | 2 | 57.2 Ų | 57.2 | 1% | 0.012 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65.1 | -42.6 | 178.7 | 170.9 | 0 | 0 | 0 | 0 | 111.8 | A48 N49 G50 Y54 L55 V56 I70 P333 T337 F343 | A48-V52 PolarHBondContact O-N 3.4Å; N49-V52 PolarHBondContact O-N 3.3Å; G50-V52 PolarHBondContact O-N 3.46Å; V52-Y54 VanDerWaalsContact C-N 3.33Å; V52-Y54 PolarHBondContact O-N 3.46Å; V52-L55 PolarHBondContact O-N 3.16Å; V52-V56 WeakPolarHBondContact O-CG2 3.27Å; V52-V56 PolarHBondContact O-N 2.82Å; V52-I70 HydrophobicContact CG1-CG2 4.11Å; V52-P333 HydrophobicContact CG2-CB 3.63Å; V52-P333 HydrophobicContact CG2-CG 4.36Å; V52-T337 HydrophobicContact CG1-CG2 4.23Å; V52-T337 HydrophobicContact CG2-CG2 3.82Å; V52-F343 HydrophobicContact CG1-CE1 4.15Å |
| 53 | I | 94.8 | Very high | 92.8 | Very high | 45 Ų | 45 | 61.7 Ų | 61.7 | 23% | 0.231 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.1 | -45.1 | 175.7 | -63 | 174.3 | 0 | 0 | 0 | 110.2 | N49 G50 V56 S57 V71 C74 A75 L78 | N49-I53 WeakPolarHBondContact O-CG1 3.42Å; N49-I53 PolarHBondContact O-N 3Å; N49-I53 VanDerWaalsContact O-N 3.15Å; G50-I53 PolarHBondContact O-N 2.96Å; I53-V56 PolarHBondContact O-N 3.04Å; I53-S57 WeakPolarHBondContact O-CB 3.13Å; I53-S57 PolarHBondContact O-N 3.04Å; I53-S57 PolarHBondContact O-OG 3.44Å; I53-V71 HydrophobicContact CG1-CG1 4.28Å; I53-C74 HydrophobicContact CD1-CB 3.96Å; I53-C74 HydrophobicContact CG1-CB 3.75Å; I53-A75 HydrophobicContact CD1-CB 4.48Å; I53-L78 HydrophobicContact CD1-CD1 3.49Å; I53-L78 VanDerWaalsContact CD1-CD1 3.49Å; I53-L78 HydrophobicContact CD1-CG 4.36Å |
| 54 | Y | 94.1 | Very high | 92.5 | Very high | 123 Ų | 123 | 59.5 Ų | 59.5 | 48% | 0.482 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 176.4 | 173.7 | -101.5 | 0 | 0 | 0 | 112.4 | G50 M51 V52 S57 S58 V350 | G50-Y54 WeakPolarHBondContact O-CB 3.47Å; G50-Y54 PolarHBondContact O-N 3.02Å; M51-Y54 PolarHBondContact O-N 3.26Å; V52-Y54 VanDerWaalsContact C-N 3.33Å; V52-Y54 PolarHBondContact O-N 3.46Å; Y54-S57 WeakPolarHBondContact CA-OG 3.32Å; Y54-S57 PolarHBondContact O-N 2.89Å; Y54-S57 PolarHBondContact O-OG 3.23Å; Y54-S58 VanDerWaalsContact CE2-OG 3.27Å; Y54-S58 WeakPolarHBondContact CE2-OG 3.23Å; Y54-S58 VanDerWaalsContact O-CB 3.22Å; Y54-S58 WeakPolarHBondContact O-CB 3.39Å; Y54-S58 PolarHBondContact O-N 3.37Å; Y54-S58 PolarHBondContact O-OG 2.99Å; Y54-V350 HydrophobicContact CE1-CG1 3.85Å; Y54-V350 HydrophobicContact CE1-CG2 3.95Å |
| 55 | L | 92.6 | Very high | 92.2 | Very high | 3 Ų | 3 | 59.3 Ų | 59.3 | 2% | 0.016 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.7 | -44.3 | -179.7 | -69.8 | 171.4 | 0 | 0 | 0 | 111.8 | M51 V52 S57 S58 F59 L62 F343 V347 V350 | M51-L55 HydrophobicContact CG-CD1 3.96Å; M51-L55 HydrophobicContact CG-CG 4.3Å; M51-L55 WeakPolarHBondContact O-CB 3.32Å; M51-L55 VanDerWaalsContact O-CG 3.23Å; M51-L55 WeakPolarHBondContact O-CG 3.17Å; M51-L55 PolarHBondContact O-N 2.89Å; V52-L55 PolarHBondContact O-N 3.16Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.38Å; L55-S58 PolarHBondContact O-N 2.84Å; L55-F59 HydrophobicContact CD2-CD2 4.15Å; L55-F59 HydrophobicContact CD2-CE2 3.78Å; L55-F59 VanDerWaalsContact O-CD2 3.32Å; L55-F59 WeakPolarHBondContact O-CD2 3.39Å; L55-F59 PolarHBondContact O-N 3.31Å; L55-L62 HydrophobicContact CB-CD1 4.23Å; L55-F343 HydrophobicContact CB-CD1 4.48Å; L55-F343 HydrophobicContact CB-CE1 4.42Å; L55-F343 HydrophobicContact CD1-CD1 4.27Å; L55-V347 HydrophobicContact CD1-CG2 3.47Å; L55-V347 VanDerWaalsContact CD1-CG2 3.47Å; L55-V350 HydrophobicContact CD2-CG2 3.87Å |
| 56 | V | 92.9 | Very high | 91.9 | Very high | 11 Ų | 11 | 59.6 Ų | 59.6 | 7% | 0.067 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.5 | -38.4 | 179.1 | 176.7 | 0 | 0 | 0 | 0 | 111.3 | V52 I53 L62 Q63 N67 V71 F343 | V52-V56 WeakPolarHBondContact O-CG2 3.27Å; V52-V56 PolarHBondContact O-N 2.82Å; I53-V56 PolarHBondContact O-N 3.04Å; V56-L62 HydrophobicContact CG2-CB 4.37Å; V56-Q63 WeakPolarHBondContact O-CG 3.34Å; V56-N67 HydrophobicContact CG1-CB 4.28Å; V56-N67 HydrophobicContact CG2-CB 4.32Å; V56-V71 HydrophobicContact CB-CG2 3.64Å; V56-V71 HydrophobicContact CG1-CG2 3.67Å; V56-V71 HydrophobicContact CG2-CG2 3.79Å; V56-F343 HydrophobicContact CG2-CE1 3.69Å; V56-F343 HydrophobicContact CG2-CZ 3.45Å; V56-F343 VanDerWaalsContact CG2-CZ 3.45Å |
| 57 | S | 93.3 | Very high | 91.7 | Very high | 72 Ų | 72 | 57.8 Ų | 57.8 | 50% | 0.503 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -70.4 | -35.8 | 177.1 | 54.7 | 0 | 0 | 0 | 0 | 112.8 | I53 Y54 L55 Q63 | I53-S57 WeakPolarHBondContact O-CB 3.13Å; I53-S57 PolarHBondContact O-N 3.04Å; I53-S57 PolarHBondContact O-OG 3.44Å; Y54-S57 WeakPolarHBondContact CA-OG 3.32Å; Y54-S57 PolarHBondContact O-N 2.89Å; Y54-S57 PolarHBondContact O-OG 3.23Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.38Å; S57-Q63 PolarHBondContact O-NE2 3.28Å |
| 58 | S | 91.5 | Very high | 91.6 | Very high | 56 Ų | 56 | 53.3 Ų | 53.3 | 39% | 0.392 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -79.1 | -36.5 | -177 | -58.7 | 0 | 0 | 0 | 0 | 113.6 | Y54 L55 | Y54-S58 VanDerWaalsContact CE2-OG 3.27Å; Y54-S58 WeakPolarHBondContact CE2-OG 3.23Å; Y54-S58 VanDerWaalsContact O-CB 3.22Å; Y54-S58 WeakPolarHBondContact O-CB 3.39Å; Y54-S58 PolarHBondContact O-N 3.37Å; Y54-S58 PolarHBondContact O-OG 2.99Å; L55-S58 PolarHBondContact O-N 2.84Å |
| 59 | F | 92.1 | Very high | 91.7 | Very high | 59 Ų | 59 | 52.4 Ų | 52.4 | 26% | 0.259 | 27% | 0.265 | S | S | . | . | trans | -104.1 | 108.2 | -174.3 | -66.7 | -85.5 | 0 | 0 | 0 | 111.7 | L55 K61 L62 Q63 S349 V350 | L55-F59 HydrophobicContact CD2-CD2 4.15Å; L55-F59 HydrophobicContact CD2-CE2 3.78Å; L55-F59 VanDerWaalsContact O-CD2 3.32Å; L55-F59 WeakPolarHBondContact O-CD2 3.39Å; L55-F59 PolarHBondContact O-N 3.31Å; F59-K61 PolarHBondContact O-N 3.48Å; F59-L62 HydrophobicContact CB-CB 4.34Å; F59-L62 HydrophobicContact CB-CD1 4.06Å; F59-L62 HydrophobicContact CB-CG 4.06Å; F59-L62 WeakPolarHBondContact O-CA 3.48Å; F59-L62 WeakPolarHBondContact O-CB 3.34Å; F59-L62 PolarHBondContact O-N 2.86Å; F59-Q63 PolarHBondContact O-N 3.35Å; F59-S349 WeakPolarHBondContact CZ-OG 3.39Å; F59-V350 HydrophobicContact CE2-CG2 3.82Å; F59-V350 HydrophobicContact CZ-CG2 3.97Å | ||
| 60 | R | 89.1 | Confident | 91.6 | Very high | 218 Ų | 218 | 52.6 Ų | 52.6 | 82% | 0.823 | 27% | 0.266 | S | S | * | . | G | 310 helix | trans | -53.8 | -30.9 | 177.7 | -70.1 | -164 | -179.6 | 177.8 | 1.9 | 114 | L62 Q63 | R60-L62 PolarHBondContact O-N 3.12Å; R60-Q63 PolarHBondContact O-N 2.93Å |
| 61 | K | 89.1 | Confident | 91.6 | Very high | 170 Ų | 170 | 53 Ų | 53 | 74% | 0.739 | 26% | 0.262 | S | S | * | . | G | 310 helix | trans | -63.6 | -26.5 | 175.2 | -68.6 | -176.7 | 179 | 178.7 | 0 | 113.1 | F59 | F59-K61 PolarHBondContact O-N 3.48Š|
| 62 | L | 87.3 | Confident | 91.8 | Very high | 2 Ų | 2 | 50.1 Ų | 50.1 | 1% | 0.01 | 25% | 0.248 | C | C | . | . | G | 310 helix | trans | -90.3 | -10.3 | 177.5 | -62.9 | -178.1 | 0 | 0 | 0 | 112.8 | L55 V56 F59 R60 T64 N67 E342 F343 | L55-L62 HydrophobicContact CB-CD1 4.23Å; V56-L62 HydrophobicContact CG2-CB 4.37Å; F59-L62 HydrophobicContact CB-CB 4.34Å; F59-L62 HydrophobicContact CB-CD1 4.06Å; F59-L62 HydrophobicContact CB-CG 4.06Å; F59-L62 WeakPolarHBondContact O-CA 3.48Å; F59-L62 WeakPolarHBondContact O-CB 3.34Å; F59-L62 PolarHBondContact O-N 2.86Å; R60-L62 PolarHBondContact O-N 3.12Å; L62-T64 PolarHBondContact O-N 2.99Å; L62-N67 WeakPolarHBondContact O-CB 3.46Å; L62-N67 PolarHBondContact O-ND2 2.92Å; L62-E342 HydrophobicContact CD2-CB 3.63Å; L62-F343 HydrophobicContact CD1-CD1 3.9Å; L62-F343 HydrophobicContact CD1-CD2 4.46Å; L62-F343 HydrophobicContact CD1-CE1 3.95Å; L62-F343 HydrophobicContact CD1-CG 4.18Å; L62-F343 HydrophobicContact CD1-CZ 4.29Å; L62-F343 HydrophobicContact CD2-CD2 3.8Å; L62-F343 HydrophobicContact CD2-CE2 3.94Å; L62-F343 HydrophobicContact CD2-CG 4.21Å; L62-F343 HydrophobicContact CD2-CZ 4.44Å |
| 63 | Q | 91.8 | Very high | 91.9 | Very high | 101 Ų | 101 | 50.2 Ų | 50.2 | 47% | 0.472 | 25% | 0.25 | S | S | . | . | trans | -78.7 | 67.2 | -178.3 | -65.4 | 176.7 | -7.3 | 0 | 0 | 112.3 | V56 S57 F59 R60 | V56-Q63 WeakPolarHBondContact O-CG 3.34Å; S57-Q63 PolarHBondContact O-NE2 3.28Å; F59-Q63 PolarHBondContact O-N 3.35Å; R60-Q63 PolarHBondContact O-N 2.93Å | ||
| 64 | T | 90.3 | Very high | 92 | Very high | 64 Ų | 64 | 48.3 Ų | 48.3 | 39% | 0.393 | 24% | 0.241 | S | C | . | . | trans | -110.6 | 157.8 | 178.9 | 67.7 | 0 | 0 | 0 | 0 | 111.3 | L62 S66 N67 A68 | L62-T64 PolarHBondContact O-N 2.99Å; T64-S66 PolarHBondContact O-N 3.49Å; T64-N67 PolarHBondContact O-N 3.15Å; T64-N67 PolarHBondContact OG1-N 3.11Å; T64-N67 PolarHBondContact OG1-ND2 3.43Å; T64-A68 PolarHBondContact O-N 2.68Å | ||
| 65 | T | 87.6 | Confident | 92.1 | Very high | 33 Ų | 33 | 44.1 Ų | 44.1 | 20% | 0.202 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -56.9 | -37.6 | 175.5 | 51.2 | 0 | 0 | 0 | 0 | 112.1 | N67 A68 F69 T158 | T65-N67 VanDerWaalsContact C-N 3.31Å; T65-N67 PolarHBondContact O-N 3.3Å; T65-A68 WeakPolarHBondContact O-CB 3.36Å; T65-A68 PolarHBondContact O-N 3.34Å; T65-F69 VanDerWaalsContact O-CD2 3.25Å; T65-F69 WeakPolarHBondContact O-CD2 3.43Å; T65-F69 PolarHBondContact O-N 3.49Å; T65-T158 HydrophobicContact CG2-CG2 4.34Å |
| 66 | S | 87.1 | Confident | 92.3 | Very high | 7 Ų | 7 | 44 Ų | 44 | 5% | 0.049 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.3 | -37 | 174.9 | -175.6 | 0 | 0 | 0 | 0 | 113.2 | T64 N137 R138 | T64-S66 PolarHBondContact O-N 3.49Å; S66-N137 VanDerWaalsContact CB-ND2 3.33Å; S66-N137 WeakPolarHBondContact CB-ND2 3.37Å; S66-N137 PolarHBondContact OG-ND2 2.87Å; S66-R138 PolarHBondContact OG-NH1 3.32Å; S66-R138 PolarHBondContact OG-NH2 3.38Å |
| 67 | N | 90.9 | Very high | 92.4 | Very high | 7 Ų | 7 | 43.5 Ų | 43.5 | 4% | 0.037 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -83 | -22.8 | -180 | -67.9 | -9.3 | 0 | 0 | 0 | 111.4 | V56 L62 T64 T65 F69 I70 V71 | V56-N67 HydrophobicContact CG1-CB 4.28Å; V56-N67 HydrophobicContact CG2-CB 4.32Å; L62-N67 WeakPolarHBondContact O-CB 3.46Å; L62-N67 PolarHBondContact O-ND2 2.92Å; T64-N67 PolarHBondContact O-N 3.15Å; T64-N67 PolarHBondContact OG1-N 3.11Å; T64-N67 PolarHBondContact OG1-ND2 3.43Å; T65-N67 VanDerWaalsContact C-N 3.31Å; T65-N67 PolarHBondContact O-N 3.3Å; N67-F69 VanDerWaalsContact C-N 3.32Å; N67-F69 PolarHBondContact O-N 3.48Å; N67-I70 WeakPolarHBondContact O-CB 3.28Å; N67-I70 PolarHBondContact O-N 2.67Å; N67-I70 VanDerWaalsContact O-N 3.16Å; N67-V71 WeakPolarHBondContact O-CG2 3.4Å; N67-V71 PolarHBondContact O-N 2.87Å |
| 68 | A | 93.8 | Very high | 92.5 | Very high | 29 Ų | 29 | 42.2 Ų | 42.2 | 24% | 0.24 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.5 | -39.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | T64 T65 I70 V71 N72 T158 | T64-A68 PolarHBondContact O-N 2.68Å; T65-A68 WeakPolarHBondContact O-CB 3.36Å; T65-A68 PolarHBondContact O-N 3.34Å; A68-I70 VanDerWaalsContact C-N 3.34Å; A68-V71 PolarHBondContact O-N 2.9Å; A68-N72 PolarHBondContact O-N 3.33Å; A68-T158 HydrophobicContact CB-CG2 4.23Å |
| 69 | F | 93.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.4 | -35 | 173.6 | -62 | -59.7 | 0 | 0 | 0 | 113.1 | T65 N67 N72 G73 L133 V134 N137 Y153 T158 M161 L162 | T65-F69 VanDerWaalsContact O-CD2 3.25Å; T65-F69 WeakPolarHBondContact O-CD2 3.43Å; T65-F69 PolarHBondContact O-N 3.49Å; N67-F69 VanDerWaalsContact C-N 3.32Å; N67-F69 PolarHBondContact O-N 3.48Å; F69-N72 PolarHBondContact O-N 3.15Å; F69-G73 PolarHBondContact O-N 3Å; F69-G73 VanDerWaalsContact O-N 3.11Å; F69-L133 HydrophobicContact CD1-CB 3.66Å; F69-L133 HydrophobicContact CD1-CD1 3.83Å; F69-L133 HydrophobicContact CD1-CG 4.31Å; F69-L133 HydrophobicContact CE1-CB 4.02Å; F69-L133 HydrophobicContact CE1-CD1 3.94Å; F69-L133 HydrophobicContact CE1-CD2 4.5Å; F69-L133 HydrophobicContact CE1-CG 4.38Å; F69-L133 HydrophobicContact CG-CB 4.11Å; F69-V134 HydrophobicContact CB-CG2 3.65Å; F69-N137 HydrophobicContact CD2-CB 4.01Å; F69-N137 HydrophobicContact CE2-CB 4.03Å; F69-Y153 AromaticContact CE2-CD1 3.72Å; F69-Y153 HydrophobicContact CE2-CD1 3.72Å; F69-Y153 AromaticContact CE2-CE1 3.47Å; F69-Y153 HydrophobicContact CE2-CE1 3.47Å; F69-Y153 VanDerWaalsContact CE2-CE1 3.47Å; F69-Y153 AromaticContact CZ-CD1 3.89Å; F69-Y153 HydrophobicContact CZ-CD1 3.89Å; F69-Y153 AromaticContact CZ-CE1 3.61Å; F69-Y153 HydrophobicContact CZ-CE1 3.61Å; F69-T158 HydrophobicContact CE1-CG2 4.13Å; F69-T158 HydrophobicContact CE2-CG2 4.3Å; F69-T158 HydrophobicContact CZ-CG2 3.83Å; F69-M161 HydrophobicContact CE1-CB 4.09Å; F69-M161 HydrophobicContact CE1-CE 3.99Å; F69-M161 HydrophobicContact CE1-SD 4.48Å; F69-M161 HydrophobicContact CZ-CE 3.69Å; F69-M161 HydrophobicContact CZ-SD 4.07Å; F69-L162 HydrophobicContact CD1-CD1 3.65Å; F69-L162 HydrophobicContact CE1-CD1 3.56Å |
| 70 | I | 91.9 | Very high | 92.7 | Very high | 5 Ų | 5 | 37.6 Ų | 37.6 | 3% | 0.026 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -66.3 | -45.9 | 175 | -61.9 | 169 | 0 | 0 | 0 | 109.6 | V52 N67 A68 N72 G73 C74 V134 Y336 | V52-I70 HydrophobicContact CG1-CG2 4.11Å; N67-I70 WeakPolarHBondContact O-CB 3.28Å; N67-I70 PolarHBondContact O-N 2.67Å; N67-I70 VanDerWaalsContact O-N 3.16Å; A68-I70 VanDerWaalsContact C-N 3.34Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.88Å; I70-G73 PolarHBondContact O-N 3.35Å; I70-G73 VanDerWaalsContact O-N 3.16Å; I70-C74 PolarHBondContact O-N 3.48Å; I70-C74 PolarHBondContact O-SG 3.49Å; I70-V134 HydrophobicContact CG1-CG2 4.14Å; I70-Y336 HydrophobicContact CD1-CG 4.36Å; I70-Y336 HydrophobicContact CG1-CG 4.3Å; I70-Y336 HydrophobicContact CG2-CD2 4.41Å; I70-Y336 HydrophobicContact CG2-CG 4.46Å |
| 71 | V | 95.2 | Very high | 93.1 | Very high | 35 Ų | 35 | 27.2 Ų | 27.2 | 21% | 0.212 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -60.7 | -39.4 | 175.9 | 167.8 | 0 | 0 | 0 | 0 | 111.7 | I53 V56 N67 A68 G73 C74 A75 | I53-V71 HydrophobicContact CG1-CG1 4.28Å; V56-V71 HydrophobicContact CB-CG2 3.64Å; V56-V71 HydrophobicContact CG1-CG2 3.67Å; V56-V71 HydrophobicContact CG2-CG2 3.79Å; N67-V71 WeakPolarHBondContact O-CG2 3.4Å; N67-V71 PolarHBondContact O-N 2.87Å; A68-V71 PolarHBondContact O-N 2.9Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-G73 PolarHBondContact O-N 2.68Å; V71-C74 PolarHBondContact O-N 3.3Å; V71-A75 WeakPolarHBondContact O-CB 3.49Å; V71-A75 PolarHBondContact O-N 3.05Å |
| 72 | N | 96.4 | Very high | 93.4 | Very high | 10 Ų | 10 | 21 Ų | 21 | 5% | 0.053 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.1 | -42.4 | 174.9 | -166.1 | 69.7 | 0 | 0 | 0 | 111.9 | A68 F69 I70 A75 A76 S130 L162 S165 W166 | A68-N72 PolarHBondContact O-N 3.33Å; F69-N72 PolarHBondContact O-N 3.15Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.88Å; N72-A75 PolarHBondContact O-N 2.6Å; N72-A76 PolarHBondContact O-N 3.38Å; N72-A76 VanDerWaalsContact O-N 3.13Å; N72-S130 PolarHBondContact ND2-OG 3.44Å; N72-L162 HydrophobicContact CB-CD2 4.13Å; N72-L162 HydrophobicContact CB-CG 4.03Å; N72-S165 PolarHBondContact ND2-OG 3.19Å; N72-S165 VanDerWaalsContact ND2-OG 3.16Å; N72-W166 PolarHBondContact OD1-NE1 3.06Å |
| 73 | G | 95.3 | Very high | 93.6 | Very high | 5 Ų | 5 | 25.4 Ų | 25.4 | 5% | 0.052 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61 | -48.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F69 I70 V71 A75 A76 D77 S130 | F69-G73 PolarHBondContact O-N 3Å; F69-G73 VanDerWaalsContact O-N 3.11Å; I70-G73 PolarHBondContact O-N 3.35Å; I70-G73 VanDerWaalsContact O-N 3.16Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-G73 PolarHBondContact O-N 2.68Å; G73-A75 VanDerWaalsContact C-N 3.29Å; G73-A75 PolarHBondContact O-N 3.11Å; G73-A76 WeakPolarHBondContact O-CB 3.44Å; G73-A76 PolarHBondContact O-N 3.31Å; G73-A76 VanDerWaalsContact O-N 3.11Å; G73-D77 VanDerWaalsContact O-CG 3.31Å; G73-D77 PolarHBondContact O-N 3.1Å; G73-S130 PolarHBondContact N-OG 3.45Å |
| 74 | C | 95.8 | Very high | 93.7 | Very high | 4 Ų | 4 | 21.1 Ų | 21.1 | 3% | 0.027 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.1 | -35.4 | 177.3 | -68.4 | 0 | 0 | 0 | 0 | 113.1 | N49 I53 I70 V71 D77 L78 | N49-C74 HydrophobicContact CB-CB 4.12Å; N49-C74 WeakPolarHBondContact OD1-CA 3.45Å; N49-C74 PolarHBondContact OD1-SG 2.87Å; N49-C74 VanDerWaalsContact OD1-SG 3.34Å; I53-C74 HydrophobicContact CD1-CB 3.96Å; I53-C74 HydrophobicContact CG1-CB 3.75Å; I70-C74 PolarHBondContact O-N 3.48Å; I70-C74 PolarHBondContact O-SG 3.49Å; V71-C74 PolarHBondContact O-N 3.3Å; C74-D77 PolarHBondContact O-N 3.06Å; C74-L78 WeakPolarHBondContact O-CB 3.44Å; C74-L78 WeakPolarHBondContact O-CG 3.46Å; C74-L78 PolarHBondContact O-N 2.74Å |
| 75 | A | 96.2 | Very high | 93.8 | Very high | 36 Ų | 36 | 18 Ų | 18 | 30% | 0.298 | 12% | 0.115 | S | C | . | . | H | α-helix | trans | -66.5 | -39.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I53 V71 N72 G73 S79 W166 | I53-A75 HydrophobicContact CD1-CB 4.48Å; V71-A75 WeakPolarHBondContact O-CB 3.49Å; V71-A75 PolarHBondContact O-N 3.05Å; N72-A75 PolarHBondContact O-N 2.6Å; G73-A75 VanDerWaalsContact C-N 3.29Å; G73-A75 PolarHBondContact O-N 3.11Å; A75-S79 PolarHBondContact O-N 3.13Å; A75-W166 HydrophobicContact CB-CZ2 4.38Å |
| 76 | A | 96.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -67 | -46.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | N72 G73 L78 S79 V80 V126 | N72-A76 PolarHBondContact O-N 3.38Å; N72-A76 VanDerWaalsContact O-N 3.13Å; G73-A76 WeakPolarHBondContact O-CB 3.44Å; G73-A76 PolarHBondContact O-N 3.31Å; G73-A76 VanDerWaalsContact O-N 3.11Å; A76-L78 VanDerWaalsContact C-N 3.29Å; A76-L78 PolarHBondContact O-N 3.39Å; A76-S79 WeakPolarHBondContact O-CB 3.11Å; A76-S79 PolarHBondContact O-N 3.11Å; A76-S79 PolarHBondContact O-OG 3.27Å; A76-V80 PolarHBondContact O-N 2.73Å; A76-V126 HydrophobicContact CB-CB 3.79Å; A76-V126 HydrophobicContact CB-CG1 3.7Å |
| 77 | D | 95.8 | Very high | 94.3 | Very high | 1 Ų | 1 | 20.6 Ų | 20.6 | 1% | 0.005 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.1 | -32.6 | 178.5 | -66.8 | -20.8 | 0 | 0 | 0 | 111.7 | G73 C74 S79 V80 C81 S127 S329 N332 | G73-D77 VanDerWaalsContact O-CG 3.31Å; G73-D77 PolarHBondContact O-N 3.1Å; C74-D77 PolarHBondContact O-N 3.06Å; D77-S79 VanDerWaalsContact C-N 3.33Å; D77-S79 PolarHBondContact O-N 3.47Å; D77-V80 PolarHBondContact O-N 3.48Å; D77-V80 VanDerWaalsContact O-N 3.16Å; D77-C81 WeakPolarHBondContact O-CB 3.49Å; D77-C81 PolarHBondContact O-N 2.86Å; D77-C81 PolarHBondContact O-SG 2.83Å; D77-C81 VanDerWaalsContact O-SG 3.39Å; D77-S127 VanDerWaalsContact OD1-CB 3.29Å; D77-S127 WeakPolarHBondContact OD1-CB 3.46Å; D77-S127 PolarHBondContact OD1-OG 3.26Å; D77-S329 WeakPolarHBondContact CB-O 3.46Å; D77-N332 WeakPolarHBondContact OD2-CB 3.4Å; D77-N332 PolarHBondContact OD2-ND2 2.9Å |
| 78 | L | 95.5 | Very high | 94.1 | Very high | 44 Ų | 44 | 21.6 Ų | 21.6 | 23% | 0.23 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.3 | -40 | 170.1 | -83.7 | -178.6 | 0 | 0 | 0 | 112.4 | T46 N49 I53 C74 A76 V80 C81 A82 | T46-L78 HydrophobicContact CG2-CD2 4.02Å; T46-L78 WeakPolarHBondContact O-CD2 3.25Å; N49-L78 HydrophobicContact CB-CD2 3.78Å; N49-L78 HydrophobicContact CB-CG 3.77Å; I53-L78 HydrophobicContact CD1-CD1 3.49Å; I53-L78 VanDerWaalsContact CD1-CD1 3.49Å; I53-L78 HydrophobicContact CD1-CG 4.36Å; C74-L78 WeakPolarHBondContact O-CB 3.44Å; C74-L78 WeakPolarHBondContact O-CG 3.46Å; C74-L78 PolarHBondContact O-N 2.74Å; A76-L78 VanDerWaalsContact C-N 3.29Å; A76-L78 PolarHBondContact O-N 3.39Å; L78-V80 PolarHBondContact O-N 3.48Å; L78-C81 PolarHBondContact O-N 3.16Å; L78-A82 WeakPolarHBondContact O-CA 3.29Å; L78-A82 WeakPolarHBondContact O-CB 3.4Å; L78-A82 PolarHBondContact O-N 3.26Å |
| 79 | S | 94.1 | Very high | 93.9 | Very high | 17 Ų | 17 | 20.4 Ų | 20.4 | 12% | 0.119 | 12% | 0.123 | C | C | . | . | I | π-helix | trans | -63 | -34 | 176.3 | 76.6 | 0 | 0 | 0 | 0 | 111.6 | A75 A76 D77 L83 W84 G123 | A75-S79 PolarHBondContact O-N 3.13Å; A76-S79 WeakPolarHBondContact O-CB 3.11Å; A76-S79 PolarHBondContact O-N 3.11Å; A76-S79 PolarHBondContact O-OG 3.27Å; D77-S79 VanDerWaalsContact C-N 3.33Å; D77-S79 PolarHBondContact O-N 3.47Å; S79-L83 VanDerWaalsContact O-CB 3.29Å; S79-L83 WeakPolarHBondContact O-CB 3.2Å; S79-L83 PolarHBondContact O-N 2.79Å; S79-W84 PolarHBondContact O-N 3.45Å; S79-G123 WeakPolarHBondContact OG-CA 3.33Å |
| 80 | V | 94.4 | Very high | 93.7 | Very high | 1 Ų | 1 | 24.5 Ų | 24.5 | 1% | 0.006 | 15% | 0.148 | C | C | . | . | I | π-helix | trans | -76.1 | -52 | 176.1 | -173.9 | 0 | 0 | 0 | 0 | 110.8 | A76 D77 L78 W84 M85 L124 | A76-V80 PolarHBondContact O-N 2.73Å; D77-V80 PolarHBondContact O-N 3.48Å; D77-V80 VanDerWaalsContact O-N 3.16Å; L78-V80 PolarHBondContact O-N 3.48Å; V80-W84 HydrophobicContact CG1-CE3 3.94Å; V80-W84 WeakPolarHBondContact O-CB 3.33Å; V80-W84 PolarHBondContact O-N 2.83Å; V80-W84 VanDerWaalsContact O-N 3.14Å; V80-M85 HydrophobicContact CG1-CE 3.75Å; V80-M85 HydrophobicContact CG1-CG 4.37Å; V80-M85 WeakPolarHBondContact O-CG 3.47Å; V80-M85 PolarHBondContact O-N 3.45Å; V80-L124 HydrophobicContact CG2-CD2 4.36Å |
| 81 | C | 95.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 15% | 0.154 | C | C | . | . | I | π-helix | trans | -69.5 | -42.4 | -175.2 | -67.7 | 0 | 0 | 0 | 0 | 113.7 | A42 D77 L78 M85 P86 | A42-C81 WeakPolarHBondContact CA-O 3.31Å; A42-C81 VanDerWaalsContact CB-O 3.24Å; A42-C81 WeakPolarHBondContact CB-O 3.33Å; D77-C81 WeakPolarHBondContact O-CB 3.49Å; D77-C81 PolarHBondContact O-N 2.86Å; D77-C81 PolarHBondContact O-SG 2.83Å; D77-C81 VanDerWaalsContact O-SG 3.39Å; L78-C81 PolarHBondContact O-N 3.16Å; C81-M85 HydrophobicContact CB-CE 4.43Å; C81-M85 HydrophobicContact CB-SD 4.4Å; C81-M85 VanDerWaalsContact SG-CE 3.51Å; C81-P86 WeakPolarHBondContact O-CD 3.36Å |
| 82 | A | 95.3 | Very high | 92.6 | Very high | 41 Ų | 41 | 24.8 Ų | 24.8 | 34% | 0.339 | 15% | 0.152 | S | C | . | . | I | π-helix | trans | -90.4 | -27.5 | -173 | 0 | 0 | 0 | 0 | 0 | 113 | T46 L78 | T46-A82 HydrophobicContact CG2-CB 3.97Å; T46-A82 WeakPolarHBondContact OG1-CA 3.46Å; T46-A82 WeakPolarHBondContact OG1-CB 3.39Å; T46-A82 PolarHBondContact OG1-N 2.89Å; L78-A82 WeakPolarHBondContact O-CA 3.29Å; L78-A82 WeakPolarHBondContact O-CB 3.4Å; L78-A82 PolarHBondContact O-N 3.26Å |
| 83 | L | 92.8 | Very high | 92 | Very high | 94 Ų | 94 | 29.1 Ų | 29.1 | 49% | 0.492 | 18% | 0.175 | S | C | . | . | I | π-helix | trans | -112.6 | -42.3 | -173.7 | -53 | 175.4 | 0 | 0 | 0 | 112.7 | S79 Q87 L119 | S79-L83 VanDerWaalsContact O-CB 3.29Å; S79-L83 WeakPolarHBondContact O-CB 3.2Å; S79-L83 PolarHBondContact O-N 2.79Å; L83-Q87 VanDerWaalsContact O-CD 3.3Å; L83-Q87 WeakPolarHBondContact O-CG 3.34Å; L83-Q87 PolarHBondContact O-NE2 2.84Å; L83-L119 HydrophobicContact CB-CD1 4.23Å; L83-L119 HydrophobicContact CB-CD2 3.48Å; L83-L119 VanDerWaalsContact CB-CD2 3.48Å; L83-L119 HydrophobicContact CB-CG 4.38Å; L83-L119 HydrophobicContact CD1-CD1 4.02Å |
| 84 | W | 93.2 | Very high | 91.1 | Very high | 10 Ų | 10 | 32 Ų | 32 | 4% | 0.038 | 19% | 0.189 | C | C | . | . | I | π-helix | trans | -88.3 | -51 | -175.6 | -178.7 | 82 | 0 | 0 | 0 | 113.9 | Y38 S79 V80 P86 Q87 E88 L119 L120 W322 | Y38-W84 HydrophobicContact CE1-CH2 4.39Å; Y38-W84 HydrophobicContact CE1-CZ3 4.09Å; S79-W84 PolarHBondContact O-N 3.45Å; V80-W84 HydrophobicContact CG1-CE3 3.94Å; V80-W84 WeakPolarHBondContact O-CB 3.33Å; V80-W84 PolarHBondContact O-N 2.83Å; V80-W84 VanDerWaalsContact O-N 3.14Å; W84-P86 VanDerWaalsContact C-CD 3.46Å; W84-Q87 WeakPolarHBondContact O-CB 3.3Å; W84-Q87 PolarHBondContact O-N 3.47Å; W84-E88 HydrophobicContact CD2-CG 3.88Å; W84-E88 VanDerWaalsContact CE2-OE1 3.28Å; W84-E88 HydrophobicContact CE3-CG 3.93Å; W84-E88 HydrophobicContact CH2-CG 3.43Å; W84-E88 VanDerWaalsContact CH2-CG 3.43Å; W84-E88 HydrophobicContact CZ2-CG 3.34Å; W84-E88 WeakPolarHBondContact CZ2-OE1 3.47Å; W84-E88 HydrophobicContact CZ3-CG 3.71Å; W84-E88 PolarHBondContact NE1-OE1 3.48Å; W84-E88 PolarHBondContact O-N 3.45Å; W84-L119 HydrophobicContact CB-CD2 3.99Å; W84-L119 HydrophobicContact CB-CG 4.32Å; W84-L120 HydrophobicContact CD2-CB 4.43Å; W84-L120 HydrophobicContact CD2-CD1 3.65Å; W84-L120 HydrophobicContact CD2-CG 4.45Å; W84-L120 HydrophobicContact CE3-CD1 3.98Å; W84-L120 HydrophobicContact CG-CB 4.2Å; W84-L120 HydrophobicContact CG-CD1 4.14Å; W84-L120 HydrophobicContact CH2-CD1 4.06Å; W84-L120 HydrophobicContact CH2-CD2 4.46Å; W84-L120 HydrophobicContact CZ2-CD1 3.75Å; W84-L120 HydrophobicContact CZ2-CD2 3.61Å; W84-L120 HydrophobicContact CZ2-CG 4.21Å; W84-L120 HydrophobicContact CZ3-CD1 4.18Å; W84-W322 HydrophobicContact CH2-CE3 4.27Å |
| 85 | M | 92.9 | Very high | 89.8 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -57.3 | -38.8 | -177.4 | -67.7 | -177.6 | -163 | 0 | 0 | 114.2 | Y38 L41 A42 V80 C81 Q87 E88 A89 C326 | Y38-M85 HydrophobicContact CD1-CB 4.45Å; Y38-M85 HydrophobicContact CD1-CG 4.34Å; L41-M85 HydrophobicContact CB-SD 3.97Å; A42-M85 HydrophobicContact CB-CB 3.82Å; V80-M85 HydrophobicContact CG1-CE 3.75Å; V80-M85 HydrophobicContact CG1-CG 4.37Å; V80-M85 WeakPolarHBondContact O-CG 3.47Å; V80-M85 PolarHBondContact O-N 3.45Å; C81-M85 HydrophobicContact CB-CE 4.43Å; C81-M85 HydrophobicContact CB-SD 4.4Å; C81-M85 VanDerWaalsContact SG-CE 3.51Å; M85-Q87 VanDerWaalsContact C-N 3.27Å; M85-Q87 PolarHBondContact O-N 3.3Å; M85-E88 WeakPolarHBondContact O-CB 3.37Å; M85-E88 PolarHBondContact O-N 2.98Å; M85-A89 PolarHBondContact O-N 2.72Å; M85-C326 VanDerWaalsContact CE-CA 3.49Å; M85-C326 HydrophobicContact CE-CB 3.39Å; M85-C326 WeakPolarHBondContact CE-O 3.38Å; M85-C326 HydrophobicContact SD-CB 3.98Å |
| 86 | P | 93.3 | Very high | 87.9 | Confident | 50 Ų | 50 | 37 Ų | 37 | 33% | 0.325 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.3 | -34.4 | 175.7 | -23.8 | 36 | 0 | 0 | 0 | 112.6 | A42 C81 W84 A89 V90 | A42-P86 HydrophobicContact CB-CG 4.02Å; C81-P86 WeakPolarHBondContact O-CD 3.36Å; W84-P86 VanDerWaalsContact C-CD 3.46Å; P86-A89 PolarHBondContact O-N 2.95Å; P86-V90 WeakPolarHBondContact O-CG2 3.47Å; P86-V90 PolarHBondContact O-N 3.43Å |
| 87 | Q | 90.8 | Very high | 85.7 | Confident | 43 Ų | 43 | 41.2 Ų | 41.2 | 20% | 0.201 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.8 | -43.8 | 175.5 | -61.1 | 173.9 | 25 | 0 | 0 | 110.3 | L83 W84 M85 A89 V90 L91 | L83-Q87 VanDerWaalsContact O-CD 3.3Å; L83-Q87 WeakPolarHBondContact O-CG 3.34Å; L83-Q87 PolarHBondContact O-NE2 2.84Å; W84-Q87 WeakPolarHBondContact O-CB 3.3Å; W84-Q87 PolarHBondContact O-N 3.47Å; M85-Q87 VanDerWaalsContact C-N 3.27Å; M85-Q87 PolarHBondContact O-N 3.3Å; Q87-A89 VanDerWaalsContact C-N 3.34Å; Q87-A89 PolarHBondContact O-N 2.93Å; Q87-V90 PolarHBondContact O-N 3.26Å; Q87-L91 WeakPolarHBondContact O-CB 3.39Å; Q87-L91 VanDerWaalsContact O-CG 3.23Å; Q87-L91 WeakPolarHBondContact O-CG 3.44Å; Q87-L91 PolarHBondContact O-N 3.43Å |
| 88 | E | 87.2 | Confident | 83.7 | Confident | 29 Ų | 29 | 44 Ų | 44 | 14% | 0.136 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 174.6 | -63.5 | -51.3 | 126.5 | 0 | 0 | 112.8 | Y38 W84 M85 L91 G92 R116 | Y38-E88 HydrophobicContact CD1-CB 4.38Å; Y38-E88 HydrophobicContact CD2-CB 4.24Å; Y38-E88 HydrophobicContact CE1-CB 4.47Å; Y38-E88 HydrophobicContact CE2-CB 4.34Å; Y38-E88 HydrophobicContact CG-CB 4.27Å; W84-E88 HydrophobicContact CD2-CG 3.88Å; W84-E88 VanDerWaalsContact CE2-OE1 3.28Å; W84-E88 HydrophobicContact CE3-CG 3.93Å; W84-E88 HydrophobicContact CH2-CG 3.43Å; W84-E88 VanDerWaalsContact CH2-CG 3.43Å; W84-E88 HydrophobicContact CZ2-CG 3.34Å; W84-E88 WeakPolarHBondContact CZ2-OE1 3.47Å; W84-E88 HydrophobicContact CZ3-CG 3.71Å; W84-E88 PolarHBondContact NE1-OE1 3.48Å; W84-E88 PolarHBondContact O-N 3.45Å; M85-E88 WeakPolarHBondContact O-CB 3.37Å; M85-E88 PolarHBondContact O-N 2.98Å; E88-L91 PolarHBondContact O-N 2.92Å; E88-G92 PolarHBondContact O-N 3.1Å; E88-R116 IonicContact OE1-CZ 2.58Å; E88-R116 IonicContact OE1-NE 3.31Å; E88-R116 PolarHBondContact OE1-NE 3.29Å; E88-R116 IonicContact OE1-NH2 2.81Å; E88-R116 PolarHBondContact OE1-NH2 3.43Å; E88-R116 IonicContact OE2-CZ 3.23Å; E88-R116 IonicContact OE2-NH2 3.6Å; E88-R116 PolarHBondContact OE2-NH2 2.94Å |
| 89 | A | 90.1 | Very high | 81.6 | Confident | 3 Ų | 3 | 43.1 Ų | 43.1 | 3% | 0.025 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | S35 S39 M85 P86 Q87 G92 L93 | S35-A89 WeakPolarHBondContact CB-O 3.26Å; S35-A89 WeakPolarHBondContact O-CB 3.28Å; S35-A89 PolarHBondContact OG-O 2.84Å; S39-A89 WeakPolarHBondContact OG-CB 3.48Å; M85-A89 PolarHBondContact O-N 2.72Å; P86-A89 PolarHBondContact O-N 2.95Å; Q87-A89 VanDerWaalsContact C-N 3.34Å; Q87-A89 PolarHBondContact O-N 2.93Å; A89-G92 PolarHBondContact O-N 3.4Å; A89-L93 WeakPolarHBondContact O-CG 3.35Å; A89-L93 PolarHBondContact O-N 2.98Å |
| 90 | V | 88.4 | Confident | 79.7 | Confident | 87 Ų | 87 | 47.2 Ų | 47.2 | 53% | 0.527 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -67.6 | -47.6 | 177 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | P86 Q87 G92 L93 L94 | P86-V90 WeakPolarHBondContact O-CG2 3.47Å; P86-V90 PolarHBondContact O-N 3.43Å; Q87-V90 PolarHBondContact O-N 3.26Å; V90-G92 PolarHBondContact O-N 3.23Å; V90-L93 PolarHBondContact O-N 2.86Å; V90-L94 PolarHBondContact O-N 3.19Å |
| 91 | L | 83.6 | Confident | 77.6 | Confident | 27 Ų | 27 | 48.4 Ų | 48.4 | 14% | 0.141 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.2 | -32 | 178.5 | -70.2 | 172.9 | 0 | 0 | 0 | 112.5 | Q87 E88 L93 L94 R116 | Q87-L91 WeakPolarHBondContact O-CB 3.39Å; Q87-L91 VanDerWaalsContact O-CG 3.23Å; Q87-L91 WeakPolarHBondContact O-CG 3.44Å; Q87-L91 PolarHBondContact O-N 3.43Å; E88-L91 PolarHBondContact O-N 2.92Å; L91-L93 VanDerWaalsContact C-N 3.26Å; L91-L93 PolarHBondContact O-N 3.45Å; L91-L94 HydrophobicContact CD2-CD1 4.21Å; L91-L94 PolarHBondContact O-N 3.39Å; L91-R116 VanDerWaalsContact CD1-CZ 3.46Å |
| 92 | G | 81.3 | Confident | 75.5 | Confident | 18 Ų | 18 | 51.9 Ų | 51.9 | 19% | 0.186 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -67.3 | -24.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | R31 S35 E88 A89 V90 | R31-G92 WeakPolarHBondContact CB-O 3.03Å; S35-G92 WeakPolarHBondContact OG-CA 3.48Å; E88-G92 PolarHBondContact O-N 3.1Å; A89-G92 PolarHBondContact O-N 3.4Å; V90-G92 PolarHBondContact O-N 3.23Å |
| 93 | L | 83 | Confident | 73.3 | Confident | 101 Ų | 101 | 51.8 Ų | 51.8 | 53% | 0.529 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -94.6 | -12.1 | 179.7 | -65.5 | 172.8 | 0 | 0 | 0 | 113.7 | I32 A89 V90 L91 | I32-L93 HydrophobicContact CG1-CD2 4.15Å; A89-L93 WeakPolarHBondContact O-CG 3.35Å; A89-L93 PolarHBondContact O-N 2.98Å; V90-L93 PolarHBondContact O-N 2.86Å; L91-L93 VanDerWaalsContact C-N 3.26Å; L91-L93 PolarHBondContact O-N 3.45Å |
| 94 | L | 78 | Confident | 71.3 | Confident | 66 Ų | 66 | 53.4 Ų | 53.4 | 35% | 0.346 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -77.7 | 138 | 178.6 | -71.6 | 175.5 | 0 | 0 | 0 | 111.5 | V90 L91 | V90-L94 PolarHBondContact O-N 3.19Å; L91-L94 HydrophobicContact CD2-CD1 4.21Å; L91-L94 PolarHBondContact O-N 3.39Å |
| 95 | P | 67.5 | Low | 69.3 | Low | 70 Ų | 70 | 60.4 Ų | 60.4 | 46% | 0.455 | 37% | 0.369 | S | S | . | . | trans | -55.5 | 144.5 | 172.6 | -24.4 | 31.5 | 0 | 0 | 0 | 112 | G97 S98 A99 | P95-G97 PolarHBondContact O-N 2.96Å; P95-S98 WeakPolarHBondContact CD-OG 3.49Å; P95-S98 PolarHBondContact O-N 3.38Å; P95-S98 PolarHBondContact O-OG 3.02Å; P95-A99 PolarHBondContact O-N 3.32Å | ||
| 96 | A | 55.5 | Low | 67.3 | Low | 76 Ų | 76 | 67.5 Ų | 67.5 | 63% | 0.628 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | -25.8 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 97 | G | 52.1 | Low | 65.6 | Low | 87 Ų | 87 | 67.9 Ų | 67.9 | 90% | 0.897 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | -6.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 116 | P95 | P95-G97 PolarHBondContact O-N 2.96Š|
| 98 | S | 53.1 | Low | 64 | Low | 60 Ų | 60 | 68.9 Ų | 68.9 | 42% | 0.42 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113 | -0.9 | 178 | 64.4 | 0 | 0 | 0 | 0 | 113.2 | P95 E100 | P95-S98 WeakPolarHBondContact CD-OG 3.49Å; P95-S98 PolarHBondContact O-N 3.38Å; P95-S98 PolarHBondContact O-OG 3.02Å; S98-E100 VanDerWaalsContact C-N 3.34Å; S98-E100 PolarHBondContact O-N 2.66Å |
| 99 | A | 52.3 | Low | 62.9 | Low | 25 Ų | 25 | 67.6 Ų | 67.6 | 21% | 0.207 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -74.8 | -16.5 | -158.1 | 0 | 0 | 0 | 0 | 0 | 115 | P95 | P95-A99 PolarHBondContact O-N 3.32Š|
| 100 | E | 53.1 | Low | 61.9 | Low | 104 Ų | 104 | 69.3 Ų | 69.3 | 49% | 0.486 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -143 | 144.8 | 167.7 | -70.4 | -162 | 162.7 | 0 | 0 | 109.8 | S98 P102 R113 | S98-E100 VanDerWaalsContact C-N 3.34Å; S98-E100 PolarHBondContact O-N 2.66Å; E100-P102 WeakPolarHBondContact O-CD 3.32Å; E100-P102 VanDerWaalsContact O-N 3.14Å; E100-R113 IonicContact OE2-NH1 3.49Å |
| 101 | P | 51.3 | Low | 61.3 | Low | 25 Ų | 25 | 68.8 Ų | 68.8 | 16% | 0.162 | 45% | 0.448 | C | S | . | . | trans | -50.6 | 123.9 | 165.2 | 21.7 | -32.1 | 0 | 0 | 0 | 108.8 | A103 W105 R113 | P101-A103 PolarHBondContact O-N 2.95Å; P101-W105 HydrophobicContact CB-CB 4.38Å; P101-W105 HydrophobicContact CB-CD2 4.04Å; P101-W105 HydrophobicContact CB-CE3 3.07Å; P101-W105 HydrophobicContact CB-CZ3 3.54Å; P101-R113 PolarHBondContact O-NH1 2.89Å | ||
| 102 | P | 50.2 | Low | 61.1 | Low | 73 Ų | 73 | 71.3 Ų | 71.3 | 47% | 0.474 | 46% | 0.457 | S | S | . | . | trans | -46.2 | 141.5 | 176 | 10.3 | -25.3 | 0 | 0 | 0 | 109.6 | E100 D104 W105 | E100-P102 WeakPolarHBondContact O-CD 3.32Å; E100-P102 VanDerWaalsContact O-N 3.14Å; P102-D104 PolarHBondContact O-N 3.19Å; P102-D104 VanDerWaalsContact O-N 3.08Å; P102-W105 HydrophobicContact CG-CB 4.49Å; P102-W105 HydrophobicContact CG-CE3 4.41Å; P102-W105 WeakPolarHBondContact O-CB 3.44Å; P102-W105 PolarHBondContact O-N 2.9Å | ||
| 103 | A | 50.3 | Low | 60.9 | Low | 40 Ų | 40 | 73.2 Ų | 73.2 | 33% | 0.331 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -17.2 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | P101 P183 | P101-A103 PolarHBondContact O-N 2.95Å; A103-P183 HydrophobicContact CB-CG 3.21Å |
| 104 | D | 50.2 | Low | 60.7 | Low | 127 Ų | 127 | 73.7 Ų | 73.7 | 68% | 0.679 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -2.5 | 171.2 | 21 | -47.7 | 0 | 0 | 0 | 112.6 | P102 D106 | P102-D104 PolarHBondContact O-N 3.19Å; P102-D104 VanDerWaalsContact O-N 3.08Å; D104-D106 PolarHBondContact O-N 3.08Å |
| 105 | W | 51.5 | Low | 61 | Low | 158 Ų | 158 | 75.9 Ų | 75.9 | 60% | 0.598 | 47% | 0.472 | S | S | * | . | S | Bend | trans | -75.8 | 77.7 | 165.3 | -145.7 | -9.4 | 0 | 0 | 0 | 108.8 | P101 P102 G107 G109 | P101-W105 HydrophobicContact CB-CB 4.38Å; P101-W105 HydrophobicContact CB-CD2 4.04Å; P101-W105 HydrophobicContact CB-CE3 3.07Å; P101-W105 HydrophobicContact CB-CZ3 3.54Å; P102-W105 HydrophobicContact CG-CB 4.49Å; P102-W105 HydrophobicContact CG-CE3 4.41Å; P102-W105 WeakPolarHBondContact O-CB 3.44Å; P102-W105 PolarHBondContact O-N 2.9Å; W105-G107 PolarHBondContact O-N 3.33Å; W105-G109 PolarHBondContact O-N 3.5Å |
| 106 | D | 50.4 | Low | 61.8 | Low | 148 Ų | 148 | 75 Ų | 75 | 79% | 0.791 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -44.2 | 120.6 | -176.3 | -71.1 | -36.9 | 0 | 0 | 0 | 112.1 | D104 A108 | D104-D106 PolarHBondContact O-N 3.08Å; D106-A108 VanDerWaalsContact C-N 3.34Å; D106-A108 PolarHBondContact O-N 3.35Å |
| 107 | G | 56.9 | Low | 63.1 | Low | 59 Ų | 59 | 73.4 Ų | 73.4 | 61% | 0.608 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.7 | -44 | 171.8 | 0 | 0 | 0 | 0 | 0 | 117 | W105 S111 | W105-G107 PolarHBondContact O-N 3.33Å; G107-S111 WeakPolarHBondContact O-CB 3.44Å; G107-S111 PolarHBondContact O-OG 3.14Å |
| 108 | A | 57.5 | Low | 64.7 | Low | 64 Ų | 64 | 70.1 Ų | 70.1 | 53% | 0.529 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -85.7 | -43 | -172.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | D106 S111 Y112 | D106-A108 VanDerWaalsContact C-N 3.34Å; D106-A108 PolarHBondContact O-N 3.35Å; A108-S111 PolarHBondContact O-N 3.32Å; A108-Y112 PolarHBondContact O-N 2.94Å; A108-Y112 VanDerWaalsContact O-N 3.14Å |
| 109 | G | 63.8 | Low | 66.3 | Low | 2 Ų | 2 | 68.6 Ų | 68.6 | 2% | 0.021 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -69.5 | -36.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | W105 R113 | W105-G109 PolarHBondContact O-N 3.5Å; G109-R113 PolarHBondContact O-N 2.9Å |
| 110 | G | 69.6 | Low | 68.1 | Low | 38 Ų | 38 | 68.8 Ų | 68.8 | 39% | 0.392 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.4 | -45.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y112 R113 L114 | G110-Y112 VanDerWaalsContact C-N 3.33Å; G110-Y112 PolarHBondContact O-N 3.05Å; G110-R113 PolarHBondContact O-N 3.43Å; G110-L114 WeakPolarHBondContact O-CB 3.48Å; G110-L114 PolarHBondContact O-N 3.5Å |
| 111 | S | 75.3 | Confident | 69.8 | Low | 77 Ų | 77 | 64.9 Ų | 64.9 | 54% | 0.538 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.4 | -40.2 | 176.8 | -61.3 | 0 | 0 | 0 | 0 | 112.4 | G107 A108 L114 L115 | G107-S111 WeakPolarHBondContact O-CB 3.44Å; G107-S111 PolarHBondContact O-OG 3.14Å; A108-S111 PolarHBondContact O-N 3.32Å; S111-L114 PolarHBondContact O-N 2.84Å; S111-L115 VanDerWaalsContact O-CB 3.28Å; S111-L115 WeakPolarHBondContact O-CB 3.32Å; S111-L115 PolarHBondContact O-N 3.37Å |
| 112 | Y | 79.4 | Confident | 71.7 | Confident | 80 Ų | 80 | 65.5 Ų | 65.5 | 31% | 0.314 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.7 | -47.1 | 176.1 | 175.3 | -110 | 0 | 0 | 0 | 112.7 | A108 G110 L114 L115 R116 | A108-Y112 PolarHBondContact O-N 2.94Å; A108-Y112 VanDerWaalsContact O-N 3.14Å; G110-Y112 VanDerWaalsContact C-N 3.33Å; G110-Y112 PolarHBondContact O-N 3.05Å; Y112-L114 VanDerWaalsContact C-N 3.31Å; Y112-L114 PolarHBondContact O-N 3.41Å; Y112-L115 PolarHBondContact O-N 3.4Å; Y112-R116 WeakPolarHBondContact O-CB 3.32Å; Y112-R116 PolarHBondContact O-N 3.41Å |
| 113 | R | 77.6 | Confident | 73.8 | Confident | 57 Ų | 57 | 62 Ų | 62 | 22% | 0.215 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 176.7 | -75.3 | -171.8 | -70.5 | -97.7 | -7.2 | 112 | E100 P101 G109 G110 G117 | E100-R113 IonicContact OE2-NH1 3.49Å; P101-R113 PolarHBondContact O-NH1 2.89Å; G109-R113 PolarHBondContact O-N 2.9Å; G110-R113 PolarHBondContact O-N 3.43Å; R113-G117 PolarHBondContact O-N 3.36Å |
| 114 | L | 79.3 | Confident | 75.7 | Confident | 111 Ų | 111 | 61.5 Ų | 61.5 | 58% | 0.581 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -63.5 | -46.3 | 175.9 | -178.2 | 64.1 | 0 | 0 | 0 | 111.5 | G110 S111 Y112 G118 P178 | G110-L114 WeakPolarHBondContact O-CB 3.48Å; G110-L114 PolarHBondContact O-N 3.5Å; S111-L114 PolarHBondContact O-N 2.84Å; Y112-L114 VanDerWaalsContact C-N 3.31Å; Y112-L114 PolarHBondContact O-N 3.41Å; L114-G118 WeakPolarHBondContact O-CA 3.45Å; L114-G118 PolarHBondContact O-N 2.95Å; L114-P178 HydrophobicContact CD1-CB 4.08Å |
| 115 | L | 83.3 | Confident | 77.8 | Confident | 112 Ų | 112 | 56.8 Ų | 56.8 | 59% | 0.586 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -61.2 | -48.3 | 177.9 | 177.5 | 63.6 | 0 | 0 | 0 | 111.3 | S111 Y112 G118 L119 | S111-L115 VanDerWaalsContact O-CB 3.28Å; S111-L115 WeakPolarHBondContact O-CB 3.32Å; S111-L115 PolarHBondContact O-N 3.37Å; Y112-L115 PolarHBondContact O-N 3.4Å; L115-G118 PolarHBondContact O-N 2.8Å; L115-L119 WeakPolarHBondContact O-CB 3.23Å; L115-L119 PolarHBondContact O-N 3.2Å |
| 116 | R | 84.9 | Confident | 79.9 | Confident | 53 Ų | 53 | 49.3 Ų | 49.3 | 20% | 0.2 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.1 | -49.5 | 179.2 | 177.2 | 176.7 | 163.1 | -122.1 | 3.5 | 111.7 | E88 L91 Y112 L120 | E88-R116 IonicContact OE1-CZ 2.58Å; E88-R116 IonicContact OE1-NE 3.31Å; E88-R116 PolarHBondContact OE1-NE 3.29Å; E88-R116 IonicContact OE1-NH2 2.81Å; E88-R116 PolarHBondContact OE1-NH2 3.43Å; E88-R116 IonicContact OE2-CZ 3.23Å; E88-R116 IonicContact OE2-NH2 3.6Å; E88-R116 PolarHBondContact OE2-NH2 2.94Å; L91-R116 VanDerWaalsContact CD1-CZ 3.46Å; Y112-R116 WeakPolarHBondContact O-CB 3.32Å; Y112-R116 PolarHBondContact O-N 3.41Å; R116-L120 PolarHBondContact O-N 3.34Å; R116-L120 VanDerWaalsContact O-N 3.13Å |
| 117 | G | 82.9 | Confident | 82 | Confident | 42 Ų | 42 | 42.4 Ų | 42.4 | 43% | 0.433 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.1 | -41.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R113 L120 G121 | R113-G117 PolarHBondContact O-N 3.36Å; G117-L120 PolarHBondContact O-N 2.98Å; G117-G121 PolarHBondContact O-N 3.47Å |
| 118 | G | 85.3 | Confident | 83.7 | Confident | 17 Ų | 17 | 41 Ų | 41 | 18% | 0.175 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66.2 | -41.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | L114 L115 G121 L122 | L114-G118 WeakPolarHBondContact O-CA 3.45Å; L114-G118 PolarHBondContact O-N 2.95Å; L115-G118 PolarHBondContact O-N 2.8Å; G118-G121 PolarHBondContact O-N 2.96Å; G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 3.24Å |
| 119 | L | 88.2 | Confident | 85.5 | Confident | 29 Ų | 29 | 40.4 Ų | 40.4 | 15% | 0.152 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.5 | -46.8 | 175.4 | 178.7 | 66.8 | 0 | 0 | 0 | 111.5 | L83 W84 L115 G123 | L83-L119 HydrophobicContact CB-CD1 4.23Å; L83-L119 HydrophobicContact CB-CD2 3.48Å; L83-L119 VanDerWaalsContact CB-CD2 3.48Å; L83-L119 HydrophobicContact CB-CG 4.38Å; L83-L119 HydrophobicContact CD1-CD1 4.02Å; W84-L119 HydrophobicContact CB-CD2 3.99Å; W84-L119 HydrophobicContact CB-CG 4.32Å; L115-L119 WeakPolarHBondContact O-CB 3.23Å; L115-L119 PolarHBondContact O-N 3.2Å; L119-G123 PolarHBondContact O-N 2.8Å |
| 120 | L | 89.3 | Confident | 86.9 | Confident | 28 Ų | 28 | 40.4 Ų | 40.4 | 15% | 0.147 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.8 | -52.5 | 175.1 | -180 | 60.9 | 0 | 0 | 0 | 111.6 | W84 R116 G117 L122 G123 L124 W322 | W84-L120 HydrophobicContact CD2-CB 4.43Å; W84-L120 HydrophobicContact CD2-CD1 3.65Å; W84-L120 HydrophobicContact CD2-CG 4.45Å; W84-L120 HydrophobicContact CE3-CD1 3.98Å; W84-L120 HydrophobicContact CG-CB 4.2Å; W84-L120 HydrophobicContact CG-CD1 4.14Å; W84-L120 HydrophobicContact CH2-CD1 4.06Å; W84-L120 HydrophobicContact CH2-CD2 4.46Å; W84-L120 HydrophobicContact CZ2-CD1 3.75Å; W84-L120 HydrophobicContact CZ2-CD2 3.61Å; W84-L120 HydrophobicContact CZ2-CG 4.21Å; W84-L120 HydrophobicContact CZ3-CD1 4.18Å; R116-L120 PolarHBondContact O-N 3.34Å; R116-L120 VanDerWaalsContact O-N 3.13Å; G117-L120 PolarHBondContact O-N 2.98Å; L120-L122 PolarHBondContact O-N 3.45Å; L120-G123 PolarHBondContact O-N 2.84Å; L120-L124 HydrophobicContact CD1-CD1 3.5Å; L120-L124 VanDerWaalsContact CD1-CD1 3.5Å; L120-L124 HydrophobicContact CD1-CG 3.85Å; L120-L124 HydrophobicContact CG-CD1 3.92Å; L120-L124 HydrophobicContact CG-CG 4.48Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 WeakPolarHBondContact O-CG 3.48Å; L120-L124 PolarHBondContact O-N 3.08Å; L120-W322 HydrophobicContact CD1-CZ3 4.24Å; L120-W322 HydrophobicContact CD2-CH2 3.96Å; L120-W322 HydrophobicContact CD2-CZ3 4.05Å |
| 121 | G | 88.4 | Confident | 87.9 | Confident | 22 Ų | 22 | 38.8 Ų | 38.8 | 23% | 0.227 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.3 | -43.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | G117 G118 T125 | G117-G121 PolarHBondContact O-N 3.47Å; G118-G121 PolarHBondContact O-N 2.96Å; G121-T125 WeakPolarHBondContact O-CB 3.26Å; G121-T125 PolarHBondContact O-N 2.88Å; G121-T125 PolarHBondContact O-OG1 3.23Å |
| 122 | L | 92.4 | Very high | 88.8 | Confident | 39 Ų | 39 | 35.9 Ų | 35.9 | 20% | 0.204 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.4 | -53.3 | 178 | -176.7 | 69.5 | 0 | 0 | 0 | 110.5 | G118 L120 L124 T125 V126 W166 A169 L170 V173 | G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 3.24Å; L120-L122 PolarHBondContact O-N 3.45Å; L122-L124 PolarHBondContact O-N 2.9Å; L122-T125 PolarHBondContact O-N 3.38Å; L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.33Å; L122-V126 PolarHBondContact O-N 3.39Å; L122-W166 HydrophobicContact CD1-CE3 4.38Å; L122-W166 HydrophobicContact CD2-CE3 4.34Å; L122-W166 HydrophobicContact CD2-CZ3 4.06Å; L122-W166 HydrophobicContact CG-CE3 4.37Å; L122-W166 HydrophobicContact CG-CZ3 4.22Å; L122-A169 HydrophobicContact CD1-CB 3.79Å; L122-L170 HydrophobicContact CD1-CB 4.08Å; L122-V173 HydrophobicContact CB-CG2 4.32Å |
| 123 | G | 93.4 | Very high | 89.5 | Confident | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.7 | -49.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | S79 L119 L120 S127 | S79-G123 WeakPolarHBondContact OG-CA 3.33Å; L119-G123 PolarHBondContact O-N 2.8Å; L120-G123 PolarHBondContact O-N 2.84Å; G123-S127 VanDerWaalsContact O-CB 3.28Å; G123-S127 WeakPolarHBondContact O-CB 3.15Å; G123-S127 PolarHBondContact O-N 3.12Å |
| 124 | L | 90.9 | Very high | 90.1 | Very high | 28 Ų | 28 | 30.6 Ų | 30.6 | 15% | 0.147 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.5 | -48.9 | 176.7 | -69.8 | 179.7 | 0 | 0 | 0 | 111.3 | V80 L120 L122 V126 S127 L128 W322 | V80-L124 HydrophobicContact CG2-CD2 4.36Å; L120-L124 HydrophobicContact CD1-CD1 3.5Å; L120-L124 VanDerWaalsContact CD1-CD1 3.5Å; L120-L124 HydrophobicContact CD1-CG 3.85Å; L120-L124 HydrophobicContact CG-CD1 3.92Å; L120-L124 HydrophobicContact CG-CG 4.48Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 WeakPolarHBondContact O-CG 3.48Å; L120-L124 PolarHBondContact O-N 3.08Å; L122-L124 PolarHBondContact O-N 2.9Å; L124-V126 PolarHBondContact O-N 2.99Å; L124-S127 CarbonylContact O-C 3.55Å; L124-S127 WeakPolarHBondContact O-CA 3.29Å; L124-S127 WeakPolarHBondContact O-CB 3.49Å; L124-S127 PolarHBondContact O-N 2.99Å; L124-S127 VanDerWaalsContact O-N 3.1Å; L124-L128 VanDerWaalsContact O-CG 3.29Å; L124-L128 WeakPolarHBondContact O-CG 3.45Å; L124-L128 PolarHBondContact O-N 3.22Å; L124-W322 HydrophobicContact CD1-CH2 4.49Å; L124-W322 HydrophobicContact CD1-CZ3 4Å |
| 125 | T | 92.8 | Very high | 90.6 | Very high | 29 Ų | 29 | 25.3 Ų | 25.3 | 18% | 0.178 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.3 | -43.6 | -176.4 | -55.5 | 0 | 0 | 0 | 0 | 112.1 | G121 L122 S127 L128 L129 A169 L172 | G121-T125 WeakPolarHBondContact O-CB 3.26Å; G121-T125 PolarHBondContact O-N 2.88Å; G121-T125 PolarHBondContact O-OG1 3.23Å; L122-T125 PolarHBondContact O-N 3.38Å; T125-S127 VanDerWaalsContact C-N 3.32Å; T125-S127 PolarHBondContact O-N 3.22Å; T125-L128 PolarHBondContact O-N 3.19Å; T125-L129 HydrophobicContact CG2-CD1 4.22Å; T125-L129 WeakPolarHBondContact O-CG 3.27Å; T125-L129 PolarHBondContact O-N 3.26Å; T125-A169 HydrophobicContact CG2-CB 3.66Å; T125-L172 HydrophobicContact CG2-CD2 4.01Å |
| 126 | V | 96.4 | Very high | 91 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.4 | -38.8 | 175.1 | 179.3 | 0 | 0 | 0 | 0 | 111 | A76 L122 L124 L129 S130 W166 A169 | A76-V126 HydrophobicContact CB-CB 3.79Å; A76-V126 HydrophobicContact CB-CG1 3.7Å; L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.33Å; L122-V126 PolarHBondContact O-N 3.39Å; L124-V126 PolarHBondContact O-N 2.99Å; V126-L129 PolarHBondContact O-N 3.3Å; V126-S130 VanDerWaalsContact O-CB 3.31Å; V126-S130 WeakPolarHBondContact O-CB 3.33Å; V126-S130 PolarHBondContact O-N 3.11Å; V126-S130 PolarHBondContact O-OG 2.81Å; V126-W166 HydrophobicContact CG1-CD2 4.01Å; V126-W166 HydrophobicContact CG1-CG 4.36Å; V126-W166 HydrophobicContact CG1-CH2 4.49Å; V126-W166 HydrophobicContact CG1-CZ2 3.93Å; V126-W166 HydrophobicContact CG2-CD2 3.84Å; V126-W166 HydrophobicContact CG2-CE3 3.79Å; V126-W166 HydrophobicContact CG2-CG 4.23Å; V126-W166 HydrophobicContact CG2-CZ3 4.21Å; V126-A169 HydrophobicContact CB-CB 4.49Å; V126-A169 HydrophobicContact CG2-CB 3.35Å |
| 127 | S | 94.2 | Very high | 91.3 | Very high | 4 Ų | 4 | 20 Ų | 20 | 3% | 0.028 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.3 | -46.6 | 174.6 | -173.7 | 0 | 0 | 0 | 0 | 111.1 | D77 G123 L124 T125 L129 S130 H131 | D77-S127 VanDerWaalsContact OD1-CB 3.29Å; D77-S127 WeakPolarHBondContact OD1-CB 3.46Å; D77-S127 PolarHBondContact OD1-OG 3.26Å; G123-S127 VanDerWaalsContact O-CB 3.28Å; G123-S127 WeakPolarHBondContact O-CB 3.15Å; G123-S127 PolarHBondContact O-N 3.12Å; L124-S127 CarbonylContact O-C 3.55Å; L124-S127 WeakPolarHBondContact O-CA 3.29Å; L124-S127 WeakPolarHBondContact O-CB 3.49Å; L124-S127 PolarHBondContact O-N 2.99Å; L124-S127 VanDerWaalsContact O-N 3.1Å; T125-S127 VanDerWaalsContact C-N 3.32Å; T125-S127 PolarHBondContact O-N 3.22Å; S127-L129 PolarHBondContact O-N 3.18Å; S127-S130 WeakPolarHBondContact O-CB 3.04Å; S127-S130 PolarHBondContact O-N 2.98Å; S127-H131 PolarHBondContact O-N 3.49Å; S127-H131 PolarHBondContact O-ND1 2.93Å; S127-H131 PolarHBondContact OG-CE1 3.27Å; S127-H131 VanDerWaalsContact OG-CE1 3.27Å |
| 128 | L | 92.6 | Very high | 91.6 | Very high | 29 Ų | 29 | 21.2 Ų | 21.2 | 15% | 0.152 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.5 | -47.5 | 176.1 | -58.3 | -171 | 0 | 0 | 0 | 111.9 | L124 T125 S130 H131 C132 A200 L201 Q204 F293 | L124-L128 VanDerWaalsContact O-CG 3.29Å; L124-L128 WeakPolarHBondContact O-CG 3.45Å; L124-L128 PolarHBondContact O-N 3.22Å; T125-L128 PolarHBondContact O-N 3.19Å; L128-S130 VanDerWaalsContact C-N 3.31Å; L128-S130 PolarHBondContact O-N 3.24Å; L128-H131 WeakPolarHBondContact O-CB 3.47Å; L128-H131 PolarHBondContact O-N 2.58Å; L128-C132 PolarHBondContact O-N 3.06Å; L128-C132 VanDerWaalsContact O-N 3.08Å; L128-C132 PolarHBondContact O-SG 2.9Å; L128-C132 VanDerWaalsContact O-SG 3.35Å; L128-A200 HydrophobicContact CD1-CB 4.43Å; L128-L201 HydrophobicContact CD1-CD2 3.76Å; L128-L201 HydrophobicContact CD1-CG 4.23Å; L128-L201 HydrophobicContact CD2-CD2 3.82Å; L128-L201 HydrophobicContact CG-CD2 4.45Å; L128-Q204 VanDerWaalsContact CB-OE1 3.3Å; L128-Q204 PolarHBondContact O-NE2 3.42Å; L128-F293 HydrophobicContact CD2-CZ 4.43Å |
| 129 | L | 94.9 | Very high | 91.7 | Very high | 52 Ų | 52 | 22.1 Ų | 22.1 | 27% | 0.272 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -61.8 | -40.2 | 176.7 | -69.9 | 172.8 | 0 | 0 | 0 | 111.3 | T125 V126 S127 H131 C132 L133 S165 L168 | T125-L129 HydrophobicContact CG2-CD1 4.22Å; T125-L129 WeakPolarHBondContact O-CG 3.27Å; T125-L129 PolarHBondContact O-N 3.26Å; V126-L129 PolarHBondContact O-N 3.3Å; S127-L129 PolarHBondContact O-N 3.18Å; L129-H131 VanDerWaalsContact C-N 3.33Å; L129-H131 PolarHBondContact O-N 3.31Å; L129-C132 WeakPolarHBondContact O-CB 3.3Å; L129-C132 PolarHBondContact O-N 2.84Å; L129-L133 VanDerWaalsContact O-CG 3.28Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 3.47Å; L129-S165 WeakPolarHBondContact CD1-O 3.44Å; L129-L168 HydrophobicContact CD1-CB 4.19Å |
| 130 | S | 94.3 | Very high | 91.9 | Very high | 1 Ų | 1 | 22 Ų | 22 | 1% | 0.007 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.8 | -41 | 176.9 | -60.6 | 0 | 0 | 0 | 0 | 111.8 | N72 G73 V126 S127 L128 L133 V134 | N72-S130 PolarHBondContact ND2-OG 3.44Å; G73-S130 PolarHBondContact N-OG 3.45Å; V126-S130 VanDerWaalsContact O-CB 3.31Å; V126-S130 WeakPolarHBondContact O-CB 3.33Å; V126-S130 PolarHBondContact O-N 3.11Å; V126-S130 PolarHBondContact O-OG 2.81Å; S127-S130 WeakPolarHBondContact O-CB 3.04Å; S127-S130 PolarHBondContact O-N 2.98Å; L128-S130 VanDerWaalsContact C-N 3.31Å; L128-S130 PolarHBondContact O-N 3.24Å; S130-L133 PolarHBondContact O-N 3.34Å; S130-V134 WeakPolarHBondContact O-CG2 3.32Å; S130-V134 PolarHBondContact O-N 2.89Å |
| 131 | H | 90.5 | Very high | 91.7 | Very high | 4 Ų | 4 | 24.5 Ų | 24.5 | 2% | 0.019 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.5 | -42 | 173.8 | -67.5 | 128.8 | 0 | 0 | 0 | 112.9 | S127 L128 L129 L133 V134 A135 F293 N332 Y336 | S127-H131 PolarHBondContact O-N 3.49Å; S127-H131 PolarHBondContact O-ND1 2.93Å; S127-H131 PolarHBondContact OG-CE1 3.27Å; S127-H131 VanDerWaalsContact OG-CE1 3.27Å; L128-H131 WeakPolarHBondContact O-CB 3.47Å; L128-H131 PolarHBondContact O-N 2.58Å; L129-H131 VanDerWaalsContact C-N 3.33Å; L129-H131 PolarHBondContact O-N 3.31Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 2.81Å; H131-V134 PolarHBondContact O-N 3.36Å; H131-A135 WeakPolarHBondContact O-CB 2.97Å; H131-A135 PolarHBondContact O-N 3.34Å; H131-F293 HydrophobicContact CB-CE2 4.15Å; H131-F293 HydrophobicContact CB-CZ 4.18Å; H131-F293 AromaticContact CD2-CE2 3.97Å; H131-F293 AromaticContact CE1-CE2 3.51Å; H131-F293 AromaticContact CG-CE2 3.49Å; H131-F293 VanDerWaalsContact CG-CE2 3.49Å; H131-F293 AromaticContact CG-CZ 3.86Å; H131-F293 AromaticContact ND1-CE2 3.2Å; H131-F293 WeakPolarHBondContact ND1-CE2 3.37Å; H131-F293 AromaticContact ND1-CZ 3.44Å; H131-F293 WeakPolarHBondContact ND1-CZ 3.26Å; H131-F293 AromaticContact NE2-CE2 3.94Å; H131-N332 PolarHBondContact CE1-ND2 3.37Å; H131-N332 PolarHBondContact NE2-ND2 3.36Å; H131-Y336 AromaticContact CD2-CZ 3.87Å; H131-Y336 PolarHBondContact CD2-OH 3.16Å |
| 132 | C | 93.3 | Very high | 91.6 | Very high | 16 Ų | 16 | 26.1 Ų | 26.1 | 11% | 0.108 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.1 | -45.7 | 172.5 | -67.5 | 0 | 0 | 0 | 0 | 111.5 | L128 L129 A135 L136 L207 | L128-C132 PolarHBondContact O-N 3.06Å; L128-C132 VanDerWaalsContact O-N 3.08Å; L128-C132 PolarHBondContact O-SG 2.9Å; L128-C132 VanDerWaalsContact O-SG 3.35Å; L129-C132 WeakPolarHBondContact O-CB 3.3Å; L129-C132 PolarHBondContact O-N 2.84Å; C132-A135 PolarHBondContact O-N 3.43Å; C132-L136 WeakPolarHBondContact O-CB 3.23Å; C132-L136 WeakPolarHBondContact O-CG 3.45Å; C132-L136 PolarHBondContact O-N 3.38Å; C132-L207 HydrophobicContact CB-CD2 3.65Å |
| 133 | L | 93.9 | Very high | 91.3 | Very high | 23 Ų | 23 | 25.1 Ų | 25.1 | 12% | 0.12 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63.8 | -42.7 | 178.3 | -67 | 176.7 | 0 | 0 | 0 | 112 | F69 L129 S130 H131 L136 N137 M161 | F69-L133 HydrophobicContact CD1-CB 3.66Å; F69-L133 HydrophobicContact CD1-CD1 3.83Å; F69-L133 HydrophobicContact CD1-CG 4.31Å; F69-L133 HydrophobicContact CE1-CB 4.02Å; F69-L133 HydrophobicContact CE1-CD1 3.94Å; F69-L133 HydrophobicContact CE1-CD2 4.5Å; F69-L133 HydrophobicContact CE1-CG 4.38Å; F69-L133 HydrophobicContact CG-CB 4.11Å; L129-L133 VanDerWaalsContact O-CG 3.28Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 3.47Å; S130-L133 PolarHBondContact O-N 3.34Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 2.81Å; L133-L136 PolarHBondContact O-N 3.49Å; L133-N137 WeakPolarHBondContact O-CB 3.29Å; L133-N137 PolarHBondContact O-N 3.49Å; L133-M161 HydrophobicContact CD2-CE 3.55Å |
| 134 | V | 90.8 | Very high | 91 | Very high | 3 Ų | 3 | 31.4 Ų | 31.4 | 2% | 0.018 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.4 | -45.5 | 174.9 | 172.9 | 0 | 0 | 0 | 0 | 110.7 | F69 I70 S130 H131 N137 R138 Y336 | F69-V134 HydrophobicContact CB-CG2 3.65Å; I70-V134 HydrophobicContact CG1-CG2 4.14Å; S130-V134 WeakPolarHBondContact O-CG2 3.32Å; S130-V134 PolarHBondContact O-N 2.89Å; H131-V134 PolarHBondContact O-N 3.36Å; V134-N137 PolarHBondContact O-N 2.86Å; V134-R138 HydrophobicContact CG1-CG 4.46Å; V134-R138 VanDerWaalsContact O-CG 3.29Å; V134-R138 WeakPolarHBondContact O-CG 3.49Å; V134-R138 PolarHBondContact O-N 3.03Å; V134-Y336 HydrophobicContact CB-CE1 4.49Å; V134-Y336 HydrophobicContact CG1-CD1 4.07Å; V134-Y336 HydrophobicContact CG1-CE1 3.59Å |
| 135 | A | 89.4 | Confident | 90.9 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.5 | -45.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | H131 C132 R138 Y139 L208 C211 Y212 | H131-A135 WeakPolarHBondContact O-CB 2.97Å; H131-A135 PolarHBondContact O-N 3.34Å; C132-A135 PolarHBondContact O-N 3.43Å; A135-R138 PolarHBondContact O-N 3.14Å; A135-Y139 VanDerWaalsContact O-CB 3.3Å; A135-Y139 WeakPolarHBondContact O-CB 3.08Å; A135-Y139 PolarHBondContact O-N 2.96Å; A135-L208 HydrophobicContact CB-CD2 3.59Å; A135-C211 HydrophobicContact CB-CB 4.17Å; A135-Y212 HydrophobicContact CB-CE2 4.43Å |
| 136 | L | 92.5 | Very high | 90.6 | Very high | 55 Ų | 55 | 36 Ų | 36 | 29% | 0.288 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.1 | -43.7 | 175.3 | -77.9 | 170.5 | 0 | 0 | 0 | 111.9 | C132 L133 R138 Y139 L140 L207 | C132-L136 WeakPolarHBondContact O-CB 3.23Å; C132-L136 WeakPolarHBondContact O-CG 3.45Å; C132-L136 PolarHBondContact O-N 3.38Å; L133-L136 PolarHBondContact O-N 3.49Å; L136-R138 PolarHBondContact O-N 2.95Å; L136-Y139 PolarHBondContact O-N 2.63Å; L136-L140 WeakPolarHBondContact O-CB 3.15Å; L136-L140 WeakPolarHBondContact O-CG 3.36Å; L136-L140 PolarHBondContact O-N 3.45Å; L136-L207 HydrophobicContact CD1-CD2 4.26Å; L136-L207 HydrophobicContact CD2-CD1 4.2Å; L136-L207 HydrophobicContact CG-CD2 4.41Å |
| 137 | N | 91.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.9 | -46.9 | 177.1 | 177.2 | 76.3 | 0 | 0 | 0 | 111.3 | S66 F69 L133 V134 L141 Y149 Y153 | S66-N137 VanDerWaalsContact CB-ND2 3.33Å; S66-N137 WeakPolarHBondContact CB-ND2 3.37Å; S66-N137 PolarHBondContact OG-ND2 2.87Å; F69-N137 HydrophobicContact CD2-CB 4.01Å; F69-N137 HydrophobicContact CE2-CB 4.03Å; L133-N137 WeakPolarHBondContact O-CB 3.29Å; L133-N137 PolarHBondContact O-N 3.49Å; V134-N137 PolarHBondContact O-N 2.86Å; N137-L141 WeakPolarHBondContact O-CB 3.28Å; N137-L141 PolarHBondContact O-N 3Å; N137-Y149 WeakPolarHBondContact OD1-CE2 3.44Å; N137-Y149 PolarHBondContact OD1-OH 3.02Å; N137-Y153 VanDerWaalsContact CA-OH 3.25Å; N137-Y153 WeakPolarHBondContact CA-OH 3.19Å; N137-Y153 HydrophobicContact CB-CE1 4.06Å; N137-Y153 PolarHBondContact N-OH 3.28Å |
| 138 | R | 87.8 | Confident | 90.3 | Very high | 67 Ų | 67 | 42.6 Ų | 42.6 | 25% | 0.253 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -64.8 | -42 | 175.9 | -67.3 | -66.5 | 178.7 | -143.3 | -2.8 | 112 | S66 V134 A135 L136 I142 I215 | S66-R138 PolarHBondContact OG-NH1 3.32Å; S66-R138 PolarHBondContact OG-NH2 3.38Å; V134-R138 HydrophobicContact CG1-CG 4.46Å; V134-R138 VanDerWaalsContact O-CG 3.29Å; V134-R138 WeakPolarHBondContact O-CG 3.49Å; V134-R138 PolarHBondContact O-N 3.03Å; A135-R138 PolarHBondContact O-N 3.14Å; L136-R138 PolarHBondContact O-N 2.95Å; R138-I142 WeakPolarHBondContact O-CB 3.46Å; R138-I142 WeakPolarHBondContact O-CD1 3.44Å; R138-I142 VanDerWaalsContact O-CG1 3.28Å; R138-I142 WeakPolarHBondContact O-CG1 3.38Å; R138-I142 PolarHBondContact O-N 3.41Å; R138-I142 VanDerWaalsContact O-N 3.15Å; R138-I215 HydrophobicContact CB-CD1 4.22Å |
| 139 | Y | 89.1 | Confident | 90.1 | Very high | 36 Ų | 36 | 42.8 Ų | 42.8 | 14% | 0.141 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.9 | -49.6 | 178.1 | 170.4 | -101.9 | 0 | 0 | 0 | 111.4 | A135 L136 I142 T143 C211 I215 | A135-Y139 VanDerWaalsContact O-CB 3.3Å; A135-Y139 WeakPolarHBondContact O-CB 3.08Å; A135-Y139 PolarHBondContact O-N 2.96Å; L136-Y139 PolarHBondContact O-N 2.63Å; Y139-I142 PolarHBondContact O-N 2.93Å; Y139-T143 HydrophobicContact CD2-CG2 3.68Å; Y139-T143 HydrophobicContact CE2-CG2 3.62Å; Y139-T143 HydrophobicContact CG-CG2 4.46Å; Y139-T143 VanDerWaalsContact O-CB 3.29Å; Y139-T143 WeakPolarHBondContact O-CB 3.43Å; Y139-T143 VanDerWaalsContact O-CG2 3.32Å; Y139-T143 WeakPolarHBondContact O-CG2 3.19Å; Y139-T143 PolarHBondContact O-N 3.42Å; Y139-T143 PolarHBondContact O-OG1 3.48Å; Y139-C211 VanDerWaalsContact CD2-O 3.32Å; Y139-C211 WeakPolarHBondContact CD2-O 3.37Å; Y139-C211 HydrophobicContact CG-CB 4.36Å; Y139-I215 HydrophobicContact CD2-CG1 4.21Å |
| 140 | L | 91.2 | Very high | 89.9 | Confident | 27 Ų | 27 | 46.7 Ų | 46.7 | 14% | 0.141 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -68.4 | -40.3 | -178.7 | -68.5 | 176.3 | 0 | 0 | 0 | 112.2 | L136 I142 R144 Y149 L152 Y153 | L136-L140 WeakPolarHBondContact O-CB 3.15Å; L136-L140 WeakPolarHBondContact O-CG 3.36Å; L136-L140 PolarHBondContact O-N 3.45Å; L140-I142 VanDerWaalsContact C-N 3.26Å; L140-I142 PolarHBondContact O-N 3.26Å; L140-R144 HydrophobicContact CD2-CG 3.56Å; L140-R144 WeakPolarHBondContact O-CB 3.35Å; L140-R144 PolarHBondContact O-N 2.85Å; L140-R144 VanDerWaalsContact O-N 3.11Å; L140-Y149 HydrophobicContact CB-CD2 4.34Å; L140-L152 HydrophobicContact CD1-CD2 3.39Å; L140-Y153 HydrophobicContact CB-CE2 4.12Å; L140-Y153 HydrophobicContact CD1-CE2 3.73Å |
| 141 | L | 86.3 | Confident | 89.8 | Confident | 79 Ų | 79 | 49.4 Ų | 49.4 | 41% | 0.414 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -58.8 | -36.9 | 176.5 | -177 | 66 | 0 | 0 | 0 | 112.5 | N137 Y149 | N137-L141 WeakPolarHBondContact O-CB 3.28Å; N137-L141 PolarHBondContact O-N 3Å; L141-Y149 HydrophobicContact CB-CD2 3.87Å; L141-Y149 HydrophobicContact CB-CE2 3.64Å; L141-Y149 HydrophobicContact CD1-CD1 3.98Å; L141-Y149 HydrophobicContact CD1-CD2 4.04Å; L141-Y149 HydrophobicContact CD1-CE1 3.79Å; L141-Y149 HydrophobicContact CD1-CE2 3.84Å; L141-Y149 HydrophobicContact CD1-CG 4.1Å; L141-Y149 HydrophobicContact CG-CE2 4.27Å |
| 142 | I | 84.6 | Confident | 89.9 | Confident | 56 Ų | 56 | 53 Ų | 53 | 29% | 0.287 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -91.8 | -35.9 | -175.4 | -62.7 | 167.8 | 0 | 0 | 0 | 112.2 | R138 Y139 L140 I215 V219 | R138-I142 WeakPolarHBondContact O-CB 3.46Å; R138-I142 WeakPolarHBondContact O-CD1 3.44Å; R138-I142 VanDerWaalsContact O-CG1 3.28Å; R138-I142 WeakPolarHBondContact O-CG1 3.38Å; R138-I142 PolarHBondContact O-N 3.41Å; R138-I142 VanDerWaalsContact O-N 3.15Å; Y139-I142 PolarHBondContact O-N 2.93Å; L140-I142 VanDerWaalsContact C-N 3.26Å; L140-I142 PolarHBondContact O-N 3.26Å; I142-I215 HydrophobicContact CB-CG1 4.5Å; I142-I215 HydrophobicContact CD1-CD1 4.2Å; I142-I215 HydrophobicContact CD1-CG1 4.21Å; I142-I215 HydrophobicContact CD1-CG2 3.84Å; I142-I215 HydrophobicContact CG2-CG2 4.19Å; I142-V219 HydrophobicContact CG2-CG2 4.32Å |
| 143 | T | 86.6 | Confident | 89.9 | Confident | 18 Ų | 18 | 53 Ų | 53 | 11% | 0.11 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -97 | -29 | -169.2 | 66.6 | 0 | 0 | 0 | 0 | 114.7 | Y139 I215 R218 | Y139-T143 HydrophobicContact CD2-CG2 3.68Å; Y139-T143 HydrophobicContact CE2-CG2 3.62Å; Y139-T143 HydrophobicContact CG-CG2 4.46Å; Y139-T143 VanDerWaalsContact O-CB 3.29Å; Y139-T143 WeakPolarHBondContact O-CB 3.43Å; Y139-T143 VanDerWaalsContact O-CG2 3.32Å; Y139-T143 WeakPolarHBondContact O-CG2 3.19Å; Y139-T143 PolarHBondContact O-N 3.42Å; Y139-T143 PolarHBondContact O-OG1 3.48Å; T143-I215 HydrophobicContact CG2-CG1 4.45Å; T143-R218 HydrophobicContact CG2-CB 3.86Å; T143-R218 HydrophobicContact CG2-CG 4.18Å |
| 144 | R | 87.5 | Confident | 89.8 | Confident | 132 Ų | 132 | 55.2 Ų | 55.2 | 50% | 0.498 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -100.3 | 167.8 | -175.8 | -57.7 | -57 | 179.6 | 100.6 | -2.6 | 112 | L140 | L140-R144 HydrophobicContact CD2-CG 3.56Å; L140-R144 WeakPolarHBondContact O-CB 3.35Å; L140-R144 PolarHBondContact O-N 2.85Å; L140-R144 VanDerWaalsContact O-N 3.11Å |
| 145 | A | 88 | Confident | 89.8 | Confident | 54 Ų | 54 | 65.5 Ų | 65.5 | 45% | 0.446 | 34% | 0.339 | S | S | . | . | trans | -65.9 | 146.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | A147 T148 Y149 | A145-A147 PolarHBondContact O-N 3.4Å; A145-T148 WeakPolarHBondContact O-CB 3.2Å; A145-T148 PolarHBondContact O-N 3.14Å; A145-T148 VanDerWaalsContact O-N 3.09Å; A145-Y149 PolarHBondContact O-N 3.27Å | ||
| 146 | P | 87 | Confident | 90 | Very high | 100 Ų | 100 | 74 Ų | 74 | 65% | 0.649 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -55 | -37.7 | -179.7 | -27.2 | 35 | 0 | 0 | 0 | 113.8 | T148 Y149 Q150 | P146-T148 PolarHBondContact O-N 3.14Å; P146-Y149 PolarHBondContact O-N 3.31Å; P146-Q150 WeakPolarHBondContact O-CG 3.35Å; P146-Q150 PolarHBondContact O-N 3.46Å |
| 147 | A | 91.7 | Very high | 90.2 | Very high | 68 Ų | 68 | 75 Ų | 75 | 56% | 0.562 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -60 | -43.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | A145 Y149 Q150 A151 | A145-A147 PolarHBondContact O-N 3.4Å; A147-Y149 PolarHBondContact O-N 3.47Å; A147-Q150 PolarHBondContact O-N 3.35Å; A147-A151 WeakPolarHBondContact O-CB 3.29Å; A147-A151 PolarHBondContact O-N 2.63Å |
| 148 | T | 91.9 | Very high | 90.3 | Very high | 74 Ų | 74 | 75.3 Ų | 75.3 | 45% | 0.454 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 176.9 | -48.4 | 0 | 0 | 0 | 0 | 111.4 | A145 P146 A151 L152 | A145-T148 WeakPolarHBondContact O-CB 3.2Å; A145-T148 PolarHBondContact O-N 3.14Å; A145-T148 VanDerWaalsContact O-N 3.09Å; P146-T148 PolarHBondContact O-N 3.14Å; T148-A151 PolarHBondContact O-N 3.39Å; T148-L152 WeakPolarHBondContact O-CB 3.11Å; T148-L152 PolarHBondContact O-N 2.78Å; T148-L152 VanDerWaalsContact O-N 3.11Å |
| 149 | Y | 89.9 | Confident | 90.7 | Very high | 34 Ų | 34 | 74.9 Ų | 74.9 | 13% | 0.133 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64 | -44.7 | 177.7 | 178.8 | -89.8 | 0 | 0 | 0 | 111.6 | N137 L140 L141 A145 P146 A147 L152 Y153 | N137-Y149 WeakPolarHBondContact OD1-CE2 3.44Å; N137-Y149 PolarHBondContact OD1-OH 3.02Å; L140-Y149 HydrophobicContact CB-CD2 4.34Å; L141-Y149 HydrophobicContact CB-CD2 3.87Å; L141-Y149 HydrophobicContact CB-CE2 3.64Å; L141-Y149 HydrophobicContact CD1-CD1 3.98Å; L141-Y149 HydrophobicContact CD1-CD2 4.04Å; L141-Y149 HydrophobicContact CD1-CE1 3.79Å; L141-Y149 HydrophobicContact CD1-CE2 3.84Å; L141-Y149 HydrophobicContact CD1-CG 4.1Å; L141-Y149 HydrophobicContact CG-CE2 4.27Å; A145-Y149 PolarHBondContact O-N 3.27Å; P146-Y149 PolarHBondContact O-N 3.31Å; A147-Y149 PolarHBondContact O-N 3.47Å; Y149-L152 PolarHBondContact O-N 3.16Å; Y149-Y153 AromaticContact CD2-CD2 3.44Å; Y149-Y153 HydrophobicContact CD2-CD2 3.44Å; Y149-Y153 VanDerWaalsContact CD2-CD2 3.44Å; Y149-Y153 AromaticContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CG 4.41Å; Y149-Y153 AromaticContact CE2-CD2 3.35Å; Y149-Y153 HydrophobicContact CE2-CD2 3.35Å; Y149-Y153 AromaticContact CE2-CE2 3.74Å; Y149-Y153 HydrophobicContact CE2-CE2 3.74Å; Y149-Y153 AromaticContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CG-CD2 4.11Å; Y149-Y153 AromaticContact CZ-CD2 3.95Å; Y149-Y153 PolarHBondContact O-N 2.79Å |
| 150 | Q | 90.8 | Very high | 91.1 | Very high | 134 Ų | 134 | 75.1 Ų | 75.1 | 63% | 0.626 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -65.6 | -36.8 | 179 | -72.6 | 174.1 | -12 | 0 | 0 | 112.8 | P146 A147 Q154 | P146-Q150 WeakPolarHBondContact O-CG 3.35Å; P146-Q150 PolarHBondContact O-N 3.46Å; A147-Q150 PolarHBondContact O-N 3.35Å; Q150-Q154 WeakPolarHBondContact O-CG 3.29Å |
| 151 | A | 92.6 | Very high | 91.4 | Very high | 57 Ų | 57 | 76 Ų | 76 | 47% | 0.471 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -66.7 | -40.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | A147 T148 | A147-A151 WeakPolarHBondContact O-CB 3.29Å; A147-A151 PolarHBondContact O-N 2.63Å; T148-A151 PolarHBondContact O-N 3.39Å |
| 152 | L | 91.8 | Very high | 91.9 | Very high | 81 Ų | 81 | 74 Ų | 74 | 42% | 0.424 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -77 | -51.4 | -177.8 | -169.9 | 68.6 | 0 | 0 | 0 | 112.2 | L140 T148 Y149 Q154 H157 | L140-L152 HydrophobicContact CD1-CD2 3.39Å; T148-L152 WeakPolarHBondContact O-CB 3.11Å; T148-L152 PolarHBondContact O-N 2.78Å; T148-L152 VanDerWaalsContact O-N 3.11Å; Y149-L152 PolarHBondContact O-N 3.16Å; L152-Q154 VanDerWaalsContact C-N 3.3Å; L152-Q154 PolarHBondContact O-N 3.28Å; L152-Q154 VanDerWaalsContact O-N 3.11Å; L152-H157 WeakPolarHBondContact O-CB 3.37Å; L152-H157 PolarHBondContact O-ND1 3.41Å; L152-H157 VanDerWaalsContact O-ND1 3.16Å |
| 153 | Y | 92.4 | Very high | 92.5 | Very high | 14 Ų | 14 | 74.3 Ų | 74.3 | 6% | 0.055 | 40% | 0.404 | C | S | . | . | S | Bend | trans | -91.4 | 55.8 | -173.5 | -69 | -79.2 | 0 | 0 | 0 | 112.8 | F69 N137 L140 Y149 M161 | F69-Y153 AromaticContact CE2-CD1 3.72Å; F69-Y153 HydrophobicContact CE2-CD1 3.72Å; F69-Y153 AromaticContact CE2-CE1 3.47Å; F69-Y153 HydrophobicContact CE2-CE1 3.47Å; F69-Y153 VanDerWaalsContact CE2-CE1 3.47Å; F69-Y153 AromaticContact CZ-CD1 3.89Å; F69-Y153 HydrophobicContact CZ-CD1 3.89Å; F69-Y153 AromaticContact CZ-CE1 3.61Å; F69-Y153 HydrophobicContact CZ-CE1 3.61Å; N137-Y153 VanDerWaalsContact CA-OH 3.25Å; N137-Y153 WeakPolarHBondContact CA-OH 3.19Å; N137-Y153 HydrophobicContact CB-CE1 4.06Å; N137-Y153 PolarHBondContact N-OH 3.28Å; L140-Y153 HydrophobicContact CB-CE2 4.12Å; L140-Y153 HydrophobicContact CD1-CE2 3.73Å; Y149-Y153 AromaticContact CD2-CD2 3.44Å; Y149-Y153 HydrophobicContact CD2-CD2 3.44Å; Y149-Y153 VanDerWaalsContact CD2-CD2 3.44Å; Y149-Y153 AromaticContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CG 4.41Å; Y149-Y153 AromaticContact CE2-CD2 3.35Å; Y149-Y153 HydrophobicContact CE2-CD2 3.35Å; Y149-Y153 AromaticContact CE2-CE2 3.74Å; Y149-Y153 HydrophobicContact CE2-CE2 3.74Å; Y149-Y153 AromaticContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CG-CD2 4.11Å; Y149-Y153 AromaticContact CZ-CD2 3.95Å; Y149-Y153 PolarHBondContact O-N 2.79Å; Y153-M161 HydrophobicContact CE1-CE 3.8Å; Y153-M161 HydrophobicContact CE1-SD 4.23Å |
| 154 | Q | 93.4 | Very high | 93 | Very high | 70 Ų | 70 | 78.1 Ų | 78.1 | 33% | 0.327 | 42% | 0.423 | S | S | . | . | trans | -79 | 153.5 | 167.1 | -63 | -176.9 | -10.2 | 0 | 0 | 110.5 | Q150 L152 R156 H157 T158 | Q150-Q154 WeakPolarHBondContact O-CG 3.29Å; L152-Q154 VanDerWaalsContact C-N 3.3Å; L152-Q154 PolarHBondContact O-N 3.28Å; L152-Q154 VanDerWaalsContact O-N 3.11Å; Q154-R156 VanDerWaalsContact C-N 3.29Å; Q154-R156 HydrophobicContact CB-CG 4.25Å; Q154-R156 PolarHBondContact O-N 3.38Å; Q154-H157 PolarHBondContact O-N 3.17Å; Q154-H157 VanDerWaalsContact O-N 3.07Å; Q154-T158 WeakPolarHBondContact O-CB 3.45Å; Q154-T158 PolarHBondContact O-N 2.88Å; Q154-T158 PolarHBondContact O-OG1 3.18Å; Q154-T158 VanDerWaalsContact O-OG1 3.09Å | ||
| 155 | R | 90.9 | Very high | 93.5 | Very high | 220 Ų | 220 | 72 Ų | 72 | 83% | 0.83 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -51.9 | -44.8 | -179.5 | -72.1 | -175.3 | 178.1 | 173.2 | -0.7 | 113 | T158 A159 | R155-T158 PolarHBondContact O-N 3Å; R155-A159 WeakPolarHBondContact O-CB 3.33Å; R155-A159 PolarHBondContact O-N 3.3Å |
| 156 | R | 93.4 | Very high | 94 | Very high | 178 Ų | 178 | 73.4 Ų | 73.4 | 67% | 0.672 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -62.3 | -44.4 | 177.6 | 58.8 | 178 | 178.1 | 177.2 | 0.7 | 113.1 | Q154 A159 G160 | Q154-R156 VanDerWaalsContact C-N 3.29Å; Q154-R156 HydrophobicContact CB-CG 4.25Å; Q154-R156 PolarHBondContact O-N 3.38Å; R156-A159 PolarHBondContact O-N 3.31Å; R156-G160 PolarHBondContact O-N 3.22Å |
| 157 | H | 95 | Very high | 94.4 | Very high | 77 Ų | 77 | 71.4 Ų | 71.4 | 36% | 0.356 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -70.3 | -40 | 179.2 | -59 | 159.5 | 0 | 0 | 0 | 110.7 | L152 Q154 G160 M161 | L152-H157 WeakPolarHBondContact O-CB 3.37Å; L152-H157 PolarHBondContact O-ND1 3.41Å; L152-H157 VanDerWaalsContact O-ND1 3.16Å; Q154-H157 PolarHBondContact O-N 3.17Å; Q154-H157 VanDerWaalsContact O-N 3.07Å; H157-G160 CarbonylContact O-C 3.59Å; H157-G160 PolarHBondContact O-N 3.42Å; H157-M161 VanDerWaalsContact O-CG 3.25Å; H157-M161 WeakPolarHBondContact O-CG 3.47Å; H157-M161 PolarHBondContact O-N 3.43Å |
| 158 | T | 94.9 | Very high | 94.6 | Very high | 6 Ų | 6 | 72.8 Ų | 72.8 | 4% | 0.037 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.5 | -49.1 | 174.8 | -59.8 | 0 | 0 | 0 | 0 | 110.6 | T65 A68 F69 Q154 R155 G160 M161 L162 | T65-T158 HydrophobicContact CG2-CG2 4.34Å; A68-T158 HydrophobicContact CB-CG2 4.23Å; F69-T158 HydrophobicContact CE1-CG2 4.13Å; F69-T158 HydrophobicContact CE2-CG2 4.3Å; F69-T158 HydrophobicContact CZ-CG2 3.83Å; Q154-T158 WeakPolarHBondContact O-CB 3.45Å; Q154-T158 PolarHBondContact O-N 2.88Å; Q154-T158 PolarHBondContact O-OG1 3.18Å; Q154-T158 VanDerWaalsContact O-OG1 3.09Å; R155-T158 PolarHBondContact O-N 3Å; T158-G160 VanDerWaalsContact C-N 3.28Å; T158-G160 PolarHBondContact O-N 3Å; T158-M161 WeakPolarHBondContact O-CB 3.07Å; T158-M161 PolarHBondContact O-N 3.35Å; T158-M161 VanDerWaalsContact O-N 3.08Å; T158-L162 HydrophobicContact CG2-CD1 3.75Å; T158-L162 WeakPolarHBondContact O-CD1 3.22Å; T158-L162 PolarHBondContact O-N 3.44Å |
| 159 | A | 95.9 | Very high | 94.6 | Very high | 58 Ų | 58 | 69.3 Ų | 69.3 | 48% | 0.479 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -56.6 | -42.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R155 R156 L162 A163 | R155-A159 WeakPolarHBondContact O-CB 3.33Å; R155-A159 PolarHBondContact O-N 3.3Å; R156-A159 PolarHBondContact O-N 3.31Å; A159-L162 PolarHBondContact O-N 3.42Å; A159-A163 PolarHBondContact O-N 2.93Å |
| 160 | G | 97.4 | Very high | 94.8 | Very high | 40 Ų | 40 | 71.7 Ų | 71.7 | 41% | 0.412 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61 | -42 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | R156 H157 T158 L162 A163 L164 | R156-G160 PolarHBondContact O-N 3.22Å; H157-G160 CarbonylContact O-C 3.59Å; H157-G160 PolarHBondContact O-N 3.42Å; T158-G160 VanDerWaalsContact C-N 3.28Å; T158-G160 PolarHBondContact O-N 3Å; G160-L162 VanDerWaalsContact C-N 3.35Å; G160-L162 PolarHBondContact O-N 2.95Å; G160-A163 PolarHBondContact O-N 3.27Å; G160-L164 WeakPolarHBondContact O-CB 3.33Å; G160-L164 PolarHBondContact O-N 3.08Å |
| 161 | M | 97.2 | Very high | 94.7 | Very high | 46 Ų | 46 | 66.5 Ų | 66.5 | 23% | 0.227 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -64.2 | -39 | 176.2 | -67.8 | 164.8 | 70.2 | 0 | 0 | 112 | F69 L133 Y153 H157 T158 S165 | F69-M161 HydrophobicContact CE1-CB 4.09Å; F69-M161 HydrophobicContact CE1-CE 3.99Å; F69-M161 HydrophobicContact CE1-SD 4.48Å; F69-M161 HydrophobicContact CZ-CE 3.69Å; F69-M161 HydrophobicContact CZ-SD 4.07Å; L133-M161 HydrophobicContact CD2-CE 3.55Å; Y153-M161 HydrophobicContact CE1-CE 3.8Å; Y153-M161 HydrophobicContact CE1-SD 4.23Å; H157-M161 VanDerWaalsContact O-CG 3.25Å; H157-M161 WeakPolarHBondContact O-CG 3.47Å; H157-M161 PolarHBondContact O-N 3.43Å; T158-M161 WeakPolarHBondContact O-CB 3.07Å; T158-M161 PolarHBondContact O-N 3.35Å; T158-M161 VanDerWaalsContact O-N 3.08Å; M161-S165 PolarHBondContact O-N 2.86Å |
| 162 | L | 97.3 | Very high | 94.5 | Very high | 37 Ų | 37 | 66.3 Ų | 66.3 | 19% | 0.194 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.7 | -54 | 174.5 | -85.8 | 69.8 | 0 | 0 | 0 | 110 | F69 N72 T158 A159 G160 L164 S165 W166 | F69-L162 HydrophobicContact CD1-CD1 3.65Å; F69-L162 HydrophobicContact CE1-CD1 3.56Å; N72-L162 HydrophobicContact CB-CD2 4.13Å; N72-L162 HydrophobicContact CB-CG 4.03Å; T158-L162 HydrophobicContact CG2-CD1 3.75Å; T158-L162 WeakPolarHBondContact O-CD1 3.22Å; T158-L162 PolarHBondContact O-N 3.44Å; A159-L162 PolarHBondContact O-N 3.42Å; G160-L162 VanDerWaalsContact C-N 3.35Å; G160-L162 PolarHBondContact O-N 2.95Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 3.34Å; L162-S165 WeakPolarHBondContact O-CB 3.44Å; L162-S165 PolarHBondContact O-N 3.13Å; L162-S165 PolarHBondContact O-OG 2.89Å; L162-W166 PolarHBondContact O-N 3.47Å |
| 163 | A | 97.5 | Very high | 94.1 | Very high | 62 Ų | 62 | 63.9 Ų | 63.9 | 51% | 0.512 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -58.1 | -42.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | A159 G160 S165 W166 A167 | A159-A163 PolarHBondContact O-N 2.93Å; G160-A163 PolarHBondContact O-N 3.27Å; A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 3.33Å; A163-W166 PolarHBondContact O-N 3.24Å; A163-A167 WeakPolarHBondContact O-CB 3.28Å; A163-A167 PolarHBondContact O-N 3.02Å |
| 164 | L | 97.2 | Very high | 93.7 | Very high | 98 Ų | 98 | 69.4 Ų | 69.4 | 51% | 0.513 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.4 | -36.4 | 177.1 | -176.3 | 63.5 | 0 | 0 | 0 | 111.9 | G160 L162 W166 A167 L168 | G160-L164 WeakPolarHBondContact O-CB 3.33Å; G160-L164 PolarHBondContact O-N 3.08Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 3.34Å; L164-W166 VanDerWaalsContact C-N 3.34Å; L164-W166 PolarHBondContact O-N 3.33Å; L164-A167 PolarHBondContact O-N 3.28Å; L164-L168 HydrophobicContact CD1-CD1 4.16Å; L164-L168 HydrophobicContact CD1-CD2 4.4Å; L164-L168 HydrophobicContact CD1-CG 3.93Å; L164-L168 HydrophobicContact CD2-CD1 4.42Å; L164-L168 HydrophobicContact CG-CD1 3.86Å; L164-L168 HydrophobicContact CG-CG 4.1Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 VanDerWaalsContact O-CG 3.25Å; L164-L168 WeakPolarHBondContact O-CG 3.34Å; L164-L168 PolarHBondContact O-N 3.45Å |
| 165 | S | 97.5 | Very high | 93.1 | Very high | 4 Ų | 4 | 72.8 Ų | 72.8 | 3% | 0.028 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -62.4 | -41.1 | 177.3 | 72.8 | 0 | 0 | 0 | 0 | 112.5 | N72 L129 M161 L162 A163 A169 | N72-S165 PolarHBondContact ND2-OG 3.19Å; N72-S165 VanDerWaalsContact ND2-OG 3.16Å; L129-S165 WeakPolarHBondContact CD1-O 3.44Å; M161-S165 PolarHBondContact O-N 2.86Å; L162-S165 WeakPolarHBondContact O-CB 3.44Å; L162-S165 PolarHBondContact O-N 3.13Å; L162-S165 PolarHBondContact O-OG 2.89Å; A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 3.33Å; S165-A169 WeakPolarHBondContact O-CB 3.36Å; S165-A169 PolarHBondContact O-N 3.47Å; S165-A169 VanDerWaalsContact O-N 3.12Å |
| 166 | W | 97.6 | Very high | 92.1 | Very high | 84 Ų | 84 | 64.8 Ų | 64.8 | 32% | 0.318 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -69.7 | -43.5 | 174.9 | -73.5 | 90.7 | 0 | 0 | 0 | 112 | N72 A75 L122 V126 L162 A163 L164 A169 L170 | N72-W166 PolarHBondContact OD1-NE1 3.06Å; A75-W166 HydrophobicContact CB-CZ2 4.38Å; L122-W166 HydrophobicContact CD1-CE3 4.38Å; L122-W166 HydrophobicContact CD2-CE3 4.34Å; L122-W166 HydrophobicContact CD2-CZ3 4.06Å; L122-W166 HydrophobicContact CG-CE3 4.37Å; L122-W166 HydrophobicContact CG-CZ3 4.22Å; V126-W166 HydrophobicContact CG1-CD2 4.01Å; V126-W166 HydrophobicContact CG1-CG 4.36Å; V126-W166 HydrophobicContact CG1-CH2 4.49Å; V126-W166 HydrophobicContact CG1-CZ2 3.93Å; V126-W166 HydrophobicContact CG2-CD2 3.84Å; V126-W166 HydrophobicContact CG2-CE3 3.79Å; V126-W166 HydrophobicContact CG2-CG 4.23Å; V126-W166 HydrophobicContact CG2-CZ3 4.21Å; L162-W166 PolarHBondContact O-N 3.47Å; A163-W166 PolarHBondContact O-N 3.24Å; L164-W166 VanDerWaalsContact C-N 3.34Å; L164-W166 PolarHBondContact O-N 3.33Å; W166-A169 PolarHBondContact O-N 3.29Å; W166-L170 VanDerWaalsContact O-CB 3.28Å; W166-L170 WeakPolarHBondContact O-CB 3.47Å; W166-L170 PolarHBondContact O-N 3.43Å |
| 167 | A | 96.8 | Very high | 90.5 | Very high | 57 Ų | 57 | 58.6 Ų | 58.6 | 47% | 0.471 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.5 | -42.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A163 L164 L170 G171 | A163-A167 WeakPolarHBondContact O-CB 3.28Å; A163-A167 PolarHBondContact O-N 3.02Å; L164-A167 PolarHBondContact O-N 3.28Å; A167-L170 PolarHBondContact O-N 3.43Å; A167-G171 PolarHBondContact O-N 3.39Å |
| 168 | L | 94.3 | Very high | 88.8 | Confident | 98 Ų | 98 | 60 Ų | 60 | 51% | 0.513 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.7 | -43.4 | 175.7 | -72.7 | 174.7 | 0 | 0 | 0 | 111.6 | L129 L164 G171 L172 | L129-L168 HydrophobicContact CD1-CB 4.19Å; L164-L168 HydrophobicContact CD1-CD1 4.16Å; L164-L168 HydrophobicContact CD1-CD2 4.4Å; L164-L168 HydrophobicContact CD1-CG 3.93Å; L164-L168 HydrophobicContact CD2-CD1 4.42Å; L164-L168 HydrophobicContact CG-CD1 3.86Å; L164-L168 HydrophobicContact CG-CG 4.1Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 VanDerWaalsContact O-CG 3.25Å; L164-L168 WeakPolarHBondContact O-CG 3.34Å; L164-L168 PolarHBondContact O-N 3.45Å; L168-G171 PolarHBondContact O-N 3.49Å; L168-L172 WeakPolarHBondContact O-CB 3.31Å; L168-L172 PolarHBondContact O-N 2.83Å |
| 169 | A | 93.7 | Very high | 86.8 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | L122 T125 V126 S165 W166 L172 V173 | L122-A169 HydrophobicContact CD1-CB 3.79Å; T125-A169 HydrophobicContact CG2-CB 3.66Å; V126-A169 HydrophobicContact CB-CB 4.49Å; V126-A169 HydrophobicContact CG2-CB 3.35Å; S165-A169 WeakPolarHBondContact O-CB 3.36Å; S165-A169 PolarHBondContact O-N 3.47Å; S165-A169 VanDerWaalsContact O-N 3.12Å; W166-A169 PolarHBondContact O-N 3.29Å; A169-L172 PolarHBondContact O-N 2.93Å; A169-V173 WeakPolarHBondContact O-CG2 3.32Å; A169-V173 PolarHBondContact O-N 2.93Å |
| 170 | L | 92.5 | Very high | 84.8 | Confident | 84 Ų | 84 | 68.8 Ų | 68.8 | 44% | 0.44 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.7 | -46.6 | 175.8 | -177.9 | 63.7 | 0 | 0 | 0 | 111.1 | L122 W166 A167 L172 V173 L174 | L122-L170 HydrophobicContact CD1-CB 4.08Å; W166-L170 VanDerWaalsContact O-CB 3.28Å; W166-L170 WeakPolarHBondContact O-CB 3.47Å; W166-L170 PolarHBondContact O-N 3.43Å; A167-L170 PolarHBondContact O-N 3.43Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.37Å; L170-V173 PolarHBondContact O-N 3.14Å; L170-L174 HydrophobicContact CD1-CD1 4.03Å; L170-L174 HydrophobicContact CD1-CG 4.12Å; L170-L174 HydrophobicContact CD2-CD1 4.47Å; L170-L174 HydrophobicContact CG-CD1 3.82Å; L170-L174 HydrophobicContact CG-CG 4.3Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 VanDerWaalsContact O-CG 3.24Å; L170-L174 WeakPolarHBondContact O-CG 3.31Å; L170-L174 PolarHBondContact O-N 3.16Å |
| 171 | G | 90.3 | Very high | 82.7 | Confident | 26 Ų | 26 | 69.9 Ų | 69.9 | 27% | 0.268 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -56.7 | -43.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A167 L168 L174 L175 | A167-G171 PolarHBondContact O-N 3.39Å; L168-G171 PolarHBondContact O-N 3.49Å; G171-L174 PolarHBondContact O-N 2.93Å; G171-L175 VanDerWaalsContact O-CB 3.27Å; G171-L175 WeakPolarHBondContact O-CB 3.4Å; G171-L175 VanDerWaalsContact O-CD1 3.32Å; G171-L175 WeakPolarHBondContact O-CD1 3.21Å; G171-L175 WeakPolarHBondContact O-CG 3.19Å; G171-L175 PolarHBondContact O-N 3.03Å |
| 172 | L | 86.7 | Confident | 80.8 | Confident | 53 Ų | 53 | 77.9 Ų | 77.9 | 28% | 0.277 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.4 | -45.5 | 177.2 | -165.5 | 67.6 | 0 | 0 | 0 | 112.3 | T125 L168 A169 L170 L174 L175 L176 L196 | T125-L172 HydrophobicContact CG2-CD2 4.01Å; L168-L172 WeakPolarHBondContact O-CB 3.31Å; L168-L172 PolarHBondContact O-N 2.83Å; A169-L172 PolarHBondContact O-N 2.93Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.37Å; L172-L174 VanDerWaalsContact C-N 3.35Å; L172-L175 PolarHBondContact O-N 3Å; L172-L176 WeakPolarHBondContact O-CB 3.37Å; L172-L176 WeakPolarHBondContact O-CG 3.4Å; L172-L176 PolarHBondContact O-N 3.23Å; L172-L196 HydrophobicContact CD1-CD1 4.48Å; L172-L196 HydrophobicContact CD1-CD2 3.59Å; L172-L196 HydrophobicContact CD1-CG 4.34Å; L172-L196 HydrophobicContact CD2-CD2 4.36Å; L172-L196 HydrophobicContact CG-CD2 4.02Å |
| 173 | V | 84.1 | Confident | 78.5 | Confident | 29 Ų | 29 | 81 Ų | 81 | 18% | 0.176 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -65.3 | -38.1 | 178.6 | 170.2 | 0 | 0 | 0 | 0 | 111.7 | L122 A169 L170 L176 | L122-V173 HydrophobicContact CB-CG2 4.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.32Å; A169-V173 PolarHBondContact O-N 2.93Å; L170-V173 PolarHBondContact O-N 3.14Å; V173-L176 VanDerWaalsContact O-O 3.09Å |
| 174 | L | 84.4 | Confident | 76.5 | Confident | 130 Ų | 130 | 82.2 Ų | 82.2 | 68% | 0.681 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -75.3 | -30.2 | 178.9 | -67.3 | 175.5 | 0 | 0 | 0 | 113 | L170 G171 L172 | L170-L174 HydrophobicContact CD1-CD1 4.03Å; L170-L174 HydrophobicContact CD1-CG 4.12Å; L170-L174 HydrophobicContact CD2-CD1 4.47Å; L170-L174 HydrophobicContact CG-CD1 3.82Å; L170-L174 HydrophobicContact CG-CG 4.3Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 VanDerWaalsContact O-CG 3.24Å; L170-L174 WeakPolarHBondContact O-CG 3.31Å; L170-L174 PolarHBondContact O-N 3.16Å; G171-L174 PolarHBondContact O-N 2.93Å; L172-L174 VanDerWaalsContact C-N 3.35Å |
| 175 | L | 79.6 | Confident | 74.9 | Confident | 142 Ų | 142 | 79.9 Ų | 79.9 | 74% | 0.743 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -78 | -26.6 | 174.8 | -74.7 | 163.5 | 0 | 0 | 0 | 112.2 | G171 L172 P177 | G171-L175 VanDerWaalsContact O-CB 3.27Å; G171-L175 WeakPolarHBondContact O-CB 3.4Å; G171-L175 VanDerWaalsContact O-CD1 3.32Å; G171-L175 WeakPolarHBondContact O-CD1 3.21Å; G171-L175 WeakPolarHBondContact O-CG 3.19Å; G171-L175 PolarHBondContact O-N 3.03Å; L172-L175 PolarHBondContact O-N 3Å; L175-P177 WeakPolarHBondContact O-CD 3.35Å; L175-P177 WeakPolarHBondContact O-CG 3.16Å |
| 176 | L | 70.3 | Confident | 73.5 | Confident | 52 Ų | 52 | 85.7 Ų | 85.7 | 27% | 0.272 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -71.6 | 115.4 | 170.2 | -80.4 | 175.4 | 0 | 0 | 0 | 108.3 | L172 V173 P193 L196 | L172-L176 WeakPolarHBondContact O-CB 3.37Å; L172-L176 WeakPolarHBondContact O-CG 3.4Å; L172-L176 PolarHBondContact O-N 3.23Å; V173-L176 VanDerWaalsContact O-O 3.09Å; L176-P193 HydrophobicContact CD2-CB 4.16Å; L176-P193 HydrophobicContact CD2-CG 4.15Å; L176-L196 HydrophobicContact CD1-CD2 4.02Å; L176-L196 HydrophobicContact CD2-CD2 3.55Å; L176-L196 HydrophobicContact CG-CD2 3.85Å |
| 177 | P | 59.4 | Low | 72 | Confident | 47 Ų | 47 | 86.2 Ų | 86.2 | 31% | 0.305 | 51% | 0.509 | S | S | . | . | trans | -82.5 | 154.7 | -162.8 | -7.4 | 27.4 | 0 | 0 | 0 | 110.2 | L175 W179 | L175-P177 WeakPolarHBondContact O-CD 3.35Å; L175-P177 WeakPolarHBondContact O-CG 3.16Å; P177-W179 HydrophobicContact CB-CD2 3.51Å; P177-W179 HydrophobicContact CB-CE3 3.86Å; P177-W179 HydrophobicContact CB-CG 4.21Å; P177-W179 HydrophobicContact CB-CH2 3.53Å; P177-W179 HydrophobicContact CB-CZ2 3.21Å; P177-W179 HydrophobicContact CB-CZ3 3.84Å; P177-W179 HydrophobicContact CG-CD2 4.18Å; P177-W179 HydrophobicContact CG-CH2 3.82Å; P177-W179 HydrophobicContact CG-CZ2 3.11Å; P177-W179 VanDerWaalsContact CG-NE1 3.31Å; P177-W179 PolarHBondContact O-N 3.34Å | ||
| 178 | P | 59.4 | Low | 70.8 | Confident | 106 Ų | 106 | 86.1 Ų | 86.1 | 69% | 0.688 | 50% | 0.503 | S | S | * | . | trans | -77.3 | 71.6 | -176.7 | 32.7 | -34.9 | 0 | 0 | 0 | 109.6 | L114 | L114-P178 HydrophobicContact CD1-CB 4.08Š| ||
| 179 | W | 53.6 | Low | 70.1 | Confident | 175 Ų | 175 | 92.5 Ų | 92.5 | 66% | 0.663 | 52% | 0.521 | S | S | * | . | trans | -126.1 | 74.2 | 173.5 | 24.5 | 65.1 | 0 | 0 | 0 | 110.4 | P177 P181 | P177-W179 HydrophobicContact CB-CD2 3.51Å; P177-W179 HydrophobicContact CB-CE3 3.86Å; P177-W179 HydrophobicContact CB-CG 4.21Å; P177-W179 HydrophobicContact CB-CH2 3.53Å; P177-W179 HydrophobicContact CB-CZ2 3.21Å; P177-W179 HydrophobicContact CB-CZ3 3.84Å; P177-W179 HydrophobicContact CG-CD2 4.18Å; P177-W179 HydrophobicContact CG-CH2 3.82Å; P177-W179 HydrophobicContact CG-CZ2 3.11Å; P177-W179 VanDerWaalsContact CG-NE1 3.31Å; P177-W179 PolarHBondContact O-N 3.34Å; W179-P181 WeakPolarHBondContact O-CD 3.29Å | ||
| 180 | A | 53 | Low | 69.6 | Low | 74 Ų | 74 | 94.6 Ų | 94.6 | 61% | 0.612 | 53% | 0.533 | S | S | * | . | S | Bend | -55.5 | 117.6 | 127.6 | 0 | 0 | 0 | 0 | 0 | 105.7 | R182 | A180-R182 PolarHBondContact O-N 3.47Š| |
| 181 | P | 53.3 | Low | 69.2 | Low | 63 Ų | 63 | 93.7 Ų | 93.7 | 41% | 0.409 | 53% | 0.526 | S | S | . | . | P | Polyproline II helix | trans | -49.6 | 135.4 | 173.4 | 16.9 | -27.4 | 0 | 0 | 0 | 108.2 | W179 A185 | W179-P181 WeakPolarHBondContact O-CD 3.29Å; P181-A185 HydrophobicContact CB-CB 4.01Å |
| 182 | R | 57.3 | Low | 68.9 | Low | 215 Ų | 215 | 100 Ų | 100 | 81% | 0.811 | 54% | 0.544 | S | S | * | . | P | Polyproline II helix | trans | -48.8 | 140.7 | 172.1 | -68.4 | -179.4 | 177.8 | 169.7 | -1.8 | 107.7 | A180 G184 A185 | A180-R182 PolarHBondContact O-N 3.47Å; R182-G184 PolarHBondContact O-N 3.28Å; R182-A185 HydrophobicContact CB-CB 4.37Å; R182-A185 WeakPolarHBondContact O-CB 3.42Å; R182-A185 PolarHBondContact O-N 3.42Å |
| 183 | P | 50.6 | Low | 68.8 | Low | 103 Ų | 103 | 100.4 Ų | 100.4 | 67% | 0.669 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | 130.9 | 175.9 | -24.6 | 34.6 | 0 | 0 | 0 | 110 | A103 | A103-P183 HydrophobicContact CB-CG 3.21Š|
| 184 | G | 55.1 | Low | 68.9 | Low | 87 Ų | 87 | 100 Ų | 100 | 90% | 0.897 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.3 | -9.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | R182 | R182-G184 PolarHBondContact O-N 3.28Š|
| 185 | A | 63.9 | Low | 69.1 | Low | 48 Ų | 48 | 95.7 Ų | 95.7 | 40% | 0.397 | 53% | 0.526 | S | S | . | . | S | Bend | trans | -72.2 | 137.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | P181 R182 | P181-A185 HydrophobicContact CB-CB 4.01Å; R182-A185 HydrophobicContact CB-CB 4.37Å; R182-A185 WeakPolarHBondContact O-CB 3.42Å; R182-A185 PolarHBondContact O-N 3.42Å |
| 186 | T | 67.1 | Low | 69.5 | Low | 126 Ų | 126 | 92 Ų | 92 | 77% | 0.773 | 51% | 0.507 | S | S | * | . | P | Polyproline II helix | trans | -57.8 | 126.9 | 176.1 | 51.4 | 0 | 0 | 0 | 0 | 109.4 | ||
| 187 | P | 66.4 | Low | 70.4 | Confident | 95 Ų | 95 | 91.4 Ų | 91.4 | 62% | 0.617 | 51% | 0.51 | S | S | * | . | P | Polyproline II helix | trans | -57.6 | 136.6 | 178.5 | 22.6 | -31.8 | 0 | 0 | 0 | 109.3 | R189 | P187-R189 PolarHBondContact O-N 2.95Š|
| 188 | P | 71.6 | Confident | 71.9 | Confident | 55 Ų | 55 | 89.2 Ų | 89.2 | 36% | 0.357 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -62.3 | 141.5 | 179.5 | 27.5 | -33.9 | 0 | 0 | 0 | 109.2 | V190 S310 | P188-V190 PolarHBondContact O-N 3.37Å; P188-V190 VanDerWaalsContact O-N 3.14Å; P188-S310 PolarHBondContact O-OG 3.49Å |
| 189 | R | 78.9 | Confident | 73.5 | Confident | 233 Ų | 233 | 86.7 Ų | 86.7 | 88% | 0.879 | 48% | 0.484 | S | S | * | . | S | Bend | trans | -59.5 | -26.6 | 175.7 | -67.3 | -175.7 | 177.9 | -164.8 | -0.8 | 112 | P187 S310 | P187-R189 PolarHBondContact O-N 2.95Å; R189-S310 PolarHBondContact O-OG 3.27Å |
| 190 | V | 84.8 | Confident | 75.3 | Confident | 43 Ų | 43 | 80.1 Ų | 80.1 | 26% | 0.261 | 47% | 0.467 | S | S | . | . | S | Bend | trans | -128.5 | 125.7 | -177.7 | -178.7 | 0 | 0 | 0 | 0 | 110.6 | P188 Y192 L195 G308 | P188-V190 PolarHBondContact O-N 3.37Å; P188-V190 VanDerWaalsContact O-N 3.14Å; V190-Y192 HydrophobicContact CG1-CD1 4.35Å; V190-Y192 HydrophobicContact CG1-CE1 4.2Å; V190-Y192 PolarHBondContact O-N 3.34Å; V190-L195 HydrophobicContact CG1-CD1 3.45Å; V190-L195 VanDerWaalsContact CG1-CD1 3.45Å; V190-G308 CarbonylContact C-O 3.57Å; V190-G308 WeakPolarHBondContact CA-O 3.46Å |
| 191 | H | 84.4 | Confident | 77.1 | Confident | 65 Ų | 65 | 77 Ų | 77 | 30% | 0.301 | 44% | 0.44 | S | S | . | . | trans | -95.5 | 87.1 | 175.8 | -59.1 | 102.1 | 0 | 0 | 0 | 110.6 | P193 A194 L195 S307 G308 S310 | H191-P193 VanDerWaalsContact C-CD 3.43Å; H191-A194 HydrophobicContact CB-CB 4.23Å; H191-A194 PolarHBondContact O-N 3.49Å; H191-A194 VanDerWaalsContact O-N 3.12Å; H191-L195 PolarHBondContact O-N 3.46Å; H191-S307 PolarHBondContact ND1-O 3.35Å; H191-G308 PolarHBondContact N-O 2.98Å; H191-S310 PolarHBondContact CE1-OG 2.93Å; H191-S310 VanDerWaalsContact CE1-OG 3.23Å; H191-S310 PolarHBondContact ND1-OG 3.4Å | ||
| 192 | Y | 83.8 | Confident | 79 | Confident | 160 Ų | 160 | 77.8 Ų | 77.8 | 63% | 0.627 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -52.7 | -40.5 | -179 | -63.4 | -79.6 | 0 | 0 | 0 | 115.4 | V190 A194 L195 L196 | V190-Y192 HydrophobicContact CG1-CD1 4.35Å; V190-Y192 HydrophobicContact CG1-CE1 4.2Å; V190-Y192 PolarHBondContact O-N 3.34Å; Y192-A194 VanDerWaalsContact C-N 3.31Å; Y192-A194 PolarHBondContact O-N 2.95Å; Y192-L195 PolarHBondContact O-N 3.5Å; Y192-L196 WeakPolarHBondContact O-CB 3.4Å; Y192-L196 PolarHBondContact O-N 2.89Å |
| 193 | P | 83.2 | Confident | 80.8 | Confident | 61 Ų | 61 | 70.6 Ų | 70.6 | 40% | 0.396 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.6 | -38 | 177.8 | -22.4 | 33 | 0 | 0 | 0 | 113 | L176 H191 L196 A197 | L176-P193 HydrophobicContact CD2-CB 4.16Å; L176-P193 HydrophobicContact CD2-CG 4.15Å; H191-P193 VanDerWaalsContact C-CD 3.43Å; P193-L196 PolarHBondContact O-N 3.22Å; P193-A197 WeakPolarHBondContact O-CB 3.47Å; P193-A197 PolarHBondContact O-N 3.44Å |
| 194 | A | 86.6 | Confident | 82.8 | Confident | 20 Ų | 20 | 66 Ų | 66 | 17% | 0.165 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -69.4 | -41.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | H191 Y192 L196 A197 A198 S304 | H191-A194 HydrophobicContact CB-CB 4.23Å; H191-A194 PolarHBondContact O-N 3.49Å; H191-A194 VanDerWaalsContact O-N 3.12Å; Y192-A194 VanDerWaalsContact C-N 3.31Å; Y192-A194 PolarHBondContact O-N 2.95Å; A194-L196 VanDerWaalsContact C-N 3.34Å; A194-L196 PolarHBondContact O-N 2.87Å; A194-A197 PolarHBondContact O-N 3.46Å; A194-A198 PolarHBondContact O-N 3.49Å; A194-S304 WeakPolarHBondContact CB-O 3.39Å; A194-S304 WeakPolarHBondContact O-CB 3.46Å |
| 195 | L | 89.3 | Confident | 84.5 | Confident | 40 Ų | 40 | 62.8 Ų | 62.8 | 21% | 0.209 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -63.1 | -39.9 | 173.5 | -68.7 | 179.8 | 0 | 0 | 0 | 112.4 | V190 H191 Y192 A198 A199 L305 F309 | V190-L195 HydrophobicContact CG1-CD1 3.45Å; V190-L195 VanDerWaalsContact CG1-CD1 3.45Å; H191-L195 PolarHBondContact O-N 3.46Å; Y192-L195 PolarHBondContact O-N 3.5Å; L195-A198 PolarHBondContact O-N 2.86Å; L195-A199 WeakPolarHBondContact O-CB 3.4Å; L195-A199 PolarHBondContact O-N 3.43Å; L195-L305 HydrophobicContact CD2-CD2 4.23Å; L195-F309 HydrophobicContact CD2-CD2 4.2Å; L195-F309 HydrophobicContact CD2-CE2 3.78Å; L195-F309 HydrophobicContact CD2-CZ 4.02Å |
| 196 | L | 88.3 | Confident | 85.9 | Confident | 63 Ų | 63 | 63.4 Ų | 63.4 | 33% | 0.33 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -66.9 | -40.7 | 177.8 | -171.3 | 60.3 | 0 | 0 | 0 | 111.6 | L172 L176 Y192 P193 A194 A199 A200 | L172-L196 HydrophobicContact CD1-CD1 4.48Å; L172-L196 HydrophobicContact CD1-CD2 3.59Å; L172-L196 HydrophobicContact CD1-CG 4.34Å; L172-L196 HydrophobicContact CD2-CD2 4.36Å; L172-L196 HydrophobicContact CG-CD2 4.02Å; L176-L196 HydrophobicContact CD1-CD2 4.02Å; L176-L196 HydrophobicContact CD2-CD2 3.55Å; L176-L196 HydrophobicContact CG-CD2 3.85Å; Y192-L196 WeakPolarHBondContact O-CB 3.4Å; Y192-L196 PolarHBondContact O-N 2.89Å; P193-L196 PolarHBondContact O-N 3.22Å; A194-L196 VanDerWaalsContact C-N 3.34Å; A194-L196 PolarHBondContact O-N 2.87Å; L196-A199 PolarHBondContact O-N 3.31Å; L196-A200 WeakPolarHBondContact O-CB 3.38Å; L196-A200 PolarHBondContact O-N 2.91Å |
| 197 | A | 88.4 | Confident | 87.1 | Confident | 41 Ų | 41 | 60 Ų | 60 | 34% | 0.339 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.3 | -45.4 | 173 | 0 | 0 | 0 | 0 | 0 | 111.6 | P193 A194 A199 A200 L201 | P193-A197 WeakPolarHBondContact O-CB 3.47Å; P193-A197 PolarHBondContact O-N 3.44Å; A194-A197 PolarHBondContact O-N 3.46Å; A197-A199 PolarHBondContact O-N 3.18Å; A197-A200 PolarHBondContact O-N 3.41Å; A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 VanDerWaalsContact O-CG 3.32Å; A197-L201 WeakPolarHBondContact O-CG 3.39Å; A197-L201 PolarHBondContact O-N 3.36Å |
| 198 | A | 91.8 | Very high | 88.3 | Confident | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.7 | -47 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | A194 L195 A200 L201 L202 L305 | A194-A198 PolarHBondContact O-N 3.49Å; L195-A198 PolarHBondContact O-N 2.86Å; A198-A200 PolarHBondContact O-N 2.98Å; A198-L201 PolarHBondContact O-N 2.95Å; A198-L202 WeakPolarHBondContact O-CB 3.38Å; A198-L202 VanDerWaalsContact O-CG 3.32Å; A198-L202 WeakPolarHBondContact O-CG 3.21Å; A198-L202 PolarHBondContact O-N 3.24Å; A198-L305 HydrophobicContact CB-CD2 3.77Å; A198-L305 HydrophobicContact CB-CG 3.7Å |
| 199 | A | 92.5 | Very high | 89.2 | Confident | 54 Ų | 54 | 56.5 Ų | 56.5 | 45% | 0.446 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | L195 L196 A197 L202 A203 | L195-A199 WeakPolarHBondContact O-CB 3.4Å; L195-A199 PolarHBondContact O-N 3.43Å; L196-A199 PolarHBondContact O-N 3.31Å; A197-A199 PolarHBondContact O-N 3.18Å; A199-L202 PolarHBondContact O-N 3.49Å; A199-A203 WeakPolarHBondContact O-CB 3.34Å; A199-A203 PolarHBondContact O-N 3.27Å |
| 200 | A | 90.8 | Very high | 89.8 | Confident | 37 Ų | 37 | 51 Ų | 51 | 31% | 0.306 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.3 | -45.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | L128 L196 A197 A198 A203 Q204 | L128-A200 HydrophobicContact CD1-CB 4.43Å; L196-A200 WeakPolarHBondContact O-CB 3.38Å; L196-A200 PolarHBondContact O-N 2.91Å; A197-A200 PolarHBondContact O-N 3.41Å; A198-A200 PolarHBondContact O-N 2.98Å; A200-A203 PolarHBondContact O-N 2.89Å; A200-Q204 VanDerWaalsContact O-CB 3.31Å; A200-Q204 WeakPolarHBondContact O-CB 3.34Å; A200-Q204 PolarHBondContact O-N 3.44Å |
| 201 | L | 91.9 | Very high | 90.1 | Very high | 8 Ų | 8 | 49 Ų | 49 | 4% | 0.042 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.2 | -38.1 | 177.6 | -72.6 | 169 | 0 | 0 | 0 | 112.4 | L128 A197 A198 T205 T297 L300 V301 | L128-L201 HydrophobicContact CD1-CD2 3.76Å; L128-L201 HydrophobicContact CD1-CG 4.23Å; L128-L201 HydrophobicContact CD2-CD2 3.82Å; L128-L201 HydrophobicContact CG-CD2 4.45Å; A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 VanDerWaalsContact O-CG 3.32Å; A197-L201 WeakPolarHBondContact O-CG 3.39Å; A197-L201 PolarHBondContact O-N 3.36Å; A198-L201 PolarHBondContact O-N 2.95Å; L201-T205 VanDerWaalsContact O-CB 3.25Å; L201-T205 WeakPolarHBondContact O-CB 3.33Å; L201-T205 PolarHBondContact O-N 3.46Å; L201-T205 PolarHBondContact O-OG1 3.41Å; L201-T297 HydrophobicContact CD2-CG2 4.23Å; L201-L300 HydrophobicContact CD1-CB 4.35Å; L201-L300 HydrophobicContact CD1-CD2 4.02Å; L201-L300 HydrophobicContact CD1-CG 4.11Å; L201-V301 HydrophobicContact CB-CG2 3.47Å; L201-V301 VanDerWaalsContact CB-CG2 3.47Å; L201-V301 HydrophobicContact CD1-CG2 3.92Å; L201-V301 HydrophobicContact CG-CG2 4.32Å |
| 202 | L | 93.4 | Very high | 90.3 | Very high | 79 Ų | 79 | 46.2 Ų | 46.2 | 41% | 0.414 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66.2 | -46.8 | 174.5 | -75.8 | 171.7 | 0 | 0 | 0 | 111.7 | A198 A199 Q204 T205 A206 V301 | A198-L202 WeakPolarHBondContact O-CB 3.38Å; A198-L202 VanDerWaalsContact O-CG 3.32Å; A198-L202 WeakPolarHBondContact O-CG 3.21Å; A198-L202 PolarHBondContact O-N 3.24Å; A199-L202 PolarHBondContact O-N 3.49Å; L202-Q204 VanDerWaalsContact C-N 3.32Å; L202-Q204 PolarHBondContact O-N 2.88Å; L202-T205 WeakPolarHBondContact O-CB 3.39Å; L202-T205 PolarHBondContact O-N 3.17Å; L202-A206 PolarHBondContact O-N 2.94Å; L202-V301 HydrophobicContact CD1-CG1 4.28Å; L202-V301 HydrophobicContact CD2-CG1 3.84Å; L202-V301 HydrophobicContact CG-CG1 3.82Å |
| 203 | A | 93.3 | Very high | 90.5 | Very high | 64 Ų | 64 | 42 Ų | 42 | 53% | 0.529 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | A199 A200 A206 L207 | A199-A203 WeakPolarHBondContact O-CB 3.34Å; A199-A203 PolarHBondContact O-N 3.27Å; A200-A203 PolarHBondContact O-N 2.89Å; A203-A206 PolarHBondContact O-N 3.41Å; A203-L207 PolarHBondContact O-N 3.32Å |
| 204 | Q | 92.4 | Very high | 90.7 | Very high | 6 Ų | 6 | 39.8 Ų | 39.8 | 3% | 0.028 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.9 | -46.1 | 174 | 171.8 | 179.1 | 20.7 | 0 | 0 | 112.3 | L128 A200 L202 A206 L207 L208 F293 | L128-Q204 VanDerWaalsContact CB-OE1 3.3Å; L128-Q204 PolarHBondContact O-NE2 3.42Å; A200-Q204 VanDerWaalsContact O-CB 3.31Å; A200-Q204 WeakPolarHBondContact O-CB 3.34Å; A200-Q204 PolarHBondContact O-N 3.44Å; L202-Q204 VanDerWaalsContact C-N 3.32Å; L202-Q204 PolarHBondContact O-N 2.88Å; Q204-A206 VanDerWaalsContact C-N 3.31Å; Q204-A206 PolarHBondContact O-N 3.38Å; Q204-L207 PolarHBondContact O-N 2.87Å; Q204-L208 HydrophobicContact CG-CD1 3.66Å; Q204-L208 HydrophobicContact CG-CG 4.32Å; Q204-L208 WeakPolarHBondContact O-CB 3.38Å; Q204-L208 WeakPolarHBondContact O-CG 3.49Å; Q204-L208 PolarHBondContact O-N 2.93Å; Q204-F293 VanDerWaalsContact CD-CE1 3.5Å; Q204-F293 HydrophobicContact CG-CE1 4.17Å |
| 205 | T | 91.3 | Very high | 90.8 | Very high | 20 Ų | 20 | 38.8 Ų | 38.8 | 12% | 0.123 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -56.3 | -47.1 | 177.2 | -69.8 | 0 | 0 | 0 | 0 | 110.8 | L201 L202 L207 L208 L209 L294 | L201-T205 VanDerWaalsContact O-CB 3.25Å; L201-T205 WeakPolarHBondContact O-CB 3.33Å; L201-T205 PolarHBondContact O-N 3.46Å; L201-T205 PolarHBondContact O-OG1 3.41Å; L202-T205 WeakPolarHBondContact O-CB 3.39Å; L202-T205 PolarHBondContact O-N 3.17Å; T205-L207 PolarHBondContact O-N 3.03Å; T205-L208 PolarHBondContact O-N 3.25Å; T205-L209 VanDerWaalsContact O-CB 3.31Å; T205-L209 WeakPolarHBondContact O-CB 3.24Å; T205-L209 PolarHBondContact O-N 2.87Å; T205-L294 HydrophobicContact CG2-CD2 3.31Å |
| 206 | A | 93.1 | Very high | 90.5 | Very high | 61 Ų | 61 | 38.2 Ų | 38.2 | 50% | 0.504 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61 | -43.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | L202 A203 Q204 L209 H210 | L202-A206 PolarHBondContact O-N 2.94Å; A203-A206 PolarHBondContact O-N 3.41Å; Q204-A206 VanDerWaalsContact C-N 3.31Å; Q204-A206 PolarHBondContact O-N 3.38Å; A206-L209 PolarHBondContact O-N 3.28Å; A206-H210 WeakPolarHBondContact O-CB 3.37Å; A206-H210 PolarHBondContact O-N 3.42Å |
| 207 | L | 93.5 | Very high | 90.4 | Very high | 55 Ų | 55 | 43.4 Ų | 43.4 | 29% | 0.288 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -65.8 | -45.5 | 178.5 | -178.1 | 63.8 | 0 | 0 | 0 | 112.5 | C132 L136 A203 Q204 T205 L209 H210 C211 | C132-L207 HydrophobicContact CB-CD2 3.65Å; L136-L207 HydrophobicContact CD1-CD2 4.26Å; L136-L207 HydrophobicContact CD2-CD1 4.2Å; L136-L207 HydrophobicContact CG-CD2 4.41Å; A203-L207 PolarHBondContact O-N 3.32Å; Q204-L207 PolarHBondContact O-N 2.87Å; T205-L207 PolarHBondContact O-N 3.03Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 2.88Å; L207-H210 PolarHBondContact O-N 2.92Å; L207-C211 WeakPolarHBondContact O-CB 3.24Å; L207-C211 PolarHBondContact O-N 3.03Å; L207-C211 PolarHBondContact O-SG 2.88Å |
| 208 | L | 90.5 | Very high | 90.3 | Very high | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.01 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.2 | -48.7 | 175.8 | -75.2 | 161.5 | 0 | 0 | 0 | 110.1 | A135 Q204 T205 H210 C211 Y212 F293 | A135-L208 HydrophobicContact CB-CD2 3.59Å; Q204-L208 HydrophobicContact CG-CD1 3.66Å; Q204-L208 HydrophobicContact CG-CG 4.32Å; Q204-L208 WeakPolarHBondContact O-CB 3.38Å; Q204-L208 WeakPolarHBondContact O-CG 3.49Å; Q204-L208 PolarHBondContact O-N 2.93Å; T205-L208 PolarHBondContact O-N 3.25Å; L208-H210 VanDerWaalsContact C-N 3.35Å; L208-H210 PolarHBondContact O-N 2.94Å; L208-C211 PolarHBondContact O-N 3.37Å; L208-Y212 HydrophobicContact CB-CD2 4.16Å; L208-Y212 HydrophobicContact CB-CE2 4.2Å; L208-Y212 HydrophobicContact CD2-CD2 4.29Å; L208-Y212 HydrophobicContact CD2-CE2 3.52Å; L208-Y212 HydrophobicContact CG-CE2 4.48Å; L208-Y212 WeakPolarHBondContact O-CB 3.44Å; L208-Y212 WeakPolarHBondContact O-CD2 3.33Å; L208-Y212 PolarHBondContact O-N 3.47Å; L208-F293 HydrophobicContact CD1-CD1 3.29Å; L208-F293 HydrophobicContact CD1-CE1 3.65Å; L208-F293 HydrophobicContact CD1-CG 3.99Å |
| 209 | L | 90.7 | Very high | 89.8 | Confident | 75 Ų | 75 | 47.8 Ų | 47.8 | 39% | 0.393 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 179 | -170.1 | 65.7 | 0 | 0 | 0 | 111.1 | T205 A206 L207 C211 Y212 L213 | T205-L209 VanDerWaalsContact O-CB 3.31Å; T205-L209 WeakPolarHBondContact O-CB 3.24Å; T205-L209 PolarHBondContact O-N 2.87Å; A206-L209 PolarHBondContact O-N 3.28Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 2.88Å; L209-C211 PolarHBondContact O-N 3.47Å; L209-Y212 PolarHBondContact O-N 3.4Å; L209-L213 HydrophobicContact CD1-CD1 3.85Å; L209-L213 HydrophobicContact CD1-CD2 4.39Å; L209-L213 HydrophobicContact CD1-CG 3.9Å; L209-L213 HydrophobicContact CD2-CD1 4.35Å; L209-L213 HydrophobicContact CG-CD1 3.68Å; L209-L213 HydrophobicContact CG-CG 4.11Å; L209-L213 WeakPolarHBondContact O-CB 3.23Å; L209-L213 WeakPolarHBondContact O-CG 3.35Å; L209-L213 PolarHBondContact O-N 3.47Å |
| 210 | H | 92.4 | Very high | 89.2 | Confident | 118 Ų | 118 | 53.6 Ų | 53.6 | 55% | 0.546 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.3 | -50.7 | 175.3 | 179.6 | 85.1 | 0 | 0 | 0 | 112 | A206 L207 L208 G214 | A206-H210 WeakPolarHBondContact O-CB 3.37Å; A206-H210 PolarHBondContact O-N 3.42Å; L207-H210 PolarHBondContact O-N 2.92Å; L208-H210 VanDerWaalsContact C-N 3.35Å; L208-H210 PolarHBondContact O-N 2.94Å; H210-G214 PolarHBondContact O-N 2.89Å |
| 211 | C | 91 | Very high | 88.8 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.1 | -49.8 | -179.7 | -69.3 | 0 | 0 | 0 | 0 | 111.6 | A135 Y139 L207 L208 L209 G214 I215 | A135-C211 HydrophobicContact CB-CB 4.17Å; Y139-C211 VanDerWaalsContact CD2-O 3.32Å; Y139-C211 WeakPolarHBondContact CD2-O 3.37Å; Y139-C211 HydrophobicContact CG-CB 4.36Å; L207-C211 WeakPolarHBondContact O-CB 3.24Å; L207-C211 PolarHBondContact O-N 3.03Å; L207-C211 PolarHBondContact O-SG 2.88Å; L208-C211 PolarHBondContact O-N 3.37Å; L209-C211 PolarHBondContact O-N 3.47Å; C211-G214 PolarHBondContact O-N 3.02Å; C211-I215 WeakPolarHBondContact O-CG1 3.49Å; C211-I215 PolarHBondContact O-N 3.3Å |
| 212 | Y | 87.4 | Confident | 88.1 | Confident | 6 Ų | 6 | 56.2 Ų | 56.2 | 2% | 0.024 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -73.8 | -40.2 | -174.5 | -69.3 | -52.6 | 0 | 0 | 0 | 113.2 | A135 L208 L209 G214 I215 V216 V286 C290 | A135-Y212 HydrophobicContact CB-CE2 4.43Å; L208-Y212 HydrophobicContact CB-CD2 4.16Å; L208-Y212 HydrophobicContact CB-CE2 4.2Å; L208-Y212 HydrophobicContact CD2-CD2 4.29Å; L208-Y212 HydrophobicContact CD2-CE2 3.52Å; L208-Y212 HydrophobicContact CG-CE2 4.48Å; L208-Y212 WeakPolarHBondContact O-CB 3.44Å; L208-Y212 WeakPolarHBondContact O-CD2 3.33Å; L208-Y212 PolarHBondContact O-N 3.47Å; L209-Y212 PolarHBondContact O-N 3.4Å; Y212-G214 VanDerWaalsContact C-N 3.26Å; Y212-G214 PolarHBondContact O-N 3.41Å; Y212-I215 HydrophobicContact CD1-CD1 3.94Å; Y212-I215 HydrophobicContact CE1-CD1 4.42Å; Y212-I215 PolarHBondContact O-N 2.98Å; Y212-V216 WeakPolarHBondContact O-CG2 3.07Å; Y212-V216 PolarHBondContact O-N 3.05Å; Y212-V286 HydrophobicContact CD1-CB 4.49Å; Y212-V286 HydrophobicContact CD1-CG1 3.15Å; Y212-V286 HydrophobicContact CE1-CG1 3.47Å; Y212-V286 VanDerWaalsContact CE1-CG1 3.47Å; Y212-V286 HydrophobicContact CG-CG1 4.24Å; Y212-C290 HydrophobicContact CD2-CB 3.4Å; Y212-C290 WeakPolarHBondContact CD2-SG 3.44Å; Y212-C290 HydrophobicContact CE2-CB 3.81Å; Y212-C290 HydrophobicContact CG-CB 3.91Å |
| 213 | L | 87.9 | Confident | 87.2 | Confident | 71 Ų | 71 | 54.4 Ų | 54.4 | 37% | 0.372 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.6 | -38.8 | 171 | -68 | 179.9 | 0 | 0 | 0 | 110.9 | L209 V216 R217 | L209-L213 HydrophobicContact CD1-CD1 3.85Å; L209-L213 HydrophobicContact CD1-CD2 4.39Å; L209-L213 HydrophobicContact CD1-CG 3.9Å; L209-L213 HydrophobicContact CD2-CD1 4.35Å; L209-L213 HydrophobicContact CG-CD1 3.68Å; L209-L213 HydrophobicContact CG-CG 4.11Å; L209-L213 WeakPolarHBondContact O-CB 3.23Å; L209-L213 WeakPolarHBondContact O-CG 3.35Å; L209-L213 PolarHBondContact O-N 3.47Å; L213-V216 PolarHBondContact O-N 3.47Å; L213-R217 WeakPolarHBondContact O-CB 3.49Å; L213-R217 WeakPolarHBondContact O-CG 3.42Å; L213-R217 PolarHBondContact O-N 2.9Å |
| 214 | G | 88.9 | Confident | 86.4 | Confident | 15 Ų | 15 | 58.6 Ų | 58.6 | 16% | 0.155 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.4 | -45.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | H210 C211 Y212 R217 R218 | H210-G214 PolarHBondContact O-N 2.89Å; C211-G214 PolarHBondContact O-N 3.02Å; Y212-G214 VanDerWaalsContact C-N 3.26Å; Y212-G214 PolarHBondContact O-N 3.41Å; G214-R217 PolarHBondContact O-N 2.92Å; G214-R218 WeakPolarHBondContact O-CB 3.31Å; G214-R218 PolarHBondContact O-N 2.9Å |
| 215 | I | 87.1 | Confident | 85.7 | Confident | 0 Ų | 0 | 66.2 Ų | 66.2 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.8 | -50.3 | 174.4 | -69.5 | 162.1 | 0 | 0 | 0 | 110.5 | R138 Y139 I142 T143 C211 Y212 R217 R218 V219 V286 | R138-I215 HydrophobicContact CB-CD1 4.22Å; Y139-I215 HydrophobicContact CD2-CG1 4.21Å; I142-I215 HydrophobicContact CB-CG1 4.5Å; I142-I215 HydrophobicContact CD1-CD1 4.2Å; I142-I215 HydrophobicContact CD1-CG1 4.21Å; I142-I215 HydrophobicContact CD1-CG2 3.84Å; I142-I215 HydrophobicContact CG2-CG2 4.19Å; T143-I215 HydrophobicContact CG2-CG1 4.45Å; C211-I215 WeakPolarHBondContact O-CG1 3.49Å; C211-I215 PolarHBondContact O-N 3.3Å; Y212-I215 HydrophobicContact CD1-CD1 3.94Å; Y212-I215 HydrophobicContact CE1-CD1 4.42Å; Y212-I215 PolarHBondContact O-N 2.98Å; I215-R217 VanDerWaalsContact C-N 3.35Å; I215-R217 PolarHBondContact O-N 3.43Å; I215-R218 PolarHBondContact O-N 3.01Å; I215-R218 VanDerWaalsContact O-N 3.17Å; I215-V219 HydrophobicContact CG2-CG2 4.2Å; I215-V219 WeakPolarHBondContact O-CG2 3.35Å; I215-V219 PolarHBondContact O-N 2.95Å; I215-V286 HydrophobicContact CD1-CG1 4.04Å; I215-V286 HydrophobicContact CG2-CG1 4.19Å |
| 216 | V | 84.1 | Confident | 84.9 | Confident | 28 Ų | 28 | 67.5 Ų | 67.5 | 17% | 0.17 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -60.5 | -45 | -179 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | Y212 L213 R218 V219 R220 | Y212-V216 WeakPolarHBondContact O-CG2 3.07Å; Y212-V216 PolarHBondContact O-N 3.05Å; L213-V216 PolarHBondContact O-N 3.47Å; V216-R218 VanDerWaalsContact C-N 3.34Å; V216-R218 PolarHBondContact O-N 2.67Å; V216-V219 PolarHBondContact O-N 3.21Å; V216-R220 HydrophobicContact CG1-CG 4.37Å; V216-R220 WeakPolarHBondContact O-CB 3.11Å; V216-R220 VanDerWaalsContact O-CG 3.29Å; V216-R220 WeakPolarHBondContact O-CG 3.01Å; V216-R220 PolarHBondContact O-N 3.32Å |
| 217 | R | 86.5 | Confident | 84.1 | Confident | 172 Ų | 172 | 68.1 Ų | 68.1 | 65% | 0.649 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -57.8 | -47.3 | 175.5 | -74.2 | 172.3 | -174 | 174.7 | 2.7 | 110.8 | L213 G214 I215 R220 V221 | L213-R217 WeakPolarHBondContact O-CB 3.49Å; L213-R217 WeakPolarHBondContact O-CG 3.42Å; L213-R217 PolarHBondContact O-N 2.9Å; G214-R217 PolarHBondContact O-N 2.92Å; I215-R217 VanDerWaalsContact C-N 3.35Å; I215-R217 PolarHBondContact O-N 3.43Å; R217-R220 PolarHBondContact O-N 2.9Å; R217-V221 WeakPolarHBondContact O-CG2 3.39Å; R217-V221 PolarHBondContact O-N 3.4Å |
| 218 | R | 85.2 | Confident | 83.2 | Confident | 105 Ų | 105 | 69.4 Ų | 69.4 | 40% | 0.396 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.9 | -46.8 | 179 | -172.9 | 67.9 | 176.2 | 179.3 | -1 | 112.2 | T143 G214 I215 V216 R220 V221 S222 | T143-R218 HydrophobicContact CG2-CB 3.86Å; T143-R218 HydrophobicContact CG2-CG 4.18Å; G214-R218 WeakPolarHBondContact O-CB 3.31Å; G214-R218 PolarHBondContact O-N 2.9Å; I215-R218 PolarHBondContact O-N 3.01Å; I215-R218 VanDerWaalsContact O-N 3.17Å; V216-R218 VanDerWaalsContact C-N 3.34Å; V216-R218 PolarHBondContact O-N 2.67Å; R218-R220 VanDerWaalsContact C-N 3.35Å; R218-R220 PolarHBondContact O-N 2.93Å; R218-V221 PolarHBondContact O-N 2.8Å; R218-S222 PolarHBondContact O-N 3.2Å; R218-S222 PolarHBondContact O-OG 2.9Å; R218-S222 VanDerWaalsContact O-OG 3.14Å |
| 219 | V | 81 | Confident | 82.5 | Confident | 28 Ų | 28 | 74.4 Ų | 74.4 | 17% | 0.17 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61 | -44.1 | 178.9 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | I142 I215 V216 V221 S222 V223 | I142-V219 HydrophobicContact CG2-CG2 4.32Å; I215-V219 HydrophobicContact CG2-CG2 4.2Å; I215-V219 WeakPolarHBondContact O-CG2 3.35Å; I215-V219 PolarHBondContact O-N 2.95Å; V216-V219 PolarHBondContact O-N 3.21Å; V219-V221 PolarHBondContact O-N 3Å; V219-S222 PolarHBondContact O-N 3.28Å; V219-V223 WeakPolarHBondContact O-CG2 3.37Å; V219-V223 PolarHBondContact O-N 2.9Å |
| 220 | R | 80.8 | Confident | 81.6 | Confident | 176 Ų | 176 | 72.6 Ų | 72.6 | 66% | 0.664 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -59.4 | -45.4 | 175.8 | -74.1 | 178.1 | -177.8 | -167 | 2 | 111.8 | V216 R217 R218 V223 K224 | V216-R220 HydrophobicContact CG1-CG 4.37Å; V216-R220 WeakPolarHBondContact O-CB 3.11Å; V216-R220 VanDerWaalsContact O-CG 3.29Å; V216-R220 WeakPolarHBondContact O-CG 3.01Å; V216-R220 PolarHBondContact O-N 3.32Å; R217-R220 PolarHBondContact O-N 2.9Å; R218-R220 VanDerWaalsContact C-N 3.35Å; R218-R220 PolarHBondContact O-N 2.93Å; R220-V223 PolarHBondContact O-N 3.3Å; R220-K224 WeakPolarHBondContact O-CG 3.15Å; R220-K224 PolarHBondContact O-N 2.85Å |
| 221 | V | 81.4 | Confident | 80.6 | Confident | 61 Ų | 61 | 73.1 Ų | 73.1 | 37% | 0.37 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 176.8 | 172 | 0 | 0 | 0 | 0 | 111.3 | R217 R218 V219 V223 K224 R225 | R217-V221 WeakPolarHBondContact O-CG2 3.39Å; R217-V221 PolarHBondContact O-N 3.4Å; R218-V221 PolarHBondContact O-N 2.8Å; V219-V221 PolarHBondContact O-N 3Å; V221-V223 VanDerWaalsContact C-N 3.32Å; V221-V223 PolarHBondContact O-N 3.3Å; V221-K224 PolarHBondContact O-N 3.04Å; V221-R225 HydrophobicContact CG1-CG 4.41Å; V221-R225 WeakPolarHBondContact O-CG 3.42Å; V221-R225 PolarHBondContact O-N 3.41Å |
| 222 | S | 77.9 | Confident | 79.8 | Confident | 38 Ų | 38 | 77.9 Ų | 77.9 | 27% | 0.266 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.4 | -39.7 | 177 | -65 | 0 | 0 | 0 | 0 | 112.3 | R218 V219 V226 | R218-S222 PolarHBondContact O-N 3.2Å; R218-S222 PolarHBondContact O-OG 2.9Å; R218-S222 VanDerWaalsContact O-OG 3.14Å; V219-S222 PolarHBondContact O-N 3.28Å; S222-V226 WeakPolarHBondContact O-CB 3.45Å; S222-V226 VanDerWaalsContact O-CG2 3.26Å; S222-V226 WeakPolarHBondContact O-CG2 3.44Å; S222-V226 PolarHBondContact O-N 3.17Å |
| 223 | V | 74.1 | Confident | 78.9 | Confident | 42 Ų | 42 | 82.2 Ų | 82.2 | 26% | 0.255 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.6 | -44.8 | 175.3 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | V219 R220 V221 V226 S227 | V219-V223 WeakPolarHBondContact O-CG2 3.37Å; V219-V223 PolarHBondContact O-N 2.9Å; R220-V223 PolarHBondContact O-N 3.3Å; V221-V223 VanDerWaalsContact C-N 3.32Å; V221-V223 PolarHBondContact O-N 3.3Å; V223-V226 PolarHBondContact O-N 2.88Å; V223-S227 WeakPolarHBondContact O-CB 3.43Å; V223-S227 PolarHBondContact O-N 3.2Å |
| 224 | K | 77.3 | Confident | 77.7 | Confident | 152 Ų | 152 | 83.5 Ų | 83.5 | 66% | 0.661 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -59.4 | -49 | 176.3 | -73 | -176.4 | 178.7 | -170.1 | 0 | 111.9 | R220 V221 V226 S227 V228 | R220-K224 WeakPolarHBondContact O-CG 3.15Å; R220-K224 PolarHBondContact O-N 2.85Å; V221-K224 PolarHBondContact O-N 3.04Å; K224-V226 PolarHBondContact O-N 2.97Å; K224-S227 WeakPolarHBondContact O-CB 3.31Å; K224-S227 PolarHBondContact O-N 3.19Å; K224-S227 VanDerWaalsContact O-N 3.14Å; K224-V228 WeakPolarHBondContact O-CG2 3.48Å; K224-V228 PolarHBondContact O-N 2.74Å |
| 225 | R | 77.7 | Confident | 76.2 | Confident | 166 Ų | 166 | 89.9 Ų | 89.9 | 63% | 0.626 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -60.3 | -43.3 | 178.8 | -71.4 | -177.6 | -176.8 | -167.6 | -1.3 | 112.6 | V221 S227 V228 L229 | V221-R225 HydrophobicContact CG1-CG 4.41Å; V221-R225 WeakPolarHBondContact O-CG 3.42Å; V221-R225 PolarHBondContact O-N 3.41Å; R225-S227 VanDerWaalsContact C-N 3.31Å; R225-S227 PolarHBondContact O-N 3.25Å; R225-V228 PolarHBondContact O-N 2.87Å; R225-L229 WeakPolarHBondContact O-CB 3.44Å; R225-L229 PolarHBondContact O-N 2.61Å |
| 226 | V | 74.8 | Confident | 74.7 | Confident | 47 Ų | 47 | 96.8 Ų | 96.8 | 29% | 0.285 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -66 | -36.1 | 176.6 | 170.9 | 0 | 0 | 0 | 0 | 111.3 | S222 V223 K224 N230 | S222-V226 WeakPolarHBondContact O-CB 3.45Å; S222-V226 VanDerWaalsContact O-CG2 3.26Å; S222-V226 WeakPolarHBondContact O-CG2 3.44Å; S222-V226 PolarHBondContact O-N 3.17Å; V223-V226 PolarHBondContact O-N 2.88Å; K224-V226 PolarHBondContact O-N 2.97Å; V226-N230 VanDerWaalsContact O-CB 3.22Å; V226-N230 WeakPolarHBondContact O-CB 3.49Å; V226-N230 PolarHBondContact O-N 3.33Å |
| 227 | S | 75.4 | Confident | 73.4 | Confident | 73 Ų | 73 | 101.3 Ų | 101.3 | 51% | 0.51 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 175.2 | -163.7 | 0 | 0 | 0 | 0 | 111.9 | V223 K224 R225 N230 F231 | V223-S227 WeakPolarHBondContact O-CB 3.43Å; V223-S227 PolarHBondContact O-N 3.2Å; K224-S227 WeakPolarHBondContact O-CB 3.31Å; K224-S227 PolarHBondContact O-N 3.19Å; K224-S227 VanDerWaalsContact O-N 3.14Å; R225-S227 VanDerWaalsContact C-N 3.31Å; R225-S227 PolarHBondContact O-N 3.25Å; S227-N230 PolarHBondContact O-N 2.85Å; S227-F231 WeakPolarHBondContact O-CB 3.39Å; S227-F231 PolarHBondContact O-N 3.43Å |
| 228 | V | 75.5 | Confident | 71.7 | Confident | 82 Ų | 82 | 98.6 Ų | 98.6 | 50% | 0.497 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.5 | -45 | 177.3 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | K224 R225 N230 F231 H232 | K224-V228 WeakPolarHBondContact O-CG2 3.48Å; K224-V228 PolarHBondContact O-N 2.74Å; R225-V228 PolarHBondContact O-N 2.87Å; V228-N230 VanDerWaalsContact C-N 3.31Å; V228-N230 PolarHBondContact O-N 2.81Å; V228-F231 WeakPolarHBondContact O-CB 3.18Å; V228-F231 PolarHBondContact O-N 3Å; V228-F231 VanDerWaalsContact O-N 3.16Å; V228-H232 PolarHBondContact O-CD2 2.66Å; V228-H232 PolarHBondContact O-N 2.67Å |
| 229 | L | 74.7 | Confident | 70.2 | Confident | 107 Ų | 107 | 96 Ų | 96 | 56% | 0.56 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.6 | -40.9 | 176.5 | -175.7 | 66.7 | 0 | 0 | 0 | 111.6 | R225 F231 H232 L233 | R225-L229 WeakPolarHBondContact O-CB 3.44Å; R225-L229 PolarHBondContact O-N 2.61Å; L229-F231 VanDerWaalsContact C-N 3.32Å; L229-H232 PolarHBondContact O-N 3.17Å; L229-L233 HydrophobicContact CG-CD1 4.26Å; L229-L233 WeakPolarHBondContact O-CB 3.36Å; L229-L233 WeakPolarHBondContact O-CG 3.18Å; L229-L233 PolarHBondContact O-N 3.2Å |
| 230 | N | 72.8 | Confident | 68.4 | Low | 37 Ų | 37 | 100.4 Ų | 100.4 | 20% | 0.198 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -65.2 | -37.5 | 175.9 | -164.3 | 74 | 0 | 0 | 0 | 111.7 | V226 S227 V228 L234 | V226-N230 VanDerWaalsContact O-CB 3.22Å; V226-N230 WeakPolarHBondContact O-CB 3.49Å; V226-N230 PolarHBondContact O-N 3.33Å; S227-N230 PolarHBondContact O-N 2.85Å; V228-N230 VanDerWaalsContact C-N 3.31Å; V228-N230 PolarHBondContact O-N 2.81Å; N230-L234 WeakPolarHBondContact O-CB 3.22Å; N230-L234 VanDerWaalsContact O-CG 3.28Å; N230-L234 WeakPolarHBondContact O-CG 3.33Å; N230-L234 PolarHBondContact O-N 3.08Å |
| 231 | F | 71.9 | Confident | 66.6 | Low | 130 Ų | 130 | 96 Ų | 96 | 57% | 0.57 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.5 | -46.3 | 173.3 | -179.1 | -100.9 | 0 | 0 | 0 | 111.4 | S227 V228 L229 L233 L234 H235 | S227-F231 WeakPolarHBondContact O-CB 3.39Å; S227-F231 PolarHBondContact O-N 3.43Å; V228-F231 WeakPolarHBondContact O-CB 3.18Å; V228-F231 PolarHBondContact O-N 3Å; V228-F231 VanDerWaalsContact O-N 3.16Å; L229-F231 VanDerWaalsContact C-N 3.32Å; F231-L233 PolarHBondContact O-N 3.05Å; F231-L234 PolarHBondContact O-N 3.39Å; F231-H235 WeakPolarHBondContact O-CB 3.41Å; F231-H235 PolarHBondContact O-N 3.4Å |
| 232 | H | 73.2 | Confident | 64.8 | Low | 99 Ų | 99 | 95.9 Ų | 95.9 | 46% | 0.458 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 176 | -80.4 | -142.9 | 0 | 0 | 0 | 112.1 | V228 L229 L234 H235 Q236 | V228-H232 PolarHBondContact O-CD2 2.66Å; V228-H232 PolarHBondContact O-N 2.67Å; L229-H232 PolarHBondContact O-N 3.17Å; H232-L234 PolarHBondContact O-N 3.08Å; H232-H235 PolarHBondContact O-N 3.47Å; H232-Q236 VanDerWaalsContact O-CB 3.23Å; H232-Q236 WeakPolarHBondContact O-CB 3.25Å; H232-Q236 VanDerWaalsContact O-CG 3.32Å; H232-Q236 WeakPolarHBondContact O-CG 3.43Å; H232-Q236 PolarHBondContact O-N 3.09Å |
| 233 | L | 68.4 | Low | 63.1 | Low | 98 Ų | 98 | 97.8 Ų | 97.8 | 51% | 0.513 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.8 | -40.4 | 177.4 | -78.3 | 169.1 | 0 | 0 | 0 | 112.4 | L229 F231 H235 L237 | L229-L233 HydrophobicContact CG-CD1 4.26Å; L229-L233 WeakPolarHBondContact O-CB 3.36Å; L229-L233 WeakPolarHBondContact O-CG 3.18Å; L229-L233 PolarHBondContact O-N 3.2Å; F231-L233 PolarHBondContact O-N 3.05Å; L233-H235 VanDerWaalsContact C-N 3.32Å; L233-L237 WeakPolarHBondContact O-CG 3.43Å; L233-L237 PolarHBondContact O-N 3.32Å |
| 234 | L | 63.3 | Low | 61.5 | Low | 97 Ų | 97 | 99.8 Ų | 99.8 | 51% | 0.508 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.9 | -34.2 | 175.8 | -73.2 | 172.2 | 0 | 0 | 0 | 112.3 | N230 F231 H232 L268 | N230-L234 WeakPolarHBondContact O-CB 3.22Å; N230-L234 VanDerWaalsContact O-CG 3.28Å; N230-L234 WeakPolarHBondContact O-CG 3.33Å; N230-L234 PolarHBondContact O-N 3.08Å; F231-L234 PolarHBondContact O-N 3.39Å; H232-L234 PolarHBondContact O-N 3.08Å; L234-L268 HydrophobicContact CD2-CD1 4.04Å |
| 235 | H | 58.2 | Low | 59.9 | Low | 149 Ų | 149 | 96.4 Ų | 96.4 | 69% | 0.69 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -88 | -17.5 | -178.3 | -148.3 | -76 | 0 | 0 | 0 | 113.7 | F231 H232 L233 | F231-H235 WeakPolarHBondContact O-CB 3.41Å; F231-H235 PolarHBondContact O-N 3.4Å; H232-H235 PolarHBondContact O-N 3.47Å; L233-H235 VanDerWaalsContact C-N 3.32Å |
| 236 | Q | 55.2 | Low | 58.2 | Low | 146 Ų | 146 | 91.7 Ų | 91.7 | 68% | 0.682 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -94.3 | -6.9 | 175.8 | -74.4 | -164.5 | -14.4 | 0 | 0 | 113.8 | H232 P238 | H232-Q236 VanDerWaalsContact O-CB 3.23Å; H232-Q236 WeakPolarHBondContact O-CB 3.25Å; H232-Q236 VanDerWaalsContact O-CG 3.32Å; H232-Q236 WeakPolarHBondContact O-CG 3.43Å; H232-Q236 PolarHBondContact O-N 3.09Å; Q236-P238 WeakPolarHBondContact O-CD 3.49Å |
| 237 | L | 55.3 | Low | 56.4 | Low | 123 Ų | 123 | 98.6 Ų | 98.6 | 64% | 0.644 | 60% | 0.595 | S | S | * | * | trans | -72.2 | 103.2 | 168.5 | -80 | 164 | 0 | 0 | 0 | 109.1 | L233 G239 | L233-L237 WeakPolarHBondContact O-CG 3.43Å; L233-L237 PolarHBondContact O-N 3.32Å; L237-G239 PolarHBondContact O-N 3.36Å | ||
| 238 | P | 50.9 | Low | 54.8 | Low | 115 Ų | 115 | 101 Ų | 101 | 75% | 0.747 | 61% | 0.609 | S | S | * | * | trans | -83.3 | 74.4 | 175.7 | 14.6 | 7.6 | 0 | 0 | 0 | 106.2 | Q236 | Q236-P238 WeakPolarHBondContact O-CD 3.49Š| ||
| 239 | G | 54.1 | Low | 53.3 | Low | 50 Ų | 50 | 100.7 Ų | 100.7 | 52% | 0.515 | 62% | 0.622 | S | S | . | * | trans | -134.9 | -7.4 | -160.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | L237 | L237-G239 PolarHBondContact O-N 3.36Š| ||
| 240 | C | 44.7 | Very low | 51.3 | Low | 120 Ų | 120 | 100.7 Ų | 100.7 | 81% | 0.811 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -131.6 | -22.1 | 172.1 | -65.2 | 0 | 0 | 0 | 0 | 113.8 | ||
| 241 | A | 42.8 | Very low | 49.7 | Very low | 84 Ų | 84 | 107.5 Ų | 107.5 | 69% | 0.694 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -87.6 | -34 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | A244 | A241-A244 PolarHBondContact O-N 3.12Š|
| 242 | A | 42.1 | Very low | 47.9 | Very low | 59 Ų | 59 | 110.3 Ų | 110.3 | 49% | 0.488 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -76.1 | -28.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | A244 A245 | A242-A244 PolarHBondContact O-N 3.48Å; A242-A245 PolarHBondContact O-N 2.97Å |
| 243 | A | 41.9 | Very low | 46.1 | Very low | 77 Ų | 77 | 109.8 Ų | 109.8 | 64% | 0.636 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -70.5 | -20 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 244 | A | 41.4 | Very low | 45.1 | Very low | 85 Ų | 85 | 111.6 Ų | 111.6 | 70% | 0.702 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -87.4 | -19.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | A241 A242 | A241-A244 PolarHBondContact O-N 3.12Å; A242-A244 PolarHBondContact O-N 3.48Å |
| 245 | A | 43.3 | Very low | 43.6 | Very low | 81 Ų | 81 | 110.3 Ų | 110.3 | 67% | 0.669 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -98.1 | -4.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | A242 | A242-A245 PolarHBondContact O-N 2.97Å |
| 246 | A | 41.5 | Very low | 43.1 | Very low | 67 Ų | 67 | 109.9 Ų | 109.9 | 55% | 0.554 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -90.7 | 9.8 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 247 | F | 38.7 | Very low | 42.7 | Very low | 191 Ų | 191 | 107 Ų | 107 | 84% | 0.838 | 74% | 0.743 | S | S | * | * | trans | -131.4 | 82.4 | 175.3 | -72.5 | -75.2 | 0 | 0 | 0 | 113.1 | ||||
| 248 | P | 40.5 | Very low | 41.7 | Very low | 124 Ų | 124 | 104.6 Ų | 104.6 | 81% | 0.805 | 75% | 0.748 | S | S | * | * | trans | -85.3 | 103.5 | 154.2 | 29.4 | -19.2 | 0 | 0 | 0 | 108.8 | ||||
| 249 | G | 44.5 | Very low | 41 | Very low | 76 Ų | 76 | 103.8 Ų | 103.8 | 78% | 0.784 | 75% | 0.751 | S | S | * | * | trans | 74.8 | 99.8 | 156 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 250 | A | 33.7 | Very low | 40.2 | Very low | 106 Ų | 106 | 106.1 Ų | 106.1 | 88% | 0.876 | 77% | 0.765 | S | S | * | * | trans | -147.6 | 105.4 | 140.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 251 | Q | 38.6 | Very low | 39.8 | Very low | 181 Ų | 181 | 108.7 Ų | 108.7 | 85% | 0.846 | 77% | 0.765 | S | S | * | * | trans | -76.6 | 155.8 | 168.5 | -67.9 | 172.4 | -16.8 | 0 | 0 | 109.7 | ||||
| 252 | H | 33.6 | Very low | 39.6 | Very low | 189 Ų | 189 | 110 Ų | 110 | 88% | 0.875 | 77% | 0.766 | S | S | * | * | trans | 79.1 | 130.8 | 176 | -76.3 | 62.1 | 0 | 0 | 0 | 116.2 | ||||
| 253 | A | 35.9 | Very low | 39.5 | Very low | 87 Ų | 87 | 112 Ų | 112 | 72% | 0.719 | 78% | 0.783 | S | S | * | * | cis | -160.8 | 172.1 | 5.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 254 | P | 46.7 | Very low | 39.2 | Very low | 136 Ų | 136 | 117 Ų | 117 | 88% | 0.883 | 79% | 0.793 | S | S | * | * | trans | -90.9 | 144.7 | -164 | 35.2 | -30.8 | 0 | 0 | 0 | 114.1 | ||||
| 255 | G | 32.5 | Very low | 39.2 | Very low | 70 Ų | 70 | 117.5 Ų | 117.5 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | trans | -133 | 136.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 256 | P | 47.8 | Very low | 39 | Very low | 141 Ų | 141 | 122.6 Ų | 122.6 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | trans | -90.4 | 141.2 | -168.4 | 35.1 | -31.4 | 0 | 0 | 0 | 111.6 | ||||
| 257 | G | 45.6 | Very low | 39 | Very low | 85 Ų | 85 | 125 Ų | 125 | 88% | 0.876 | 82% | 0.817 | S | S | * | * | trans | 111.1 | 92.6 | 162.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 258 | G | 34.7 | Very low | 39.3 | Very low | 73 Ų | 73 | 120 Ų | 120 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | 169.1 | 96.1 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | A260 | G258-A260 PolarHBondContact O-N 3.18Š| ||
| 259 | A | 36.5 | Very low | 39.4 | Very low | 97 Ų | 97 | 118 Ų | 118 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -57.8 | 112 | 174.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | H261 | A259-H261 PolarHBondContact O-N 2.68Å; A259-H261 VanDerWaalsContact O-N 3.16Å | ||
| 260 | A | 36.3 | Very low | 39.5 | Very low | 99 Ų | 99 | 119.8 Ų | 119.8 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -71.3 | 105.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | G258 | G258-A260 PolarHBondContact O-N 3.18Š| ||
| 261 | H | 38 | Very low | 40.1 | Very low | 175 Ų | 175 | 118 Ų | 118 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | trans | -67.6 | 130.8 | 164 | -87.5 | -69.6 | 0 | 0 | 0 | 109 | A259 A263 | A259-H261 PolarHBondContact O-N 2.68Å; A259-H261 VanDerWaalsContact O-N 3.16Å; H261-A263 PolarHBondContact O-N 3.34Å | ||
| 262 | P | 38.4 | Very low | 40.5 | Very low | 110 Ų | 110 | 112.7 Ų | 112.7 | 71% | 0.714 | 75% | 0.746 | S | S | * | * | trans | -65.2 | 126.3 | 171.8 | 26.5 | -30.4 | 0 | 0 | 0 | 108.2 | Q264 | P262-Q264 PolarHBondContact O-N 3.1Š| ||
| 263 | A | 40.2 | Very low | 40.9 | Very low | 103 Ų | 103 | 109.7 Ų | 109.7 | 85% | 0.851 | 73% | 0.732 | S | S | * | * | trans | -56.7 | 103.5 | 173 | 0 | 0 | 0 | 0 | 0 | 108.9 | H261 A265 | H261-A263 PolarHBondContact O-N 3.34Å; A263-A265 PolarHBondContact O-N 3.49Å | ||
| 264 | Q | 34.6 | Very low | 41.3 | Very low | 181 Ų | 181 | 108.7 Ų | 108.7 | 85% | 0.846 | 72% | 0.718 | S | S | * | * | trans | -61.6 | 124.2 | 172.2 | -78.6 | -177.8 | -9 | 0 | 0 | 108.3 | P262 Q266 | P262-Q264 PolarHBondContact O-N 3.1Å; Q264-Q266 PolarHBondContact O-N 2.88Å | ||
| 265 | A | 41.3 | Very low | 41.5 | Very low | 96 Ų | 96 | 110.1 Ų | 110.1 | 79% | 0.793 | 71% | 0.706 | S | S | * | * | trans | -55.2 | 106.9 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | A263 P267 | A263-A265 PolarHBondContact O-N 3.49Å; A265-P267 VanDerWaalsContact O-CD 3.23Å; A265-P267 WeakPolarHBondContact O-CD 3.32Å; A265-P267 VanDerWaalsContact O-N 3.15Å | ||
| 266 | Q | 39.3 | Very low | 42.2 | Very low | 187 Ų | 187 | 110.8 Ų | 110.8 | 87% | 0.874 | 69% | 0.687 | S | S | * | * | trans | -64.5 | 115 | -176.2 | -152.7 | 159.3 | -24.9 | 0 | 0 | 108.2 | Q264 L268 | Q264-Q266 PolarHBondContact O-N 2.88Å; Q266-L268 PolarHBondContact O-N 3.43Å | ||
| 267 | P | 42.3 | Very low | 42 | Very low | 117 Ų | 117 | 106.4 Ų | 106.4 | 76% | 0.76 | 66% | 0.663 | S | S | * | * | trans | -62.6 | 137.8 | -179.5 | -16.6 | 29.4 | 0 | 0 | 0 | 108.9 | A265 | A265-P267 VanDerWaalsContact O-CD 3.23Å; A265-P267 WeakPolarHBondContact O-CD 3.32Å; A265-P267 VanDerWaalsContact O-N 3.15Å | ||
| 268 | L | 44.9 | Very low | 42.3 | Very low | 87 Ų | 87 | 109.1 Ų | 109.1 | 46% | 0.455 | 65% | 0.652 | S | S | . | * | trans | -42.5 | 137.7 | 173.6 | -128.7 | 98.5 | 0 | 0 | 0 | 110.3 | L234 Q266 L272 | L234-L268 HydrophobicContact CD2-CD1 4.04Å; Q266-L268 PolarHBondContact O-N 3.43Å; L268-L272 HydrophobicContact CD2-CD1 4.05Å | ||
| 269 | P | 42.2 | Very low | 43.2 | Very low | 82 Ų | 82 | 111.4 Ų | 111.4 | 53% | 0.532 | 64% | 0.638 | S | S | . | * | trans | -56.1 | 131.3 | -174.1 | 17.4 | -29.7 | 0 | 0 | 0 | 111.3 | A271 L272 | P269-A271 PolarHBondContact O-N 3.12Å; P269-L272 PolarHBondContact O-N 3.47Å | ||
| 270 | P | 47.4 | Very low | 43.8 | Very low | 113 Ų | 113 | 114.4 Ų | 114.4 | 73% | 0.734 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | -6.7 | -174.9 | 19.8 | -30.7 | 0 | 0 | 0 | 114.3 | L272 P274 | P270-L272 PolarHBondContact O-N 3.24Å; P270-P274 WeakPolarHBondContact O-CD 3.43Å |
| 271 | A | 46 | Very low | 44.6 | Very low | 68 Ų | 68 | 114.4 Ų | 114.4 | 56% | 0.562 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | -17.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | P269 P274 | P269-A271 PolarHBondContact O-N 3.12Å; A271-P274 WeakPolarHBondContact O-CD 3.32Å; A271-P274 WeakPolarHBondContact O-CG 3.28Å |
| 272 | L | 45.6 | Very low | 45.6 | Very low | 70 Ų | 70 | 108.5 Ų | 108.5 | 37% | 0.366 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -87.9 | -25.3 | -178.6 | -79 | 166.3 | 0 | 0 | 0 | 114.3 | L268 P269 P270 | L268-L272 HydrophobicContact CD2-CD1 4.05Å; P269-L272 PolarHBondContact O-N 3.47Å; P270-L272 PolarHBondContact O-N 3.24Å |
| 273 | H | 43.5 | Very low | 46.7 | Very low | 126 Ų | 126 | 103.9 Ų | 103.9 | 58% | 0.583 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67.5 | -43.6 | 174.3 | -83.6 | -83.3 | 0 | 0 | 0 | 115.1 | R275 R276 A277 | H273-R275 VanDerWaalsContact C-N 3.3Å; H273-R275 PolarHBondContact O-N 3.31Å; H273-R276 PolarHBondContact O-N 3.46Å; H273-R276 VanDerWaalsContact O-N 3.17Å; H273-A277 PolarHBondContact O-N 3.17Å |
| 274 | P | 43.5 | Very low | 47.9 | Very low | 66 Ų | 66 | 104.3 Ų | 104.3 | 43% | 0.429 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.5 | -35.4 | -177.3 | 20.2 | -31 | 0 | 0 | 0 | 112.3 | P270 A271 R276 Q278 | P270-P274 WeakPolarHBondContact O-CD 3.43Å; A271-P274 WeakPolarHBondContact O-CD 3.32Å; A271-P274 WeakPolarHBondContact O-CG 3.28Å; P274-R276 VanDerWaalsContact C-N 3.33Å; P274-R276 PolarHBondContact O-N 3.23Å; P274-Q278 WeakPolarHBondContact O-CB 3.18Å; P274-Q278 PolarHBondContact O-N 2.82Å |
| 275 | R | 51 | Low | 49.3 | Very low | 166 Ų | 166 | 96.9 Ų | 96.9 | 63% | 0.626 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67 | -29.9 | 178.3 | -70.1 | -178 | 172.7 | 177.1 | -0.8 | 113.3 | H273 R279 | H273-R275 VanDerWaalsContact C-N 3.3Å; H273-R275 PolarHBondContact O-N 3.31Å; R275-R279 WeakPolarHBondContact O-CB 3.43Å; R275-R279 WeakPolarHBondContact O-CD 3.15Å; R275-R279 WeakPolarHBondContact O-CG 3.32Å; R275-R279 PolarHBondContact O-N 3.38Å |
| 276 | R | 47.8 | Very low | 50.6 | Low | 84 Ų | 84 | 93.1 Ų | 93.1 | 32% | 0.317 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -76.2 | -45.1 | 178.5 | -74 | 179.3 | -178.4 | 164.3 | 2.3 | 111.8 | H273 P274 R280 | H273-R276 PolarHBondContact O-N 3.46Å; H273-R276 VanDerWaalsContact O-N 3.17Å; P274-R276 VanDerWaalsContact C-N 3.33Å; P274-R276 PolarHBondContact O-N 3.23Å; R276-R280 PolarHBondContact O-N 2.67Å |
| 277 | A | 43.4 | Very low | 52.1 | Low | 50 Ų | 50 | 88 Ų | 88 | 41% | 0.413 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.6 | -47.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | H273 R279 R280 L281 | H273-A277 PolarHBondContact O-N 3.17Å; A277-R279 VanDerWaalsContact C-N 3.34Å; A277-R279 PolarHBondContact O-N 2.92Å; A277-R280 PolarHBondContact O-N 3.06Å; A277-L281 HydrophobicContact CB-CD1 4.28Å; A277-L281 VanDerWaalsContact O-CB 3.31Å; A277-L281 WeakPolarHBondContact O-CB 3.36Å; A277-L281 WeakPolarHBondContact O-CD1 3.48Å; A277-L281 WeakPolarHBondContact O-CG 3.35Å; A277-L281 PolarHBondContact O-N 3.2Å |
| 278 | Q | 51.5 | Low | 53.6 | Low | 141 Ų | 141 | 87 Ų | 87 | 66% | 0.659 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -62.6 | -35.4 | -178.3 | -168.1 | 163.1 | -11.3 | 0 | 0 | 113.4 | P274 S282 | P274-Q278 WeakPolarHBondContact O-CB 3.18Å; P274-Q278 PolarHBondContact O-N 2.82Å; Q278-S282 VanDerWaalsContact O-CB 3.29Å; Q278-S282 WeakPolarHBondContact O-CB 3.23Å; Q278-S282 PolarHBondContact O-N 3.12Å |
| 279 | R | 53.2 | Low | 55.1 | Low | 122 Ų | 122 | 84.1 Ų | 84.1 | 46% | 0.46 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -72.2 | -37.5 | 174.5 | -72.9 | 172.8 | -176.7 | -174.5 | 1 | 113.2 | R275 A277 G283 | R275-R279 WeakPolarHBondContact O-CB 3.43Å; R275-R279 WeakPolarHBondContact O-CD 3.15Å; R275-R279 WeakPolarHBondContact O-CG 3.32Å; R275-R279 PolarHBondContact O-N 3.38Å; A277-R279 VanDerWaalsContact C-N 3.34Å; A277-R279 PolarHBondContact O-N 2.92Å; R279-G283 PolarHBondContact O-N 3.18Å |
| 280 | R | 49.9 | Very low | 56.8 | Low | 159 Ų | 159 | 80.4 Ų | 80.4 | 60% | 0.6 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -71.5 | -42 | 176.1 | -75.8 | -178.5 | 175.6 | -95.7 | 5.2 | 112.2 | R276 A277 S282 G283 L284 | R276-R280 PolarHBondContact O-N 2.67Å; A277-R280 PolarHBondContact O-N 3.06Å; R280-S282 VanDerWaalsContact C-N 3.31Å; R280-S282 PolarHBondContact O-N 2.94Å; R280-G283 PolarHBondContact O-N 2.92Å; R280-L284 PolarHBondContact O-N 3.48Å; R280-L284 VanDerWaalsContact O-N 3.12Å |
| 281 | L | 53.3 | Low | 58.5 | Low | 99 Ų | 99 | 77.6 Ų | 77.6 | 52% | 0.518 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.4 | -40 | 174.3 | -79.5 | 153.6 | 0 | 0 | 0 | 111.2 | A277 S285 | A277-L281 HydrophobicContact CB-CD1 4.28Å; A277-L281 VanDerWaalsContact O-CB 3.31Å; A277-L281 WeakPolarHBondContact O-CB 3.36Å; A277-L281 WeakPolarHBondContact O-CD1 3.48Å; A277-L281 WeakPolarHBondContact O-CG 3.35Å; A277-L281 PolarHBondContact O-N 3.2Å; L281-S285 WeakPolarHBondContact O-CB 3.5Å; L281-S285 PolarHBondContact O-N 3.33Å; L281-S285 VanDerWaalsContact O-N 3.09Å; L281-S285 PolarHBondContact O-OG 3.48Å |
| 282 | S | 59.1 | Low | 60.2 | Low | 52 Ų | 52 | 76.8 Ų | 76.8 | 36% | 0.364 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.9 | -47.4 | 174.6 | 177.4 | 0 | 0 | 0 | 0 | 112.3 | Q278 R280 L284 S285 V286 | Q278-S282 VanDerWaalsContact O-CB 3.29Å; Q278-S282 WeakPolarHBondContact O-CB 3.23Å; Q278-S282 PolarHBondContact O-N 3.12Å; R280-S282 VanDerWaalsContact C-N 3.31Å; R280-S282 PolarHBondContact O-N 2.94Å; S282-L284 PolarHBondContact O-N 3.37Å; S282-S285 PolarHBondContact O-N 2.79Å; S282-V286 WeakPolarHBondContact O-CB 3.23Å; S282-V286 WeakPolarHBondContact O-CG2 3.5Å; S282-V286 PolarHBondContact O-N 2.85Å; S282-V286 VanDerWaalsContact O-N 3.08Å |
| 283 | G | 60.3 | Low | 62 | Low | 12 Ų | 12 | 73.7 Ų | 73.7 | 12% | 0.124 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.8 | -38.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | R279 R280 L287 | R279-G283 PolarHBondContact O-N 3.18Å; R280-G283 PolarHBondContact O-N 2.92Å; G283-L287 PolarHBondContact O-N 3.25Å |
| 284 | L | 65.6 | Low | 63.8 | Low | 113 Ų | 113 | 69.4 Ų | 69.4 | 59% | 0.592 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -68.3 | -41.4 | 175.5 | -88.6 | 159.7 | 0 | 0 | 0 | 112.6 | R280 S282 V286 L287 L288 | R280-L284 PolarHBondContact O-N 3.48Å; R280-L284 VanDerWaalsContact O-N 3.12Å; S282-L284 PolarHBondContact O-N 3.37Å; L284-V286 VanDerWaalsContact C-N 3.26Å; L284-V286 PolarHBondContact O-N 3.29Å; L284-L287 PolarHBondContact O-N 3.14Å; L284-L288 WeakPolarHBondContact O-CB 3.41Å; L284-L288 PolarHBondContact O-N 2.94Å |
| 285 | S | 65.2 | Low | 65.8 | Low | 25 Ų | 25 | 72.5 Ų | 72.5 | 18% | 0.175 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -59.1 | -42.4 | 175.7 | -49.9 | 0 | 0 | 0 | 0 | 111.5 | L281 S282 L288 L289 R339 | L281-S285 WeakPolarHBondContact O-CB 3.5Å; L281-S285 PolarHBondContact O-N 3.33Å; L281-S285 VanDerWaalsContact O-N 3.09Å; L281-S285 PolarHBondContact O-OG 3.48Å; S282-S285 PolarHBondContact O-N 2.79Å; S285-L288 PolarHBondContact O-N 2.91Å; S285-L289 PolarHBondContact O-N 3.28Å; S285-L289 VanDerWaalsContact O-N 3.08Å; S285-R339 WeakPolarHBondContact OG-CD 3.24Å; S285-R339 PolarHBondContact OG-NH1 3.44Å |
| 286 | V | 67.7 | Low | 67.4 | Low | 17 Ų | 17 | 65 Ų | 65 | 10% | 0.103 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.6 | -38.8 | -177.9 | 166.9 | 0 | 0 | 0 | 0 | 111.3 | Y212 I215 S282 L284 L289 C290 | Y212-V286 HydrophobicContact CD1-CB 4.49Å; Y212-V286 HydrophobicContact CD1-CG1 3.15Å; Y212-V286 HydrophobicContact CE1-CG1 3.47Å; Y212-V286 VanDerWaalsContact CE1-CG1 3.47Å; Y212-V286 HydrophobicContact CG-CG1 4.24Å; I215-V286 HydrophobicContact CD1-CG1 4.04Å; I215-V286 HydrophobicContact CG2-CG1 4.19Å; S282-V286 WeakPolarHBondContact O-CB 3.23Å; S282-V286 WeakPolarHBondContact O-CG2 3.5Å; S282-V286 PolarHBondContact O-N 2.85Å; S282-V286 VanDerWaalsContact O-N 3.08Å; L284-V286 VanDerWaalsContact C-N 3.26Å; L284-V286 PolarHBondContact O-N 3.29Å; V286-L289 WeakPolarHBondContact O-CB 3.36Å; V286-C290 PolarHBondContact O-N 3.04Å |
| 287 | L | 70.8 | Confident | 69.2 | Low | 78 Ų | 78 | 61.1 Ų | 61.1 | 41% | 0.408 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -67.8 | -43.1 | 174.1 | -175.9 | 66.7 | 0 | 0 | 0 | 111.8 | G283 L284 L289 C290 C291 | G283-L287 PolarHBondContact O-N 3.25Å; L284-L287 PolarHBondContact O-N 3.14Å; L287-L289 VanDerWaalsContact C-N 3.28Å; L287-L289 PolarHBondContact O-N 3.28Å; L287-C290 WeakPolarHBondContact O-CB 3.18Å; L287-C290 PolarHBondContact O-N 3.33Å; L287-C290 VanDerWaalsContact O-N 3.17Å; L287-C291 PolarHBondContact O-N 2.94Å; L287-C291 PolarHBondContact O-SG 3.17Å |
| 288 | L | 74.4 | Confident | 71.5 | Confident | 97 Ų | 97 | 61.4 Ų | 61.4 | 51% | 0.508 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -57.4 | -44.1 | 176.1 | -178.8 | 69.4 | 0 | 0 | 0 | 111.2 | L284 S285 C290 C291 V292 | L284-L288 WeakPolarHBondContact O-CB 3.41Å; L284-L288 PolarHBondContact O-N 2.94Å; S285-L288 PolarHBondContact O-N 2.91Å; L288-C290 VanDerWaalsContact C-N 3.32Å; L288-C290 PolarHBondContact O-N 3.43Å; L288-C291 PolarHBondContact O-N 2.99Å; L288-V292 WeakPolarHBondContact O-CG2 3.45Å; L288-V292 PolarHBondContact O-N 3.02Å |
| 289 | L | 74.9 | Confident | 73.4 | Confident | 27 Ų | 27 | 56.9 Ų | 56.9 | 14% | 0.141 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.9 | -45.9 | 176 | -142.1 | 73.1 | 0 | 0 | 0 | 112.2 | S285 V286 L287 F293 L335 Y336 | S285-L289 PolarHBondContact O-N 3.28Å; S285-L289 VanDerWaalsContact O-N 3.08Å; V286-L289 WeakPolarHBondContact O-CB 3.36Å; L287-L289 VanDerWaalsContact C-N 3.28Å; L287-L289 PolarHBondContact O-N 3.28Å; L289-F293 WeakPolarHBondContact O-CB 3.43Å; L289-F293 PolarHBondContact O-N 2.9Å; L289-F293 VanDerWaalsContact O-N 3.12Å; L289-L335 HydrophobicContact CD1-CB 3.58Å; L289-L335 HydrophobicContact CD1-CD2 4.3Å; L289-L335 HydrophobicContact CD1-CG 4.45Å; L289-L335 WeakPolarHBondContact CD1-O 3.44Å; L289-Y336 HydrophobicContact CD2-CD1 3.79Å; L289-Y336 HydrophobicContact CD2-CE1 3.39Å; L289-Y336 HydrophobicContact CG-CE1 4.23Å |
| 290 | C | 79.3 | Confident | 75.2 | Confident | 4 Ų | 4 | 51.5 Ų | 51.5 | 3% | 0.027 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 175.6 | -172 | 0 | 0 | 0 | 0 | 111 | Y212 V286 L287 L288 V292 F293 L294 | Y212-C290 HydrophobicContact CD2-CB 3.4Å; Y212-C290 WeakPolarHBondContact CD2-SG 3.44Å; Y212-C290 HydrophobicContact CE2-CB 3.81Å; Y212-C290 HydrophobicContact CG-CB 3.91Å; V286-C290 PolarHBondContact O-N 3.04Å; L287-C290 WeakPolarHBondContact O-CB 3.18Å; L287-C290 PolarHBondContact O-N 3.33Å; L287-C290 VanDerWaalsContact O-N 3.17Å; L288-C290 VanDerWaalsContact C-N 3.32Å; L288-C290 PolarHBondContact O-N 3.43Å; C290-V292 PolarHBondContact O-N 3.35Å; C290-F293 PolarHBondContact O-N 3.03Å; C290-L294 WeakPolarHBondContact O-CB 3.24Å; C290-L294 WeakPolarHBondContact O-CG 3.41Å; C290-L294 PolarHBondContact O-N 3.41Å |
| 291 | C | 81.6 | Confident | 77.3 | Confident | 53 Ų | 53 | 43.9 Ų | 43.9 | 36% | 0.358 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.9 | -45.2 | -179.4 | -67.9 | 0 | 0 | 0 | 0 | 112.4 | L287 L288 F293 L294 L295 | L287-C291 PolarHBondContact O-N 2.94Å; L287-C291 PolarHBondContact O-SG 3.17Å; L288-C291 PolarHBondContact O-N 2.99Å; C291-F293 VanDerWaalsContact C-N 3.33Å; C291-F293 PolarHBondContact O-N 3.32Å; C291-L294 PolarHBondContact O-N 2.93Å; C291-L295 WeakPolarHBondContact O-CB 3.26Å; C291-L295 VanDerWaalsContact O-CG 3.24Å; C291-L295 WeakPolarHBondContact O-CG 3.41Å; C291-L295 PolarHBondContact O-N 2.92Å |
| 292 | V | 83.4 | Confident | 79.3 | Confident | 51 Ų | 51 | 47.3 Ų | 47.3 | 31% | 0.309 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.6 | -47 | 176.6 | 173.8 | 0 | 0 | 0 | 0 | 110.3 | L288 C290 L294 L295 A296 L328 L335 | L288-V292 WeakPolarHBondContact O-CG2 3.45Å; L288-V292 PolarHBondContact O-N 3.02Å; C290-V292 PolarHBondContact O-N 3.35Å; V292-L294 PolarHBondContact O-N 3.34Å; V292-L295 PolarHBondContact O-N 3.43Å; V292-A296 WeakPolarHBondContact O-CB 3.41Å; V292-A296 PolarHBondContact O-N 3.3Å; V292-L328 HydrophobicContact CG1-CD1 4.34Å; V292-L335 HydrophobicContact CB-CD1 4.44Å; V292-L335 HydrophobicContact CB-CD2 4.17Å; V292-L335 HydrophobicContact CG1-CD1 3.77Å; V292-L335 HydrophobicContact CG1-CD2 3.94Å; V292-L335 HydrophobicContact CG2-CD2 4.11Å |
| 293 | F | 82.2 | Confident | 80.9 | Confident | 5 Ų | 5 | 45.2 Ų | 45.2 | 2% | 0.022 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.2 | -44.5 | -179.3 | -155.7 | -85.1 | 0 | 0 | 0 | 112.7 | L128 H131 Q204 L208 L289 C290 C291 T297 L328 | L128-F293 HydrophobicContact CD2-CZ 4.43Å; H131-F293 HydrophobicContact CB-CE2 4.15Å; H131-F293 HydrophobicContact CB-CZ 4.18Å; H131-F293 AromaticContact CD2-CE2 3.97Å; H131-F293 AromaticContact CE1-CE2 3.51Å; H131-F293 AromaticContact CG-CE2 3.49Å; H131-F293 VanDerWaalsContact CG-CE2 3.49Å; H131-F293 AromaticContact CG-CZ 3.86Å; H131-F293 AromaticContact ND1-CE2 3.2Å; H131-F293 WeakPolarHBondContact ND1-CE2 3.37Å; H131-F293 AromaticContact ND1-CZ 3.44Å; H131-F293 WeakPolarHBondContact ND1-CZ 3.26Å; H131-F293 AromaticContact NE2-CE2 3.94Å; Q204-F293 VanDerWaalsContact CD-CE1 3.5Å; Q204-F293 HydrophobicContact CG-CE1 4.17Å; L208-F293 HydrophobicContact CD1-CD1 3.29Å; L208-F293 HydrophobicContact CD1-CE1 3.65Å; L208-F293 HydrophobicContact CD1-CG 3.99Å; L289-F293 WeakPolarHBondContact O-CB 3.43Å; L289-F293 PolarHBondContact O-N 2.9Å; L289-F293 VanDerWaalsContact O-N 3.12Å; C290-F293 PolarHBondContact O-N 3.03Å; C291-F293 VanDerWaalsContact C-N 3.33Å; C291-F293 PolarHBondContact O-N 3.32Å; F293-T297 HydrophobicContact CD1-CG2 3.98Å; F293-T297 HydrophobicContact CE1-CG2 3.59Å; F293-T297 HydrophobicContact CZ-CG2 3.98Å; F293-T297 WeakPolarHBondContact O-CB 3.33Å; F293-T297 VanDerWaalsContact O-CG2 3.31Å; F293-T297 WeakPolarHBondContact O-CG2 3.24Å; F293-T297 PolarHBondContact O-N 2.82Å; F293-T297 VanDerWaalsContact O-N 3.1Å; F293-T297 PolarHBondContact O-OG1 3.29Å; F293-L328 HydrophobicContact CD2-CD1 4.15Å; F293-L328 HydrophobicContact CD2-CD2 3.91Å; F293-L328 HydrophobicContact CD2-CG 4.43Å; F293-L328 HydrophobicContact CE2-CD1 4.45Å; F293-L328 HydrophobicContact CE2-CD2 3.6Å; F293-L328 HydrophobicContact CE2-CG 4.25Å; F293-L328 HydrophobicContact CZ-CD2 3.99Å |
| 294 | L | 82.8 | Confident | 82.4 | Confident | 37 Ų | 37 | 45.1 Ų | 45.1 | 19% | 0.194 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.5 | -55 | 176.5 | -69.1 | 174 | 0 | 0 | 0 | 110.7 | T205 C290 C291 V292 A296 T297 Q298 | T205-L294 HydrophobicContact CG2-CD2 3.31Å; C290-L294 WeakPolarHBondContact O-CB 3.24Å; C290-L294 WeakPolarHBondContact O-CG 3.41Å; C290-L294 PolarHBondContact O-N 3.41Å; C291-L294 PolarHBondContact O-N 2.93Å; V292-L294 PolarHBondContact O-N 3.34Å; L294-A296 VanDerWaalsContact C-N 3.26Å; L294-A296 PolarHBondContact O-N 2.97Å; L294-T297 PolarHBondContact O-N 3.41Å; L294-T297 PolarHBondContact O-OG1 3.46Å; L294-Q298 VanDerWaalsContact O-CG 3.25Å; L294-Q298 WeakPolarHBondContact O-CG 3.36Å; L294-Q298 PolarHBondContact O-N 2.92Å |
| 295 | L | 84.1 | Confident | 83.7 | Confident | 130 Ų | 130 | 41.9 Ų | 41.9 | 68% | 0.681 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -61.9 | -36.3 | -177 | -68.9 | 171.5 | 0 | 0 | 0 | 112.1 | C291 V292 P299 | C291-L295 WeakPolarHBondContact O-CB 3.26Å; C291-L295 VanDerWaalsContact O-CG 3.24Å; C291-L295 WeakPolarHBondContact O-CG 3.41Å; C291-L295 PolarHBondContact O-N 2.92Å; V292-L295 PolarHBondContact O-N 3.43Å; L295-P299 VanDerWaalsContact O-CD 3.26Å; L295-P299 WeakPolarHBondContact O-CD 3.38Å |
| 296 | A | 84.9 | Confident | 85 | Confident | 8 Ų | 8 | 41.7 Ų | 41.7 | 7% | 0.066 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -72.8 | -30.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V292 L294 L324 L328 | V292-A296 WeakPolarHBondContact O-CB 3.41Å; V292-A296 PolarHBondContact O-N 3.3Å; L294-A296 VanDerWaalsContact C-N 3.26Å; L294-A296 PolarHBondContact O-N 2.97Å; A296-L324 HydrophobicContact CB-CD1 4.31Å; A296-L324 HydrophobicContact CB-CG 4.07Å; A296-L324 WeakPolarHBondContact O-CD2 3.14Å; A296-L324 WeakPolarHBondContact O-CG 3.36Å; A296-L328 HydrophobicContact CB-CB 4.26Å; A296-L328 HydrophobicContact CB-CD1 3.98Å; A296-L328 HydrophobicContact CB-CD2 3.97Å; A296-L328 HydrophobicContact CB-CG 4.31Å |
| 297 | T | 86.6 | Confident | 86 | Confident | 4 Ų | 4 | 42.4 Ų | 42.4 | 3% | 0.025 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -96.6 | -24.6 | -174.8 | 55 | 0 | 0 | 0 | 0 | 114 | L201 F293 L294 L300 V301 L328 | L201-T297 HydrophobicContact CD2-CG2 4.23Å; F293-T297 HydrophobicContact CD1-CG2 3.98Å; F293-T297 HydrophobicContact CE1-CG2 3.59Å; F293-T297 HydrophobicContact CZ-CG2 3.98Å; F293-T297 WeakPolarHBondContact O-CB 3.33Å; F293-T297 VanDerWaalsContact O-CG2 3.31Å; F293-T297 WeakPolarHBondContact O-CG2 3.24Å; F293-T297 PolarHBondContact O-N 2.82Å; F293-T297 VanDerWaalsContact O-N 3.1Å; F293-T297 PolarHBondContact O-OG1 3.29Å; L294-T297 PolarHBondContact O-N 3.41Å; L294-T297 PolarHBondContact O-OG1 3.46Å; T297-L300 PolarHBondContact O-N 2.9Å; T297-V301 PolarHBondContact O-N 2.99Å; T297-V301 VanDerWaalsContact O-N 3.12Å; T297-L328 HydrophobicContact CG2-CD2 3.67Å |
| 298 | Q | 90.1 | Very high | 86.9 | Confident | 55 Ų | 55 | 38.7 Ų | 38.7 | 26% | 0.257 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -58.1 | -43.9 | -178.1 | -74.1 | -40.4 | -81.2 | 0 | 0 | 114.2 | L294 L300 V301 W302 | L294-Q298 VanDerWaalsContact O-CG 3.25Å; L294-Q298 WeakPolarHBondContact O-CG 3.36Å; L294-Q298 PolarHBondContact O-N 2.92Å; Q298-L300 VanDerWaalsContact C-N 3.27Å; Q298-L300 PolarHBondContact O-N 3.45Å; Q298-V301 WeakPolarHBondContact O-CB 3.25Å; Q298-V301 PolarHBondContact O-N 3.24Å; Q298-V301 VanDerWaalsContact O-N 3.15Å; Q298-W302 PolarHBondContact O-N 2.8Å |
| 299 | P | 92.4 | Very high | 87.7 | Confident | 47 Ų | 47 | 39.8 Ų | 39.8 | 31% | 0.305 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -58.3 | -41.2 | 178.1 | -27.1 | 38.1 | 0 | 0 | 0 | 112.3 | L295 V301 W302 V303 S321 L324 | L295-P299 VanDerWaalsContact O-CD 3.26Å; L295-P299 WeakPolarHBondContact O-CD 3.38Å; P299-V301 PolarHBondContact O-N 3.4Å; P299-W302 PolarHBondContact O-N 2.81Å; P299-V303 WeakPolarHBondContact O-CG2 3.4Å; P299-V303 PolarHBondContact O-N 3.15Å; P299-S321 WeakPolarHBondContact CB-OG 3.42Å; P299-L324 HydrophobicContact CG-CD2 3.84Å |
| 300 | L | 91 | Very high | 88.4 | Confident | 8 Ų | 8 | 41.1 Ų | 41.1 | 4% | 0.042 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -66.9 | -34.3 | 178.3 | -169.6 | 66.4 | 0 | 0 | 0 | 112.5 | L201 T297 Q298 S304 W322 C325 | L201-L300 HydrophobicContact CD1-CB 4.35Å; L201-L300 HydrophobicContact CD1-CD2 4.02Å; L201-L300 HydrophobicContact CD1-CG 4.11Å; T297-L300 PolarHBondContact O-N 2.9Å; Q298-L300 VanDerWaalsContact C-N 3.27Å; Q298-L300 PolarHBondContact O-N 3.45Å; L300-S304 WeakPolarHBondContact O-CB 3.21Å; L300-S304 PolarHBondContact O-N 3.17Å; L300-S304 PolarHBondContact O-OG 3.14Å; L300-W322 HydrophobicContact CD1-CD2 4.02Å; L300-W322 HydrophobicContact CD1-CE3 4.35Å; L300-W322 HydrophobicContact CD1-CG 4.43Å; L300-W322 HydrophobicContact CD1-CZ2 4.25Å; L300-C325 HydrophobicContact CD2-CB 3.86Å |
| 301 | V | 94.1 | Very high | 88.8 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.6 | -52 | 173 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | L201 L202 T297 Q298 P299 S304 L305 | L201-V301 HydrophobicContact CB-CG2 3.47Å; L201-V301 VanDerWaalsContact CB-CG2 3.47Å; L201-V301 HydrophobicContact CD1-CG2 3.92Å; L201-V301 HydrophobicContact CG-CG2 4.32Å; L202-V301 HydrophobicContact CD1-CG1 4.28Å; L202-V301 HydrophobicContact CD2-CG1 3.84Å; L202-V301 HydrophobicContact CG-CG1 3.82Å; T297-V301 PolarHBondContact O-N 2.99Å; T297-V301 VanDerWaalsContact O-N 3.12Å; Q298-V301 WeakPolarHBondContact O-CB 3.25Å; Q298-V301 PolarHBondContact O-N 3.24Å; Q298-V301 VanDerWaalsContact O-N 3.15Å; P299-V301 PolarHBondContact O-N 3.4Å; V301-S304 PolarHBondContact O-N 3.35Å; V301-L305 HydrophobicContact CG1-CD1 4.08Å; V301-L305 WeakPolarHBondContact O-CG 3.49Å; V301-L305 PolarHBondContact O-N 2.93Å |
| 302 | W | 94 | Very high | 89.1 | Confident | 171 Ų | 171 | 49.3 Ų | 49.3 | 65% | 0.648 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -67.6 | -41.7 | -176.5 | -67.5 | 114.1 | 0 | 0 | 0 | 112.3 | Q298 P299 S304 L305 A306 | Q298-W302 PolarHBondContact O-N 2.8Å; P299-W302 PolarHBondContact O-N 2.81Å; W302-S304 VanDerWaalsContact C-N 3.32Å; W302-S304 PolarHBondContact O-N 3.31Å; W302-L305 HydrophobicContact CE3-CD1 3.94Å; W302-L305 HydrophobicContact CZ3-CD1 4.07Å; W302-L305 PolarHBondContact O-N 2.91Å; W302-A306 WeakPolarHBondContact O-CB 3.44Å; W302-A306 PolarHBondContact O-N 3.43Å |
| 303 | V | 92.8 | Very high | 89.3 | Confident | 7 Ų | 7 | 48.4 Ų | 48.4 | 4% | 0.042 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60 | -44.9 | 172.8 | 169.6 | 0 | 0 | 0 | 0 | 110.6 | P299 L305 A306 S307 V313 V317 Q318 S321 | P299-V303 WeakPolarHBondContact O-CG2 3.4Å; P299-V303 PolarHBondContact O-N 3.15Å; V303-L305 PolarHBondContact O-N 2.87Å; V303-A306 PolarHBondContact O-N 3.44Å; V303-S307 WeakPolarHBondContact O-CB 3.24Å; V303-S307 PolarHBondContact O-N 2.89Å; V303-S307 PolarHBondContact O-OG 3.47Å; V303-V313 HydrophobicContact CG1-CG1 4.41Å; V303-V313 HydrophobicContact CG2-CG1 4.18Å; V303-V317 HydrophobicContact CG2-CG1 3.88Å; V303-Q318 HydrophobicContact CG1-CB 4.37Å; V303-Q318 HydrophobicContact CG1-CG 4.22Å; V303-S321 WeakPolarHBondContact CG2-OG 3.35Å |
| 304 | S | 91.9 | Very high | 89.6 | Confident | 10 Ų | 10 | 52.2 Ų | 52.2 | 7% | 0.07 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -66.6 | -36.7 | -179.9 | -58.3 | 0 | 0 | 0 | 0 | 112.8 | A194 L300 V301 W302 G308 | A194-S304 WeakPolarHBondContact CB-O 3.39Å; A194-S304 WeakPolarHBondContact O-CB 3.46Å; L300-S304 WeakPolarHBondContact O-CB 3.21Å; L300-S304 PolarHBondContact O-N 3.17Å; L300-S304 PolarHBondContact O-OG 3.14Å; V301-S304 PolarHBondContact O-N 3.35Å; W302-S304 VanDerWaalsContact C-N 3.32Å; W302-S304 PolarHBondContact O-N 3.31Å; S304-G308 WeakPolarHBondContact O-CA 3.35Å; S304-G308 PolarHBondContact O-N 2.9Å |
| 305 | L | 94.3 | Very high | 89.7 | Confident | 45 Ų | 45 | 56.5 Ų | 56.5 | 24% | 0.236 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.3 | -48.7 | 172.1 | -76.6 | 169.8 | 0 | 0 | 0 | 111.4 | L195 A198 V301 W302 V303 G308 F309 | L195-L305 HydrophobicContact CD2-CD2 4.23Å; A198-L305 HydrophobicContact CB-CD2 3.77Å; A198-L305 HydrophobicContact CB-CG 3.7Å; V301-L305 HydrophobicContact CG1-CD1 4.08Å; V301-L305 WeakPolarHBondContact O-CG 3.49Å; V301-L305 PolarHBondContact O-N 2.93Å; W302-L305 HydrophobicContact CE3-CD1 3.94Å; W302-L305 HydrophobicContact CZ3-CD1 4.07Å; W302-L305 PolarHBondContact O-N 2.91Å; V303-L305 PolarHBondContact O-N 2.87Å; L305-G308 WeakPolarHBondContact O-CA 3.44Å; L305-G308 PolarHBondContact O-N 3.03Å; L305-G308 VanDerWaalsContact O-N 3.13Å; L305-F309 WeakPolarHBondContact O-CD2 3.37Å; L305-F309 PolarHBondContact O-N 3.2Å; L305-F309 VanDerWaalsContact O-N 3.13Å |
| 306 | A | 92.4 | Very high | 89.8 | Confident | 21 Ų | 21 | 51.7 Ų | 51.7 | 17% | 0.174 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.8 | -48.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | W302 V303 G308 F309 S310 L311 V313 | W302-A306 WeakPolarHBondContact O-CB 3.44Å; W302-A306 PolarHBondContact O-N 3.43Å; V303-A306 PolarHBondContact O-N 3.44Å; A306-G308 VanDerWaalsContact C-N 3.28Å; A306-G308 PolarHBondContact O-N 2.89Å; A306-F309 CarbonylContact O-C 3.59Å; A306-F309 PolarHBondContact O-N 2.94Å; A306-S310 PolarHBondContact O-N 3.02Å; A306-L311 HydrophobicContact CB-CB 4.14Å; A306-L311 HydrophobicContact CB-CD1 4.5Å; A306-L311 WeakPolarHBondContact O-CB 3.31Å; A306-L311 PolarHBondContact O-N 3.2Å; A306-V313 HydrophobicContact CB-CG2 3.49Å; A306-V313 VanDerWaalsContact CB-CG2 3.49Å |
| 307 | S | 89.1 | Confident | 90 | Very high | 33 Ų | 33 | 54.9 Ų | 54.9 | 23% | 0.231 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.6 | -38.8 | 172.9 | -61.2 | 0 | 0 | 0 | 0 | 111.8 | H191 V303 F309 S310 | H191-S307 PolarHBondContact ND1-O 3.35Å; V303-S307 WeakPolarHBondContact O-CB 3.24Å; V303-S307 PolarHBondContact O-N 2.89Å; V303-S307 PolarHBondContact O-OG 3.47Å; S307-F309 VanDerWaalsContact C-N 3.27Å; S307-F309 PolarHBondContact O-N 3.29Å; S307-S310 PolarHBondContact O-N 2.91Å |
| 308 | G | 89 | Confident | 90.1 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -54.8 | -38.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | V190 H191 S304 L305 A306 | V190-G308 CarbonylContact C-O 3.57Å; V190-G308 WeakPolarHBondContact CA-O 3.46Å; H191-G308 PolarHBondContact N-O 2.98Å; S304-G308 WeakPolarHBondContact O-CA 3.35Å; S304-G308 PolarHBondContact O-N 2.9Å; L305-G308 WeakPolarHBondContact O-CA 3.44Å; L305-G308 PolarHBondContact O-N 3.03Å; L305-G308 VanDerWaalsContact O-N 3.13Å; A306-G308 VanDerWaalsContact C-N 3.28Å; A306-G308 PolarHBondContact O-N 2.89Å |
| 309 | F | 91.5 | Very high | 90 | Very high | 119 Ų | 119 | 56.8 Ų | 56.8 | 52% | 0.522 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 13.2 | 177.1 | -65.6 | -69.9 | 0 | 0 | 0 | 113.8 | L195 L305 A306 S307 L311 | L195-F309 HydrophobicContact CD2-CD2 4.2Å; L195-F309 HydrophobicContact CD2-CE2 3.78Å; L195-F309 HydrophobicContact CD2-CZ 4.02Å; L305-F309 WeakPolarHBondContact O-CD2 3.37Å; L305-F309 PolarHBondContact O-N 3.2Å; L305-F309 VanDerWaalsContact O-N 3.13Å; A306-F309 CarbonylContact O-C 3.59Å; A306-F309 PolarHBondContact O-N 2.94Å; S307-F309 VanDerWaalsContact C-N 3.27Å; S307-F309 PolarHBondContact O-N 3.29Å; F309-L311 HydrophobicContact CB-CD1 4.43Å; F309-L311 HydrophobicContact CB-CG 4.13Å; F309-L311 PolarHBondContact O-N 3.31Å |
| 310 | S | 88 | Confident | 89.9 | Confident | 56 Ų | 56 | 57.2 Ų | 57.2 | 39% | 0.392 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.7 | 28.9 | -178.2 | -50.1 | 0 | 0 | 0 | 0 | 113.6 | P188 R189 H191 A306 S307 | P188-S310 PolarHBondContact O-OG 3.49Å; R189-S310 PolarHBondContact O-OG 3.27Å; H191-S310 PolarHBondContact CE1-OG 2.93Å; H191-S310 VanDerWaalsContact CE1-OG 3.23Å; H191-S310 PolarHBondContact ND1-OG 3.4Å; A306-S310 PolarHBondContact O-N 3.02Å; S307-S310 PolarHBondContact O-N 2.91Å |
| 311 | L | 89.4 | Confident | 89.9 | Confident | 101 Ų | 101 | 57 Ų | 57 | 53% | 0.529 | 32% | 0.317 | S | S | . | . | trans | -74.9 | 141.7 | 174.1 | -63.2 | 176.4 | 0 | 0 | 0 | 109.7 | A306 F309 V313 | A306-L311 HydrophobicContact CB-CB 4.14Å; A306-L311 HydrophobicContact CB-CD1 4.5Å; A306-L311 WeakPolarHBondContact O-CB 3.31Å; A306-L311 PolarHBondContact O-N 3.2Å; F309-L311 HydrophobicContact CB-CD1 4.43Å; F309-L311 HydrophobicContact CB-CG 4.13Å; F309-L311 PolarHBondContact O-N 3.31Å; L311-V313 PolarHBondContact O-N 3.47Å | ||
| 312 | P | 87.2 | Confident | 89.7 | Confident | 127 Ų | 127 | 60 Ų | 60 | 83% | 0.825 | 33% | 0.328 | S | S | * | . | trans | -66.5 | 122.4 | 178.3 | 27.2 | -33.4 | 0 | 0 | 0 | 110.2 | ||||
| 313 | V | 86.9 | Confident | 89.6 | Confident | 33 Ų | 33 | 53 Ų | 53 | 20% | 0.2 | 30% | 0.303 | C | S | . | . | trans | -113.6 | 128.1 | 174.6 | -178.9 | 0 | 0 | 0 | 0 | 108.6 | V303 A306 L311 W315 V317 Q318 | V303-V313 HydrophobicContact CG1-CG1 4.41Å; V303-V313 HydrophobicContact CG2-CG1 4.18Å; A306-V313 HydrophobicContact CB-CG2 3.49Å; A306-V313 VanDerWaalsContact CB-CG2 3.49Å; L311-V313 PolarHBondContact O-N 3.47Å; V313-W315 PolarHBondContact O-N 2.84Å; V313-V317 HydrophobicContact CG1-CB 4.22Å; V313-V317 HydrophobicContact CG1-CG1 4.3Å; V313-Q318 HydrophobicContact CG1-CB 4.32Å | ||
| 314 | P | 89.7 | Confident | 89.5 | Confident | 84 Ų | 84 | 55.8 Ų | 55.8 | 55% | 0.545 | 32% | 0.318 | S | S | . | . | trans | -59.2 | 135.7 | 174.8 | -22.5 | 32.6 | 0 | 0 | 0 | 111.2 | G316 V317 Q318 | P314-G316 PolarHBondContact O-N 3.32Å; P314-G316 VanDerWaalsContact O-N 3.09Å; P314-V317 HydrophobicContact CB-CG2 4.14Å; P314-V317 HydrophobicContact CG-CG2 4.29Å; P314-V317 WeakPolarHBondContact O-CB 3.43Å; P314-V317 PolarHBondContact O-N 3.21Å; P314-Q318 PolarHBondContact O-N 3.46Å | ||
| 315 | W | 84.9 | Confident | 89.4 | Confident | 128 Ų | 128 | 56 Ų | 56 | 49% | 0.485 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -52.2 | -39.1 | -177.1 | 79.9 | -92.5 | 0 | 0 | 0 | 112.6 | R30 V34 V313 V317 Q318 A319 | R30-W315 HydrophobicContact CB-CH2 3.8Å; R30-W315 HydrophobicContact CB-CZ2 3.89Å; R30-W315 HydrophobicContact CB-CZ3 4.45Å; R30-W315 VanDerWaalsContact CD-CZ2 3.48Å; R30-W315 HydrophobicContact CG-CH2 4.07Å; R30-W315 HydrophobicContact CG-CZ2 3.71Å; V34-W315 HydrophobicContact CG2-CZ3 4.26Å; V313-W315 PolarHBondContact O-N 2.84Å; W315-V317 VanDerWaalsContact C-N 3.34Å; W315-V317 PolarHBondContact O-N 2.98Å; W315-Q318 PolarHBondContact O-N 3.15Å; W315-A319 HydrophobicContact CE3-CB 4.01Å; W315-A319 HydrophobicContact CZ3-CB 4Å; W315-A319 WeakPolarHBondContact O-CB 3.42Å; W315-A319 PolarHBondContact O-N 3.12Å |
| 316 | G | 85.6 | Confident | 89.3 | Confident | 29 Ų | 29 | 53.9 Ų | 53.9 | 30% | 0.299 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -66.4 | -36.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P314 A320 | P314-G316 PolarHBondContact O-N 3.32Å; P314-G316 VanDerWaalsContact O-N 3.09Å; G316-A320 WeakPolarHBondContact O-CB 3.29Å; G316-A320 PolarHBondContact O-N 2.99Å |
| 317 | V | 89.1 | Confident | 89.3 | Confident | 74 Ų | 74 | 53.9 Ų | 53.9 | 45% | 0.448 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -68.7 | -41.4 | 175.7 | 178.6 | 0 | 0 | 0 | 0 | 110.1 | V303 V313 P314 W315 S321 | V303-V317 HydrophobicContact CG2-CG1 3.88Å; V313-V317 HydrophobicContact CG1-CB 4.22Å; V313-V317 HydrophobicContact CG1-CG1 4.3Å; P314-V317 HydrophobicContact CB-CG2 4.14Å; P314-V317 HydrophobicContact CG-CG2 4.29Å; P314-V317 WeakPolarHBondContact O-CB 3.43Å; P314-V317 PolarHBondContact O-N 3.21Å; W315-V317 VanDerWaalsContact C-N 3.34Å; W315-V317 PolarHBondContact O-N 2.98Å; V317-S321 WeakPolarHBondContact O-CB 3.41Å; V317-S321 PolarHBondContact O-N 3.36Å; V317-S321 PolarHBondContact O-OG 3.38Å |
| 318 | Q | 88.6 | Confident | 89.3 | Confident | 83 Ų | 83 | 52.9 Ų | 52.9 | 39% | 0.388 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63.9 | -50.8 | 175.6 | -177.8 | 171.9 | -9.2 | 0 | 0 | 111.1 | V303 V313 P314 W315 A320 S321 W322 | V303-Q318 HydrophobicContact CG1-CB 4.37Å; V303-Q318 HydrophobicContact CG1-CG 4.22Å; V313-Q318 HydrophobicContact CG1-CB 4.32Å; P314-Q318 PolarHBondContact O-N 3.46Å; W315-Q318 PolarHBondContact O-N 3.15Å; Q318-A320 PolarHBondContact O-N 3.23Å; Q318-S321 PolarHBondContact O-N 2.77Å; Q318-W322 PolarHBondContact O-N 3.13Å |
| 319 | A | 87.2 | Confident | 89.3 | Confident | 17 Ų | 17 | 53.1 Ų | 53.1 | 14% | 0.14 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.5 | -46.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V34 W315 S321 W322 L323 | V34-A319 HydrophobicContact CG2-CB 4.5Å; W315-A319 HydrophobicContact CE3-CB 4.01Å; W315-A319 HydrophobicContact CZ3-CB 4Å; W315-A319 WeakPolarHBondContact O-CB 3.42Å; W315-A319 PolarHBondContact O-N 3.12Å; A319-S321 VanDerWaalsContact C-N 3.34Å; A319-S321 PolarHBondContact O-N 3.32Å; A319-W322 PolarHBondContact O-N 3.21Å; A319-L323 WeakPolarHBondContact O-CB 3.26Å; A319-L323 VanDerWaalsContact O-CG 3.28Å; A319-L323 WeakPolarHBondContact O-CG 3.36Å; A319-L323 PolarHBondContact O-N 2.89Å |
| 320 | A | 90.4 | Very high | 89.2 | Confident | 56 Ų | 56 | 47.6 Ų | 47.6 | 46% | 0.463 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62 | -40.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | G316 Q318 L323 L324 | G316-A320 WeakPolarHBondContact O-CB 3.29Å; G316-A320 PolarHBondContact O-N 2.99Å; Q318-A320 PolarHBondContact O-N 3.23Å; A320-L323 PolarHBondContact O-N 3.2Å; A320-L324 VanDerWaalsContact O-CB 3.29Å; A320-L324 WeakPolarHBondContact O-CB 3.28Å; A320-L324 PolarHBondContact O-N 3.19Å |
| 321 | S | 91.3 | Very high | 89 | Confident | 3 Ų | 3 | 49 Ų | 49 | 2% | 0.021 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.1 | -41.3 | 178.7 | -58.9 | 0 | 0 | 0 | 0 | 112 | P299 V303 V317 Q318 A319 C325 | P299-S321 WeakPolarHBondContact CB-OG 3.42Å; V303-S321 WeakPolarHBondContact CG2-OG 3.35Å; V317-S321 WeakPolarHBondContact O-CB 3.41Å; V317-S321 PolarHBondContact O-N 3.36Å; V317-S321 PolarHBondContact O-OG 3.38Å; Q318-S321 PolarHBondContact O-N 2.77Å; A319-S321 VanDerWaalsContact C-N 3.34Å; A319-S321 PolarHBondContact O-N 3.32Å; S321-C325 PolarHBondContact O-N 3.13Å; S321-C325 VanDerWaalsContact O-N 3.14Å |
| 322 | W | 90.4 | Very high | 88.7 | Confident | 63 Ų | 63 | 44.3 Ų | 44.3 | 24% | 0.239 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -68.6 | -44.2 | 174.8 | -79.9 | 108.3 | 0 | 0 | 0 | 112.6 | Y38 W84 L120 L124 L300 Q318 A319 L324 C325 C326 | Y38-W322 WeakPolarHBondContact OH-CB 3.28Å; W84-W322 HydrophobicContact CH2-CE3 4.27Å; L120-W322 HydrophobicContact CD1-CZ3 4.24Å; L120-W322 HydrophobicContact CD2-CH2 3.96Å; L120-W322 HydrophobicContact CD2-CZ3 4.05Å; L124-W322 HydrophobicContact CD1-CH2 4.49Å; L124-W322 HydrophobicContact CD1-CZ3 4Å; L300-W322 HydrophobicContact CD1-CD2 4.02Å; L300-W322 HydrophobicContact CD1-CE3 4.35Å; L300-W322 HydrophobicContact CD1-CG 4.43Å; L300-W322 HydrophobicContact CD1-CZ2 4.25Å; Q318-W322 PolarHBondContact O-N 3.13Å; A319-W322 PolarHBondContact O-N 3.21Å; W322-L324 VanDerWaalsContact C-N 3.26Å; W322-L324 PolarHBondContact O-N 2.84Å; W322-C325 WeakPolarHBondContact O-CB 3.38Å; W322-C325 PolarHBondContact O-N 3.03Å; W322-C326 PolarHBondContact O-N 3.29Å; W322-C326 PolarHBondContact O-SG 3.44Å |
| 323 | L | 91.4 | Very high | 88.2 | Confident | 24 Ų | 24 | 38.4 Ų | 38.4 | 13% | 0.126 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.2 | -37.4 | 175.6 | -76.1 | 170 | 0 | 0 | 0 | 111.9 | V34 L37 Y38 L41 A319 A320 C326 A327 | V34-L323 HydrophobicContact CG1-CD1 4.37Å; L37-L323 HydrophobicContact CB-CD2 3.86Å; L37-L323 HydrophobicContact CD1-CD1 3.91Å; Y38-L323 HydrophobicContact CD1-CD2 4.15Å; Y38-L323 HydrophobicContact CD2-CD2 4.13Å; Y38-L323 HydrophobicContact CE1-CD2 4.07Å; Y38-L323 HydrophobicContact CE2-CD2 4.07Å; Y38-L323 HydrophobicContact CG-CD2 4.17Å; L41-L323 HydrophobicContact CD1-CD2 4.19Å; A319-L323 WeakPolarHBondContact O-CB 3.26Å; A319-L323 VanDerWaalsContact O-CG 3.28Å; A319-L323 WeakPolarHBondContact O-CG 3.36Å; A319-L323 PolarHBondContact O-N 2.89Å; A320-L323 PolarHBondContact O-N 3.2Å; L323-C326 WeakPolarHBondContact O-CB 3.34Å; L323-C326 PolarHBondContact O-N 2.9Å; L323-A327 WeakPolarHBondContact O-CB 3.39Å; L323-A327 PolarHBondContact O-N 2.91Å |
| 324 | L | 92 | Very high | 87.6 | Confident | 66 Ų | 66 | 40.5 Ų | 40.5 | 35% | 0.346 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -68 | -39.1 | 176.4 | -171.7 | 60.1 | 0 | 0 | 0 | 112.1 | A296 P299 A320 W322 C326 A327 L328 | A296-L324 HydrophobicContact CB-CD1 4.31Å; A296-L324 HydrophobicContact CB-CG 4.07Å; A296-L324 WeakPolarHBondContact O-CD2 3.14Å; A296-L324 WeakPolarHBondContact O-CG 3.36Å; P299-L324 HydrophobicContact CG-CD2 3.84Å; A320-L324 VanDerWaalsContact O-CB 3.29Å; A320-L324 WeakPolarHBondContact O-CB 3.28Å; A320-L324 PolarHBondContact O-N 3.19Å; W322-L324 VanDerWaalsContact C-N 3.26Å; W322-L324 PolarHBondContact O-N 2.84Å; L324-C326 VanDerWaalsContact C-N 3.33Å; L324-A327 PolarHBondContact O-N 2.83Å; L324-L328 PolarHBondContact O-N 2.94Å |
| 325 | C | 89.9 | Confident | 86.8 | Confident | 13 Ų | 13 | 38.7 Ų | 38.7 | 9% | 0.088 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.7 | -39.1 | 171.8 | -175.9 | 0 | 0 | 0 | 0 | 112.1 | L300 S321 W322 L328 S329 | L300-C325 HydrophobicContact CD2-CB 3.86Å; S321-C325 PolarHBondContact O-N 3.13Å; S321-C325 VanDerWaalsContact O-N 3.14Å; W322-C325 WeakPolarHBondContact O-CB 3.38Å; W322-C325 PolarHBondContact O-N 3.03Å; C325-L328 WeakPolarHBondContact O-CB 3.29Å; C325-L328 PolarHBondContact O-N 3.38Å; C325-S329 PolarHBondContact O-N 2.98Å; C325-S329 PolarHBondContact O-OG 3.5Å; C325-S329 VanDerWaalsContact O-OG 3.05Å |
| 326 | C | 91.6 | Very high | 86.1 | Confident | 2 Ų | 2 | 34 Ų | 34 | 1% | 0.014 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.4 | -42.4 | 175.6 | -66.8 | 0 | 0 | 0 | 0 | 111.8 | Y38 L41 M85 W322 L323 L324 L328 S329 A330 | Y38-C326 HydrophobicContact CE1-CB 4.37Å; Y38-C326 VanDerWaalsContact CE1-SG 3.56Å; L41-C326 HydrophobicContact CD1-CB 3.81Å; M85-C326 VanDerWaalsContact CE-CA 3.49Å; M85-C326 HydrophobicContact CE-CB 3.39Å; M85-C326 WeakPolarHBondContact CE-O 3.38Å; M85-C326 HydrophobicContact SD-CB 3.98Å; W322-C326 PolarHBondContact O-N 3.29Å; W322-C326 PolarHBondContact O-SG 3.44Å; L323-C326 WeakPolarHBondContact O-CB 3.34Å; L323-C326 PolarHBondContact O-N 2.9Å; L324-C326 VanDerWaalsContact C-N 3.33Å; C326-L328 VanDerWaalsContact C-N 3.28Å; C326-L328 PolarHBondContact O-N 2.84Å; C326-S329 PolarHBondContact O-N 3.48Å; C326-A330 WeakPolarHBondContact O-CB 3.32Å; C326-A330 PolarHBondContact O-N 3.46Å |
| 327 | A | 91.4 | Very high | 85.6 | Confident | 21 Ų | 21 | 33.4 Ų | 33.4 | 17% | 0.174 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.4 | -39.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L41 L323 L324 A330 L331 | L41-A327 HydrophobicContact CD1-CB 4.42Å; L41-A327 HydrophobicContact CD2-CB 4.09Å; L323-A327 WeakPolarHBondContact O-CB 3.39Å; L323-A327 PolarHBondContact O-N 2.91Å; L324-A327 PolarHBondContact O-N 2.83Å; A327-A330 PolarHBondContact O-N 2.97Å; A327-L331 HydrophobicContact CB-CD1 4.49Å; A327-L331 VanDerWaalsContact O-CB 3.24Å; A327-L331 WeakPolarHBondContact O-CB 3.18Å; A327-L331 WeakPolarHBondContact O-CG 3.2Å; A327-L331 PolarHBondContact O-N 3.42Å |
| 328 | L | 89.1 | Confident | 84.9 | Confident | 12 Ų | 12 | 33.6 Ų | 33.6 | 6% | 0.063 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.7 | -50.2 | 173.8 | -170.3 | 63.2 | 0 | 0 | 0 | 110.8 | V292 F293 A296 T297 L324 C325 C326 A330 L331 N332 L335 | V292-L328 HydrophobicContact CG1-CD1 4.34Å; F293-L328 HydrophobicContact CD2-CD1 4.15Å; F293-L328 HydrophobicContact CD2-CD2 3.91Å; F293-L328 HydrophobicContact CD2-CG 4.43Å; F293-L328 HydrophobicContact CE2-CD1 4.45Å; F293-L328 HydrophobicContact CE2-CD2 3.6Å; F293-L328 HydrophobicContact CE2-CG 4.25Å; F293-L328 HydrophobicContact CZ-CD2 3.99Å; A296-L328 HydrophobicContact CB-CB 4.26Å; A296-L328 HydrophobicContact CB-CD1 3.98Å; A296-L328 HydrophobicContact CB-CD2 3.97Å; A296-L328 HydrophobicContact CB-CG 4.31Å; T297-L328 HydrophobicContact CG2-CD2 3.67Å; L324-L328 PolarHBondContact O-N 2.94Å; C325-L328 WeakPolarHBondContact O-CB 3.29Å; C325-L328 PolarHBondContact O-N 3.38Å; C326-L328 VanDerWaalsContact C-N 3.28Å; C326-L328 PolarHBondContact O-N 2.84Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 3.38Å; L328-L331 PolarHBondContact O-N 2.96Å; L328-N332 WeakPolarHBondContact O-CB 3.48Å; L328-N332 PolarHBondContact O-N 3.3Å; L328-N332 PolarHBondContact O-ND2 3.35Å; L328-N332 PolarHBondContact O-OD1 3.38Å; L328-L335 HydrophobicContact CD1-CD1 4.1Å |
| 329 | S | 90.9 | Very high | 84 | Confident | 4 Ų | 4 | 36 Ų | 36 | 3% | 0.028 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.9 | -36.9 | 177.3 | -52.2 | 0 | 0 | 0 | 0 | 112.8 | N49 D77 C325 C326 | N49-S329 PolarHBondContact ND2-O 3.38Å; D77-S329 WeakPolarHBondContact CB-O 3.46Å; C325-S329 PolarHBondContact O-N 2.98Å; C325-S329 PolarHBondContact O-OG 3.5Å; C325-S329 VanDerWaalsContact O-OG 3.05Å; C326-S329 PolarHBondContact O-N 3.48Å |
| 330 | A | 88.8 | Confident | 83.5 | Confident | 4 Ų | 4 | 37.5 Ų | 37.5 | 3% | 0.033 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -74.3 | -34.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | L41 C326 A327 L328 | L41-A330 HydrophobicContact CD2-CB 4.2Å; C326-A330 WeakPolarHBondContact O-CB 3.32Å; C326-A330 PolarHBondContact O-N 3.46Å; A327-A330 PolarHBondContact O-N 2.97Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 3.38Å |
| 331 | L | 84.3 | Confident | 83 | Confident | 85 Ų | 85 | 37.7 Ų | 37.7 | 45% | 0.445 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -100.8 | -7.6 | -171.1 | -59.9 | 173.1 | 0 | 0 | 0 | 114 | A327 L328 P333 L334 L335 | A327-L331 HydrophobicContact CB-CD1 4.49Å; A327-L331 VanDerWaalsContact O-CB 3.24Å; A327-L331 WeakPolarHBondContact O-CB 3.18Å; A327-L331 WeakPolarHBondContact O-CG 3.2Å; A327-L331 PolarHBondContact O-N 3.42Å; L328-L331 PolarHBondContact O-N 2.96Å; L331-P333 VanDerWaalsContact C-CD 3.47Å; L331-P333 VanDerWaalsContact C-N 3.32Å; L331-L334 HydrophobicContact CD2-CD1 3.82Å; L331-L334 WeakPolarHBondContact O-CB 3.45Å; L331-L334 PolarHBondContact O-N 3.3Å; L331-L335 PolarHBondContact O-N 2.85Å |
| 332 | N | 81.9 | Confident | 82.6 | Confident | 3 Ų | 3 | 40.9 Ų | 40.9 | 2% | 0.016 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -47.1 | -46.3 | 174.5 | -77.1 | -24.1 | 0 | 0 | 0 | 113.4 | D77 H131 L328 L334 L335 Y336 | D77-N332 WeakPolarHBondContact OD2-CB 3.4Å; D77-N332 PolarHBondContact OD2-ND2 2.9Å; H131-N332 PolarHBondContact CE1-ND2 3.37Å; H131-N332 PolarHBondContact NE2-ND2 3.36Å; L328-N332 WeakPolarHBondContact O-CB 3.48Å; L328-N332 PolarHBondContact O-N 3.3Å; L328-N332 PolarHBondContact O-ND2 3.35Å; L328-N332 PolarHBondContact O-OD1 3.38Å; N332-L334 VanDerWaalsContact C-N 3.27Å; N332-L334 PolarHBondContact O-N 2.79Å; N332-L335 WeakPolarHBondContact O-CB 3.46Å; N332-L335 PolarHBondContact O-N 2.87Å; N332-Y336 HydrophobicContact CB-CE2 4.38Å; N332-Y336 WeakPolarHBondContact O-CD2 3.49Å; N332-Y336 PolarHBondContact O-N 2.97Å |
| 333 | P | 77.1 | Confident | 82.2 | Confident | 2 Ų | 2 | 38 Ų | 38 | 1% | 0.013 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -44.9 | -48.2 | 171 | -37.4 | 41.1 | 0 | 0 | 0 | 114.6 | A48 N49 V52 L331 Y336 T337 | A48-P333 HydrophobicContact CB-CB 4.15Å; A48-P333 HydrophobicContact CB-CG 4.06Å; N49-P333 HydrophobicContact CB-CG 4.23Å; N49-P333 WeakPolarHBondContact OD1-CD 3.32Å; N49-P333 WeakPolarHBondContact OD1-CG 3.43Å; V52-P333 HydrophobicContact CG2-CB 3.63Å; V52-P333 HydrophobicContact CG2-CG 4.36Å; L331-P333 VanDerWaalsContact C-CD 3.47Å; L331-P333 VanDerWaalsContact C-N 3.32Å; P333-Y336 PolarHBondContact O-N 3.13Å; P333-T337 VanDerWaalsContact O-CB 3.3Å; P333-T337 WeakPolarHBondContact O-CB 3.26Å; P333-T337 VanDerWaalsContact O-CG2 3.26Å; P333-T337 WeakPolarHBondContact O-CG2 3.39Å; P333-T337 PolarHBondContact O-N 3.06Å; P333-T337 PolarHBondContact O-OG1 3.47Å |
| 334 | L | 73.3 | Confident | 81.9 | Confident | 77 Ų | 77 | 41.9 Ų | 41.9 | 40% | 0.403 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -70.1 | -40.7 | -175.4 | -62.5 | 174.1 | 0 | 0 | 0 | 110.9 | L331 N332 Y336 T337 W338 | L331-L334 HydrophobicContact CD2-CD1 3.82Å; L331-L334 WeakPolarHBondContact O-CB 3.45Å; L331-L334 PolarHBondContact O-N 3.3Å; N332-L334 VanDerWaalsContact C-N 3.27Å; N332-L334 PolarHBondContact O-N 2.79Å; L334-Y336 VanDerWaalsContact C-N 3.26Å; L334-Y336 PolarHBondContact O-N 3.48Å; L334-T337 PolarHBondContact O-N 3.43Å; L334-W338 WeakPolarHBondContact O-CB 3.4Å; L334-W338 PolarHBondContact O-N 2.94Å |
| 335 | L | 72.9 | Confident | 81.6 | Confident | 46 Ų | 46 | 44.4 Ų | 44.4 | 24% | 0.241 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -54.4 | -43.5 | 177.5 | -70.4 | 178.6 | 0 | 0 | 0 | 111.6 | L289 V292 L328 L331 N332 | L289-L335 HydrophobicContact CD1-CB 3.58Å; L289-L335 HydrophobicContact CD1-CD2 4.3Å; L289-L335 HydrophobicContact CD1-CG 4.45Å; L289-L335 WeakPolarHBondContact CD1-O 3.44Å; V292-L335 HydrophobicContact CB-CD1 4.44Å; V292-L335 HydrophobicContact CB-CD2 4.17Å; V292-L335 HydrophobicContact CG1-CD1 3.77Å; V292-L335 HydrophobicContact CG1-CD2 3.94Å; V292-L335 HydrophobicContact CG2-CD2 4.11Å; L328-L335 HydrophobicContact CD1-CD1 4.1Å; L331-L335 PolarHBondContact O-N 2.85Å; N332-L335 WeakPolarHBondContact O-CB 3.46Å; N332-L335 PolarHBondContact O-N 2.87Å |
| 336 | Y | 71.4 | Confident | 81.4 | Confident | 31 Ų | 31 | 44.2 Ų | 44.2 | 12% | 0.122 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -86.5 | -32.4 | -177.6 | -62.6 | -68.5 | 0 | 0 | 0 | 114.5 | I70 H131 V134 L289 N332 P333 L334 | I70-Y336 HydrophobicContact CD1-CG 4.36Å; I70-Y336 HydrophobicContact CG1-CG 4.3Å; I70-Y336 HydrophobicContact CG2-CD2 4.41Å; I70-Y336 HydrophobicContact CG2-CG 4.46Å; H131-Y336 AromaticContact CD2-CZ 3.87Å; H131-Y336 PolarHBondContact CD2-OH 3.16Å; V134-Y336 HydrophobicContact CB-CE1 4.49Å; V134-Y336 HydrophobicContact CG1-CD1 4.07Å; V134-Y336 HydrophobicContact CG1-CE1 3.59Å; L289-Y336 HydrophobicContact CD2-CD1 3.79Å; L289-Y336 HydrophobicContact CD2-CE1 3.39Å; L289-Y336 HydrophobicContact CG-CE1 4.23Å; N332-Y336 HydrophobicContact CB-CE2 4.38Å; N332-Y336 WeakPolarHBondContact O-CD2 3.49Å; N332-Y336 PolarHBondContact O-N 2.97Å; P333-Y336 PolarHBondContact O-N 3.13Å; L334-Y336 VanDerWaalsContact C-N 3.26Å; L334-Y336 PolarHBondContact O-N 3.48Å |
| 337 | T | 74.7 | Confident | 81.1 | Confident | 16 Ų | 16 | 45.4 Ų | 45.4 | 10% | 0.098 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -98.7 | -26.5 | -168.4 | 64.2 | 0 | 0 | 0 | 0 | 113.9 | V52 P333 L334 R339 N340 F343 | V52-T337 HydrophobicContact CG1-CG2 4.23Å; V52-T337 HydrophobicContact CG2-CG2 3.82Å; P333-T337 VanDerWaalsContact O-CB 3.3Å; P333-T337 WeakPolarHBondContact O-CB 3.26Å; P333-T337 VanDerWaalsContact O-CG2 3.26Å; P333-T337 WeakPolarHBondContact O-CG2 3.39Å; P333-T337 PolarHBondContact O-N 3.06Å; P333-T337 PolarHBondContact O-OG1 3.47Å; L334-T337 PolarHBondContact O-N 3.43Å; T337-R339 VanDerWaalsContact C-N 3.27Å; T337-R339 PolarHBondContact O-N 2.77Å; T337-R339 VanDerWaalsContact O-N 3.14Å; T337-N340 PolarHBondContact O-N 2.94Å; T337-F343 HydrophobicContact CG2-CD1 3.57Å; T337-F343 HydrophobicContact CG2-CD2 4.12Å; T337-F343 HydrophobicContact CG2-CE1 3.59Å; T337-F343 HydrophobicContact CG2-CE2 4.12Å; T337-F343 HydrophobicContact CG2-CG 3.83Å; T337-F343 HydrophobicContact CG2-CZ 3.86Å |
| 338 | W | 73.9 | Confident | 80.8 | Confident | 77 Ų | 77 | 49.5 Ų | 49.5 | 29% | 0.292 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55 | -39.9 | -173.6 | -178.2 | -89.1 | 0 | 0 | 0 | 113.7 | L334 R344 A358 A359 V362 | L334-W338 WeakPolarHBondContact O-CB 3.4Å; L334-W338 PolarHBondContact O-N 2.94Å; W338-R344 WeakPolarHBondContact O-CD 3.07Å; W338-A358 HydrophobicContact CH2-CB 4.07Å; W338-A358 WeakPolarHBondContact CH2-O 3.45Å; W338-A358 HydrophobicContact CZ3-CB 3.91Å; W338-A359 HydrophobicContact CH2-CB 4.47Å; W338-V362 HydrophobicContact CD2-CG2 4.15Å; W338-V362 HydrophobicContact CE3-CG2 4.01Å; W338-V362 HydrophobicContact CH2-CB 3.68Å; W338-V362 HydrophobicContact CH2-CG1 4.44Å; W338-V362 HydrophobicContact CH2-CG2 3.28Å; W338-V362 HydrophobicContact CZ2-CB 3.35Å; W338-V362 HydrophobicContact CZ2-CG1 3.69Å; W338-V362 HydrophobicContact CZ2-CG2 3.39Å; W338-V362 HydrophobicContact CZ3-CB 4.44Å; W338-V362 HydrophobicContact CZ3-CG2 3.57Å |
| 339 | R | 70.6 | Confident | 80.6 | Confident | 135 Ų | 135 | 52.5 Ų | 52.5 | 51% | 0.509 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92 | -3.4 | -179 | -69.6 | -162.4 | 172.9 | -163 | -1.2 | 114.1 | S285 T337 E341 | S285-R339 WeakPolarHBondContact OG-CD 3.24Å; S285-R339 PolarHBondContact OG-NH1 3.44Å; T337-R339 VanDerWaalsContact C-N 3.27Å; T337-R339 PolarHBondContact O-N 2.77Å; T337-R339 VanDerWaalsContact O-N 3.14Å; R339-E341 PolarHBondContact O-N 3.35Å |
| 340 | N | 76.2 | Confident | 80.4 | Confident | 48 Ų | 48 | 55 Ų | 55 | 26% | 0.257 | 26% | 0.256 | S | S | . | . | trans | -88.6 | 111.4 | 178.7 | -171.5 | -27.8 | 0 | 0 | 0 | 110.1 | T337 E342 F343 R344 | T337-N340 PolarHBondContact O-N 2.94Å; N340-E342 VanDerWaalsContact C-N 3.28Å; N340-E342 PolarHBondContact O-N 3.01Å; N340-E342 PolarHBondContact OD1-N 3.46Å; N340-F343 HydrophobicContact CB-CB 4.14Å; N340-F343 HydrophobicContact CB-CD2 3.75Å; N340-F343 HydrophobicContact CB-CG 4.41Å; N340-F343 WeakPolarHBondContact ND2-CD2 3.21Å; N340-F343 WeakPolarHBondContact O-CB 3.18Å; N340-F343 PolarHBondContact O-N 2.81Å; N340-F343 VanDerWaalsContact O-N 3.1Å; N340-R344 PolarHBondContact O-N 3.26Å | ||
| 341 | E | 79.8 | Confident | 80 | Confident | 59 Ų | 59 | 58 Ų | 58 | 28% | 0.276 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -57.2 | -39.9 | -178.4 | -173.2 | 60.8 | -152.5 | 0 | 0 | 113 | R339 F343 R344 R345 R348 | R339-E341 PolarHBondContact O-N 3.35Å; E341-F343 VanDerWaalsContact C-N 3.32Å; E341-F343 PolarHBondContact O-N 3.25Å; E341-R344 PolarHBondContact O-N 3.21Å; E341-R344 IonicContact OE2-CZ 2.67Å; E341-R344 VanDerWaalsContact OE2-CZ 3.23Å; E341-R344 IonicContact OE2-NE 2.66Å; E341-R344 PolarHBondContact OE2-NE 2.7Å; E341-R344 IonicContact OE2-NH2 3.88Å; E341-R344 PolarHBondContact OE2-NH2 3.24Å; E341-R345 WeakPolarHBondContact O-CG 3.49Å; E341-R345 PolarHBondContact O-N 3.18Å; E341-R345 IonicContact OE1-CZ 3.48Å; E341-R345 IonicContact OE1-NE 3.88Å; E341-R345 PolarHBondContact OE1-NE 3.37Å; E341-R345 IonicContact OE1-NH2 3.18Å; E341-R348 IonicContact OE1-NH2 2.74Å; E341-R348 PolarHBondContact OE1-NH2 3.26Å |
| 342 | E | 82.3 | Confident | 79.1 | Confident | 70 Ų | 70 | 59.6 Ų | 59.6 | 33% | 0.327 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -66.1 | -36.8 | 179 | -61.8 | -59.6 | 153 | 0 | 0 | 111.3 | L62 N340 R345 S346 | L62-E342 HydrophobicContact CD2-CB 3.63Å; N340-E342 VanDerWaalsContact C-N 3.28Å; N340-E342 PolarHBondContact O-N 3.01Å; N340-E342 PolarHBondContact OD1-N 3.46Å; E342-R345 VanDerWaalsContact CD-NH1 3.29Å; E342-R345 IonicContact OE1-NH1 3.9Å; E342-R345 PolarHBondContact OE1-NH1 2.79Å; E342-R345 IonicContact OE2-NH1 3.04Å; E342-R345 PolarHBondContact OE2-NH1 2.9Å; E342-S346 WeakPolarHBondContact O-CB 3.47Å; E342-S346 PolarHBondContact O-N 3.47Å; E342-S346 PolarHBondContact O-OG 3.22Å |
| 343 | F | 83.6 | Confident | 78 | Confident | 2 Ų | 2 | 61.8 Ų | 61.8 | 1% | 0.009 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.2 | -46.9 | 171.8 | -88.4 | -84.6 | 0 | 0 | 0 | 111 | V52 L55 V56 L62 T337 N340 E341 R345 S346 V347 | V52-F343 HydrophobicContact CG1-CE1 4.15Å; L55-F343 HydrophobicContact CB-CD1 4.48Å; L55-F343 HydrophobicContact CB-CE1 4.42Å; L55-F343 HydrophobicContact CD1-CD1 4.27Å; V56-F343 HydrophobicContact CG2-CE1 3.69Å; V56-F343 HydrophobicContact CG2-CZ 3.45Å; V56-F343 VanDerWaalsContact CG2-CZ 3.45Å; L62-F343 HydrophobicContact CD1-CD1 3.9Å; L62-F343 HydrophobicContact CD1-CD2 4.46Å; L62-F343 HydrophobicContact CD1-CE1 3.95Å; L62-F343 HydrophobicContact CD1-CG 4.18Å; L62-F343 HydrophobicContact CD1-CZ 4.29Å; L62-F343 HydrophobicContact CD2-CD2 3.8Å; L62-F343 HydrophobicContact CD2-CE2 3.94Å; L62-F343 HydrophobicContact CD2-CG 4.21Å; L62-F343 HydrophobicContact CD2-CZ 4.44Å; T337-F343 HydrophobicContact CG2-CD1 3.57Å; T337-F343 HydrophobicContact CG2-CD2 4.12Å; T337-F343 HydrophobicContact CG2-CE1 3.59Å; T337-F343 HydrophobicContact CG2-CE2 4.12Å; T337-F343 HydrophobicContact CG2-CG 3.83Å; T337-F343 HydrophobicContact CG2-CZ 3.86Å; N340-F343 HydrophobicContact CB-CB 4.14Å; N340-F343 HydrophobicContact CB-CD2 3.75Å; N340-F343 HydrophobicContact CB-CG 4.41Å; N340-F343 WeakPolarHBondContact ND2-CD2 3.21Å; N340-F343 WeakPolarHBondContact O-CB 3.18Å; N340-F343 PolarHBondContact O-N 2.81Å; N340-F343 VanDerWaalsContact O-N 3.1Å; E341-F343 VanDerWaalsContact C-N 3.32Å; E341-F343 PolarHBondContact O-N 3.25Å; F343-R345 VanDerWaalsContact C-N 3.3Å; F343-R345 PolarHBondContact O-N 3.17Å; F343-S346 PolarHBondContact O-N 3.28Å; F343-S346 VanDerWaalsContact O-N 3.12Å; F343-V347 WeakPolarHBondContact O-CG2 3.22Å; F343-V347 PolarHBondContact O-N 3.46Å |
| 344 | R | 83.6 | Confident | 77.1 | Confident | 107 Ų | 107 | 65.1 Ų | 65.1 | 40% | 0.404 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.2 | -37 | 178.6 | -66.3 | -162.5 | -62.7 | 158.6 | -9.3 | 113.1 | W338 N340 E341 R348 | W338-R344 WeakPolarHBondContact O-CD 3.07Å; N340-R344 PolarHBondContact O-N 3.26Å; E341-R344 PolarHBondContact O-N 3.21Å; E341-R344 IonicContact OE2-CZ 2.67Å; E341-R344 VanDerWaalsContact OE2-CZ 3.23Å; E341-R344 IonicContact OE2-NE 2.66Å; E341-R344 PolarHBondContact OE2-NE 2.7Å; E341-R344 IonicContact OE2-NH2 3.88Å; E341-R344 PolarHBondContact OE2-NH2 3.24Å; R344-R348 WeakPolarHBondContact O-CG 3.49Å; R344-R348 PolarHBondContact O-N 3.36Å; R344-R348 VanDerWaalsContact O-N 3.11Å; R344-R348 PolarHBondContact O-NE 3.36Å |
| 345 | R | 85.8 | Confident | 76 | Confident | 119 Ų | 119 | 62.4 Ų | 62.4 | 45% | 0.449 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -66.9 | -43.6 | 173.6 | -71.6 | -177 | -164.3 | 129.8 | -3.7 | 111.3 | E341 E342 F343 R348 S349 | E341-R345 WeakPolarHBondContact O-CG 3.49Å; E341-R345 PolarHBondContact O-N 3.18Å; E341-R345 IonicContact OE1-CZ 3.48Å; E341-R345 IonicContact OE1-NE 3.88Å; E341-R345 PolarHBondContact OE1-NE 3.37Å; E341-R345 IonicContact OE1-NH2 3.18Å; E342-R345 VanDerWaalsContact CD-NH1 3.29Å; E342-R345 IonicContact OE1-NH1 3.9Å; E342-R345 PolarHBondContact OE1-NH1 2.79Å; E342-R345 IonicContact OE2-NH1 3.04Å; E342-R345 PolarHBondContact OE2-NH1 2.9Å; F343-R345 VanDerWaalsContact C-N 3.3Å; F343-R345 PolarHBondContact O-N 3.17Å; R345-R348 PolarHBondContact O-N 3.06Å; R345-S349 PolarHBondContact O-N 2.75Å |
| 346 | S | 86.3 | Confident | 75 | Confident | 8 Ų | 8 | 65.8 Ų | 65.8 | 6% | 0.056 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 178.3 | -55 | 0 | 0 | 0 | 0 | 111.6 | E342 F343 S349 V350 | E342-S346 WeakPolarHBondContact O-CB 3.47Å; E342-S346 PolarHBondContact O-N 3.47Å; E342-S346 PolarHBondContact O-OG 3.22Å; F343-S346 PolarHBondContact O-N 3.28Å; F343-S346 VanDerWaalsContact O-N 3.12Å; S346-S349 WeakPolarHBondContact CA-OG 3.47Å; S346-S349 PolarHBondContact O-N 3.09Å; S346-S349 PolarHBondContact O-OG 3.42Å; S346-V350 WeakPolarHBondContact O-CG2 3.43Å; S346-V350 PolarHBondContact O-N 3Å |
| 347 | V | 85.3 | Confident | 73.9 | Confident | 27 Ų | 27 | 67.3 Ų | 67.3 | 16% | 0.164 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -57.9 | -50.5 | 172.8 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | L55 F343 S349 V350 L351 | L55-V347 HydrophobicContact CD1-CG2 3.47Å; L55-V347 VanDerWaalsContact CD1-CG2 3.47Å; F343-V347 WeakPolarHBondContact O-CG2 3.22Å; F343-V347 PolarHBondContact O-N 3.46Å; V347-S349 PolarHBondContact O-N 3.45Å; V347-V350 PolarHBondContact O-N 2.79Å; V347-V350 VanDerWaalsContact O-N 3.08Å; V347-L351 PolarHBondContact O-N 2.83Å |
| 348 | R | 85.1 | Confident | 72.5 | Confident | 107 Ų | 107 | 68.3 Ų | 68.3 | 40% | 0.404 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60 | -32.2 | 178.8 | -79.9 | -179 | -74.2 | 172 | -5.5 | 113.2 | E341 R344 R345 | E341-R348 IonicContact OE1-NH2 2.74Å; E341-R348 PolarHBondContact OE1-NH2 3.26Å; R344-R348 WeakPolarHBondContact O-CG 3.49Å; R344-R348 PolarHBondContact O-N 3.36Å; R344-R348 VanDerWaalsContact O-N 3.11Å; R344-R348 PolarHBondContact O-NE 3.36Å; R345-R348 PolarHBondContact O-N 3.06Å |
| 349 | S | 85.9 | Confident | 71.2 | Confident | 75 Ų | 75 | 66.5 Ų | 66.5 | 52% | 0.524 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -74.6 | -24.9 | 176.7 | 65.7 | 0 | 0 | 0 | 0 | 114.1 | F59 R345 S346 V347 | F59-S349 WeakPolarHBondContact CZ-OG 3.39Å; R345-S349 PolarHBondContact O-N 2.75Å; S346-S349 WeakPolarHBondContact CA-OG 3.47Å; S346-S349 PolarHBondContact O-N 3.09Å; S346-S349 PolarHBondContact O-OG 3.42Å; V347-S349 PolarHBondContact O-N 3.45Å |
| 350 | V | 84.8 | Confident | 69.9 | Low | 56 Ų | 56 | 62.8 Ų | 62.8 | 34% | 0.339 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -93.2 | -36.8 | 179.5 | 176.2 | 0 | 0 | 0 | 0 | 111.4 | Y54 L55 F59 S346 V347 | Y54-V350 HydrophobicContact CE1-CG1 3.85Å; Y54-V350 HydrophobicContact CE1-CG2 3.95Å; L55-V350 HydrophobicContact CD2-CG2 3.87Å; F59-V350 HydrophobicContact CE2-CG2 3.82Å; F59-V350 HydrophobicContact CZ-CG2 3.97Å; S346-V350 WeakPolarHBondContact O-CG2 3.43Å; S346-V350 PolarHBondContact O-N 3Å; V347-V350 PolarHBondContact O-N 2.79Å; V347-V350 VanDerWaalsContact O-N 3.08Å |
| 351 | L | 81.5 | Confident | 68.3 | Low | 69 Ų | 69 | 63.2 Ų | 63.2 | 36% | 0.361 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -126.1 | 77.4 | -179.6 | -69.3 | 165 | 0 | 0 | 0 | 109.3 | M51 V347 G353 V354 | M51-L351 HydrophobicContact SD-CD1 4.1Å; V347-L351 PolarHBondContact O-N 2.83Å; L351-G353 PolarHBondContact O-N 3.38Å; L351-V354 HydrophobicContact CB-CB 3.98Å; L351-V354 HydrophobicContact CB-CG2 3.92Å; L351-V354 HydrophobicContact CD1-CB 4.43Å; L351-V354 HydrophobicContact CD1-CG2 4.31Å; L351-V354 HydrophobicContact CD2-CG2 4.46Å; L351-V354 HydrophobicContact CG-CG2 4.47Å; L351-V354 PolarHBondContact O-N 3.43Å |
| 352 | P | 65.2 | Low | 66.7 | Low | 118 Ų | 118 | 63.2 Ų | 63.2 | 77% | 0.766 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | 109.1 | 173.9 | 24.8 | -32.9 | 0 | 0 | 0 | 109.2 | ||
| 353 | G | 59.5 | Low | 64.8 | Low | 49 Ų | 49 | 63 Ų | 63 | 51% | 0.505 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 120.7 | -25.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | L351 | L351-G353 PolarHBondContact O-N 3.38Š|
| 354 | V | 57.7 | Low | 62.8 | Low | 72 Ų | 72 | 66.9 Ų | 66.9 | 44% | 0.436 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -78.9 | -29.4 | -179.3 | 176 | 0 | 0 | 0 | 0 | 112.2 | L351 D356 A357 A358 | L351-V354 HydrophobicContact CB-CB 3.98Å; L351-V354 HydrophobicContact CB-CG2 3.92Å; L351-V354 HydrophobicContact CD1-CB 4.43Å; L351-V354 HydrophobicContact CD1-CG2 4.31Å; L351-V354 HydrophobicContact CD2-CG2 4.46Å; L351-V354 HydrophobicContact CG-CG2 4.47Å; L351-V354 PolarHBondContact O-N 3.43Å; V354-D356 PolarHBondContact O-N 2.89Å; V354-A357 PolarHBondContact O-N 3Å; V354-A358 WeakPolarHBondContact O-CB 3.3Å; V354-A358 PolarHBondContact O-N 2.97Å |
| 355 | G | 50.3 | Low | 60.6 | Low | 20 Ų | 20 | 67.1 Ų | 67.1 | 21% | 0.206 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -61 | -32.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | A359 | G355-A359 WeakPolarHBondContact O-CB 3.39Å; G355-A359 PolarHBondContact O-N 3.48Å |
| 356 | D | 51.1 | Low | 58.3 | Low | 116 Ų | 116 | 64.3 Ų | 64.3 | 62% | 0.62 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -82.2 | -37.4 | -179.8 | -60.1 | -34.6 | 0 | 0 | 0 | 111.3 | V354 A359 A360 | V354-D356 PolarHBondContact O-N 2.89Å; D356-A359 PolarHBondContact O-N 3.2Å; D356-A360 VanDerWaalsContact O-CB 3.28Å; D356-A360 WeakPolarHBondContact O-CB 3.2Å; D356-A360 PolarHBondContact O-N 3.1Å |
| 357 | A | 48 | Very low | 55.8 | Low | 64 Ų | 64 | 69.8 Ų | 69.8 | 53% | 0.529 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -68.9 | -43.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V354 A360 A361 | V354-A357 PolarHBondContact O-N 3Å; A357-A360 PolarHBondContact O-N 2.75Å; A357-A361 WeakPolarHBondContact O-CB 3.48Å; A357-A361 PolarHBondContact O-N 3.48Å |
| 358 | A | 45.5 | Very low | 53.5 | Low | 36 Ų | 36 | 74 Ų | 74 | 30% | 0.298 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.6 | -43.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | W338 V354 A360 A361 V362 | W338-A358 HydrophobicContact CH2-CB 4.07Å; W338-A358 WeakPolarHBondContact CH2-O 3.45Å; W338-A358 HydrophobicContact CZ3-CB 3.91Å; V354-A358 WeakPolarHBondContact O-CB 3.3Å; V354-A358 PolarHBondContact O-N 2.97Å; A358-A360 VanDerWaalsContact C-N 3.29Å; A358-A360 PolarHBondContact O-N 2.97Å; A358-A361 PolarHBondContact O-N 3.45Å; A358-V362 PolarHBondContact O-N 3.45Å |
| 359 | A | 46.5 | Very low | 51.3 | Low | 39 Ų | 39 | 73.2 Ų | 73.2 | 32% | 0.322 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.8 | -38.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | W338 G355 D356 A363 | W338-A359 HydrophobicContact CH2-CB 4.47Å; G355-A359 WeakPolarHBondContact O-CB 3.39Å; G355-A359 PolarHBondContact O-N 3.48Å; D356-A359 PolarHBondContact O-N 3.2Å; A359-A363 VanDerWaalsContact O-CB 3.24Å; A359-A363 WeakPolarHBondContact O-CB 3.35Å; A359-A363 PolarHBondContact O-N 2.83Å |
| 360 | A | 43.9 | Very low | 49.2 | Very low | 58 Ų | 58 | 76 Ų | 76 | 48% | 0.479 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.8 | -41 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | D356 A357 A358 A363 A364 | D356-A360 VanDerWaalsContact O-CB 3.28Å; D356-A360 WeakPolarHBondContact O-CB 3.2Å; D356-A360 PolarHBondContact O-N 3.1Å; A357-A360 PolarHBondContact O-N 2.75Å; A358-A360 VanDerWaalsContact C-N 3.29Å; A358-A360 PolarHBondContact O-N 2.97Å; A360-A363 PolarHBondContact O-N 3.34Å; A360-A364 VanDerWaalsContact O-CB 3.31Å; A360-A364 WeakPolarHBondContact O-CB 3.38Å; A360-A364 PolarHBondContact O-N 3.36Å |
| 361 | A | 42.9 | Very low | 46.9 | Very low | 57 Ų | 57 | 78.2 Ų | 78.2 | 47% | 0.471 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.1 | -42.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | A357 A358 A364 T365 | A357-A361 WeakPolarHBondContact O-CB 3.48Å; A357-A361 PolarHBondContact O-N 3.48Å; A358-A361 PolarHBondContact O-N 3.45Å; A361-A364 PolarHBondContact O-N 3.13Å; A361-T365 PolarHBondContact O-N 3.05Å; A361-T365 PolarHBondContact O-OG1 3.21Å |
| 362 | V | 46.5 | Very low | 44.6 | Very low | 58 Ų | 58 | 83.7 Ų | 83.7 | 35% | 0.352 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -69.6 | -36.4 | 175.6 | 173.9 | 0 | 0 | 0 | 0 | 111.6 | W338 A358 A364 T365 A366 | W338-V362 HydrophobicContact CD2-CG2 4.15Å; W338-V362 HydrophobicContact CE3-CG2 4.01Å; W338-V362 HydrophobicContact CH2-CB 3.68Å; W338-V362 HydrophobicContact CH2-CG1 4.44Å; W338-V362 HydrophobicContact CH2-CG2 3.28Å; W338-V362 HydrophobicContact CZ2-CB 3.35Å; W338-V362 HydrophobicContact CZ2-CG1 3.69Å; W338-V362 HydrophobicContact CZ2-CG2 3.39Å; W338-V362 HydrophobicContact CZ3-CB 4.44Å; W338-V362 HydrophobicContact CZ3-CG2 3.57Å; A358-V362 PolarHBondContact O-N 3.45Å; V362-A364 VanDerWaalsContact C-N 3.33Å; V362-T365 WeakPolarHBondContact CA-OG1 3.4Å; V362-T365 PolarHBondContact O-N 2.97Å; V362-T365 PolarHBondContact O-OG1 3.26Å; V362-A366 PolarHBondContact O-N 2.86Å; V362-A366 VanDerWaalsContact O-N 3.13Å |
| 363 | A | 42.5 | Very low | 43.3 | Very low | 67 Ų | 67 | 82.1 Ų | 82.1 | 55% | 0.554 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.3 | -34.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A359 A360 A366 | A359-A363 VanDerWaalsContact O-CB 3.24Å; A359-A363 WeakPolarHBondContact O-CB 3.35Å; A359-A363 PolarHBondContact O-N 2.83Å; A360-A363 PolarHBondContact O-N 3.34Å; A363-A366 PolarHBondContact O-N 3.42Å |
| 364 | A | 40.5 | Very low | 42.3 | Very low | 83 Ų | 83 | 88.9 Ų | 88.9 | 69% | 0.686 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -71.6 | -29.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | A360 A361 V362 | A360-A364 VanDerWaalsContact O-CB 3.31Å; A360-A364 WeakPolarHBondContact O-CB 3.38Å; A360-A364 PolarHBondContact O-N 3.36Å; A361-A364 PolarHBondContact O-N 3.13Å; V362-A364 VanDerWaalsContact C-N 3.33Å |
| 365 | T | 38.5 | Very low | 41.3 | Very low | 112 Ų | 112 | 93.2 Ų | 93.2 | 69% | 0.687 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -81.5 | -14.7 | 172.9 | 56.3 | 0 | 0 | 0 | 0 | 114.1 | A361 V362 V367 | A361-T365 PolarHBondContact O-N 3.05Å; A361-T365 PolarHBondContact O-OG1 3.21Å; V362-T365 WeakPolarHBondContact CA-OG1 3.4Å; V362-T365 PolarHBondContact O-N 2.97Å; V362-T365 PolarHBondContact O-OG1 3.26Å; T365-V367 PolarHBondContact O-N 3.05Å |
| 366 | A | 36.3 | Very low | 40.6 | Very low | 60 Ų | 60 | 95.4 Ų | 95.4 | 50% | 0.496 | 63% | 0.631 | S | S | . | * | S | Bend | trans | -77.5 | 106.5 | 169.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | V362 A363 P368 | V362-A366 PolarHBondContact O-N 2.86Å; V362-A366 VanDerWaalsContact O-N 3.13Å; A363-A366 PolarHBondContact O-N 3.42Å; A366-P368 VanDerWaalsContact O-N 3.13Å |
| 367 | V | 34.2 | Very low | 40 | Very low | 122 Ų | 122 | 95.9 Ų | 95.9 | 74% | 0.739 | 64% | 0.638 | S | S | * | * | trans | -41.3 | 122.5 | 172.3 | 176.3 | 0 | 0 | 0 | 0 | 108.9 | T365 A369 | T365-V367 PolarHBondContact O-N 3.05Å; V367-A369 PolarHBondContact O-N 3.24Å | ||
| 368 | P | 36.3 | Very low | 39.7 | Very low | 116 Ų | 116 | 104.8 Ų | 104.8 | 75% | 0.753 | 66% | 0.658 | S | S | * | * | trans | -72.6 | 82.1 | 177.1 | 28.6 | -31.1 | 0 | 0 | 0 | 108.1 | A366 V370 | A366-P368 VanDerWaalsContact O-N 3.13Å; P368-V370 PolarHBondContact O-N 3.23Å | ||
| 369 | A | 40.9 | Very low | 39.7 | Very low | 90 Ų | 90 | 107.5 Ų | 107.5 | 74% | 0.744 | 68% | 0.68 | S | S | * | * | trans | -78 | 41.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111.2 | V367 | V367-A369 PolarHBondContact O-N 3.24Š| ||
| 370 | V | 40.9 | Very low | 39.2 | Very low | 134 Ų | 134 | 110.8 Ų | 110.8 | 81% | 0.812 | 71% | 0.707 | S | S | * | * | trans | -156.2 | 76.4 | 167.8 | -168.8 | 0 | 0 | 0 | 0 | 109.5 | P368 | P368-V370 PolarHBondContact O-N 3.23Š| ||
| 371 | S | 35.3 | Very low | 38.5 | Very low | 102 Ų | 102 | 111.3 Ų | 111.3 | 71% | 0.713 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -158.6 | 36.7 | 155.6 | -166.1 | 0 | 0 | 0 | 0 | 113.2 | ||
| 372 | Q | 34.4 | Very low | 38.5 | Very low | 184 Ų | 184 | 116 Ų | 116 | 86% | 0.86 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -125.2 | -0.6 | 170.5 | -83.9 | -103.2 | -24.4 | 0 | 0 | 112.9 | ||
| 373 | A | 38.3 | Very low | 38.5 | Very low | 86 Ų | 86 | 122.3 Ų | 122.3 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -92.9 | -0.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 374 | Q | 38.7 | Very low | 38.2 | Very low | 190 Ų | 190 | 132.6 Ų | 132.6 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -110.7 | 3.9 | 179.1 | -78.5 | -166.1 | -52.1 | 0 | 0 | 115.1 | ||
| 375 | L | 36.8 | Very low | 38.1 | Very low | 164 Ų | 164 | 135.1 Ų | 135.1 | 86% | 0.859 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -107.7 | 1.8 | 175.2 | -90.7 | 142 | 0 | 0 | 0 | 113.9 | ||
| 376 | G | 34 | Very low | 38.1 | Very low | 65 Ų | 65 | 136.3 Ų | 136.3 | 67% | 0.67 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -107.2 | 0.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 377 | T | 38.7 | Very low | 38.2 | Very low | 126 Ų | 126 | 140.6 Ų | 140.6 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -120.8 | 30.6 | -175.1 | 48.5 | 0 | 0 | 0 | 0 | 114.1 | ||
| 378 | R | 42.3 | Very low | 38.4 | Very low | 252 Ų | 252 | 141.6 Ų | 141.6 | 95% | 0.951 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -125 | 20 | 173.6 | -116.3 | -174.8 | -170.7 | 174.9 | 3.2 | 116.1 | ||
| 379 | A | 45.2 | Very low | 38.6 | Very low | 92 Ų | 92 | 143.3 Ų | 143.3 | 76% | 0.76 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -138.8 | 138.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 380 | A | 35.1 | Very low | 38.4 | Very low | 108 Ų | 108 | 146.8 Ų | 146.8 | 89% | 0.893 | 82% | 0.819 | S | S | * | * | S | Bend | trans | 82.5 | 88.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||
| 381 | G | 31.1 | Very low | 38.2 | Very low | 70 Ų | 70 | 147.7 Ų | 147.7 | 72% | 0.722 | 82% | 0.82 | S | S | * | * | trans | 114 | 122.5 | 132.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 382 | Q | 42.6 | Very low | 38.5 | Very low | 154 Ų | 154 | 151.2 Ų | 151.2 | 72% | 0.72 | 83% | 0.828 | S | S | * | * | cis | -152 | 158.1 | 2.9 | -76.2 | 146.1 | -43.1 | 0 | 0 | 103 | W384 | Q382-W384 VanDerWaalsContact C-N 3.35Å; Q382-W384 VanDerWaalsContact CB-C 3.49Å; Q382-W384 WeakPolarHBondContact CB-O 3.42Å; Q382-W384 WeakPolarHBondContact CG-O 3.01Å; Q382-W384 PolarHBondContact O-N 3.38Å; Q382-W384 PolarHBondContact OE1-O 3.36Å | ||
| 383 | H | 46.4 | Very low | 38.8 | Very low | 191 Ų | 191 | 148.5 Ų | 148.5 | 88% | 0.884 | 83% | 0.825 | S | S | * | * | trans | -85.2 | 104.5 | 141.8 | -90.2 | -68.7 | 0 | 0 | 0 | 104.6 | ||||
| 384 | W | 36.4 | Very low | 38.8 | Very low | 284 Ų | 284 | 154.2 Ų | 154.2 | 100% | 1.076 | 84% | 0.836 | S | S | * | * | trans | 95.5 | 0 | -175.5 | -53.6 | 102.7 | 0 | 0 | 0 | 117.2 | Q382 | Q382-W384 VanDerWaalsContact C-N 3.35Å; Q382-W384 VanDerWaalsContact CB-C 3.49Å; Q382-W384 WeakPolarHBondContact CB-O 3.42Å; Q382-W384 WeakPolarHBondContact CG-O 3.01Å; Q382-W384 PolarHBondContact O-N 3.38Å; Q382-W384 PolarHBondContact OE1-O 3.36Å |
Retrieved 384 of 384 residues in 1577.6 ms
(Link to these results)