| 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 | 65.9 | Low | 92 | Very high | 170 Ų | 170 | 92.9 Ų | 92.9 | 84% | 0.837 | 55% | 0.545 | S | S | * | . | 0 | 135 | 0 | -65.8 | 179.3 | 69 | 0 | 0 | 107.8 | L6 | M1-L6 HydrophobicContact CB-CD1 4.48Å; M1-L6 HydrophobicContact SD-CD1 4.11Å | |||
| 2 | T | 90.8 | Very high | 92.4 | Very high | 106 Ų | 106 | 96.1 Ų | 96.1 | 65% | 0.65 | 55% | 0.547 | S | S | * | . | trans | -60.2 | 144.9 | 172.3 | 52.8 | 0 | 0 | 0 | 0 | 109.1 | L4 A5 L6 | T2-L4 PolarHBondContact O-N 3.39Å; T2-L4 VanDerWaalsContact O-N 3.15Å; T2-A5 PolarHBondContact O-N 3.13Å; T2-A5 VanDerWaalsContact OG1-CB 3.26Å; T2-A5 WeakPolarHBondContact OG1-CB 3.5Å; T2-L6 PolarHBondContact O-N 2.97Å | ||
| 3 | G | 93.6 | Very high | 92.7 | Very high | 64 Ų | 64 | 96.1 Ų | 96.1 | 66% | 0.66 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -55.4 | -35 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | L6 L7 | G3-L6 PolarHBondContact O-N 3.45Å; G3-L7 PolarHBondContact O-N 3.04Å; G3-L7 VanDerWaalsContact O-N 3.17Å |
| 4 | L | 94.1 | Very high | 93.1 | Very high | 108 Ų | 108 | 92.9 Ų | 92.9 | 57% | 0.565 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.4 | -42.3 | 176.3 | -142.9 | 81.1 | 0 | 0 | 0 | 112.7 | T2 L6 L7 Y8 | T2-L4 PolarHBondContact O-N 3.39Å; T2-L4 VanDerWaalsContact O-N 3.15Å; L4-L6 VanDerWaalsContact C-N 3.3Å; L4-L6 PolarHBondContact O-N 3.31Å; L4-L7 WeakPolarHBondContact O-CB 3.26Å; L4-L7 PolarHBondContact O-N 3.15Å; L4-Y8 HydrophobicContact CB-CE2 4.4Å; L4-Y8 HydrophobicContact CD2-CE2 3.62Å; L4-Y8 HydrophobicContact CG-CD2 4.41Å; L4-Y8 HydrophobicContact CG-CE2 3.64Å; L4-Y8 WeakPolarHBondContact O-CD2 3.37Å; L4-Y8 PolarHBondContact O-N 2.89Å; L4-Y8 VanDerWaalsContact O-N 3.09Å |
| 5 | A | 94.6 | Very high | 93.3 | Very high | 40 Ų | 40 | 95.7 Ų | 95.7 | 33% | 0.331 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.3 | -36.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T2 S9 | T2-A5 PolarHBondContact O-N 3.13Å; T2-A5 VanDerWaalsContact OG1-CB 3.26Å; T2-A5 WeakPolarHBondContact OG1-CB 3.5Å; A5-S9 WeakPolarHBondContact O-CB 3.35Å; A5-S9 PolarHBondContact O-N 3.36Å; A5-S9 PolarHBondContact O-OG 3.44Å; A5-S9 VanDerWaalsContact O-OG 3.09Å |
| 6 | L | 94.3 | Very high | 93.6 | Very high | 102 Ų | 102 | 98.9 Ų | 98.9 | 53% | 0.534 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 173.4 | -166.6 | 98.6 | 0 | 0 | 0 | 110.8 | M1 T2 G3 L4 S9 G10 | M1-L6 HydrophobicContact CB-CD1 4.48Å; M1-L6 HydrophobicContact SD-CD1 4.11Å; T2-L6 PolarHBondContact O-N 2.97Å; G3-L6 PolarHBondContact O-N 3.45Å; L4-L6 VanDerWaalsContact C-N 3.3Å; L4-L6 PolarHBondContact O-N 3.31Å; L6-S9 WeakPolarHBondContact CA-OG 3.37Å; L6-S9 PolarHBondContact O-N 3.06Å; L6-S9 PolarHBondContact O-OG 3.28Å; L6-G10 PolarHBondContact O-N 2.84Å |
| 7 | L | 95.2 | Very high | 93.8 | Very high | 103 Ų | 103 | 96.4 Ų | 96.4 | 54% | 0.539 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -58.1 | -52 | 177.5 | -179.3 | 68 | 0 | 0 | 0 | 112 | G3 L4 S9 G10 V11 | G3-L7 PolarHBondContact O-N 3.04Å; G3-L7 VanDerWaalsContact O-N 3.17Å; L4-L7 WeakPolarHBondContact O-CB 3.26Å; L4-L7 PolarHBondContact O-N 3.15Å; L7-S9 VanDerWaalsContact C-N 3.34Å; L7-S9 PolarHBondContact O-N 3.19Å; L7-G10 PolarHBondContact O-N 3.29Å; L7-V11 HydrophobicContact CD1-CG2 4.31Å; L7-V11 WeakPolarHBondContact O-CG2 3.33Å; L7-V11 PolarHBondContact O-N 2.79Å |
| 8 | Y | 95.5 | Very high | 94 | Very high | 152 Ų | 152 | 95.6 Ų | 95.6 | 60% | 0.596 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62.3 | -41.4 | 179.5 | -63.7 | -54.3 | 0 | 0 | 0 | 112.4 | L4 F12 | L4-Y8 HydrophobicContact CB-CE2 4.4Å; L4-Y8 HydrophobicContact CD2-CE2 3.62Å; L4-Y8 HydrophobicContact CG-CD2 4.41Å; L4-Y8 HydrophobicContact CG-CE2 3.64Å; L4-Y8 WeakPolarHBondContact O-CD2 3.37Å; L4-Y8 PolarHBondContact O-N 2.89Å; L4-Y8 VanDerWaalsContact O-N 3.09Å; Y8-F12 VanDerWaalsContact O-CB 3.31Å; Y8-F12 WeakPolarHBondContact O-CB 3.49Å; Y8-F12 PolarHBondContact O-N 3.09Å |
| 9 | S | 94.8 | Very high | 94.1 | Very high | 46 Ų | 46 | 92.8 Ų | 92.8 | 32% | 0.322 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.9 | -41 | 176.7 | 68 | 0 | 0 | 0 | 0 | 112.2 | A5 L6 L7 F12 V13 | A5-S9 WeakPolarHBondContact O-CB 3.35Å; A5-S9 PolarHBondContact O-N 3.36Å; A5-S9 PolarHBondContact O-OG 3.44Å; A5-S9 VanDerWaalsContact O-OG 3.09Å; L6-S9 WeakPolarHBondContact CA-OG 3.37Å; L6-S9 PolarHBondContact O-N 3.06Å; L6-S9 PolarHBondContact O-OG 3.28Å; L7-S9 VanDerWaalsContact C-N 3.34Å; L7-S9 PolarHBondContact O-N 3.19Å; S9-F12 PolarHBondContact O-N 2.98Å; S9-V13 VanDerWaalsContact O-CG2 3.31Å; S9-V13 WeakPolarHBondContact O-CG2 3.47Å; S9-V13 PolarHBondContact O-N 2.66Å |
| 10 | G | 96.1 | Very high | 94.2 | Very high | 39 Ų | 39 | 94 Ų | 94 | 40% | 0.402 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.5 | -46.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L6 L7 F12 V13 A14 | L6-G10 PolarHBondContact O-N 2.84Å; L7-G10 PolarHBondContact O-N 3.29Å; G10-F12 PolarHBondContact O-N 3.13Å; G10-V13 PolarHBondContact O-N 3.45Å; G10-A14 VanDerWaalsContact O-CB 3.28Å; G10-A14 WeakPolarHBondContact O-CB 3.32Å; G10-A14 PolarHBondContact O-N 3.46Å |
| 11 | V | 96.9 | Very high | 94.3 | Very high | 92 Ų | 92 | 92 Ų | 92 | 56% | 0.558 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.5 | -43 | 177.2 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | L7 A14 F15 | L7-V11 HydrophobicContact CD1-CG2 4.31Å; L7-V11 WeakPolarHBondContact O-CG2 3.33Å; L7-V11 PolarHBondContact O-N 2.79Å; V11-A14 PolarHBondContact O-N 3.31Å; V11-F15 WeakPolarHBondContact O-CB 3.43Å; V11-F15 PolarHBondContact O-N 3.01Å |
| 12 | F | 96.8 | Very high | 95.7 | Very high | 131 Ų | 131 | 87.6 Ų | 87.6 | 58% | 0.575 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.9 | -48.5 | 178.5 | -177.7 | -96.2 | 0 | 0 | 0 | 111.9 | Y8 S9 G10 F15 W16 | Y8-F12 VanDerWaalsContact O-CB 3.31Å; Y8-F12 WeakPolarHBondContact O-CB 3.49Å; Y8-F12 PolarHBondContact O-N 3.09Å; S9-F12 PolarHBondContact O-N 2.98Å; G10-F12 PolarHBondContact O-N 3.13Å; F12-F15 PolarHBondContact O-N 3.2Å; F12-W16 AromaticContact CD1-CD1 3.85Å; F12-W16 AromaticContact CD2-CD1 3.88Å; F12-W16 AromaticContact CD2-NE1 3.74Å; F12-W16 AromaticContact CE1-CD1 3.56Å; F12-W16 AromaticContact CE1-NE1 3.79Å; F12-W16 AromaticContact CE2-CD1 3.61Å; F12-W16 AromaticContact CE2-NE1 3.11Å; F12-W16 AromaticContact CZ-CD1 3.44Å; F12-W16 VanDerWaalsContact CZ-CD1 3.44Å; F12-W16 AromaticContact CZ-NE1 3.14Å; F12-W16 VanDerWaalsContact O-CD1 3.23Å; F12-W16 PolarHBondContact O-N 3.18Å; F12-W16 VanDerWaalsContact O-N 3.14Å |
| 13 | V | 97.3 | Very high | 95.8 | Very high | 96 Ų | 96 | 84.3 Ų | 84.3 | 58% | 0.582 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.6 | -43.1 | 178.8 | 173 | 0 | 0 | 0 | 0 | 111.2 | S9 G10 F15 W16 A17 | S9-V13 VanDerWaalsContact O-CG2 3.31Å; S9-V13 WeakPolarHBondContact O-CG2 3.47Å; S9-V13 PolarHBondContact O-N 2.66Å; G10-V13 PolarHBondContact O-N 3.45Å; V13-F15 PolarHBondContact O-N 3.15Å; V13-W16 PolarHBondContact O-N 3.32Å; V13-A17 VanDerWaalsContact O-CB 3.26Å; V13-A17 WeakPolarHBondContact O-CB 3.3Å; V13-A17 PolarHBondContact O-N 2.93Å |
| 14 | A | 97.1 | Very high | 95.9 | Very high | 52 Ų | 52 | 85.1 Ų | 85.1 | 43% | 0.43 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | G10 V11 A17 C18 | G10-A14 VanDerWaalsContact O-CB 3.28Å; G10-A14 WeakPolarHBondContact O-CB 3.32Å; G10-A14 PolarHBondContact O-N 3.46Å; V11-A14 PolarHBondContact O-N 3.31Å; A14-A17 PolarHBondContact O-N 3.32Å; A14-C18 WeakPolarHBondContact O-CB 3.25Å; A14-C18 PolarHBondContact O-N 2.86Å; A14-C18 PolarHBondContact O-SG 2.88Å; A14-C18 VanDerWaalsContact O-SG 3.34Å |
| 15 | F | 97.4 | Very high | 95.9 | Very high | 134 Ų | 134 | 82.8 Ų | 82.8 | 59% | 0.588 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.4 | -50 | 177.1 | 174.2 | -100.2 | 0 | 0 | 0 | 111.8 | V11 F12 V13 C18 A19 | V11-F15 WeakPolarHBondContact O-CB 3.43Å; V11-F15 PolarHBondContact O-N 3.01Å; F12-F15 PolarHBondContact O-N 3.2Å; V13-F15 PolarHBondContact O-N 3.15Å; F15-C18 PolarHBondContact O-N 3.26Å; F15-A19 WeakPolarHBondContact O-CB 3.37Å; F15-A19 PolarHBondContact O-N 3.18Å |
| 16 | W | 97.3 | Very high | 95.8 | Very high | 147 Ų | 147 | 84.7 Ų | 84.7 | 56% | 0.557 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -69.3 | -36.7 | -179 | -77.8 | 110.3 | 0 | 0 | 0 | 113.4 | F12 V13 A19 L20 | F12-W16 AromaticContact CD1-CD1 3.85Å; F12-W16 AromaticContact CD2-CD1 3.88Å; F12-W16 AromaticContact CD2-NE1 3.74Å; F12-W16 AromaticContact CE1-CD1 3.56Å; F12-W16 AromaticContact CE1-NE1 3.79Å; F12-W16 AromaticContact CE2-CD1 3.61Å; F12-W16 AromaticContact CE2-NE1 3.11Å; F12-W16 AromaticContact CZ-CD1 3.44Å; F12-W16 VanDerWaalsContact CZ-CD1 3.44Å; F12-W16 AromaticContact CZ-NE1 3.14Å; F12-W16 VanDerWaalsContact O-CD1 3.23Å; F12-W16 PolarHBondContact O-N 3.18Å; F12-W16 VanDerWaalsContact O-N 3.14Å; V13-W16 PolarHBondContact O-N 3.32Å; W16-A19 PolarHBondContact O-N 2.94Å; W16-L20 VanDerWaalsContact O-CB 3.32Å; W16-L20 WeakPolarHBondContact O-CB 3.25Å; W16-L20 PolarHBondContact O-N 3.43Å |
| 17 | A | 97.2 | Very high | 95.7 | Very high | 57 Ų | 57 | 84.8 Ų | 84.8 | 47% | 0.471 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63 | -45.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | V13 A14 L20 A21 | V13-A17 VanDerWaalsContact O-CB 3.26Å; V13-A17 WeakPolarHBondContact O-CB 3.3Å; V13-A17 PolarHBondContact O-N 2.93Å; A14-A17 PolarHBondContact O-N 3.32Å; A17-L20 PolarHBondContact O-N 3.17Å; A17-A21 WeakPolarHBondContact O-CB 3.42Å; A17-A21 PolarHBondContact O-N 2.97Å |
| 18 | C | 96.9 | Very high | 95.7 | Very high | 82 Ų | 82 | 85.4 Ų | 85.4 | 55% | 0.554 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.6 | -45 | 174.7 | -72.9 | 0 | 0 | 0 | 0 | 111.9 | A14 F15 L20 A21 V22 | A14-C18 WeakPolarHBondContact O-CB 3.25Å; A14-C18 PolarHBondContact O-N 2.86Å; A14-C18 PolarHBondContact O-SG 2.88Å; A14-C18 VanDerWaalsContact O-SG 3.34Å; F15-C18 PolarHBondContact O-N 3.26Å; C18-L20 VanDerWaalsContact C-N 3.33Å; C18-L20 PolarHBondContact O-N 3.23Å; C18-A21 PolarHBondContact O-N 3.43Å; C18-V22 WeakPolarHBondContact O-CB 3.46Å; C18-V22 VanDerWaalsContact O-CG2 3.27Å; C18-V22 WeakPolarHBondContact O-CG2 3.44Å; C18-V22 PolarHBondContact O-N 3.48Å |
| 19 | A | 95.9 | Very high | 95.7 | Very high | 42 Ų | 42 | 85 Ų | 85 | 35% | 0.347 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -41.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | F15 W16 G23 | F15-A19 WeakPolarHBondContact O-CB 3.37Å; F15-A19 PolarHBondContact O-N 3.18Å; W16-A19 PolarHBondContact O-N 2.94Å; A19-G23 PolarHBondContact O-N 3.02Å |
| 20 | L | 96.1 | Very high | 95.4 | Very high | 117 Ų | 117 | 89.4 Ų | 89.4 | 61% | 0.613 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.3 | -47.3 | 175.6 | -178 | 67.7 | 0 | 0 | 0 | 111.4 | W16 A17 C18 V22 G23 I24 | W16-L20 VanDerWaalsContact O-CB 3.32Å; W16-L20 WeakPolarHBondContact O-CB 3.25Å; W16-L20 PolarHBondContact O-N 3.43Å; A17-L20 PolarHBondContact O-N 3.17Å; C18-L20 VanDerWaalsContact C-N 3.33Å; C18-L20 PolarHBondContact O-N 3.23Å; L20-V22 PolarHBondContact O-N 3.36Å; L20-G23 PolarHBondContact O-N 3.13Å; L20-I24 HydrophobicContact CD1-CD1 4.12Å; L20-I24 HydrophobicContact CD1-CG1 4.47Å; L20-I24 HydrophobicContact CG-CD1 3.92Å; L20-I24 VanDerWaalsContact O-CG1 3.28Å; L20-I24 WeakPolarHBondContact O-CG1 3.42Å; L20-I24 PolarHBondContact O-N 3.33Å |
| 21 | A | 96.1 | Very high | 95.2 | Very high | 52 Ų | 52 | 90.4 Ų | 90.4 | 43% | 0.43 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.3 | -45.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | A17 C18 I24 C25 | A17-A21 WeakPolarHBondContact O-CB 3.42Å; A17-A21 PolarHBondContact O-N 2.97Å; C18-A21 PolarHBondContact O-N 3.43Å; A21-I24 PolarHBondContact O-N 3.09Å; A21-C25 WeakPolarHBondContact O-CB 3.11Å; A21-C25 PolarHBondContact O-N 2.92Å; A21-C25 PolarHBondContact O-SG 3.45Å |
| 22 | V | 95.6 | Very high | 94.8 | Very high | 78 Ų | 78 | 87.9 Ų | 87.9 | 47% | 0.473 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.3 | -46.2 | 176.3 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | C18 L20 I24 C25 Y26 | C18-V22 WeakPolarHBondContact O-CB 3.46Å; C18-V22 VanDerWaalsContact O-CG2 3.27Å; C18-V22 WeakPolarHBondContact O-CG2 3.44Å; C18-V22 PolarHBondContact O-N 3.48Å; L20-V22 PolarHBondContact O-N 3.36Å; V22-I24 PolarHBondContact O-N 2.97Å; V22-C25 PolarHBondContact O-N 2.92Å; V22-Y26 HydrophobicContact CG1-CD2 3.58Å; V22-Y26 HydrophobicContact CG1-CE2 3.53Å; V22-Y26 VanDerWaalsContact O-CD2 3.3Å; V22-Y26 WeakPolarHBondContact O-CD2 3.39Å; V22-Y26 PolarHBondContact O-N 3.35Å |
| 23 | G | 93.8 | Very high | 94.4 | Very high | 37 Ų | 37 | 89.2 Ų | 89.2 | 38% | 0.381 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.9 | -45.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A19 L20 Y26 T27 | A19-G23 PolarHBondContact O-N 3.02Å; L20-G23 PolarHBondContact O-N 3.13Å; G23-Y26 PolarHBondContact O-N 3.42Å; G23-T27 PolarHBondContact O-N 3.01Å |
| 24 | I | 94.4 | Very high | 94.1 | Very high | 80 Ų | 80 | 92.4 Ų | 92.4 | 41% | 0.41 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 176.1 | -66.9 | 166.5 | 0 | 0 | 0 | 110.7 | L20 A21 V22 Y26 T27 I28 | L20-I24 HydrophobicContact CD1-CD1 4.12Å; L20-I24 HydrophobicContact CD1-CG1 4.47Å; L20-I24 HydrophobicContact CG-CD1 3.92Å; L20-I24 VanDerWaalsContact O-CG1 3.28Å; L20-I24 WeakPolarHBondContact O-CG1 3.42Å; L20-I24 PolarHBondContact O-N 3.33Å; A21-I24 PolarHBondContact O-N 3.09Å; V22-I24 PolarHBondContact O-N 2.97Å; I24-Y26 PolarHBondContact O-N 3.48Å; I24-T27 PolarHBondContact O-N 3.07Å; I24-T27 VanDerWaalsContact O-N 3.11Å; I24-T27 PolarHBondContact O-OG1 3.22Å; I24-I28 HydrophobicContact CG2-CD1 3.5Å; I24-I28 VanDerWaalsContact CG2-CD1 3.5Å; I24-I28 HydrophobicContact CG2-CG1 4.17Å; I24-I28 WeakPolarHBondContact O-CG1 3.32Å; I24-I28 PolarHBondContact O-N 3.14Å |
| 25 | C | 93.9 | Very high | 93.8 | Very high | 60 Ų | 60 | 97.1 Ų | 97.1 | 41% | 0.405 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -58 | -45.1 | 177.1 | -72.7 | 0 | 0 | 0 | 0 | 112.2 | A21 V22 T27 I28 F29 | A21-C25 WeakPolarHBondContact O-CB 3.11Å; A21-C25 PolarHBondContact O-N 2.92Å; A21-C25 PolarHBondContact O-SG 3.45Å; V22-C25 PolarHBondContact O-N 2.92Å; C25-T27 PolarHBondContact O-N 3.01Å; C25-I28 PolarHBondContact O-N 3.13Å; C25-F29 HydrophobicContact CB-CD2 4.11Å; C25-F29 HydrophobicContact CB-CE2 4.19Å; C25-F29 WeakPolarHBondContact O-CD2 3.19Å; C25-F29 PolarHBondContact O-N 2.96Å |
| 26 | Y | 93.3 | Very high | 93.6 | Very high | 80 Ų | 80 | 94.8 Ų | 94.8 | 31% | 0.314 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.2 | -33.9 | 177.1 | -89.8 | -76.4 | 0 | 0 | 0 | 112.8 | V22 G23 I24 L31 G32 R34 | V22-Y26 HydrophobicContact CG1-CD2 3.58Å; V22-Y26 HydrophobicContact CG1-CE2 3.53Å; V22-Y26 VanDerWaalsContact O-CD2 3.3Å; V22-Y26 WeakPolarHBondContact O-CD2 3.39Å; V22-Y26 PolarHBondContact O-N 3.35Å; G23-Y26 PolarHBondContact O-N 3.42Å; I24-Y26 PolarHBondContact O-N 3.48Å; Y26-L31 HydrophobicContact CD1-CB 3.93Å; Y26-L31 WeakPolarHBondContact CD1-O 3.49Å; Y26-L31 HydrophobicContact CE1-CB 4.28Å; Y26-L31 PolarHBondContact O-N 3.26Å; Y26-G32 PolarHBondContact O-N 3.42Å; Y26-R34 HydrophobicContact CE1-CB 4.18Å |
| 27 | T | 92.8 | Very high | 93.4 | Very high | 103 Ų | 103 | 91.4 Ų | 91.4 | 63% | 0.632 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -76.6 | -36.8 | 176.2 | 59.8 | 0 | 0 | 0 | 0 | 113.8 | G23 I24 C25 | G23-T27 PolarHBondContact O-N 3.01Å; I24-T27 PolarHBondContact O-N 3.07Å; I24-T27 VanDerWaalsContact O-N 3.11Å; I24-T27 PolarHBondContact O-OG1 3.22Å; C25-T27 PolarHBondContact O-N 3.01Å |
| 28 | I | 95 | Very high | 93.1 | Very high | 117 Ų | 117 | 91.5 Ų | 91.5 | 60% | 0.6 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -77.9 | -36.1 | -176.2 | -68.8 | 176.9 | 0 | 0 | 0 | 112.1 | I24 C25 D30 | I24-I28 HydrophobicContact CG2-CD1 3.5Å; I24-I28 VanDerWaalsContact CG2-CD1 3.5Å; I24-I28 HydrophobicContact CG2-CG1 4.17Å; I24-I28 WeakPolarHBondContact O-CG1 3.32Å; I24-I28 PolarHBondContact O-N 3.14Å; C25-I28 PolarHBondContact O-N 3.13Å; I28-D30 VanDerWaalsContact C-N 3.26Å; I28-D30 PolarHBondContact O-N 3.22Å |
| 29 | F | 94.4 | Very high | 92.9 | Very high | 142 Ų | 142 | 94.9 Ų | 94.9 | 62% | 0.623 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | 8 | -176.7 | -69.3 | -69.3 | 0 | 0 | 0 | 113.8 | C25 L31 | C25-F29 HydrophobicContact CB-CD2 4.11Å; C25-F29 HydrophobicContact CB-CE2 4.19Å; C25-F29 WeakPolarHBondContact O-CD2 3.19Å; C25-F29 PolarHBondContact O-N 2.96Å; F29-L31 HydrophobicContact CB-CD1 3.44Å; F29-L31 VanDerWaalsContact CB-CD1 3.44Å; F29-L31 VanDerWaalsContact O-CD1 3.29Å; F29-L31 WeakPolarHBondContact O-CD1 3.34Å; F29-L31 PolarHBondContact O-N 2.93Å; F29-L31 VanDerWaalsContact O-N 3.12Å |
| 30 | D | 89.4 | Confident | 92.7 | Very high | 139 Ų | 139 | 97.9 Ų | 97.9 | 74% | 0.743 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.2 | 19.5 | -173.9 | -72.9 | -45.8 | 0 | 0 | 0 | 114.4 | I28 G32 F33 | I28-D30 VanDerWaalsContact C-N 3.26Å; I28-D30 PolarHBondContact O-N 3.22Å; D30-G32 PolarHBondContact O-N 3.38Å; D30-F33 WeakPolarHBondContact O-CD1 3.41Å |
| 31 | L | 92.5 | Very high | 92.5 | Very high | 60 Ų | 60 | 95.2 Ų | 95.2 | 31% | 0.314 | 50% | 0.498 | S | S | . | . | G | 310 helix | trans | -85.8 | 13.3 | 172.3 | -75.2 | 100.3 | 0 | 0 | 0 | 113.2 | Y26 F29 F33 R34 | Y26-L31 HydrophobicContact CD1-CB 3.93Å; Y26-L31 WeakPolarHBondContact CD1-O 3.49Å; Y26-L31 HydrophobicContact CE1-CB 4.28Å; Y26-L31 PolarHBondContact O-N 3.26Å; F29-L31 HydrophobicContact CB-CD1 3.44Å; F29-L31 VanDerWaalsContact CB-CD1 3.44Å; F29-L31 VanDerWaalsContact O-CD1 3.29Å; F29-L31 WeakPolarHBondContact O-CD1 3.34Å; F29-L31 PolarHBondContact O-N 2.93Å; F29-L31 VanDerWaalsContact O-N 3.12Å; L31-F33 PolarHBondContact O-N 3.49Å; L31-F33 VanDerWaalsContact O-N 3.11Å; L31-R34 WeakPolarHBondContact O-CB 3.26Å; L31-R34 PolarHBondContact O-N 3.45Å |
| 32 | G | 87.3 | Confident | 92.2 | Very high | 39 Ų | 39 | 95.2 Ų | 95.2 | 40% | 0.402 | 49% | 0.493 | S | S | . | . | G | 310 helix | trans | -55.9 | -29.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y26 D30 R34 F35 | Y26-G32 PolarHBondContact O-N 3.42Å; D30-G32 PolarHBondContact O-N 3.38Å; G32-R34 PolarHBondContact O-N 2.91Å; G32-R34 VanDerWaalsContact O-N 3.12Å; G32-F35 PolarHBondContact O-N 3.43Å |
| 33 | F | 89.2 | Confident | 91.9 | Very high | 159 Ų | 159 | 97.1 Ų | 97.1 | 70% | 0.697 | 50% | 0.497 | S | S | * | . | G | 310 helix | trans | -61.3 | -19.2 | 175.9 | 71.2 | -90.6 | 0 | 0 | 0 | 114.2 | D30 L31 | D30-F33 WeakPolarHBondContact O-CD1 3.41Å; L31-F33 PolarHBondContact O-N 3.49Å; L31-F33 VanDerWaalsContact O-N 3.11Å |
| 34 | R | 90.7 | Very high | 91.7 | Very high | 164 Ų | 164 | 96.4 Ų | 96.4 | 62% | 0.619 | 49% | 0.485 | S | S | * | . | G | 310 helix | trans | -82.2 | -18.6 | 176.2 | -62.8 | -175.2 | 67.9 | -178.5 | 2.5 | 112.9 | Y26 L31 G32 D36 | Y26-R34 HydrophobicContact CE1-CB 4.18Å; L31-R34 WeakPolarHBondContact O-CB 3.26Å; L31-R34 PolarHBondContact O-N 3.45Å; G32-R34 PolarHBondContact O-N 2.91Å; G32-R34 VanDerWaalsContact O-N 3.12Å; R34-D36 VanDerWaalsContact C-N 3.31Å; R34-D36 PolarHBondContact O-N 3.04Å; R34-D36 VanDerWaalsContact O-N 3.15Å |
| 35 | F | 91.8 | Very high | 91.4 | Very high | 150 Ų | 150 | 95.3 Ų | 95.3 | 66% | 0.658 | 49% | 0.485 | S | S | * | . | trans | -86.7 | 75.4 | 176.3 | -167.8 | -95.2 | 0 | 0 | 0 | 109.3 | G32 V37 | G32-F35 PolarHBondContact O-N 3.43Å; F35-V37 HydrophobicContact CD1-CG2 4.26Å; F35-V37 HydrophobicContact CE1-CG2 3.76Å; F35-V37 HydrophobicContact CZ-CG2 4.49Å | ||
| 36 | D | 92.7 | Very high | 91.1 | Very high | 85 Ų | 85 | 92.8 Ų | 92.8 | 46% | 0.455 | 47% | 0.467 | S | S | . | . | trans | -100.8 | 101.3 | -177.6 | -170.1 | -4 | 0 | 0 | 0 | 111.6 | R34 A38 W39 F40 | R34-D36 VanDerWaalsContact C-N 3.31Å; R34-D36 PolarHBondContact O-N 3.04Å; R34-D36 VanDerWaalsContact O-N 3.15Å; D36-A38 VanDerWaalsContact C-N 3.29Å; D36-A38 WeakPolarHBondContact OD1-CA 3.31Å; D36-A38 WeakPolarHBondContact OD1-CB 3.31Å; D36-A38 PolarHBondContact OD1-N 3.49Å; D36-W39 HydrophobicContact CB-CB 3.92Å; D36-W39 PolarHBondContact OD1-N 3.45Å; D36-W39 VanDerWaalsContact OD1-N 3.12Å; D36-F40 PolarHBondContact O-N 3.45Å | ||
| 37 | V | 92.5 | Very high | 90.9 | Very high | 77 Ų | 77 | 92.3 Ų | 92.3 | 47% | 0.467 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.3 | -29.7 | 174.4 | -177.7 | 0 | 0 | 0 | 0 | 111.2 | F35 F40 L41 | F35-V37 HydrophobicContact CD1-CG2 4.26Å; F35-V37 HydrophobicContact CE1-CG2 3.76Å; F35-V37 HydrophobicContact CZ-CG2 4.49Å; V37-F40 PolarHBondContact O-N 3Å; V37-L41 HydrophobicContact CG1-CD1 4.06Å; V37-L41 HydrophobicContact CG1-CG 4.32Å; V37-L41 WeakPolarHBondContact O-CB 3.44Å; V37-L41 WeakPolarHBondContact O-CG 3.28Å; V37-L41 PolarHBondContact O-N 3.46Å |
| 38 | A | 91.8 | Very high | 90.9 | Very high | 58 Ų | 58 | 91.5 Ų | 91.5 | 48% | 0.479 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -66.2 | -46.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | D36 F40 L41 T42 | D36-A38 VanDerWaalsContact C-N 3.29Å; D36-A38 WeakPolarHBondContact OD1-CA 3.31Å; D36-A38 WeakPolarHBondContact OD1-CB 3.31Å; D36-A38 PolarHBondContact OD1-N 3.49Å; A38-F40 VanDerWaalsContact C-N 3.34Å; A38-F40 PolarHBondContact O-N 2.9Å; A38-L41 PolarHBondContact O-N 3.49Å; A38-T42 WeakPolarHBondContact O-CG2 3.32Å; A38-T42 PolarHBondContact O-N 3.32Å; A38-T42 PolarHBondContact O-OG1 2.95Å |
| 39 | W | 91.2 | Very high | 90.8 | Very high | 153 Ų | 153 | 87.9 Ų | 87.9 | 58% | 0.58 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -55.9 | -47.5 | 174.1 | -180 | 75.2 | 0 | 0 | 0 | 111.9 | D36 L41 T42 E43 | D36-W39 HydrophobicContact CB-CB 3.92Å; D36-W39 PolarHBondContact OD1-N 3.45Å; D36-W39 VanDerWaalsContact OD1-N 3.12Å; W39-L41 VanDerWaalsContact C-N 3.34Å; W39-L41 PolarHBondContact O-N 2.81Å; W39-T42 PolarHBondContact O-N 3.49Å; W39-T42 PolarHBondContact O-OG1 3.45Å; W39-E43 HydrophobicContact CD2-CB 4.44Å; W39-E43 HydrophobicContact CZ2-CB 4.31Å; W39-E43 HydrophobicContact CZ2-CG 3.88Å; W39-E43 PolarHBondContact NE1-OE2 3.1Å; W39-E43 WeakPolarHBondContact O-CB 3.44Å; W39-E43 PolarHBondContact O-N 3.45Å |
| 40 | F | 93.6 | Very high | 90.6 | Very high | 105 Ų | 105 | 81.3 Ų | 81.3 | 46% | 0.461 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -57.5 | -45.3 | 177.3 | 174.5 | -102.6 | 0 | 0 | 0 | 112.4 | D36 V37 A38 T44 W49 | D36-F40 PolarHBondContact O-N 3.45Å; V37-F40 PolarHBondContact O-N 3Å; A38-F40 VanDerWaalsContact C-N 3.34Å; A38-F40 PolarHBondContact O-N 2.9Å; F40-T44 WeakPolarHBondContact O-CB 3.28Å; F40-T44 PolarHBondContact O-N 2.96Å; F40-T44 PolarHBondContact O-OG1 2.77Å; F40-W49 HydrophobicContact CE1-CZ2 4.36Å |
| 41 | L | 91.6 | Very high | 90.8 | Very high | 61 Ų | 61 | 79.4 Ų | 79.4 | 32% | 0.319 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -71.1 | -35.7 | -178.4 | -74 | 178.2 | 0 | 0 | 0 | 113 | V37 A38 W39 W49 Y135 | V37-L41 HydrophobicContact CG1-CD1 4.06Å; V37-L41 HydrophobicContact CG1-CG 4.32Å; V37-L41 WeakPolarHBondContact O-CB 3.44Å; V37-L41 WeakPolarHBondContact O-CG 3.28Å; V37-L41 PolarHBondContact O-N 3.46Å; A38-L41 PolarHBondContact O-N 3.49Å; W39-L41 VanDerWaalsContact C-N 3.34Å; W39-L41 PolarHBondContact O-N 2.81Å; L41-W49 HydrophobicContact CD2-CZ2 4.48Å; L41-Y135 WeakPolarHBondContact CB-OH 3.48Å; L41-Y135 HydrophobicContact CD2-CE1 4.33Å; L41-Y135 PolarHBondContact O-OH 3.07Å |
| 42 | T | 88.9 | Confident | 91 | Very high | 53 Ų | 53 | 80.4 Ų | 80.4 | 33% | 0.325 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -83.7 | -35.7 | -178.8 | 56.5 | 0 | 0 | 0 | 0 | 113.5 | A38 W39 T44 Y131 | A38-T42 WeakPolarHBondContact O-CG2 3.32Å; A38-T42 PolarHBondContact O-N 3.32Å; A38-T42 PolarHBondContact O-OG1 2.95Å; W39-T42 PolarHBondContact O-N 3.49Å; W39-T42 PolarHBondContact O-OG1 3.45Å; T42-T44 VanDerWaalsContact C-N 3.34Å; T42-Y131 WeakPolarHBondContact O-CE1 3.41Å; T42-Y131 PolarHBondContact O-OH 2.98Å |
| 43 | E | 89.1 | Confident | 91.3 | Very high | 117 Ų | 117 | 78.5 Ų | 78.5 | 55% | 0.547 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -72.7 | -33.5 | 179.2 | -166.4 | 66.1 | -150.1 | 0 | 0 | 111 | W39 S45 | W39-E43 HydrophobicContact CD2-CB 4.44Å; W39-E43 HydrophobicContact CZ2-CB 4.31Å; W39-E43 HydrophobicContact CZ2-CG 3.88Å; W39-E43 PolarHBondContact NE1-OE2 3.1Å; W39-E43 WeakPolarHBondContact O-CB 3.44Å; W39-E43 PolarHBondContact O-N 3.45Å; E43-S45 PolarHBondContact O-N 3.28Å |
| 44 | T | 90.4 | Very high | 91.5 | Very high | 23 Ų | 23 | 72.1 Ų | 72.1 | 14% | 0.141 | 36% | 0.356 | C | S | . | . | S | Bend | trans | -68.8 | 126.6 | 176.2 | -60.5 | 0 | 0 | 0 | 0 | 110.8 | F40 T42 M48 W49 | F40-T44 WeakPolarHBondContact O-CB 3.28Å; F40-T44 PolarHBondContact O-N 2.96Å; F40-T44 PolarHBondContact O-OG1 2.77Å; T42-T44 VanDerWaalsContact C-N 3.34Å; T44-M48 HydrophobicContact CG2-CB 4.47Å; T44-M48 HydrophobicContact CG2-CE 3.16Å; T44-M48 HydrophobicContact CG2-SD 3.83Å; T44-W49 HydrophobicContact CG2-CZ2 4.42Å |
| 45 | S | 87.9 | Confident | 91.8 | Very high | 57 Ų | 57 | 66 Ų | 66 | 40% | 0.399 | 34% | 0.344 | S | S | . | . | trans | -64.7 | 137.5 | -176.3 | 70.8 | 0 | 0 | 0 | 0 | 112.7 | E43 F47 M48 | E43-S45 PolarHBondContact O-N 3.28Å; S45-F47 PolarHBondContact O-N 3.41Å; S45-M48 WeakPolarHBondContact O-CB 3.36Å; S45-M48 PolarHBondContact O-N 3.05Å; S45-M48 VanDerWaalsContact O-N 3.08Å | ||
| 46 | P | 87.1 | Confident | 92 | Very high | 6 Ų | 6 | 60.9 Ų | 60.9 | 4% | 0.039 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -57.7 | -28.5 | 173.8 | -27 | 34 | 0 | 0 | 0 | 114 | M48 W49 S50 F118 I126 Y131 | P46-M48 VanDerWaalsContact C-N 3.3Å; P46-M48 PolarHBondContact O-N 3.38Å; P46-W49 PolarHBondContact O-N 3.47Å; P46-S50 PolarHBondContact O-N 3.46Å; P46-F118 HydrophobicContact CB-CE1 4.42Å; P46-F118 HydrophobicContact CB-CZ 4.33Å; P46-F118 HydrophobicContact CG-CZ 3.99Å; P46-I126 HydrophobicContact CG-CG2 4.3Å; P46-Y131 HydrophobicContact CG-CD1 3.86Å; P46-Y131 HydrophobicContact CG-CE1 3.98Å; P46-Y131 HydrophobicContact CG-CG 4.45Å |
| 47 | F | 89.1 | Confident | 92.1 | Very high | 71 Ų | 71 | 56.9 Ų | 56.9 | 31% | 0.311 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63 | -35.1 | 175.9 | -66.5 | -63.3 | 0 | 0 | 0 | 112.8 | S45 W49 S50 N51 F118 | S45-F47 PolarHBondContact O-N 3.41Å; F47-W49 VanDerWaalsContact C-N 3.35Å; F47-S50 PolarHBondContact O-N 3.1Å; F47-N51 VanDerWaalsContact O-CB 3.3Å; F47-N51 WeakPolarHBondContact O-CB 3.43Å; F47-N51 VanDerWaalsContact O-CG 3.32Å; F47-N51 PolarHBondContact O-N 3.31Å; F47-N51 PolarHBondContact O-ND2 3.11Å; F47-N51 VanDerWaalsContact O-ND2 3.12Å; F47-F118 HydrophobicContact CD2-CE1 4.12Å; F47-F118 HydrophobicContact CD2-CZ 4.08Å; F47-F118 HydrophobicContact CE1-CD1 4.2Å; F47-F118 AromaticContact CE1-CE1 3.94Å; F47-F118 HydrophobicContact CE1-CE1 3.94Å; F47-F118 AromaticContact CE2-CD1 3.92Å; F47-F118 HydrophobicContact CE2-CD1 3.92Å; F47-F118 AromaticContact CE2-CE1 3.4Å; F47-F118 HydrophobicContact CE2-CE1 3.4Å; F47-F118 HydrophobicContact CE2-CE2 4.1Å; F47-F118 HydrophobicContact CE2-CG 4.46Å; F47-F118 AromaticContact CE2-CZ 3.5Å; F47-F118 HydrophobicContact CE2-CZ 3.5Å; F47-F118 VanDerWaalsContact CE2-CZ 3.5Å; F47-F118 AromaticContact CZ-CD1 3.45Å; F47-F118 HydrophobicContact CZ-CD1 3.45Å; F47-F118 VanDerWaalsContact CZ-CD1 3.45Å; F47-F118 AromaticContact CZ-CE1 3.28Å; F47-F118 HydrophobicContact CZ-CE1 3.28Å; F47-F118 HydrophobicContact CZ-CG 4.19Å; F47-F118 AromaticContact CZ-CZ 3.91Å; F47-F118 HydrophobicContact CZ-CZ 3.91Å |
| 48 | M | 93.3 | Very high | 92.3 | Very high | 86 Ų | 86 | 56.2 Ų | 56.2 | 42% | 0.424 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.3 | -47.9 | 177 | -171.5 | -172 | 80.9 | 0 | 0 | 110.5 | T44 S45 P46 L52 | T44-M48 HydrophobicContact CG2-CB 4.47Å; T44-M48 HydrophobicContact CG2-CE 3.16Å; T44-M48 HydrophobicContact CG2-SD 3.83Å; S45-M48 WeakPolarHBondContact O-CB 3.36Å; S45-M48 PolarHBondContact O-N 3.05Å; S45-M48 VanDerWaalsContact O-N 3.08Å; P46-M48 VanDerWaalsContact C-N 3.3Å; P46-M48 PolarHBondContact O-N 3.38Å; M48-L52 WeakPolarHBondContact O-CB 3.41Å; M48-L52 PolarHBondContact O-N 3.17Å |
| 49 | W | 91.9 | Very high | 92.6 | Very high | 41 Ų | 41 | 55.9 Ų | 55.9 | 16% | 0.155 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.1 | -46.6 | 179 | -64.8 | 106.2 | 0 | 0 | 0 | 112.2 | F40 L41 T44 P46 F47 G53 Y135 F138 | F40-W49 HydrophobicContact CE1-CZ2 4.36Å; L41-W49 HydrophobicContact CD2-CZ2 4.48Å; T44-W49 HydrophobicContact CG2-CZ2 4.42Å; P46-W49 PolarHBondContact O-N 3.47Å; F47-W49 VanDerWaalsContact C-N 3.35Å; W49-G53 PolarHBondContact O-N 2.96Å; W49-Y135 HydrophobicContact CB-CD1 4.47Å; W49-Y135 AromaticContact CD1-CE1 3.66Å; W49-Y135 HydrophobicContact CD2-CD1 4.24Å; W49-Y135 HydrophobicContact CD2-CE1 4.2Å; W49-Y135 AromaticContact CE2-CE1 3.96Å; W49-Y135 HydrophobicContact CG-CD1 4.01Å; W49-Y135 HydrophobicContact CG-CE1 4.02Å; W49-Y135 AromaticContact NE1-CE1 3.61Å; W49-F138 HydrophobicContact CB-CB 4.05Å; W49-F138 HydrophobicContact CE3-CB 4.34Å; W49-F138 AromaticContact CE3-CD1 3.72Å; W49-F138 HydrophobicContact CE3-CD1 3.72Å; W49-F138 AromaticContact CE3-CD2 3.95Å; W49-F138 HydrophobicContact CE3-CD2 3.95Å; W49-F138 AromaticContact CE3-CE1 3.94Å; W49-F138 HydrophobicContact CE3-CE1 3.94Å; W49-F138 HydrophobicContact CE3-CE2 4.17Å; W49-F138 AromaticContact CE3-CG 3.72Å; W49-F138 HydrophobicContact CE3-CG 3.72Å; W49-F138 HydrophobicContact CE3-CZ 4.17Å; W49-F138 HydrophobicContact CZ3-CD1 4.03Å; W49-F138 AromaticContact CZ3-CE1 3.79Å; W49-F138 HydrophobicContact CZ3-CE1 3.79Å; W49-F138 HydrophobicContact CZ3-CE2 4.36Å; W49-F138 HydrophobicContact CZ3-CG 4.41Å; W49-F138 AromaticContact CZ3-CZ 3.97Å; W49-F138 HydrophobicContact CZ3-CZ 3.97Å; W49-F138 WeakPolarHBondContact O-CB 3.37Å |
| 50 | S | 90.9 | Very high | 92.9 | Very high | 4 Ų | 4 | 50.4 Ų | 50.4 | 3% | 0.028 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.5 | -52.9 | 178.3 | 176 | 0 | 0 | 0 | 0 | 112.3 | P46 F47 L52 G53 I54 M137 | P46-S50 PolarHBondContact O-N 3.46Å; F47-S50 PolarHBondContact O-N 3.1Å; S50-L52 VanDerWaalsContact C-N 3.35Å; S50-L52 PolarHBondContact O-N 3.27Å; S50-G53 WeakPolarHBondContact O-CA 3.43Å; S50-G53 PolarHBondContact O-N 3.36Å; S50-G53 VanDerWaalsContact O-N 3.12Å; S50-I54 WeakPolarHBondContact O-CG1 3.38Å; S50-I54 PolarHBondContact O-N 3.31Å; S50-M137 PolarHBondContact OG-SD 3.12Å |
| 51 | N | 93.3 | Very high | 93.1 | Very high | 98 Ų | 98 | 45.4 Ų | 45.4 | 52% | 0.524 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -66.5 | -37.1 | -177.8 | -70.5 | -35.7 | 0 | 0 | 0 | 112.3 | F47 G53 I54 G55 | F47-N51 VanDerWaalsContact O-CB 3.3Å; F47-N51 WeakPolarHBondContact O-CB 3.43Å; F47-N51 VanDerWaalsContact O-CG 3.32Å; F47-N51 PolarHBondContact O-N 3.31Å; F47-N51 PolarHBondContact O-ND2 3.11Å; F47-N51 VanDerWaalsContact O-ND2 3.12Å; N51-G53 VanDerWaalsContact C-N 3.33Å; N51-I54 PolarHBondContact O-N 3.01Å; N51-G55 PolarHBondContact O-N 2.9Å |
| 52 | L | 96.4 | Very high | 93.3 | Very high | 81 Ų | 81 | 46 Ų | 46 | 42% | 0.424 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.8 | -41.1 | 173.4 | -174.1 | 65.2 | 0 | 0 | 0 | 110.7 | M48 S50 G55 L56 F138 | M48-L52 WeakPolarHBondContact O-CB 3.41Å; M48-L52 PolarHBondContact O-N 3.17Å; S50-L52 VanDerWaalsContact C-N 3.35Å; S50-L52 PolarHBondContact O-N 3.27Å; L52-G55 PolarHBondContact O-N 3.47Å; L52-L56 HydrophobicContact CD1-CD1 4.18Å; L52-L56 HydrophobicContact CD1-CG 4.2Å; L52-L56 HydrophobicContact CD2-CD1 4.49Å; L52-L56 HydrophobicContact CG-CD1 3.88Å; L52-L56 HydrophobicContact CG-CG 4.28Å; L52-L56 VanDerWaalsContact O-CB 3.31Å; L52-L56 WeakPolarHBondContact O-CB 3.36Å; L52-L56 WeakPolarHBondContact O-CG 3.16Å; L52-L56 PolarHBondContact O-N 3.02Å; L52-F138 HydrophobicContact CB-CD2 4.33Å; L52-F138 HydrophobicContact CB-CE2 4.41Å; L52-F138 HydrophobicContact CD2-CD2 4.22Å; L52-F138 HydrophobicContact CD2-CE2 3.58Å; L52-F138 HydrophobicContact CD2-CZ 4.41Å; L52-F138 HydrophobicContact CG-CD2 4.31Å; L52-F138 HydrophobicContact CG-CE2 3.91Å |
| 53 | G | 94.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.2 | -50.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | W49 S50 N51 G55 L56 A57 G141 | W49-G53 PolarHBondContact O-N 2.96Å; S50-G53 WeakPolarHBondContact O-CA 3.43Å; S50-G53 PolarHBondContact O-N 3.36Å; S50-G53 VanDerWaalsContact O-N 3.12Å; N51-G53 VanDerWaalsContact C-N 3.33Å; G53-G55 PolarHBondContact O-N 3.23Å; G53-L56 PolarHBondContact O-N 3.37Å; G53-A57 WeakPolarHBondContact O-CB 3.46Å; G53-A57 PolarHBondContact O-N 3.48Å; G53-G141 WeakPolarHBondContact O-CA 3.3Å |
| 54 | I | 92.9 | Very high | 94.1 | Very high | 25 Ų | 25 | 41.4 Ų | 41.4 | 13% | 0.128 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.5 | -45.8 | 178.3 | -63.3 | 162.6 | 0 | 0 | 0 | 110.6 | S50 N51 A57 I58 A108 I111 | S50-I54 WeakPolarHBondContact O-CG1 3.38Å; S50-I54 PolarHBondContact O-N 3.31Å; N51-I54 PolarHBondContact O-N 3.01Å; I54-A57 PolarHBondContact O-N 3.46Å; I54-I58 PolarHBondContact O-N 3.31Å; I54-A108 HydrophobicContact CG2-CB 4.2Å; I54-I111 HydrophobicContact CD1-CG2 4.15Å; I54-I111 HydrophobicContact CG1-CB 4.05Å; I54-I111 HydrophobicContact CG1-CG2 3.53Å |
| 55 | G | 95.9 | Very high | 94.4 | Very high | 34 Ų | 34 | 40.5 Ų | 40.5 | 35% | 0.351 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -63.9 | -43.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | N51 L52 G53 I58 S59 | N51-G55 PolarHBondContact O-N 2.9Å; L52-G55 PolarHBondContact O-N 3.47Å; G53-G55 PolarHBondContact O-N 3.23Å; G55-I58 WeakPolarHBondContact O-CG2 3.35Å; G55-S59 VanDerWaalsContact O-CB 3.28Å; G55-S59 WeakPolarHBondContact O-CB 3.33Å; G55-S59 PolarHBondContact O-N 3.13Å; G55-S59 PolarHBondContact O-OG 3.18Å |
| 56 | L | 96.6 | Very high | 94.8 | Very high | 44 Ų | 44 | 40.5 Ų | 40.5 | 23% | 0.23 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.4 | -35.5 | 177.9 | -71.2 | 177.3 | 0 | 0 | 0 | 112.4 | L52 G53 I58 S59 L60 F138 L142 | L52-L56 HydrophobicContact CD1-CD1 4.18Å; L52-L56 HydrophobicContact CD1-CG 4.2Å; L52-L56 HydrophobicContact CD2-CD1 4.49Å; L52-L56 HydrophobicContact CG-CD1 3.88Å; L52-L56 HydrophobicContact CG-CG 4.28Å; L52-L56 VanDerWaalsContact O-CB 3.31Å; L52-L56 WeakPolarHBondContact O-CB 3.36Å; L52-L56 WeakPolarHBondContact O-CG 3.16Å; L52-L56 PolarHBondContact O-N 3.02Å; G53-L56 PolarHBondContact O-N 3.37Å; L56-I58 PolarHBondContact O-N 3.41Å; L56-S59 WeakPolarHBondContact CA-OG 3.21Å; L56-L60 HydrophobicContact CB-CD1 4.21Å; L56-L60 HydrophobicContact CD2-CD1 4.27Å; L56-L60 HydrophobicContact CD2-CG 4.4Å; L56-L60 VanDerWaalsContact O-CB 3.27Å; L56-L60 WeakPolarHBondContact O-CB 3.47Å; L56-L60 WeakPolarHBondContact O-CG 3.45Å; L56-L60 PolarHBondContact O-N 3.06Å; L56-F138 HydrophobicContact CD1-CE2 4.03Å; L56-L142 HydrophobicContact CD1-CD1 4.21Å |
| 57 | A | 95.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.8 | -50.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G53 I54 S61 G141 V144 | G53-A57 WeakPolarHBondContact O-CB 3.46Å; G53-A57 PolarHBondContact O-N 3.48Å; I54-A57 PolarHBondContact O-N 3.46Å; A57-S61 VanDerWaalsContact O-CB 3.3Å; A57-S61 WeakPolarHBondContact O-CB 3.32Å; A57-S61 PolarHBondContact O-OG 3.09Å; A57-G141 WeakPolarHBondContact CA-O 3.46Å; A57-V144 HydrophobicContact CB-CG1 3.71Å |
| 58 | I | 96.9 | Very high | 95.7 | Very high | 63 Ų | 63 | 43.6 Ų | 43.6 | 32% | 0.323 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -76.7 | -46.7 | -179.1 | -169.4 | 167.7 | 0 | 0 | 0 | 112.1 | I54 G55 L56 S61 V62 I105 A108 | I54-I58 PolarHBondContact O-N 3.31Å; G55-I58 WeakPolarHBondContact O-CG2 3.35Å; L56-I58 PolarHBondContact O-N 3.41Å; I58-S61 PolarHBondContact O-N 3.5Å; I58-V62 HydrophobicContact CG1-CG2 4.27Å; I58-V62 VanDerWaalsContact O-CG2 3.28Å; I58-V62 WeakPolarHBondContact O-CG2 3.29Å; I58-V62 PolarHBondContact O-N 3.37Å; I58-I105 HydrophobicContact CD1-CB 4.24Å; I58-I105 HydrophobicContact CD1-CD1 4.39Å; I58-I105 HydrophobicContact CD1-CG1 4.04Å; I58-A108 HydrophobicContact CB-CB 4.09Å |
| 59 | S | 97.8 | Very high | 95.8 | Very high | 52 Ų | 52 | 42.5 Ų | 42.5 | 36% | 0.364 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -64.3 | -48.1 | -174.2 | 56.7 | 0 | 0 | 0 | 0 | 112.3 | G55 L56 S61 V62 V63 | G55-S59 VanDerWaalsContact O-CB 3.28Å; G55-S59 WeakPolarHBondContact O-CB 3.33Å; G55-S59 PolarHBondContact O-N 3.13Å; G55-S59 PolarHBondContact O-OG 3.18Å; L56-S59 WeakPolarHBondContact CA-OG 3.21Å; S59-S61 PolarHBondContact O-N 3.14Å; S59-V62 PolarHBondContact O-N 2.96Å; S59-V63 VanDerWaalsContact O-CG2 3.28Å; S59-V63 WeakPolarHBondContact O-CG2 3.34Å; S59-V63 PolarHBondContact O-N 2.89Å |
| 60 | L | 97.4 | Very high | 96.1 | Very high | 37 Ų | 37 | 48.2 Ų | 48.2 | 19% | 0.194 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.7 | -37 | -180 | -63.9 | 175.3 | 0 | 0 | 0 | 112.1 | L56 V63 G64 L142 G145 L146 | L56-L60 HydrophobicContact CB-CD1 4.21Å; L56-L60 HydrophobicContact CD2-CD1 4.27Å; L56-L60 HydrophobicContact CD2-CG 4.4Å; L56-L60 VanDerWaalsContact O-CB 3.27Å; L56-L60 WeakPolarHBondContact O-CB 3.47Å; L56-L60 WeakPolarHBondContact O-CG 3.45Å; L56-L60 PolarHBondContact O-N 3.06Å; L60-V63 PolarHBondContact O-N 3.43Å; L60-G64 PolarHBondContact O-N 3.01Å; L60-L142 HydrophobicContact CD1-CD1 4.48Å; L60-G145 WeakPolarHBondContact CB-O 3.27Å; L60-L146 HydrophobicContact CD1-CD2 3.99Å; L60-L146 HydrophobicContact CD1-CG 4.17Å |
| 61 | S | 96.6 | Very high | 96.4 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 175.7 | -61.1 | 0 | 0 | 0 | 0 | 111.8 | A57 I58 S59 G64 A65 G104 N148 | A57-S61 VanDerWaalsContact O-CB 3.3Å; A57-S61 WeakPolarHBondContact O-CB 3.32Å; A57-S61 PolarHBondContact O-OG 3.09Å; I58-S61 PolarHBondContact O-N 3.5Å; S59-S61 PolarHBondContact O-N 3.14Å; S61-G64 PolarHBondContact O-N 3.34Å; S61-A65 PolarHBondContact O-N 3.33Å; S61-G104 WeakPolarHBondContact OG-CA 3.38Å; S61-N148 WeakPolarHBondContact OG-CB 3.39Å; S61-N148 PolarHBondContact OG-ND2 3.02Å |
| 62 | V | 97.4 | Very high | 96.5 | Very high | 73 Ų | 73 | 45 Ų | 45 | 44% | 0.442 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -68.4 | -37.5 | 178.7 | 174.3 | 0 | 0 | 0 | 0 | 111.4 | I58 S59 G64 A65 A66 A101 | I58-V62 HydrophobicContact CG1-CG2 4.27Å; I58-V62 VanDerWaalsContact O-CG2 3.28Å; I58-V62 WeakPolarHBondContact O-CG2 3.29Å; I58-V62 PolarHBondContact O-N 3.37Å; S59-V62 PolarHBondContact O-N 2.96Å; V62-G64 VanDerWaalsContact C-N 3.33Å; V62-G64 PolarHBondContact O-N 2.92Å; V62-A65 PolarHBondContact O-N 3.47Å; V62-A66 WeakPolarHBondContact O-CB 3.47Å; V62-A66 PolarHBondContact O-N 3.21Å; V62-A101 HydrophobicContact CG2-CB 4.34Å |
| 63 | V | 98.2 | Very high | 96.4 | Very high | 74 Ų | 74 | 41.9 Ų | 41.9 | 45% | 0.448 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.3 | -43.4 | 173.5 | 170.4 | 0 | 0 | 0 | 0 | 110.8 | S59 L60 A66 W67 L149 | S59-V63 VanDerWaalsContact O-CG2 3.28Å; S59-V63 WeakPolarHBondContact O-CG2 3.34Å; S59-V63 PolarHBondContact O-N 2.89Å; L60-V63 PolarHBondContact O-N 3.43Å; V63-A66 PolarHBondContact O-N 2.94Å; V63-W67 WeakPolarHBondContact O-CB 3.49Å; V63-W67 PolarHBondContact O-N 3.43Å; V63-L149 HydrophobicContact CB-CD1 4.24Å; V63-L149 HydrophobicContact CG1-CD1 3.82Å |
| 64 | G | 96.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.3 | -46.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L60 S61 V62 W67 G68 | L60-G64 PolarHBondContact O-N 3.01Å; S61-G64 PolarHBondContact O-N 3.34Å; V62-G64 VanDerWaalsContact C-N 3.33Å; V62-G64 PolarHBondContact O-N 2.92Å; G64-W67 PolarHBondContact O-N 3.24Å; G64-G68 PolarHBondContact O-N 3.17Å |
| 65 | A | 95.4 | Very high | 96.6 | Very high | 5 Ų | 5 | 44.3 Ų | 44.3 | 4% | 0.041 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.7 | -48.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | S61 V62 W67 G68 I69 C97 A101 | S61-A65 PolarHBondContact O-N 3.33Å; V62-A65 PolarHBondContact O-N 3.47Å; A65-W67 VanDerWaalsContact C-N 3.32Å; A65-W67 PolarHBondContact O-N 3.42Å; A65-G68 PolarHBondContact O-N 2.96Å; A65-I69 WeakPolarHBondContact O-CB 3.43Å; A65-I69 WeakPolarHBondContact O-CD1 3.3Å; A65-I69 WeakPolarHBondContact O-CG1 3.39Å; A65-I69 PolarHBondContact O-N 3.42Å; A65-C97 WeakPolarHBondContact CB-O 3.39Å; A65-A101 HydrophobicContact CB-CB 3.81Å |
| 66 | A | 97.5 | Very high | 96.6 | Very high | 56 Ų | 56 | 43.3 Ų | 43.3 | 46% | 0.463 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -60.4 | -41.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | V62 V63 I69 Y70 | V62-A66 WeakPolarHBondContact O-CB 3.47Å; V62-A66 PolarHBondContact O-N 3.21Å; V63-A66 PolarHBondContact O-N 2.94Å; A66-I69 PolarHBondContact O-N 2.97Å; A66-Y70 WeakPolarHBondContact O-CB 3Å; A66-Y70 PolarHBondContact O-N 3.47Å |
| 67 | W | 97.6 | Very high | 96.5 | Very high | 142 Ų | 142 | 47.3 Ų | 47.3 | 54% | 0.538 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.2 | -47 | 176.6 | -157.4 | -30.6 | 0 | 0 | 0 | 111.2 | V63 G64 A65 I69 Y70 I71 V153 | V63-W67 WeakPolarHBondContact O-CB 3.49Å; V63-W67 PolarHBondContact O-N 3.43Å; G64-W67 PolarHBondContact O-N 3.24Å; A65-W67 VanDerWaalsContact C-N 3.32Å; A65-W67 PolarHBondContact O-N 3.42Å; W67-I69 PolarHBondContact O-N 2.97Å; W67-Y70 PolarHBondContact O-N 2.92Å; W67-I71 HydrophobicContact CG-CD1 4.47Å; W67-I71 WeakPolarHBondContact O-CG1 3.38Å; W67-I71 PolarHBondContact O-N 2.7Å; W67-I71 VanDerWaalsContact O-N 3.1Å; W67-V153 HydrophobicContact CB-CG2 4.13Å; W67-V153 HydrophobicContact CD2-CG2 4.18Å; W67-V153 HydrophobicContact CE3-CG2 4.43Å; W67-V153 HydrophobicContact CG-CG2 4.05Å |
| 68 | G | 96.4 | Very high | 96.5 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.9 | -44 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | G64 A65 Y70 I71 T72 G152 | G64-G68 PolarHBondContact O-N 3.17Å; A65-G68 PolarHBondContact O-N 2.96Å; G68-Y70 PolarHBondContact O-N 3.24Å; G68-I71 PolarHBondContact O-N 3.3Å; G68-T72 PolarHBondContact O-N 2.91Å; G68-T72 PolarHBondContact O-OG1 3.38Å; G68-G152 WeakPolarHBondContact CA-O 3.18Å |
| 69 | I | 96.8 | Very high | 96.2 | Very high | 63 Ų | 63 | 47.3 Ų | 47.3 | 32% | 0.323 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.6 | -43.8 | 177.2 | -66.4 | 166.6 | 0 | 0 | 0 | 111 | A65 A66 W67 G73 I94 C97 | A65-I69 WeakPolarHBondContact O-CB 3.43Å; A65-I69 WeakPolarHBondContact O-CD1 3.3Å; A65-I69 WeakPolarHBondContact O-CG1 3.39Å; A65-I69 PolarHBondContact O-N 3.42Å; A66-I69 PolarHBondContact O-N 2.97Å; W67-I69 PolarHBondContact O-N 2.97Å; I69-G73 WeakPolarHBondContact O-CA 2.98Å; I69-G73 PolarHBondContact O-N 3.41Å; I69-I94 HydrophobicContact CG1-CG2 4.22Å; I69-I94 HydrophobicContact CG2-CG2 4.4Å; I69-C97 HydrophobicContact CG1-CB 3.86Å |
| 70 | Y | 97.3 | Very high | 96 | Very high | 162 Ų | 162 | 45.7 Ų | 45.7 | 64% | 0.635 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -62.9 | -44.4 | 178.9 | 163.5 | -109.6 | 0 | 0 | 0 | 112.5 | A66 W67 G68 S74 | A66-Y70 WeakPolarHBondContact O-CB 3Å; A66-Y70 PolarHBondContact O-N 3.47Å; W67-Y70 PolarHBondContact O-N 2.92Å; G68-Y70 PolarHBondContact O-N 3.24Å; Y70-S74 WeakPolarHBondContact O-CB 3.45Å; Y70-S74 PolarHBondContact O-N 3.04Å; Y70-S74 PolarHBondContact O-OG 3.29Å |
| 71 | I | 97.1 | Very high | 95.9 | Very high | 33 Ų | 33 | 50 Ų | 50 | 17% | 0.169 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.2 | -50.5 | 179.7 | -67.9 | 168.7 | 0 | 0 | 0 | 110.8 | W67 G68 S74 S75 G156 I157 | W67-I71 HydrophobicContact CG-CD1 4.47Å; W67-I71 WeakPolarHBondContact O-CG1 3.38Å; W67-I71 PolarHBondContact O-N 2.7Å; W67-I71 VanDerWaalsContact O-N 3.1Å; G68-I71 PolarHBondContact O-N 3.3Å; I71-S74 PolarHBondContact O-OG 3.23Å; I71-S75 PolarHBondContact O-OG 3.36Å; I71-G156 WeakPolarHBondContact CG2-O 3.37Å; I71-I157 HydrophobicContact CD1-CG1 4.2Å |
| 72 | T | 95.2 | Very high | 95.7 | Very high | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -68.1 | -44.1 | 179.3 | -63.4 | 0 | 0 | 0 | 0 | 111.5 | G68 S74 S75 I76 I94 G156 | G68-T72 PolarHBondContact O-N 2.91Å; G68-T72 PolarHBondContact O-OG1 3.38Å; T72-S74 PolarHBondContact O-N 3.5Å; T72-S75 WeakPolarHBondContact O-CB 3.49Å; T72-S75 PolarHBondContact O-N 3.08Å; T72-S75 VanDerWaalsContact O-N 3.13Å; T72-I76 HydrophobicContact CG2-CD1 3.67Å; T72-I76 HydrophobicContact CG2-CG1 4.17Å; T72-I76 WeakPolarHBondContact O-CG1 3.18Å; T72-I76 PolarHBondContact O-N 2.88Å; T72-I94 HydrophobicContact CG2-CG1 4.31Å; T72-G156 WeakPolarHBondContact OG1-CA 3.39Å; T72-G156 PolarHBondContact OG1-O 3.42Å |
| 73 | G | 95.3 | Very high | 95.3 | Very high | 16 Ų | 16 | 56.4 Ų | 56.4 | 17% | 0.165 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.9 | -43 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | I69 S75 I76 I77 | I69-G73 WeakPolarHBondContact O-CA 2.98Å; I69-G73 PolarHBondContact O-N 3.41Å; G73-S75 PolarHBondContact O-N 3.2Å; G73-I76 PolarHBondContact O-N 3.42Å; G73-I77 VanDerWaalsContact O-CG1 3.32Å; G73-I77 WeakPolarHBondContact O-CG1 3.49Å; G73-I77 PolarHBondContact O-N 3.3Å |
| 74 | S | 96.4 | Very high | 95 | Very high | 59 Ų | 59 | 56.7 Ų | 56.7 | 41% | 0.413 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.3 | -36.1 | 174.8 | 57 | 0 | 0 | 0 | 0 | 112.2 | Y70 I71 T72 G78 | Y70-S74 WeakPolarHBondContact O-CB 3.45Å; Y70-S74 PolarHBondContact O-N 3.04Å; Y70-S74 PolarHBondContact O-OG 3.29Å; I71-S74 PolarHBondContact O-OG 3.23Å; T72-S74 PolarHBondContact O-N 3.5Å; S74-G78 PolarHBondContact O-N 3.23Å |
| 75 | S | 95.6 | Very high | 94.6 | Very high | 17 Ų | 17 | 62.9 Ų | 62.9 | 12% | 0.119 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -74.9 | -39.2 | 179.1 | -54.9 | 0 | 0 | 0 | 0 | 112.7 | I71 T72 G73 G78 G79 S160 | I71-S75 PolarHBondContact O-OG 3.36Å; T72-S75 WeakPolarHBondContact O-CB 3.49Å; T72-S75 PolarHBondContact O-N 3.08Å; T72-S75 VanDerWaalsContact O-N 3.13Å; G73-S75 PolarHBondContact O-N 3.2Å; S75-G78 PolarHBondContact O-N 3.16Å; S75-G79 PolarHBondContact O-N 3.43Å; S75-S160 WeakPolarHBondContact CB-OG 3.4Å; S75-S160 WeakPolarHBondContact OG-CB 3.07Å; S75-S160 PolarHBondContact OG-OG 3.41Å |
| 76 | I | 95.1 | Very high | 94.3 | Very high | 13 Ų | 13 | 62.6 Ų | 62.6 | 7% | 0.067 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 174 | -69 | 172.2 | 0 | 0 | 0 | 110.3 | T72 G73 G80 N90 I94 A163 | T72-I76 HydrophobicContact CG2-CD1 3.67Å; T72-I76 HydrophobicContact CG2-CG1 4.17Å; T72-I76 WeakPolarHBondContact O-CG1 3.18Å; T72-I76 PolarHBondContact O-N 2.88Å; G73-I76 PolarHBondContact O-N 3.42Å; I76-G80 WeakPolarHBondContact O-CA 3.46Å; I76-G80 PolarHBondContact O-N 3.3Å; I76-N90 HydrophobicContact CD1-CB 3.88Å; I76-N90 HydrophobicContact CG1-CB 4.04Å; I76-I94 HydrophobicContact CD1-CD1 3.95Å; I76-I94 HydrophobicContact CD1-CG1 4.27Å; I76-A163 HydrophobicContact CG1-CB 3.74Å |
| 77 | I | 95.3 | Very high | 93.8 | Very high | 129 Ų | 129 | 66 Ų | 66 | 66% | 0.662 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -65.9 | -44.6 | 178.8 | -64 | 167.6 | 0 | 0 | 0 | 110 | G73 G80 V81 | G73-I77 VanDerWaalsContact O-CG1 3.32Å; G73-I77 WeakPolarHBondContact O-CG1 3.49Å; G73-I77 PolarHBondContact O-N 3.3Å; I77-G80 PolarHBondContact O-N 2.97Å; I77-V81 PolarHBondContact O-N 3.23Å |
| 78 | G | 94.8 | Very high | 93.4 | Very high | 52 Ų | 52 | 63.7 Ų | 63.7 | 54% | 0.536 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.4 | -48.4 | 178 | 0 | 0 | 0 | 0 | 0 | 113.5 | S74 S75 G80 | S74-G78 PolarHBondContact O-N 3.23Å; S75-G78 PolarHBondContact O-N 3.16Å; G78-G80 VanDerWaalsContact C-N 3.32Å |
| 79 | G | 91.3 | Very high | 92.9 | Very high | 11 Ų | 11 | 68.7 Ų | 68.7 | 11% | 0.113 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -70.6 | -28.2 | 176 | 0 | 0 | 0 | 0 | 0 | 113.5 | S75 V81 A83 | S75-G79 PolarHBondContact O-N 3.43Å; G79-V81 VanDerWaalsContact C-N 3.29Å; G79-V81 PolarHBondContact O-N 2.94Å; G79-A83 PolarHBondContact O-N 3.44Å |
| 80 | G | 92.9 | Very high | 92.5 | Very high | 17 Ų | 17 | 65.7 Ų | 65.7 | 18% | 0.175 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -71.6 | -18.7 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | I76 I77 G78 A83 P84 | I76-G80 WeakPolarHBondContact O-CA 3.46Å; I76-G80 PolarHBondContact O-N 3.3Å; I77-G80 PolarHBondContact O-N 2.97Å; G78-G80 VanDerWaalsContact C-N 3.32Å; G80-A83 CarbonylContact O-C 3.56Å; G80-P84 WeakPolarHBondContact O-CA 3.47Å |
| 81 | V | 95.3 | Very high | 92.2 | Very high | 128 Ų | 128 | 61.8 Ų | 61.8 | 78% | 0.776 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.3 | -45.9 | 176.3 | 179.9 | 0 | 0 | 0 | 0 | 111.1 | I77 G79 | I77-V81 PolarHBondContact O-N 3.23Å; G79-V81 VanDerWaalsContact C-N 3.29Å; G79-V81 PolarHBondContact O-N 2.94Å |
| 82 | K | 91.4 | Very high | 91.9 | Very high | 200 Ų | 200 | 62.1 Ų | 62.1 | 87% | 0.87 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | -32.9 | -179.5 | -170 | 173.8 | -179.5 | 179.5 | 0 | 112.4 | ||
| 83 | A | 90.8 | Very high | 91.6 | Very high | 8 Ų | 8 | 62.1 Ų | 62.1 | 7% | 0.066 | 34% | 0.343 | C | S | . | . | trans | -127.6 | 81.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | G79 G80 R85 I86 A167 | G79-A83 PolarHBondContact O-N 3.44Å; G80-A83 CarbonylContact O-C 3.56Å; A83-R85 PolarHBondContact O-N 2.86Å; A83-I86 HydrophobicContact CB-CG2 4.23Å; A83-I86 WeakPolarHBondContact O-CG1 3.44Å; A83-I86 PolarHBondContact O-N 3.48Å; A83-A167 HydrophobicContact CB-CB 4.5Å | ||
| 84 | P | 91.1 | Very high | 91.6 | Very high | 80 Ų | 80 | 63.2 Ų | 63.2 | 52% | 0.519 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -8.8 | -173.2 | 27.4 | -36.2 | 0 | 0 | 0 | 114.5 | G80 I86 K87 | G80-P84 WeakPolarHBondContact O-CA 3.47Å; P84-I86 VanDerWaalsContact C-N 3.26Å; P84-I86 PolarHBondContact O-N 3.43Å; P84-K87 WeakPolarHBondContact O-CD 3.47Å; P84-K87 WeakPolarHBondContact O-CG 3.34Å |
| 85 | R | 88.7 | Confident | 91.5 | Very high | 129 Ų | 129 | 63.8 Ų | 63.8 | 49% | 0.487 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -21.2 | 175.3 | 65.9 | 179.1 | -178.2 | -108.7 | -5.8 | 113.8 | A83 K87 | A83-R85 PolarHBondContact O-N 2.86Å; R85-K87 VanDerWaalsContact C-N 3.29Å; R85-K87 PolarHBondContact O-N 3.15Å |
| 86 | I | 88.7 | Confident | 91.3 | Very high | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -74.9 | -21 | -177.9 | 76.6 | -179 | 0 | 0 | 0 | 112.4 | A83 P84 T88 K89 N90 D166 A167 | A83-I86 HydrophobicContact CB-CG2 4.23Å; A83-I86 WeakPolarHBondContact O-CG1 3.44Å; A83-I86 PolarHBondContact O-N 3.48Å; P84-I86 VanDerWaalsContact C-N 3.26Å; P84-I86 PolarHBondContact O-N 3.43Å; I86-T88 PolarHBondContact O-N 3.47Å; I86-T88 VanDerWaalsContact O-N 3.17Å; I86-K89 PolarHBondContact O-N 3.28Å; I86-N90 WeakPolarHBondContact O-CB 3.47Å; I86-N90 PolarHBondContact O-N 3.21Å; I86-N90 VanDerWaalsContact O-N 3.11Å; I86-N90 PolarHBondContact O-OD1 3.36Å; I86-N90 VanDerWaalsContact O-OD1 3.1Å; I86-D166 HydrophobicContact CG2-CB 4.43Å; I86-D166 VanDerWaalsContact CG2-OD2 3.25Å; I86-D166 WeakPolarHBondContact CG2-OD2 3.45Å; I86-A167 HydrophobicContact CD1-CB 4.1Å; I86-A167 HydrophobicContact CG2-CB 4.36Å |
| 87 | K | 86.9 | Confident | 91.1 | Very high | 128 Ų | 128 | 63 Ų | 63 | 56% | 0.557 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -63.9 | -24.3 | -172.8 | 78.6 | -171.3 | 175.5 | 171.5 | 0 | 114.3 | P84 R85 L91 | P84-K87 WeakPolarHBondContact O-CD 3.47Å; P84-K87 WeakPolarHBondContact O-CG 3.34Å; R85-K87 VanDerWaalsContact C-N 3.29Å; R85-K87 PolarHBondContact O-N 3.15Å; K87-L91 WeakPolarHBondContact O-CG 3.28Å |
| 88 | T | 88.5 | Confident | 91.1 | Very high | 93 Ų | 93 | 61.8 Ų | 61.8 | 57% | 0.571 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -99.6 | -38.9 | -179.4 | 49.4 | 0 | 0 | 0 | 0 | 111.8 | I86 | I86-T88 PolarHBondContact O-N 3.47Å; I86-T88 VanDerWaalsContact O-N 3.17Å |
| 89 | K | 86.9 | Confident | 90.9 | Very high | 104 Ų | 104 | 60 Ų | 60 | 45% | 0.452 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -67.8 | -42 | -179.8 | -69.6 | -172.7 | 173.7 | -171.7 | 0 | 112.5 | I86 L91 F173 | I86-K89 PolarHBondContact O-N 3.28Å; K89-L91 VanDerWaalsContact C-N 3.27Å; K89-L91 PolarHBondContact O-N 3.4Å; K89-F173 VanDerWaalsContact O-CZ 3.28Å; K89-F173 WeakPolarHBondContact O-CZ 3.36Å |
| 90 | N | 88.5 | Confident | 90.9 | Very high | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 30% | 0.303 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | 3.3 | -175.1 | -62.8 | 69.5 | 0 | 0 | 0 | 113.6 | I76 I86 V92 S93 A163 D166 F173 | I76-N90 HydrophobicContact CD1-CB 3.88Å; I76-N90 HydrophobicContact CG1-CB 4.04Å; I86-N90 WeakPolarHBondContact O-CB 3.47Å; I86-N90 PolarHBondContact O-N 3.21Å; I86-N90 VanDerWaalsContact O-N 3.11Å; I86-N90 PolarHBondContact O-OD1 3.36Å; I86-N90 VanDerWaalsContact O-OD1 3.1Å; N90-V92 PolarHBondContact O-N 2.94Å; N90-S93 PolarHBondContact O-N 3.22Å; N90-A163 VanDerWaalsContact ND2-CA 3.3Å; N90-A163 WeakPolarHBondContact ND2-CA 3.39Å; N90-D166 PolarHBondContact OD1-OD2 3.02Å; N90-F173 HydrophobicContact CB-CE2 4.4Å; N90-F173 WeakPolarHBondContact ND2-CD2 3.14Å; N90-F173 WeakPolarHBondContact ND2-CE2 3.39Å |
| 91 | L | 90.7 | Very high | 91 | Very high | 81 Ų | 81 | 59.6 Ų | 59.6 | 42% | 0.424 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64 | -25 | 171.8 | -70.7 | 175.2 | 0 | 0 | 0 | 112.3 | K87 K89 S93 I94 I95 | K87-L91 WeakPolarHBondContact O-CG 3.28Å; K89-L91 VanDerWaalsContact C-N 3.27Å; K89-L91 PolarHBondContact O-N 3.4Å; L91-S93 PolarHBondContact O-N 3.03Å; L91-I94 HydrophobicContact CD2-CD1 3.9Å; L91-I94 WeakPolarHBondContact O-CB 3.41Å; L91-I94 PolarHBondContact O-N 3.27Å; L91-I95 WeakPolarHBondContact O-CG1 3.1Å; L91-I95 PolarHBondContact O-N 3.21Å; L91-I95 VanDerWaalsContact O-N 3.16Å |
| 92 | V | 90.9 | Very high | 91 | Very high | 39 Ų | 39 | 56.8 Ų | 56.8 | 24% | 0.236 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -54.9 | -38.5 | 175.9 | -178.6 | 0 | 0 | 0 | 0 | 111.2 | N90 I94 I95 F96 L177 | N90-V92 PolarHBondContact O-N 2.94Å; V92-I94 VanDerWaalsContact C-N 3.33Å; V92-I94 PolarHBondContact O-N 2.94Å; V92-I95 PolarHBondContact O-N 2.83Å; V92-F96 HydrophobicContact CG1-CD2 4.03Å; V92-F96 HydrophobicContact CG1-CE2 3.44Å; V92-F96 VanDerWaalsContact CG1-CE2 3.44Å; V92-F96 HydrophobicContact CG1-CZ 3.88Å; V92-F96 WeakPolarHBondContact O-CD2 3.27Å; V92-F96 PolarHBondContact O-N 2.89Å; V92-F96 VanDerWaalsContact O-N 3.08Å; V92-L177 HydrophobicContact CG1-CD1 4.12Å |
| 93 | S | 89.3 | Confident | 91 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.8 | -31.1 | 179 | -57 | 0 | 0 | 0 | 0 | 113.8 | N90 L91 C97 E180 | N90-S93 PolarHBondContact O-N 3.22Å; L91-S93 PolarHBondContact O-N 3.03Å; S93-C97 PolarHBondContact O-N 3.5Å; S93-C97 PolarHBondContact O-SG 3.47Å; S93-E180 WeakPolarHBondContact CA-OE1 3.48Å; S93-E180 WeakPolarHBondContact CB-OE1 3.42Å; S93-E180 WeakPolarHBondContact CB-OE2 3.39Å; S93-E180 VanDerWaalsContact OG-CD 3.32Å; S93-E180 PolarHBondContact OG-OE1 2.86Å; S93-E180 PolarHBondContact OG-OE2 2.89Å |
| 94 | I | 93.9 | Very high | 91 | Very high | 40 Ų | 40 | 47.6 Ų | 47.6 | 21% | 0.205 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -69.3 | -40.8 | 173.9 | -64.1 | 173.2 | 0 | 0 | 0 | 110 | I69 T72 I76 L91 V92 F96 C97 E98 | I69-I94 HydrophobicContact CG1-CG2 4.22Å; I69-I94 HydrophobicContact CG2-CG2 4.4Å; T72-I94 HydrophobicContact CG2-CG1 4.31Å; I76-I94 HydrophobicContact CD1-CD1 3.95Å; I76-I94 HydrophobicContact CD1-CG1 4.27Å; L91-I94 HydrophobicContact CD2-CD1 3.9Å; L91-I94 WeakPolarHBondContact O-CB 3.41Å; L91-I94 PolarHBondContact O-N 3.27Å; V92-I94 VanDerWaalsContact C-N 3.33Å; V92-I94 PolarHBondContact O-N 2.94Å; I94-F96 VanDerWaalsContact C-N 3.32Å; I94-F96 PolarHBondContact O-N 3.5Å; I94-C97 WeakPolarHBondContact O-CB 3.41Å; I94-C97 PolarHBondContact O-N 3.45Å; I94-C97 VanDerWaalsContact O-N 3.16Å; I94-E98 PolarHBondContact O-N 3.42Å |
| 95 | I | 94 | Very high | 91.1 | Very high | 71 Ų | 71 | 47.5 Ų | 47.5 | 36% | 0.364 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -64.2 | -37.9 | 178.9 | -61.7 | 167.5 | 0 | 0 | 0 | 110.8 | L91 V92 C97 E98 A99 | L91-I95 WeakPolarHBondContact O-CG1 3.1Å; L91-I95 PolarHBondContact O-N 3.21Å; L91-I95 VanDerWaalsContact O-N 3.16Å; V92-I95 PolarHBondContact O-N 2.83Å; I95-C97 VanDerWaalsContact C-N 3.34Å; I95-C97 PolarHBondContact O-N 2.93Å; I95-E98 WeakPolarHBondContact O-CB 3.42Å; I95-E98 PolarHBondContact O-N 3.04Å; I95-A99 PolarHBondContact O-N 3.44Å |
| 96 | F | 91.4 | Very high | 91.3 | Very high | 12 Ų | 12 | 43.4 Ų | 43.4 | 5% | 0.053 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.7 | -37.6 | 174.2 | -70.2 | -47.2 | 0 | 0 | 0 | 112.7 | V92 I94 E98 A99 V155 E180 I181 F252 | V92-F96 HydrophobicContact CG1-CD2 4.03Å; V92-F96 HydrophobicContact CG1-CE2 3.44Å; V92-F96 VanDerWaalsContact CG1-CE2 3.44Å; V92-F96 HydrophobicContact CG1-CZ 3.88Å; V92-F96 WeakPolarHBondContact O-CD2 3.27Å; V92-F96 PolarHBondContact O-N 2.89Å; V92-F96 VanDerWaalsContact O-N 3.08Å; I94-F96 VanDerWaalsContact C-N 3.32Å; I94-F96 PolarHBondContact O-N 3.5Å; F96-E98 VanDerWaalsContact C-N 3.32Å; F96-A99 PolarHBondContact O-N 2.89Å; F96-V155 HydrophobicContact CB-CG1 3.93Å; F96-E180 HydrophobicContact CD2-CG 4.01Å; F96-I181 HydrophobicContact CZ-CG1 4.44Å; F96-F252 AromaticContact CD1-CE2 3.59Å; F96-F252 HydrophobicContact CD1-CE2 3.59Å; F96-F252 AromaticContact CD1-CZ 3.61Å; F96-F252 HydrophobicContact CD1-CZ 3.61Å; F96-F252 HydrophobicContact CE1-CE1 4.11Å; F96-F252 AromaticContact CE1-CE2 3.63Å; F96-F252 HydrophobicContact CE1-CE2 3.63Å; F96-F252 AromaticContact CE1-CZ 3.37Å; F96-F252 HydrophobicContact CE1-CZ 3.37Å |
| 97 | C | 91.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.9 | -35.2 | 172.8 | -63.3 | 0 | 0 | 0 | 0 | 111.9 | A65 I69 S93 I94 I95 | A65-C97 WeakPolarHBondContact CB-O 3.39Å; I69-C97 HydrophobicContact CG1-CB 3.86Å; S93-C97 PolarHBondContact O-N 3.5Å; S93-C97 PolarHBondContact O-SG 3.47Å; I94-C97 WeakPolarHBondContact O-CB 3.41Å; I94-C97 PolarHBondContact O-N 3.45Å; I94-C97 VanDerWaalsContact O-N 3.16Å; I95-C97 VanDerWaalsContact C-N 3.34Å; I95-C97 PolarHBondContact O-N 2.93Å |
| 98 | E | 94.8 | Very high | 91.6 | Very high | 105 Ų | 105 | 37.9 Ų | 37.9 | 49% | 0.491 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -69.8 | -39.9 | 176.2 | -170.4 | -174.4 | 170.5 | 0 | 0 | 112.4 | I94 I95 F96 V100 A101 I102 | I94-E98 PolarHBondContact O-N 3.42Å; I95-E98 WeakPolarHBondContact O-CB 3.42Å; I95-E98 PolarHBondContact O-N 3.04Å; F96-E98 VanDerWaalsContact C-N 3.32Å; E98-V100 PolarHBondContact O-N 3.35Å; E98-V100 VanDerWaalsContact O-N 3.13Å; E98-A101 WeakPolarHBondContact O-CB 3.46Å; E98-A101 PolarHBondContact O-N 3.19Å; E98-I102 PolarHBondContact O-N 2.9Å |
| 99 | A | 91 | Very high | 91.6 | Very high | 13 Ų | 13 | 37.9 Ų | 37.9 | 11% | 0.107 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -55.4 | -33.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | I95 F96 A101 I102 Y103 F252 | I95-A99 PolarHBondContact O-N 3.44Å; F96-A99 PolarHBondContact O-N 2.89Å; A99-A101 VanDerWaalsContact C-N 3.33Å; A99-A101 PolarHBondContact O-N 2.97Å; A99-I102 WeakPolarHBondContact O-CB 3.46Å; A99-I102 PolarHBondContact O-N 2.96Å; A99-I102 VanDerWaalsContact O-N 3.15Å; A99-Y103 WeakPolarHBondContact O-CD2 3.2Å; A99-Y103 VanDerWaalsContact O-CG 3.31Å; A99-Y103 PolarHBondContact O-N 3.03Å; A99-F252 HydrophobicContact CB-CE2 4.37Å |
| 100 | V | 92.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.7 | -36.2 | 175.2 | 178 | 0 | 0 | 0 | 0 | 112.3 | E98 Y103 G104 N148 | E98-V100 PolarHBondContact O-N 3.35Å; E98-V100 VanDerWaalsContact O-N 3.13Å; V100-Y103 PolarHBondContact O-N 3.32Å; V100-G104 PolarHBondContact O-N 3.47Å; V100-N148 HydrophobicContact CG1-CB 3.47Å; V100-N148 VanDerWaalsContact CG1-CB 3.47Å; V100-N148 WeakPolarHBondContact CG1-O 3.28Å; V100-N148 PolarHBondContact O-ND2 3.42Å |
| 101 | A | 94.1 | Very high | 91.4 | Very high | 21 Ų | 21 | 34 Ų | 34 | 17% | 0.174 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -70 | -36.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V62 A65 E98 A99 Y103 G104 I105 | V62-A101 HydrophobicContact CG2-CB 4.34Å; A65-A101 HydrophobicContact CB-CB 3.81Å; E98-A101 WeakPolarHBondContact O-CB 3.46Å; E98-A101 PolarHBondContact O-N 3.19Å; A99-A101 VanDerWaalsContact C-N 3.33Å; A99-A101 PolarHBondContact O-N 2.97Å; A101-Y103 VanDerWaalsContact C-N 3.29Å; A101-Y103 PolarHBondContact O-N 3.49Å; A101-G104 PolarHBondContact O-N 3.16Å; A101-G104 VanDerWaalsContact O-N 3.12Å; A101-I105 PolarHBondContact O-N 3.44Å |
| 102 | I | 94.8 | Very high | 91.3 | Very high | 68 Ų | 68 | 33 Ų | 33 | 35% | 0.349 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 176.1 | -61.1 | 176.8 | 0 | 0 | 0 | 110.4 | E98 A99 G104 I105 I106 | E98-I102 PolarHBondContact O-N 2.9Å; A99-I102 WeakPolarHBondContact O-CB 3.46Å; A99-I102 PolarHBondContact O-N 2.96Å; A99-I102 VanDerWaalsContact O-N 3.15Å; I102-G104 VanDerWaalsContact C-N 3.31Å; I102-G104 PolarHBondContact O-N 3.38Å; I102-I105 VanDerWaalsContact O-CG2 3.26Å; I102-I105 WeakPolarHBondContact O-CG2 3.36Å; I102-I105 PolarHBondContact O-N 3.27Å; I102-I106 HydrophobicContact CG2-CD1 3.71Å; I102-I106 HydrophobicContact CG2-CG1 4.31Å; I102-I106 WeakPolarHBondContact O-CB 3.3Å; I102-I106 VanDerWaalsContact O-CG1 3.24Å; I102-I106 WeakPolarHBondContact O-CG1 3.14Å; I102-I106 PolarHBondContact O-N 2.96Å |
| 103 | Y | 92.8 | Very high | 91.1 | Very high | 15 Ų | 15 | 36.6 Ų | 36.6 | 6% | 0.059 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.9 | -41.4 | 173.7 | -59.3 | -26.8 | 0 | 0 | 0 | 112.3 | A99 V100 A101 M107 L188 V191 | A99-Y103 WeakPolarHBondContact O-CD2 3.2Å; A99-Y103 VanDerWaalsContact O-CG 3.31Å; A99-Y103 PolarHBondContact O-N 3.03Å; V100-Y103 PolarHBondContact O-N 3.32Å; A101-Y103 VanDerWaalsContact C-N 3.29Å; A101-Y103 PolarHBondContact O-N 3.49Å; Y103-M107 WeakPolarHBondContact O-CG 3.49Å; Y103-M107 PolarHBondContact O-N 3.34Å; Y103-M107 VanDerWaalsContact O-N 3.14Å; Y103-L188 HydrophobicContact CE1-CD2 3.98Å; Y103-L188 HydrophobicContact CE2-CD2 3.92Å; Y103-L188 HydrophobicContact CE2-CG 4.22Å; Y103-V191 HydrophobicContact CG-CG2 4.28Å |
| 104 | G | 90.7 | Very high | 90.6 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64 | -48.2 | 177 | 0 | 0 | 0 | 0 | 0 | 113.9 | S61 V100 A101 I102 M107 A108 N148 | S61-G104 WeakPolarHBondContact OG-CA 3.38Å; V100-G104 PolarHBondContact O-N 3.47Å; A101-G104 PolarHBondContact O-N 3.16Å; A101-G104 VanDerWaalsContact O-N 3.12Å; I102-G104 VanDerWaalsContact C-N 3.31Å; I102-G104 PolarHBondContact O-N 3.38Å; G104-M107 PolarHBondContact O-N 2.71Å; G104-A108 WeakPolarHBondContact O-CB 3.37Å; G104-A108 PolarHBondContact O-N 3.04Å; G104-N148 PolarHBondContact N-ND2 3.26Å |
| 105 | I | 93 | Very high | 89.9 | Confident | 78 Ų | 78 | 40 Ų | 40 | 40% | 0.4 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -67.4 | -38 | 179.8 | -170.9 | 170.7 | 0 | 0 | 0 | 112.1 | I58 A101 I102 M107 A108 I109 | I58-I105 HydrophobicContact CD1-CB 4.24Å; I58-I105 HydrophobicContact CD1-CD1 4.39Å; I58-I105 HydrophobicContact CD1-CG1 4.04Å; A101-I105 PolarHBondContact O-N 3.44Å; I102-I105 VanDerWaalsContact O-CG2 3.26Å; I102-I105 WeakPolarHBondContact O-CG2 3.36Å; I102-I105 PolarHBondContact O-N 3.27Å; I105-M107 VanDerWaalsContact C-N 3.33Å; I105-M107 PolarHBondContact O-N 3.11Å; I105-A108 PolarHBondContact O-N 3.4Å; I105-I109 HydrophobicContact CG1-CD1 4.12Å; I105-I109 WeakPolarHBondContact O-CG1 3.42Å; I105-I109 PolarHBondContact O-N 2.93Å |
| 106 | I | 92.8 | Very high | 89.3 | Confident | 44 Ų | 44 | 41.2 Ų | 41.2 | 23% | 0.226 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.7 | -47.3 | 174.7 | -71.3 | 170.2 | 0 | 0 | 0 | 109.8 | I102 I109 V110 L244 | I102-I106 HydrophobicContact CG2-CD1 3.71Å; I102-I106 HydrophobicContact CG2-CG1 4.31Å; I102-I106 WeakPolarHBondContact O-CB 3.3Å; I102-I106 VanDerWaalsContact O-CG1 3.24Å; I102-I106 WeakPolarHBondContact O-CG1 3.14Å; I102-I106 PolarHBondContact O-N 2.96Å; I106-I109 PolarHBondContact O-N 3.28Å; I106-V110 HydrophobicContact CG2-CG2 4.46Å; I106-V110 WeakPolarHBondContact O-CG2 3.22Å; I106-V110 PolarHBondContact O-N 3.37Å; I106-L244 HydrophobicContact CD1-CD2 4.31Å; I106-L244 HydrophobicContact CG1-CD2 4.2Å; I106-L244 HydrophobicContact CG2-CD2 3.92Å |
| 107 | M | 90.6 | Very high | 88.8 | Confident | 3 Ų | 3 | 46.4 Ų | 46.4 | 2% | 0.015 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.3 | -37.2 | 180 | -73.8 | -53.3 | -56 | 0 | 0 | 113 | Y103 G104 I105 I109 V110 I111 V144 V191 A194 I195 | Y103-M107 WeakPolarHBondContact O-CG 3.49Å; Y103-M107 PolarHBondContact O-N 3.34Å; Y103-M107 VanDerWaalsContact O-N 3.14Å; G104-M107 PolarHBondContact O-N 2.71Å; I105-M107 VanDerWaalsContact C-N 3.33Å; I105-M107 PolarHBondContact O-N 3.11Å; M107-I109 VanDerWaalsContact C-N 3.33Å; M107-I109 PolarHBondContact O-N 3.21Å; M107-V110 PolarHBondContact O-N 3.13Å; M107-I111 HydrophobicContact CE-CD1 4.47Å; M107-I111 HydrophobicContact CE-CG1 4.47Å; M107-I111 VanDerWaalsContact O-CG1 3.27Å; M107-I111 WeakPolarHBondContact O-CG1 3.18Å; M107-I111 PolarHBondContact O-N 3.17Å; M107-V144 HydrophobicContact CB-CG1 4.17Å; M107-V144 HydrophobicContact CB-CG2 4.23Å; M107-V144 HydrophobicContact CG-CG2 3.99Å; M107-V191 HydrophobicContact CG-CG1 4.1Å; M107-V191 HydrophobicContact CG-CG2 4.3Å; M107-V191 HydrophobicContact SD-CG1 3.91Å; M107-A194 HydrophobicContact CE-CB 3.87Å; M107-I195 HydrophobicContact CE-CG1 3.74Å; M107-I195 HydrophobicContact SD-CD1 4.03Å; M107-I195 HydrophobicContact SD-CG1 3.61Å |
| 108 | A | 90.4 | Very high | 88.2 | Confident | 8 Ų | 8 | 49.3 Ų | 49.3 | 7% | 0.066 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.9 | -43 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I54 I58 G104 I105 S112 | I54-A108 HydrophobicContact CG2-CB 4.2Å; I58-A108 HydrophobicContact CB-CB 4.09Å; G104-A108 WeakPolarHBondContact O-CB 3.37Å; G104-A108 PolarHBondContact O-N 3.04Å; I105-A108 PolarHBondContact O-N 3.4Å; A108-S112 VanDerWaalsContact O-CB 3.26Å; A108-S112 WeakPolarHBondContact O-CB 3.28Å; A108-S112 PolarHBondContact O-N 3.4Å |
| 109 | I | 89.2 | Confident | 87.3 | Confident | 94 Ų | 94 | 50.2 Ų | 50.2 | 48% | 0.482 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.3 | -43.9 | 176.4 | -66.7 | 165.9 | 0 | 0 | 0 | 111 | I105 I106 M107 S112 N113 | I105-I109 HydrophobicContact CG1-CD1 4.12Å; I105-I109 WeakPolarHBondContact O-CG1 3.42Å; I105-I109 PolarHBondContact O-N 2.93Å; I106-I109 PolarHBondContact O-N 3.28Å; M107-I109 VanDerWaalsContact C-N 3.33Å; M107-I109 PolarHBondContact O-N 3.21Å; I109-S112 PolarHBondContact O-N 3.46Å; I109-N113 VanDerWaalsContact O-CG 3.3Å; I109-N113 PolarHBondContact O-N 3.2Å; I109-N113 PolarHBondContact O-ND2 3.08Å; I109-N113 VanDerWaalsContact O-ND2 3.09Å |
| 110 | V | 86.9 | Confident | 86.7 | Confident | 22 Ų | 22 | 51.3 Ų | 51.3 | 13% | 0.133 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.6 | -47.6 | 179.1 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | I106 M107 N113 M114 | I106-V110 HydrophobicContact CG2-CG2 4.46Å; I106-V110 WeakPolarHBondContact O-CG2 3.22Å; I106-V110 PolarHBondContact O-N 3.37Å; M107-V110 PolarHBondContact O-N 3.13Å; V110-N113 PolarHBondContact O-N 3.19Å; V110-M114 HydrophobicContact CG1-CE 4.49Å |
| 111 | I | 85.3 | Confident | 85.9 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -66.6 | -40.2 | 179.3 | -62.4 | 168.1 | 0 | 0 | 0 | 110.5 | I54 M107 N113 M114 M137 A140 V198 | I54-I111 HydrophobicContact CD1-CG2 4.15Å; I54-I111 HydrophobicContact CG1-CB 4.05Å; I54-I111 HydrophobicContact CG1-CG2 3.53Å; M107-I111 HydrophobicContact CE-CD1 4.47Å; M107-I111 HydrophobicContact CE-CG1 4.47Å; M107-I111 VanDerWaalsContact O-CG1 3.27Å; M107-I111 WeakPolarHBondContact O-CG1 3.18Å; M107-I111 PolarHBondContact O-N 3.17Å; I111-N113 VanDerWaalsContact C-N 3.31Å; I111-N113 PolarHBondContact O-N 3.45Å; I111-M114 PolarHBondContact O-N 3.18Å; I111-M114 VanDerWaalsContact O-N 3.14Å; I111-M137 HydrophobicContact CG2-CB 3.83Å; I111-M137 HydrophobicContact CG2-CG 3.86Å; I111-M137 HydrophobicContact CG2-SD 4.41Å; I111-A140 HydrophobicContact CD1-CB 4.09Å; I111-V198 HydrophobicContact CG1-CG2 4.49Å |
| 112 | S | 86.9 | Confident | 85.2 | Confident | 61 Ų | 61 | 61 Ų | 61 | 43% | 0.427 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.8 | -35.2 | 178.1 | -174.2 | 0 | 0 | 0 | 0 | 113.2 | A108 I109 M114 A115 | A108-S112 VanDerWaalsContact O-CB 3.26Å; A108-S112 WeakPolarHBondContact O-CB 3.28Å; A108-S112 PolarHBondContact O-N 3.4Å; I109-S112 PolarHBondContact O-N 3.46Å; S112-M114 PolarHBondContact O-N 3.32Å; S112-A115 PolarHBondContact O-N 3.25Å |
| 113 | N | 86.6 | Confident | 84.3 | Confident | 113 Ų | 113 | 60.2 Ų | 60.2 | 60% | 0.604 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | -12.1 | 178.6 | -74.4 | -36 | 0 | 0 | 0 | 113.4 | I109 V110 I111 | I109-N113 VanDerWaalsContact O-CG 3.3Å; I109-N113 PolarHBondContact O-N 3.2Å; I109-N113 PolarHBondContact O-ND2 3.08Å; I109-N113 VanDerWaalsContact O-ND2 3.09Å; V110-N113 PolarHBondContact O-N 3.19Å; I111-N113 VanDerWaalsContact C-N 3.31Å; I111-N113 PolarHBondContact O-N 3.45Å |
| 114 | M | 79.6 | Confident | 83.5 | Confident | 73 Ų | 73 | 69.4 Ų | 69.4 | 36% | 0.36 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.6 | -8.2 | 177.9 | -65.8 | 167.1 | 156.1 | 0 | 0 | 112.4 | V110 I111 S112 E116 M137 V198 | V110-M114 HydrophobicContact CG1-CE 4.49Å; I111-M114 PolarHBondContact O-N 3.18Å; I111-M114 VanDerWaalsContact O-N 3.14Å; S112-M114 PolarHBondContact O-N 3.32Å; M114-E116 PolarHBondContact O-N 3.48Å; M114-M137 HydrophobicContact CB-CE 3.67Å; M114-M137 WeakPolarHBondContact O-CE 3.39Å; M114-V198 HydrophobicContact CE-CG1 3.95Å; M114-V198 HydrophobicContact SD-CB 4.41Å; M114-V198 HydrophobicContact SD-CG1 3.15Å; M114-V198 WeakPolarHBondContact SD-CG1 3.29Å |
| 115 | A | 80.1 | Confident | 82.7 | Confident | 40 Ų | 40 | 72.4 Ų | 72.4 | 33% | 0.331 | 42% | 0.418 | S | S | . | . | trans | -81.2 | 107.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | S112 | S112-A115 PolarHBondContact O-N 3.25Š| ||
| 116 | E | 81.1 | Confident | 81.9 | Confident | 95 Ų | 95 | 69.4 Ų | 69.4 | 44% | 0.444 | 40% | 0.402 | S | S | . | . | trans | -111.6 | 144.1 | 175.8 | -67.4 | -177.4 | 168.1 | 0 | 0 | 111 | M114 | M114-E116 PolarHBondContact O-N 3.48Š| ||
| 117 | P | 81 | Confident | 81.2 | Confident | 122 Ų | 122 | 68.6 Ų | 68.6 | 79% | 0.792 | 40% | 0.404 | S | S | * | . | trans | -73.4 | 143.7 | 177.2 | 30.5 | -34 | 0 | 0 | 0 | 111.5 | ||||
| 118 | F | 78.6 | Confident | 80.8 | Confident | 60 Ų | 60 | 76.4 Ų | 76.4 | 26% | 0.263 | 44% | 0.441 | S | S | . | . | trans | -128.3 | 149.8 | 170.7 | 60.5 | -93.5 | 0 | 0 | 0 | 110 | P46 F47 A120 I126 | P46-F118 HydrophobicContact CB-CE1 4.42Å; P46-F118 HydrophobicContact CB-CZ 4.33Å; P46-F118 HydrophobicContact CG-CZ 3.99Å; F47-F118 HydrophobicContact CD2-CE1 4.12Å; F47-F118 HydrophobicContact CD2-CZ 4.08Å; F47-F118 HydrophobicContact CE1-CD1 4.2Å; F47-F118 AromaticContact CE1-CE1 3.94Å; F47-F118 HydrophobicContact CE1-CE1 3.94Å; F47-F118 AromaticContact CE2-CD1 3.92Å; F47-F118 HydrophobicContact CE2-CD1 3.92Å; F47-F118 AromaticContact CE2-CE1 3.4Å; F47-F118 HydrophobicContact CE2-CE1 3.4Å; F47-F118 HydrophobicContact CE2-CE2 4.1Å; F47-F118 HydrophobicContact CE2-CG 4.46Å; F47-F118 AromaticContact CE2-CZ 3.5Å; F47-F118 HydrophobicContact CE2-CZ 3.5Å; F47-F118 VanDerWaalsContact CE2-CZ 3.5Å; F47-F118 AromaticContact CZ-CD1 3.45Å; F47-F118 HydrophobicContact CZ-CD1 3.45Å; F47-F118 VanDerWaalsContact CZ-CD1 3.45Å; F47-F118 AromaticContact CZ-CE1 3.28Å; F47-F118 HydrophobicContact CZ-CE1 3.28Å; F47-F118 HydrophobicContact CZ-CG 4.19Å; F47-F118 AromaticContact CZ-CZ 3.91Å; F47-F118 HydrophobicContact CZ-CZ 3.91Å; F118-A120 WeakPolarHBondContact CE2-O 3.16Å; F118-I126 HydrophobicContact CD2-CG1 4.35Å; F118-I126 HydrophobicContact CE2-CD1 3.95Å; F118-I126 HydrophobicContact CE2-CG1 3.82Å; F118-I126 HydrophobicContact CE2-CG2 4.22Å; F118-I126 HydrophobicContact CZ-CG2 4.39Å | ||
| 119 | S | 76 | Confident | 80.4 | Confident | 124 Ų | 124 | 80 Ų | 80 | 87% | 0.867 | 45% | 0.452 | S | S | * | . | trans | -97 | -12.3 | -172.5 | -162.9 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 120 | A | 77.9 | Confident | 80 | Confident | 37 Ų | 37 | 76.9 Ų | 76.9 | 31% | 0.306 | 44% | 0.437 | S | S | . | . | trans | -73.9 | 129.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | F118 A125 I126 | F118-A120 WeakPolarHBondContact CE2-O 3.16Å; A120-A125 HydrophobicContact CB-CB 3.95Å; A120-I126 HydrophobicContact CB-CG1 4.14Å; A120-I126 WeakPolarHBondContact O-CG1 3.3Å | ||
| 121 | T | 76.3 | Confident | 79.9 | Confident | 119 Ų | 119 | 76.8 Ų | 76.8 | 73% | 0.73 | 43% | 0.434 | S | S | * | . | trans | -100.9 | -26.6 | 177.9 | 51.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 122 | D | 79.1 | Confident | 80 | Confident | 105 Ų | 105 | 81.2 Ų | 81.2 | 56% | 0.561 | 46% | 0.455 | S | S | * | . | S | Bend | trans | -77.1 | 133.4 | -177.4 | -62 | -36 | 0 | 0 | 0 | 111 | K124 A125 I126 | D122-K124 PolarHBondContact O-N 3.08Å; D122-K124 VanDerWaalsContact O-N 3.12Å; D122-A125 HydrophobicContact CB-CB 3.94Å; D122-A125 WeakPolarHBondContact O-CA 3.49Å; D122-A125 WeakPolarHBondContact O-CB 3.39Å; D122-A125 PolarHBondContact O-N 3Å; D122-I126 WeakPolarHBondContact O-CG1 3.48Å; D122-I126 PolarHBondContact O-N 3.24Å |
| 123 | P | 75.5 | Confident | 79.9 | Confident | 51 Ų | 51 | 79.5 Ų | 79.5 | 33% | 0.331 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -56.6 | -33.8 | -179 | -28.4 | 35 | 0 | 0 | 0 | 114 | G127 Y131 | P123-G127 PolarHBondContact O-N 3.46Å; P123-Y131 WeakPolarHBondContact CA-OH 3.22Å |
| 124 | K | 75.2 | Confident | 80 | Confident | 208 Ų | 208 | 74.3 Ų | 74.3 | 90% | 0.904 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -72.1 | -29.1 | 175.3 | -69 | -177 | -179.6 | 177.3 | 0 | 112.8 | D122 | D122-K124 PolarHBondContact O-N 3.08Å; D122-K124 VanDerWaalsContact O-N 3.12Å |
| 125 | A | 75 | Confident | 80.5 | Confident | 64 Ų | 64 | 74.3 Ų | 74.3 | 53% | 0.529 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -84.1 | -30.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A120 D122 G127 | A120-A125 HydrophobicContact CB-CB 3.95Å; D122-A125 HydrophobicContact CB-CB 3.94Å; D122-A125 WeakPolarHBondContact O-CA 3.49Å; D122-A125 WeakPolarHBondContact O-CB 3.39Å; D122-A125 PolarHBondContact O-N 3Å; A125-G127 VanDerWaalsContact C-N 3.3Å |
| 126 | I | 75.2 | Confident | 81 | Confident | 15 Ų | 15 | 73.4 Ų | 73.4 | 8% | 0.077 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -64.5 | -38 | 173.4 | -66.5 | 170.7 | 0 | 0 | 0 | 110.5 | P46 F118 A120 D122 N130 Y131 | P46-I126 HydrophobicContact CG-CG2 4.3Å; F118-I126 HydrophobicContact CD2-CG1 4.35Å; F118-I126 HydrophobicContact CE2-CD1 3.95Å; F118-I126 HydrophobicContact CE2-CG1 3.82Å; F118-I126 HydrophobicContact CE2-CG2 4.22Å; F118-I126 HydrophobicContact CZ-CG2 4.39Å; A120-I126 HydrophobicContact CB-CG1 4.14Å; A120-I126 WeakPolarHBondContact O-CG1 3.3Å; D122-I126 WeakPolarHBondContact O-CG1 3.48Å; D122-I126 PolarHBondContact O-N 3.24Å; I126-N130 HydrophobicContact CG2-CB 3.57Å; I126-N130 WeakPolarHBondContact O-CB 3.44Å; I126-N130 VanDerWaalsContact O-CG 3.31Å; I126-N130 PolarHBondContact O-ND2 3.49Å; I126-N130 VanDerWaalsContact O-ND2 3.08Å; I126-Y131 HydrophobicContact CB-CE2 3.84Å; I126-Y131 HydrophobicContact CG2-CD2 3.87Å; I126-Y131 HydrophobicContact CG2-CE2 3.53Å |
| 127 | G | 79.5 | Confident | 81.4 | Confident | 26 Ų | 26 | 69.8 Ų | 69.8 | 27% | 0.268 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | 71.4 | 160.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | P123 A125 R129 N130 Y131 | P123-G127 PolarHBondContact O-N 3.46Å; A125-G127 VanDerWaalsContact C-N 3.3Å; G127-R129 PolarHBondContact O-N 2.99Å; G127-R129 VanDerWaalsContact O-N 3.08Å; G127-N130 PolarHBondContact O-N 3.05Å; G127-Y131 VanDerWaalsContact O-CD2 3.29Å; G127-Y131 WeakPolarHBondContact O-CD2 3.47Å |
| 128 | H | 81.7 | Confident | 82.1 | Confident | 168 Ų | 168 | 66.1 Ų | 66.1 | 78% | 0.778 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -58.5 | -27.3 | -175 | 59.5 | 78.4 | 0 | 0 | 0 | 113.8 | H132 | H128-H132 VanDerWaalsContact O-CB 3.31Å; H128-H132 WeakPolarHBondContact O-CB 3.46Å; H128-H132 PolarHBondContact O-N 3.39Å |
| 129 | R | 81.1 | Confident | 82.8 | Confident | 82 Ų | 82 | 64.3 Ų | 64.3 | 31% | 0.309 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -68.8 | -42.1 | -176.2 | -169 | 174.6 | 69 | -167.5 | -15.3 | 112.5 | G127 H132 A133 P205 L206 P208 | G127-R129 PolarHBondContact O-N 2.99Å; G127-R129 VanDerWaalsContact O-N 3.08Å; R129-H132 PolarHBondContact O-N 3.02Å; R129-A133 PolarHBondContact O-N 3.04Å; R129-P205 PolarHBondContact NH1-O 2.93Å; R129-L206 HydrophobicContact CG-CB 4.33Å; R129-L206 HydrophobicContact CG-CD2 3.71Å; R129-L206 HydrophobicContact CG-CG 3.96Å; R129-L206 PolarHBondContact NE-O 3.47Å; R129-L206 PolarHBondContact NH2-O 3.49Å; R129-P208 VanDerWaalsContact NH2-CD 3.32Å |
| 130 | N | 82.4 | Confident | 83.6 | Confident | 29 Ų | 29 | 58.4 Ų | 58.4 | 16% | 0.155 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -75.1 | -35.9 | -178.3 | -66.8 | -3.6 | 0 | 0 | 0 | 111.5 | I126 G127 A133 G134 | I126-N130 HydrophobicContact CG2-CB 3.57Å; I126-N130 WeakPolarHBondContact O-CB 3.44Å; I126-N130 VanDerWaalsContact O-CG 3.31Å; I126-N130 PolarHBondContact O-ND2 3.49Å; I126-N130 VanDerWaalsContact O-ND2 3.08Å; G127-N130 PolarHBondContact O-N 3.05Å; N130-A133 PolarHBondContact O-N 3.42Å; N130-G134 PolarHBondContact O-N 2.85Å; N130-G134 VanDerWaalsContact O-N 3.1Å |
| 131 | Y | 84.8 | Confident | 84.4 | Confident | 21 Ų | 21 | 56.6 Ų | 56.6 | 8% | 0.082 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.8 | -45.5 | 171 | -73.4 | -75.2 | 0 | 0 | 0 | 111.8 | T42 P46 P123 I126 G127 A133 G134 Y135 | T42-Y131 WeakPolarHBondContact O-CE1 3.41Å; T42-Y131 PolarHBondContact O-OH 2.98Å; P46-Y131 HydrophobicContact CG-CD1 3.86Å; P46-Y131 HydrophobicContact CG-CE1 3.98Å; P46-Y131 HydrophobicContact CG-CG 4.45Å; P123-Y131 WeakPolarHBondContact CA-OH 3.22Å; I126-Y131 HydrophobicContact CB-CE2 3.84Å; I126-Y131 HydrophobicContact CG2-CD2 3.87Å; I126-Y131 HydrophobicContact CG2-CE2 3.53Å; G127-Y131 VanDerWaalsContact O-CD2 3.29Å; G127-Y131 WeakPolarHBondContact O-CD2 3.47Å; Y131-A133 VanDerWaalsContact C-N 3.31Å; Y131-A133 PolarHBondContact O-N 3.43Å; Y131-G134 PolarHBondContact O-N 3.46Å; Y131-Y135 VanDerWaalsContact O-CD2 3.26Å; Y131-Y135 WeakPolarHBondContact O-CD2 3.25Å; Y131-Y135 PolarHBondContact O-N 3Å |
| 132 | H | 86.3 | Confident | 85.4 | Confident | 93 Ų | 93 | 53.8 Ų | 53.8 | 43% | 0.431 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60 | -41.2 | 176.3 | -178.8 | -89.6 | 0 | 0 | 0 | 112.1 | H128 R129 Y135 S136 | H128-H132 VanDerWaalsContact O-CB 3.31Å; H128-H132 WeakPolarHBondContact O-CB 3.46Å; H128-H132 PolarHBondContact O-N 3.39Å; R129-H132 PolarHBondContact O-N 3.02Å; H132-Y135 PolarHBondContact O-N 3.39Å; H132-S136 VanDerWaalsContact O-CB 3.28Å; H132-S136 WeakPolarHBondContact O-CB 3.35Å; H132-S136 PolarHBondContact O-N 2.66Å |
| 133 | A | 85.5 | Confident | 86.2 | Confident | 24 Ų | 24 | 51 Ų | 51 | 20% | 0.198 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | R129 N130 Y131 Y135 S136 M137 L206 | R129-A133 PolarHBondContact O-N 3.04Å; N130-A133 PolarHBondContact O-N 3.42Å; Y131-A133 VanDerWaalsContact C-N 3.31Å; Y131-A133 PolarHBondContact O-N 3.43Å; A133-Y135 PolarHBondContact O-N 3.2Å; A133-S136 PolarHBondContact O-N 3.46Å; A133-M137 VanDerWaalsContact O-CG 3.24Å; A133-M137 WeakPolarHBondContact O-CG 3.43Å; A133-M137 PolarHBondContact O-N 3Å; A133-L206 HydrophobicContact CB-CD2 4.13Å |
| 134 | G | 87.5 | Confident | 87.2 | Confident | 4 Ų | 4 | 48.6 Ų | 48.6 | 4% | 0.041 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.7 | -45.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | N130 Y131 F138 | N130-G134 PolarHBondContact O-N 2.85Å; N130-G134 VanDerWaalsContact O-N 3.1Å; Y131-G134 PolarHBondContact O-N 3.46Å; G134-F138 PolarHBondContact O-N 3.44Å; G134-F138 VanDerWaalsContact O-N 3.09Å |
| 135 | Y | 90.7 | Very high | 88.2 | Confident | 74 Ų | 74 | 38.7 Ų | 38.7 | 29% | 0.29 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -70.8 | -37.3 | 178.9 | -58.2 | -37.4 | 0 | 0 | 0 | 113.2 | L41 W49 Y131 H132 A133 F138 G139 | L41-Y135 WeakPolarHBondContact CB-OH 3.48Å; L41-Y135 HydrophobicContact CD2-CE1 4.33Å; L41-Y135 PolarHBondContact O-OH 3.07Å; W49-Y135 HydrophobicContact CB-CD1 4.47Å; W49-Y135 AromaticContact CD1-CE1 3.66Å; W49-Y135 HydrophobicContact CD2-CD1 4.24Å; W49-Y135 HydrophobicContact CD2-CE1 4.2Å; W49-Y135 AromaticContact CE2-CE1 3.96Å; W49-Y135 HydrophobicContact CG-CD1 4.01Å; W49-Y135 HydrophobicContact CG-CE1 4.02Å; W49-Y135 AromaticContact NE1-CE1 3.61Å; Y131-Y135 VanDerWaalsContact O-CD2 3.26Å; Y131-Y135 WeakPolarHBondContact O-CD2 3.25Å; Y131-Y135 PolarHBondContact O-N 3Å; H132-Y135 PolarHBondContact O-N 3.39Å; A133-Y135 PolarHBondContact O-N 3.2Å; Y135-F138 PolarHBondContact O-N 3.41Å; Y135-G139 PolarHBondContact O-N 3.46Å |
| 136 | S | 89.8 | Confident | 89.3 | Confident | 21 Ų | 21 | 38.7 Ų | 38.7 | 15% | 0.147 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.7 | -44.8 | 174.7 | 166.5 | 0 | 0 | 0 | 0 | 111.2 | H132 A133 F138 G139 A140 Q197 | H132-S136 VanDerWaalsContact O-CB 3.28Å; H132-S136 WeakPolarHBondContact O-CB 3.35Å; H132-S136 PolarHBondContact O-N 2.66Å; A133-S136 PolarHBondContact O-N 3.46Å; S136-F138 VanDerWaalsContact C-N 3.35Å; S136-F138 PolarHBondContact O-N 3.32Å; S136-G139 PolarHBondContact O-N 3.15Å; S136-A140 VanDerWaalsContact O-CB 3.27Å; S136-A140 WeakPolarHBondContact O-CB 3.22Å; S136-A140 PolarHBondContact O-N 3.23Å; S136-Q197 PolarHBondContact OG-O 3.4Å |
| 137 | M | 90.4 | Very high | 90.4 | Very high | 19 Ų | 19 | 39.1 Ų | 39.1 | 9% | 0.094 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.7 | -40.6 | 176.3 | -68.8 | 176.6 | -178.9 | 0 | 0 | 112.4 | S50 I111 M114 A133 G141 | S50-M137 PolarHBondContact OG-SD 3.12Å; I111-M137 HydrophobicContact CG2-CB 3.83Å; I111-M137 HydrophobicContact CG2-CG 3.86Å; I111-M137 HydrophobicContact CG2-SD 4.41Å; M114-M137 HydrophobicContact CB-CE 3.67Å; M114-M137 WeakPolarHBondContact O-CE 3.39Å; A133-M137 VanDerWaalsContact O-CG 3.24Å; A133-M137 WeakPolarHBondContact O-CG 3.43Å; A133-M137 PolarHBondContact O-N 3Å; M137-G141 PolarHBondContact O-N 3.43Å |
| 138 | F | 95.1 | Very high | 91.2 | Very high | 44 Ų | 44 | 37.9 Ų | 37.9 | 19% | 0.193 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.8 | -50.1 | 174.5 | 178.4 | -110.3 | 0 | 0 | 0 | 112.2 | W49 L52 L56 G134 Y135 S136 A140 G141 L142 | W49-F138 HydrophobicContact CB-CB 4.05Å; W49-F138 HydrophobicContact CE3-CB 4.34Å; W49-F138 AromaticContact CE3-CD1 3.72Å; W49-F138 HydrophobicContact CE3-CD1 3.72Å; W49-F138 AromaticContact CE3-CD2 3.95Å; W49-F138 HydrophobicContact CE3-CD2 3.95Å; W49-F138 AromaticContact CE3-CE1 3.94Å; W49-F138 HydrophobicContact CE3-CE1 3.94Å; W49-F138 HydrophobicContact CE3-CE2 4.17Å; W49-F138 AromaticContact CE3-CG 3.72Å; W49-F138 HydrophobicContact CE3-CG 3.72Å; W49-F138 HydrophobicContact CE3-CZ 4.17Å; W49-F138 HydrophobicContact CZ3-CD1 4.03Å; W49-F138 AromaticContact CZ3-CE1 3.79Å; W49-F138 HydrophobicContact CZ3-CE1 3.79Å; W49-F138 HydrophobicContact CZ3-CE2 4.36Å; W49-F138 HydrophobicContact CZ3-CG 4.41Å; W49-F138 AromaticContact CZ3-CZ 3.97Å; W49-F138 HydrophobicContact CZ3-CZ 3.97Å; W49-F138 WeakPolarHBondContact O-CB 3.37Å; L52-F138 HydrophobicContact CB-CD2 4.33Å; L52-F138 HydrophobicContact CB-CE2 4.41Å; L52-F138 HydrophobicContact CD2-CD2 4.22Å; L52-F138 HydrophobicContact CD2-CE2 3.58Å; L52-F138 HydrophobicContact CD2-CZ 4.41Å; L52-F138 HydrophobicContact CG-CD2 4.31Å; L52-F138 HydrophobicContact CG-CE2 3.91Å; L56-F138 HydrophobicContact CD1-CE2 4.03Å; G134-F138 PolarHBondContact O-N 3.44Å; G134-F138 VanDerWaalsContact O-N 3.09Å; Y135-F138 PolarHBondContact O-N 3.41Å; S136-F138 VanDerWaalsContact C-N 3.35Å; S136-F138 PolarHBondContact O-N 3.32Å; F138-A140 VanDerWaalsContact C-N 3.35Å; F138-A140 PolarHBondContact O-N 3.48Å; F138-G141 PolarHBondContact O-N 2.91Å; F138-L142 HydrophobicContact CE1-CD2 4.42Å; F138-L142 HydrophobicContact CZ-CD2 4.42Å; F138-L142 WeakPolarHBondContact O-CB 3.41Å; F138-L142 PolarHBondContact O-N 3.13Å |
| 139 | G | 94.4 | Very high | 91.9 | Very high | 22 Ų | 22 | 31.2 Ų | 31.2 | 23% | 0.227 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.5 | -41.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y135 S136 L142 T143 Q197 | Y135-G139 PolarHBondContact O-N 3.46Å; S136-G139 PolarHBondContact O-N 3.15Å; G139-L142 PolarHBondContact O-N 3.05Å; G139-T143 VanDerWaalsContact O-CB 3.31Å; G139-T143 WeakPolarHBondContact O-CB 3.35Å; G139-T143 PolarHBondContact O-N 3.01Å; G139-T143 PolarHBondContact O-OG1 3.41Å; G139-Q197 PolarHBondContact O-OE1 3.43Å |
| 140 | A | 92.5 | Very high | 92.7 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.2 | -45.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | I111 S136 F138 T143 V144 A194 Q197 V198 | I111-A140 HydrophobicContact CD1-CB 4.09Å; S136-A140 VanDerWaalsContact O-CB 3.27Å; S136-A140 WeakPolarHBondContact O-CB 3.22Å; S136-A140 PolarHBondContact O-N 3.23Å; F138-A140 VanDerWaalsContact C-N 3.35Å; F138-A140 PolarHBondContact O-N 3.48Å; A140-T143 PolarHBondContact O-N 3.12Å; A140-V144 WeakPolarHBondContact O-CG1 3.31Å; A140-V144 PolarHBondContact O-N 3.02Å; A140-A194 HydrophobicContact CB-CB 4.18Å; A140-Q197 HydrophobicContact CB-CB 4.33Å; A140-Q197 VanDerWaalsContact N-OE1 3.07Å; A140-V198 HydrophobicContact CB-CG2 3.34Å |
| 141 | G | 95 | Very high | 93.4 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.4 | -41.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | G53 A57 M137 F138 V144 G145 | G53-G141 WeakPolarHBondContact O-CA 3.3Å; A57-G141 WeakPolarHBondContact CA-O 3.46Å; M137-G141 PolarHBondContact O-N 3.43Å; F138-G141 PolarHBondContact O-N 2.91Å; G141-V144 WeakPolarHBondContact O-CG1 3.43Å; G141-G145 PolarHBondContact O-N 2.73Å |
| 142 | L | 97.3 | Very high | 93.9 | Very high | 59 Ų | 59 | 31.3 Ų | 31.3 | 31% | 0.309 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -67.5 | -42.2 | 176.9 | -172 | 65.9 | 0 | 0 | 0 | 112 | L56 L60 F138 G139 G145 L146 | L56-L142 HydrophobicContact CD1-CD1 4.21Å; L60-L142 HydrophobicContact CD1-CD1 4.48Å; F138-L142 HydrophobicContact CE1-CD2 4.42Å; F138-L142 HydrophobicContact CZ-CD2 4.42Å; F138-L142 WeakPolarHBondContact O-CB 3.41Å; F138-L142 PolarHBondContact O-N 3.13Å; G139-L142 PolarHBondContact O-N 3.05Å; L142-G145 PolarHBondContact O-N 2.67Å; L142-L146 HydrophobicContact CD1-CD1 3.83Å; L142-L146 HydrophobicContact CD1-CG 4.14Å; L142-L146 HydrophobicContact CG-CD1 3.94Å; L142-L146 WeakPolarHBondContact O-CB 3.3Å; L142-L146 WeakPolarHBondContact O-CG 3.39Å; L142-L146 PolarHBondContact O-N 3.02Å |
| 143 | T | 96.2 | Very high | 94.4 | Very high | 48 Ų | 48 | 28.5 Ų | 28.5 | 29% | 0.294 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -61.5 | -50.8 | 179.2 | -59.1 | 0 | 0 | 0 | 0 | 111 | G139 A140 S147 V193 Q197 | G139-T143 VanDerWaalsContact O-CB 3.31Å; G139-T143 WeakPolarHBondContact O-CB 3.35Å; G139-T143 PolarHBondContact O-N 3.01Å; G139-T143 PolarHBondContact O-OG1 3.41Å; A140-T143 PolarHBondContact O-N 3.12Å; T143-S147 WeakPolarHBondContact O-CB 3.42Å; T143-S147 PolarHBondContact O-N 3.44Å; T143-V193 HydrophobicContact CG2-CB 4.38Å; T143-V193 HydrophobicContact CG2-CG1 4.02Å; T143-Q197 PolarHBondContact OG1-NE2 3Å |
| 144 | V | 96.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -66.6 | -43.1 | 179.1 | 69.9 | 0 | 0 | 0 | 0 | 111.4 | A57 M107 A140 G141 S147 N148 V191 A194 | A57-V144 HydrophobicContact CB-CG1 3.71Å; M107-V144 HydrophobicContact CB-CG1 4.17Å; M107-V144 HydrophobicContact CB-CG2 4.23Å; M107-V144 HydrophobicContact CG-CG2 3.99Å; A140-V144 WeakPolarHBondContact O-CG1 3.31Å; A140-V144 PolarHBondContact O-N 3.02Å; G141-V144 WeakPolarHBondContact O-CG1 3.43Å; V144-S147 PolarHBondContact O-N 3.29Å; V144-N148 WeakPolarHBondContact CG2-ND2 3.28Å; V144-N148 WeakPolarHBondContact O-CB 3.21Å; V144-N148 VanDerWaalsContact O-CG 3.22Å; V144-N148 PolarHBondContact O-N 3.12Å; V144-N148 PolarHBondContact O-ND2 3.45Å; V144-V191 HydrophobicContact CG2-CG2 3.99Å; V144-A194 HydrophobicContact CB-CB 4.06Å |
| 145 | G | 96.9 | Very high | 95.3 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.3 | -48.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L60 G141 L142 L149 | L60-G145 WeakPolarHBondContact CB-O 3.27Å; G141-G145 PolarHBondContact O-N 2.73Å; L142-G145 PolarHBondContact O-N 2.67Å; G145-L149 WeakPolarHBondContact O-CB 3.38Å; G145-L149 PolarHBondContact O-N 3Å |
| 146 | L | 97.8 | Very high | 95.6 | Very high | 63 Ų | 63 | 26 Ų | 26 | 33% | 0.33 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -71.5 | -39.7 | 178.7 | -69.8 | 175.2 | 0 | 0 | 0 | 112.6 | L60 L142 N148 L149 F150 | L60-L146 HydrophobicContact CD1-CD2 3.99Å; L60-L146 HydrophobicContact CD1-CG 4.17Å; L142-L146 HydrophobicContact CD1-CD1 3.83Å; L142-L146 HydrophobicContact CD1-CG 4.14Å; L142-L146 HydrophobicContact CG-CD1 3.94Å; L142-L146 WeakPolarHBondContact O-CB 3.3Å; L142-L146 WeakPolarHBondContact O-CG 3.39Å; L142-L146 PolarHBondContact O-N 3.02Å; L146-N148 VanDerWaalsContact C-N 3.31Å; L146-N148 PolarHBondContact O-N 3.04Å; L146-L149 HydrophobicContact CD2-CD2 4.22Å; L146-L149 WeakPolarHBondContact O-CB 3.42Å; L146-L149 PolarHBondContact O-N 3.47Å; L146-F150 HydrophobicContact CB-CE2 4.23Å; L146-F150 WeakPolarHBondContact O-CD2 3.31Å; L146-F150 WeakPolarHBondContact O-CG 3.29Å; L146-F150 PolarHBondContact O-N 2.98Å |
| 147 | S | 97 | Very high | 95.9 | Very high | 24 Ų | 24 | 29.9 Ų | 29.9 | 17% | 0.168 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60 | -44.1 | 176.2 | -170.2 | 0 | 0 | 0 | 0 | 111.3 | T143 V144 C151 I186 | T143-S147 WeakPolarHBondContact O-CB 3.42Å; T143-S147 PolarHBondContact O-N 3.44Å; V144-S147 PolarHBondContact O-N 3.29Å; S147-C151 WeakPolarHBondContact O-CB 3.36Å; S147-C151 PolarHBondContact O-N 2.9Å; S147-I186 PolarHBondContact OG-O 2.99Å; S147-I186 VanDerWaalsContact OG-O 3.08Å |
| 148 | N | 96.4 | Very high | 96.2 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.1 | -37.8 | 176.8 | -74.7 | -8.7 | 0 | 0 | 0 | 112.3 | S61 V100 G104 V144 L146 F150 C151 G152 G187 | S61-N148 WeakPolarHBondContact OG-CB 3.39Å; S61-N148 PolarHBondContact OG-ND2 3.02Å; V100-N148 HydrophobicContact CG1-CB 3.47Å; V100-N148 VanDerWaalsContact CG1-CB 3.47Å; V100-N148 WeakPolarHBondContact CG1-O 3.28Å; V100-N148 PolarHBondContact O-ND2 3.42Å; G104-N148 PolarHBondContact N-ND2 3.26Å; V144-N148 WeakPolarHBondContact CG2-ND2 3.28Å; V144-N148 WeakPolarHBondContact O-CB 3.21Å; V144-N148 VanDerWaalsContact O-CG 3.22Å; V144-N148 PolarHBondContact O-N 3.12Å; V144-N148 PolarHBondContact O-ND2 3.45Å; L146-N148 VanDerWaalsContact C-N 3.31Å; L146-N148 PolarHBondContact O-N 3.04Å; N148-F150 PolarHBondContact O-N 3.15Å; N148-C151 PolarHBondContact O-N 3.42Å; N148-G152 PolarHBondContact O-N 3.44Å; N148-G187 WeakPolarHBondContact OD1-CA 3.16Å |
| 149 | L | 97.5 | Very high | 96.2 | Very high | 28 Ų | 28 | 28.4 Ų | 28.4 | 15% | 0.147 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -55.7 | -53.2 | 173.4 | 177.8 | 67 | 0 | 0 | 0 | 111.2 | V63 G145 L146 G152 V153 | V63-L149 HydrophobicContact CB-CD1 4.24Å; V63-L149 HydrophobicContact CG1-CD1 3.82Å; G145-L149 WeakPolarHBondContact O-CB 3.38Å; G145-L149 PolarHBondContact O-N 3Å; L146-L149 HydrophobicContact CD2-CD2 4.22Å; L146-L149 WeakPolarHBondContact O-CB 3.42Å; L146-L149 PolarHBondContact O-N 3.47Å; L149-G152 PolarHBondContact O-N 2.95Å; L149-V153 WeakPolarHBondContact O-CG2 3.32Å; L149-V153 PolarHBondContact O-N 3.06Å |
| 150 | F | 97.3 | Very high | 96.3 | Very high | 134 Ų | 134 | 28.4 Ų | 28.4 | 59% | 0.588 | 16% | 0.155 | S | C | * | . | H | α-helix | trans | -69.8 | -38.2 | -178.7 | -61 | -45.8 | 0 | 0 | 0 | 112.6 | L146 N148 V153 C154 | L146-F150 HydrophobicContact CB-CE2 4.23Å; L146-F150 WeakPolarHBondContact O-CD2 3.31Å; L146-F150 WeakPolarHBondContact O-CG 3.29Å; L146-F150 PolarHBondContact O-N 2.98Å; N148-F150 PolarHBondContact O-N 3.15Å; F150-V153 PolarHBondContact O-N 3.46Å; F150-C154 VanDerWaalsContact O-CB 3.29Å; F150-C154 WeakPolarHBondContact O-CB 3.45Å; F150-C154 PolarHBondContact O-N 2.84Å |
| 151 | C | 96 | Very high | 96.4 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -58.8 | -49.6 | 174 | 177.7 | 0 | 0 | 0 | 0 | 111.7 | S147 N148 V153 C154 V155 G183 I186 | S147-C151 WeakPolarHBondContact O-CB 3.36Å; S147-C151 PolarHBondContact O-N 2.9Å; N148-C151 PolarHBondContact O-N 3.42Å; C151-V153 PolarHBondContact O-N 3.05Å; C151-C154 PolarHBondContact O-N 3.35Å; C151-V155 WeakPolarHBondContact O-CB 3.48Å; C151-V155 VanDerWaalsContact O-CG2 3.3Å; C151-V155 WeakPolarHBondContact O-CG2 3.35Å; C151-V155 PolarHBondContact O-N 2.74Å; C151-G183 PolarHBondContact SG-O 2.67Å; C151-G183 VanDerWaalsContact SG-O 3.36Å; C151-I186 HydrophobicContact CB-CB 4.36Å |
| 152 | G | 95.6 | Very high | 96.3 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.5 | -40.8 | -180 | 0 | 0 | 0 | 0 | 0 | 113 | G68 N148 L149 G156 | G68-G152 WeakPolarHBondContact CA-O 3.18Å; N148-G152 PolarHBondContact O-N 3.44Å; L149-G152 PolarHBondContact O-N 2.95Å; G152-G156 PolarHBondContact O-N 3.33Å |
| 153 | V | 97.3 | Very high | 96.2 | Very high | 34 Ų | 34 | 27.3 Ų | 27.3 | 21% | 0.206 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66.8 | -43.9 | 175.1 | 175.1 | 0 | 0 | 0 | 0 | 111.3 | W67 L149 F150 C151 G156 I157 | W67-V153 HydrophobicContact CB-CG2 4.13Å; W67-V153 HydrophobicContact CD2-CG2 4.18Å; W67-V153 HydrophobicContact CE3-CG2 4.43Å; W67-V153 HydrophobicContact CG-CG2 4.05Å; L149-V153 WeakPolarHBondContact O-CG2 3.32Å; L149-V153 PolarHBondContact O-N 3.06Å; F150-V153 PolarHBondContact O-N 3.46Å; C151-V153 PolarHBondContact O-N 3.05Å; V153-G156 PolarHBondContact O-N 2.81Å; V153-I157 HydrophobicContact CG1-CD1 3.87Å; V153-I157 VanDerWaalsContact O-CG1 3.32Å; V153-I157 WeakPolarHBondContact O-CG1 3.44Å; V153-I157 PolarHBondContact O-N 3.37Å |
| 154 | C | 96.8 | Very high | 96.1 | Very high | 51 Ų | 51 | 29.3 Ų | 29.3 | 35% | 0.345 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -59.4 | -50.8 | 177.9 | -178.3 | 0 | 0 | 0 | 0 | 111.7 | F150 C151 G156 I157 V158 | F150-C154 VanDerWaalsContact O-CB 3.29Å; F150-C154 WeakPolarHBondContact O-CB 3.45Å; F150-C154 PolarHBondContact O-N 2.84Å; C151-C154 PolarHBondContact O-N 3.35Å; C154-G156 VanDerWaalsContact C-N 3.32Å; C154-G156 PolarHBondContact O-N 2.79Å; C154-I157 PolarHBondContact O-N 3.43Å; C154-V158 WeakPolarHBondContact O-CG2 3.13Å; C154-V158 PolarHBondContact O-N 2.78Å; C154-V158 VanDerWaalsContact O-N 3.09Å |
| 155 | V | 95.9 | Very high | 96 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61 | -41.9 | 177.9 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | F96 C151 I157 V158 G159 E180 | F96-V155 HydrophobicContact CB-CG1 3.93Å; C151-V155 WeakPolarHBondContact O-CB 3.48Å; C151-V155 VanDerWaalsContact O-CG2 3.3Å; C151-V155 WeakPolarHBondContact O-CG2 3.35Å; C151-V155 PolarHBondContact O-N 2.74Å; V155-I157 PolarHBondContact O-N 3.47Å; V155-V158 PolarHBondContact O-N 3.12Å; V155-G159 PolarHBondContact O-N 2.93Å; V155-E180 HydrophobicContact CG1-CG 3.7Å; V155-E180 VanDerWaalsContact CG1-OE1 3.3Å; V155-E180 WeakPolarHBondContact CG1-OE1 3.44Å |
| 156 | G | 95.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.6 | -41.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | I71 T72 G152 V153 C154 G159 S160 | I71-G156 WeakPolarHBondContact CG2-O 3.37Å; T72-G156 WeakPolarHBondContact OG1-CA 3.39Å; T72-G156 PolarHBondContact OG1-O 3.42Å; G152-G156 PolarHBondContact O-N 3.33Å; V153-G156 PolarHBondContact O-N 2.81Å; C154-G156 VanDerWaalsContact C-N 3.32Å; C154-G156 PolarHBondContact O-N 2.79Å; G156-G159 PolarHBondContact O-N 2.95Å; G156-S160 WeakPolarHBondContact O-CB 3.49Å; G156-S160 PolarHBondContact O-N 2.8Å |
| 157 | I | 97.3 | Very high | 95.6 | Very high | 101 Ų | 101 | 28.3 Ų | 28.3 | 52% | 0.518 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -66.1 | -44 | 177 | -66.8 | 166.4 | 0 | 0 | 0 | 110.6 | I71 V153 C154 V155 S160 G161 | I71-I157 HydrophobicContact CD1-CG1 4.2Å; V153-I157 HydrophobicContact CG1-CD1 3.87Å; V153-I157 VanDerWaalsContact O-CG1 3.32Å; V153-I157 WeakPolarHBondContact O-CG1 3.44Å; V153-I157 PolarHBondContact O-N 3.37Å; C154-I157 PolarHBondContact O-N 3.43Å; V155-I157 PolarHBondContact O-N 3.47Å; I157-S160 PolarHBondContact O-N 2.92Å; I157-G161 PolarHBondContact O-N 3.43Å |
| 158 | V | 96.4 | Very high | 95.4 | Very high | 32 Ų | 32 | 34.2 Ų | 34.2 | 19% | 0.194 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.4 | -42.8 | 177 | 175.5 | 0 | 0 | 0 | 0 | 111 | C154 V155 S160 G161 A162 I176 V179 E180 | C154-V158 WeakPolarHBondContact O-CG2 3.13Å; C154-V158 PolarHBondContact O-N 2.78Å; C154-V158 VanDerWaalsContact O-N 3.09Å; V155-V158 PolarHBondContact O-N 3.12Å; V158-S160 PolarHBondContact O-N 2.86Å; V158-G161 PolarHBondContact O-N 3.04Å; V158-A162 PolarHBondContact O-N 2.94Å; V158-I176 HydrophobicContact CG1-CG2 4.13Å; V158-V179 HydrophobicContact CG1-CB 4.19Å; V158-V179 HydrophobicContact CG1-CG1 4.13Å; V158-V179 HydrophobicContact CG2-CG1 4.28Å; V158-E180 HydrophobicContact CG1-CB 4.24Å |
| 159 | G | 95.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.3 | -38.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | V155 G156 A162 A163 | V155-G159 PolarHBondContact O-N 2.93Å; G156-G159 PolarHBondContact O-N 2.95Å; G159-A162 PolarHBondContact O-N 3.34Å; G159-A163 WeakPolarHBondContact O-CB 3.48Å; G159-A163 PolarHBondContact O-N 3.14Å |
| 160 | S | 95.9 | Very high | 94.9 | Very high | 22 Ų | 22 | 40.1 Ų | 40.1 | 15% | 0.154 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.5 | -47 | 170.7 | 166.8 | 0 | 0 | 0 | 0 | 111.9 | S75 G156 I157 V158 A162 A163 L164 | S75-S160 WeakPolarHBondContact CB-OG 3.4Å; S75-S160 WeakPolarHBondContact OG-CB 3.07Å; S75-S160 PolarHBondContact OG-OG 3.41Å; G156-S160 WeakPolarHBondContact O-CB 3.49Å; G156-S160 PolarHBondContact O-N 2.8Å; I157-S160 PolarHBondContact O-N 2.92Å; V158-S160 PolarHBondContact O-N 2.86Å; S160-A162 VanDerWaalsContact C-N 3.34Å; S160-A162 PolarHBondContact O-N 3.42Å; S160-A163 PolarHBondContact O-N 2.97Å; S160-L164 WeakPolarHBondContact O-CG 3.49Å; S160-L164 PolarHBondContact O-N 3.44Å; S160-L164 VanDerWaalsContact O-N 3.15Å |
| 161 | G | 94.4 | Very high | 94.6 | Very high | 37 Ų | 37 | 37.9 Ų | 37.9 | 38% | 0.381 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.3 | -41 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | I157 V158 L164 A165 | I157-G161 PolarHBondContact O-N 3.43Å; V158-G161 PolarHBondContact O-N 3.04Å; G161-L164 PolarHBondContact O-N 3.11Å; G161-A165 WeakPolarHBondContact O-CB 3.43Å; G161-A165 PolarHBondContact O-N 3.47Å |
| 162 | A | 93.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.4 | -43 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V158 G159 S160 A165 D166 I176 | V158-A162 PolarHBondContact O-N 2.94Å; G159-A162 PolarHBondContact O-N 3.34Å; S160-A162 VanDerWaalsContact C-N 3.34Å; S160-A162 PolarHBondContact O-N 3.42Å; A162-A165 PolarHBondContact O-N 3.41Å; A162-D166 WeakPolarHBondContact O-CB 3.49Å; A162-D166 PolarHBondContact O-N 3.24Å; A162-I176 HydrophobicContact CB-CB 4.17Å; A162-I176 HydrophobicContact CB-CG2 3.61Å |
| 163 | A | 94.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.9 | -43.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I76 N90 G159 S160 A167 | I76-A163 HydrophobicContact CG1-CB 3.74Å; N90-A163 VanDerWaalsContact ND2-CA 3.3Å; N90-A163 WeakPolarHBondContact ND2-CA 3.39Å; G159-A163 WeakPolarHBondContact O-CB 3.48Å; G159-A163 PolarHBondContact O-N 3.14Å; S160-A163 PolarHBondContact O-N 2.97Å; A163-A167 PolarHBondContact O-N 3.49Å |
| 164 | L | 94.5 | Very high | 93.5 | Very high | 90 Ų | 90 | 45.4 Ų | 45.4 | 47% | 0.471 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -70 | -36.8 | 178.7 | -67 | 174.1 | 0 | 0 | 0 | 112.3 | S160 G161 | S160-L164 WeakPolarHBondContact O-CG 3.49Å; S160-L164 PolarHBondContact O-N 3.44Å; S160-L164 VanDerWaalsContact O-N 3.15Å; G161-L164 PolarHBondContact O-N 3.11Å |
| 165 | A | 94 | Very high | 93.3 | Very high | 24 Ų | 24 | 50.3 Ų | 50.3 | 20% | 0.198 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -68.5 | -42.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | G161 A162 A167 Q168 N169 I176 | G161-A165 WeakPolarHBondContact O-CB 3.43Å; G161-A165 PolarHBondContact O-N 3.47Å; A162-A165 PolarHBondContact O-N 3.41Å; A165-A167 VanDerWaalsContact C-N 3.27Å; A165-A167 PolarHBondContact O-N 2.94Å; A165-Q168 PolarHBondContact O-N 3.42Å; A165-Q168 VanDerWaalsContact O-N 3.13Å; A165-N169 PolarHBondContact O-N 3.36Å; A165-I176 HydrophobicContact CB-CD1 3.59Å |
| 166 | D | 93.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.1 | -33.1 | 177.7 | -169.8 | 61.8 | 0 | 0 | 0 | 112.2 | I86 N90 A162 Q168 N169 P170 F173 | I86-D166 HydrophobicContact CG2-CB 4.43Å; I86-D166 VanDerWaalsContact CG2-OD2 3.25Å; I86-D166 WeakPolarHBondContact CG2-OD2 3.45Å; N90-D166 PolarHBondContact OD1-OD2 3.02Å; A162-D166 WeakPolarHBondContact O-CB 3.49Å; A162-D166 PolarHBondContact O-N 3.24Å; D166-Q168 PolarHBondContact O-N 3.28Å; D166-N169 PolarHBondContact O-N 3.47Å; D166-P170 VanDerWaalsContact OD1-CA 3.25Å; D166-P170 WeakPolarHBondContact OD1-CA 3.26Å; D166-F173 HydrophobicContact CB-CB 4.3Å; D166-F173 WeakPolarHBondContact OD1-CB 3.24Å |
| 167 | A | 92.7 | Very high | 92.8 | Very high | 17 Ų | 17 | 53.8 Ų | 53.8 | 14% | 0.14 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60 | -34.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A83 I86 A163 A165 | A83-A167 HydrophobicContact CB-CB 4.5Å; I86-A167 HydrophobicContact CD1-CB 4.1Å; I86-A167 HydrophobicContact CG2-CB 4.36Å; A163-A167 PolarHBondContact O-N 3.49Å; A165-A167 VanDerWaalsContact C-N 3.27Å; A165-A167 PolarHBondContact O-N 2.94Å |
| 168 | Q | 94.1 | Very high | 92.6 | Very high | 148 Ų | 148 | 53.4 Ų | 53.4 | 69% | 0.692 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -81.1 | -51.6 | 175.5 | -58.1 | -56.1 | -41.9 | 0 | 0 | 111.5 | A165 D166 | A165-Q168 PolarHBondContact O-N 3.42Å; A165-Q168 VanDerWaalsContact O-N 3.13Å; D166-Q168 PolarHBondContact O-N 3.28Å |
| 169 | N | 93.1 | Very high | 92.5 | Very high | 91 Ų | 91 | 55.7 Ų | 55.7 | 49% | 0.487 | 32% | 0.315 | S | S | . | . | trans | -142.2 | 112.8 | -170.9 | -79 | -51.1 | 0 | 0 | 0 | 111 | A165 D166 S171 L172 | A165-N169 PolarHBondContact O-N 3.36Å; D166-N169 PolarHBondContact O-N 3.47Å; N169-S171 PolarHBondContact O-N 3.36Å; N169-S171 VanDerWaalsContact O-N 3.13Å; N169-L172 HydrophobicContact CB-CD1 3.47Å; N169-L172 VanDerWaalsContact CB-CD1 3.47Å; N169-L172 PolarHBondContact O-N 2.94Å | ||
| 170 | P | 89.4 | Confident | 92.4 | Very high | 61 Ų | 61 | 55.7 Ų | 55.7 | 40% | 0.396 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -9.6 | -171.5 | 28.6 | -35.5 | 0 | 0 | 0 | 115 | D166 L172 | D166-P170 VanDerWaalsContact OD1-CA 3.25Å; D166-P170 WeakPolarHBondContact OD1-CA 3.26Å; P170-L172 VanDerWaalsContact C-N 3.31Å |
| 171 | S | 91.7 | Very high | 92.2 | Very high | 87 Ų | 87 | 57.5 Ų | 57.5 | 61% | 0.608 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | -8.4 | 178.3 | 56.5 | 0 | 0 | 0 | 0 | 113.4 | N169 | N169-S171 PolarHBondContact O-N 3.36Å; N169-S171 VanDerWaalsContact O-N 3.13Å |
| 172 | L | 89.5 | Confident | 92.1 | Very high | 68 Ų | 68 | 62.9 Ų | 62.9 | 36% | 0.356 | 34% | 0.335 | S | S | . | . | S | Bend | trans | -89.9 | -21.5 | -177.1 | -82.2 | 84 | 0 | 0 | 0 | 113.4 | N169 P170 V174 K175 I176 | N169-L172 HydrophobicContact CB-CD1 3.47Å; N169-L172 VanDerWaalsContact CB-CD1 3.47Å; N169-L172 PolarHBondContact O-N 2.94Å; P170-L172 VanDerWaalsContact C-N 3.31Å; L172-V174 PolarHBondContact O-N 3.31Å; L172-K175 PolarHBondContact O-N 3.41Å; L172-K175 VanDerWaalsContact O-N 3.14Å; L172-I176 HydrophobicContact CB-CD1 4.47Å; L172-I176 PolarHBondContact O-N 3.12Å |
| 173 | F | 86.9 | Confident | 92 | Very high | 21 Ų | 21 | 63.2 Ų | 63.2 | 9% | 0.092 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -55.1 | -50.9 | -174.8 | 176 | -108.4 | 0 | 0 | 0 | 113.4 | K89 N90 D166 K175 I176 L177 | K89-F173 VanDerWaalsContact O-CZ 3.28Å; K89-F173 WeakPolarHBondContact O-CZ 3.36Å; N90-F173 HydrophobicContact CB-CE2 4.4Å; N90-F173 WeakPolarHBondContact ND2-CD2 3.14Å; N90-F173 WeakPolarHBondContact ND2-CE2 3.39Å; D166-F173 HydrophobicContact CB-CB 4.3Å; D166-F173 WeakPolarHBondContact OD1-CB 3.24Å; F173-K175 PolarHBondContact O-N 2.83Å; F173-I176 PolarHBondContact O-N 3.02Å; F173-I176 VanDerWaalsContact O-N 3.13Å; F173-L177 HydrophobicContact CE1-CD1 3.88Å; F173-L177 HydrophobicContact CZ-CD1 3.83Å; F173-L177 WeakPolarHBondContact O-CB 3.24Å; F173-L177 PolarHBondContact O-N 3.41Å |
| 174 | V | 89.1 | Confident | 91.8 | Very high | 104 Ų | 104 | 63.3 Ų | 63.3 | 63% | 0.63 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -61.8 | -32.3 | -177.9 | -176.8 | 0 | 0 | 0 | 0 | 112 | L172 | L172-V174 PolarHBondContact O-N 3.31Å |
| 175 | K | 92 | Very high | 91.6 | Very high | 153 Ų | 153 | 60.4 Ų | 60.4 | 67% | 0.665 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -71.8 | -37.2 | 178.9 | -60.3 | -176.7 | -177.7 | -179 | 0 | 111.9 | L172 F173 | L172-K175 PolarHBondContact O-N 3.41Å; L172-K175 VanDerWaalsContact O-N 3.14Å; F173-K175 PolarHBondContact O-N 2.83Å |
| 176 | I | 91.4 | Very high | 91.6 | Very high | 39 Ų | 39 | 62.8 Ų | 62.8 | 20% | 0.2 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -77.5 | -31.7 | 179.7 | -58.7 | 169.8 | 0 | 0 | 0 | 110.8 | V158 A162 A165 L172 F173 I178 V179 E180 | V158-I176 HydrophobicContact CG1-CG2 4.13Å; A162-I176 HydrophobicContact CB-CB 4.17Å; A162-I176 HydrophobicContact CB-CG2 3.61Å; A165-I176 HydrophobicContact CB-CD1 3.59Å; L172-I176 HydrophobicContact CB-CD1 4.47Å; L172-I176 PolarHBondContact O-N 3.12Å; F173-I176 PolarHBondContact O-N 3.02Å; F173-I176 VanDerWaalsContact O-N 3.13Å; I176-I178 PolarHBondContact O-N 3.2Å; I176-V179 WeakPolarHBondContact O-CB 3.37Å; I176-V179 PolarHBondContact O-N 3.34Å; I176-E180 PolarHBondContact O-N 2.99Å |
| 177 | L | 90.4 | Very high | 91.4 | Very high | 35 Ų | 35 | 62.8 Ų | 62.8 | 18% | 0.183 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -57.7 | -31 | 177.2 | -174.2 | 143.5 | 0 | 0 | 0 | 113 | V92 F173 V179 E180 I181 | V92-L177 HydrophobicContact CG1-CD1 4.12Å; F173-L177 HydrophobicContact CE1-CD1 3.88Å; F173-L177 HydrophobicContact CZ-CD1 3.83Å; F173-L177 WeakPolarHBondContact O-CB 3.24Å; F173-L177 PolarHBondContact O-N 3.41Å; L177-V179 VanDerWaalsContact C-N 3.28Å; L177-V179 PolarHBondContact O-N 3.44Å; L177-E180 WeakPolarHBondContact O-CB 3.38Å; L177-E180 PolarHBondContact O-N 3.43Å; L177-E180 VanDerWaalsContact O-N 3.13Å; L177-I181 HydrophobicContact CD2-CD1 3.63Å; L177-I181 HydrophobicContact CD2-CG1 4.16Å; L177-I181 WeakPolarHBondContact O-CG1 3.34Å; L177-I181 PolarHBondContact O-N 3.37Å |
| 178 | I | 92.9 | Very high | 91.2 | Very high | 92 Ų | 92 | 65 Ų | 65 | 47% | 0.472 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.2 | -39.2 | 174.9 | -62.8 | 169.2 | 0 | 0 | 0 | 111.3 | I176 E180 I181 F182 | I176-I178 PolarHBondContact O-N 3.2Å; I178-E180 VanDerWaalsContact C-N 3.29Å; I178-E180 PolarHBondContact O-N 2.89Å; I178-I181 PolarHBondContact O-N 3.39Å; I178-F182 HydrophobicContact CG2-CD2 4.03Å; I178-F182 HydrophobicContact CG2-CE2 3.59Å; I178-F182 WeakPolarHBondContact O-CD2 3.35Å; I178-F182 PolarHBondContact O-N 2.87Å |
| 179 | V | 93.6 | Very high | 91.1 | Very high | 80 Ų | 80 | 64.5 Ų | 64.5 | 49% | 0.485 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -67.5 | -35.7 | 177.7 | -175.2 | 0 | 0 | 0 | 0 | 110.6 | V158 I176 L177 F182 G183 | V158-V179 HydrophobicContact CG1-CB 4.19Å; V158-V179 HydrophobicContact CG1-CG1 4.13Å; V158-V179 HydrophobicContact CG2-CG1 4.28Å; I176-V179 WeakPolarHBondContact O-CB 3.37Å; I176-V179 PolarHBondContact O-N 3.34Å; L177-V179 VanDerWaalsContact C-N 3.28Å; L177-V179 PolarHBondContact O-N 3.44Å; V179-F182 PolarHBondContact O-N 3.47Å; V179-G183 PolarHBondContact O-N 3.09Å |
| 180 | E | 92.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -65 | -39.4 | 177.3 | -160.9 | 169.9 | -178.9 | 0 | 0 | 112.2 | S93 F96 V155 V158 I176 L177 I178 G183 S184 | S93-E180 WeakPolarHBondContact CA-OE1 3.48Å; S93-E180 WeakPolarHBondContact CB-OE1 3.42Å; S93-E180 WeakPolarHBondContact CB-OE2 3.39Å; S93-E180 VanDerWaalsContact OG-CD 3.32Å; S93-E180 PolarHBondContact OG-OE1 2.86Å; S93-E180 PolarHBondContact OG-OE2 2.89Å; F96-E180 HydrophobicContact CD2-CG 4.01Å; V155-E180 HydrophobicContact CG1-CG 3.7Å; V155-E180 VanDerWaalsContact CG1-OE1 3.3Å; V155-E180 WeakPolarHBondContact CG1-OE1 3.44Å; V158-E180 HydrophobicContact CG1-CB 4.24Å; I176-E180 PolarHBondContact O-N 2.99Å; L177-E180 WeakPolarHBondContact O-CB 3.38Å; L177-E180 PolarHBondContact O-N 3.43Å; L177-E180 VanDerWaalsContact O-N 3.13Å; I178-E180 VanDerWaalsContact C-N 3.29Å; I178-E180 PolarHBondContact O-N 2.89Å; E180-G183 PolarHBondContact O-N 3.3Å; E180-S184 PolarHBondContact O-N 3.05Å |
| 181 | I | 92.8 | Very high | 91.1 | Very high | 61 Ų | 61 | 57.8 Ų | 57.8 | 31% | 0.313 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 173.9 | -64.8 | 169.6 | 0 | 0 | 0 | 110.6 | F96 L177 I178 G183 S184 A185 | F96-I181 HydrophobicContact CZ-CG1 4.44Å; L177-I181 HydrophobicContact CD2-CD1 3.63Å; L177-I181 HydrophobicContact CD2-CG1 4.16Å; L177-I181 WeakPolarHBondContact O-CG1 3.34Å; L177-I181 PolarHBondContact O-N 3.37Å; I178-I181 PolarHBondContact O-N 3.39Å; I181-G183 VanDerWaalsContact C-N 3.29Å; I181-G183 PolarHBondContact O-N 2.85Å; I181-S184 PolarHBondContact O-N 3.49Å; I181-S184 PolarHBondContact O-OG 3.33Å; I181-A185 PolarHBondContact O-N 2.99Å; I181-A185 VanDerWaalsContact O-N 3.15Å |
| 182 | F | 93.3 | Very high | 91 | Very high | 149 Ų | 149 | 57.5 Ų | 57.5 | 65% | 0.654 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -63.6 | -35.2 | 176.2 | -72.4 | -59.9 | 0 | 0 | 0 | 112.7 | I178 V179 A185 | I178-F182 HydrophobicContact CG2-CD2 4.03Å; I178-F182 HydrophobicContact CG2-CE2 3.59Å; I178-F182 WeakPolarHBondContact O-CD2 3.35Å; I178-F182 PolarHBondContact O-N 2.87Å; V179-F182 PolarHBondContact O-N 3.47Å; F182-A185 WeakPolarHBondContact O-CB 3.27Å; F182-A185 PolarHBondContact O-N 3.25Å |
| 183 | G | 90.4 | Very high | 91.2 | Very high | 7 Ų | 7 | 57.3 Ų | 57.3 | 7% | 0.072 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.3 | -47.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112 | C151 V179 E180 I181 A185 I186 | C151-G183 PolarHBondContact SG-O 2.67Å; C151-G183 VanDerWaalsContact SG-O 3.36Å; V179-G183 PolarHBondContact O-N 3.09Å; E180-G183 PolarHBondContact O-N 3.3Å; I181-G183 VanDerWaalsContact C-N 3.29Å; I181-G183 PolarHBondContact O-N 2.85Å; G183-A185 PolarHBondContact O-N 3.45Å; G183-I186 WeakPolarHBondContact O-CB 3.39Å; G183-I186 WeakPolarHBondContact O-CG1 3.36Å; G183-I186 PolarHBondContact O-N 3.26Å |
| 184 | S | 90.1 | Very high | 91.3 | Very high | 3 Ų | 3 | 56.3 Ų | 56.3 | 2% | 0.021 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65.8 | -23.9 | -179.9 | 71 | 0 | 0 | 0 | 0 | 114.1 | E180 I181 I186 G187 | E180-S184 PolarHBondContact O-N 3.05Å; I181-S184 PolarHBondContact O-N 3.49Å; I181-S184 PolarHBondContact O-OG 3.33Å; S184-I186 PolarHBondContact O-N 3.29Å; S184-G187 PolarHBondContact O-N 3.46Å |
| 185 | A | 91.1 | Very high | 91.2 | Very high | 28 Ų | 28 | 53.3 Ų | 53.3 | 23% | 0.231 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.7 | -25.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113.3 | I181 F182 G183 G187 L188 F189 | I181-A185 PolarHBondContact O-N 2.99Å; I181-A185 VanDerWaalsContact O-N 3.15Å; F182-A185 WeakPolarHBondContact O-CB 3.27Å; F182-A185 PolarHBondContact O-N 3.25Å; G183-A185 PolarHBondContact O-N 3.45Å; A185-G187 VanDerWaalsContact C-N 3.32Å; A185-G187 PolarHBondContact O-N 3.31Å; A185-L188 PolarHBondContact O-N 2.94Å; A185-F189 WeakPolarHBondContact O-CD2 3.21Å; A185-F189 PolarHBondContact O-N 3.43Å; A185-F189 VanDerWaalsContact O-N 3.08Å |
| 186 | I | 92.8 | Very high | 90.9 | Very high | 75 Ų | 75 | 51.5 Ų | 51.5 | 39% | 0.385 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.2 | -41.5 | 176.7 | -57.4 | 171.9 | 0 | 0 | 0 | 110.5 | S147 C151 G183 S184 L188 F189 G190 | S147-I186 PolarHBondContact OG-O 2.99Å; S147-I186 VanDerWaalsContact OG-O 3.08Å; C151-I186 HydrophobicContact CB-CB 4.36Å; G183-I186 WeakPolarHBondContact O-CB 3.39Å; G183-I186 WeakPolarHBondContact O-CG1 3.36Å; G183-I186 PolarHBondContact O-N 3.26Å; S184-I186 PolarHBondContact O-N 3.29Å; I186-L188 VanDerWaalsContact C-N 3.35Å; I186-L188 PolarHBondContact O-N 3.36Å; I186-F189 PolarHBondContact O-N 3.44Å; I186-G190 PolarHBondContact O-N 2.96Å |
| 187 | G | 89.3 | Confident | 90.7 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.7 | -42.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | N148 S184 A185 F189 G190 V191 | N148-G187 WeakPolarHBondContact OD1-CA 3.16Å; S184-G187 PolarHBondContact O-N 3.46Å; A185-G187 VanDerWaalsContact C-N 3.32Å; A185-G187 PolarHBondContact O-N 3.31Å; G187-F189 PolarHBondContact O-N 2.99Å; G187-G190 PolarHBondContact O-N 3.12Å; G187-V191 PolarHBondContact O-N 2.94Å; G187-V191 VanDerWaalsContact O-N 3.13Å |
| 188 | L | 89.4 | Confident | 90.3 | Very high | 63 Ų | 63 | 52.5 Ų | 52.5 | 33% | 0.33 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.3 | -39.5 | 177.1 | -70.2 | 174.2 | 0 | 0 | 0 | 112.5 | Y103 A185 I186 G190 V191 I192 | Y103-L188 HydrophobicContact CE1-CD2 3.98Å; Y103-L188 HydrophobicContact CE2-CD2 3.92Å; Y103-L188 HydrophobicContact CE2-CG 4.22Å; A185-L188 PolarHBondContact O-N 2.94Å; I186-L188 VanDerWaalsContact C-N 3.35Å; I186-L188 PolarHBondContact O-N 3.36Å; L188-G190 VanDerWaalsContact C-N 3.32Å; L188-G190 PolarHBondContact O-N 3.05Å; L188-V191 PolarHBondContact O-N 2.87Å; L188-I192 WeakPolarHBondContact O-CG1 3.34Å; L188-I192 PolarHBondContact O-N 3.25Å |
| 189 | F | 92.3 | Very high | 89.4 | Confident | 137 Ų | 137 | 51.7 Ų | 51.7 | 60% | 0.601 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -62.4 | -40.2 | 174.4 | -66.1 | -37.4 | 0 | 0 | 0 | 112.2 | A185 I186 G187 V191 I192 V193 | A185-F189 WeakPolarHBondContact O-CD2 3.21Å; A185-F189 PolarHBondContact O-N 3.43Å; A185-F189 VanDerWaalsContact O-N 3.08Å; I186-F189 PolarHBondContact O-N 3.44Å; G187-F189 PolarHBondContact O-N 2.99Å; F189-V191 VanDerWaalsContact C-N 3.32Å; F189-V191 PolarHBondContact O-N 3.45Å; F189-I192 HydrophobicContact CD1-CD1 4.38Å; F189-I192 PolarHBondContact O-N 3.32Å; F189-V193 WeakPolarHBondContact O-CG2 3.33Å; F189-V193 PolarHBondContact O-N 2.96Å |
| 190 | G | 91.3 | Very high | 87.8 | Confident | 5 Ų | 5 | 51.7 Ų | 51.7 | 5% | 0.052 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.4 | -42.7 | 174 | 0 | 0 | 0 | 0 | 0 | 113 | I186 G187 L188 A194 | I186-G190 PolarHBondContact O-N 2.96Å; G187-G190 PolarHBondContact O-N 3.12Å; L188-G190 VanDerWaalsContact C-N 3.32Å; L188-G190 PolarHBondContact O-N 3.05Å; G190-A194 WeakPolarHBondContact O-CB 3.42Å; G190-A194 PolarHBondContact O-N 2.71Å |
| 191 | V | 90 | Very high | 85.3 | Confident | 6 Ų | 6 | 57.5 Ų | 57.5 | 4% | 0.036 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 176.2 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | Y103 M107 V144 G187 L188 F189 V193 A194 I195 L245 | Y103-V191 HydrophobicContact CG-CG2 4.28Å; M107-V191 HydrophobicContact CG-CG1 4.1Å; M107-V191 HydrophobicContact CG-CG2 4.3Å; M107-V191 HydrophobicContact SD-CG1 3.91Å; V144-V191 HydrophobicContact CG2-CG2 3.99Å; G187-V191 PolarHBondContact O-N 2.94Å; G187-V191 VanDerWaalsContact O-N 3.13Å; L188-V191 PolarHBondContact O-N 2.87Å; F189-V191 VanDerWaalsContact C-N 3.32Å; F189-V191 PolarHBondContact O-N 3.45Å; V191-V193 VanDerWaalsContact C-N 3.34Å; V191-V193 PolarHBondContact O-N 3.33Å; V191-A194 PolarHBondContact O-N 3.34Å; V191-I195 HydrophobicContact CG1-CD1 3.83Å; V191-I195 HydrophobicContact CG1-CG1 4.43Å; V191-I195 WeakPolarHBondContact O-CG1 3.27Å; V191-I195 PolarHBondContact O-N 2.89Å; V191-L245 HydrophobicContact CG1-CD1 4.26Å |
| 192 | I | 91.1 | Very high | 82.7 | Confident | 81 Ų | 81 | 61 Ų | 61 | 42% | 0.415 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.5 | -47.4 | 179.7 | -68.1 | 164.4 | 0 | 0 | 0 | 110.4 | L188 F189 A194 I195 L196 | L188-I192 WeakPolarHBondContact O-CG1 3.34Å; L188-I192 PolarHBondContact O-N 3.25Å; F189-I192 HydrophobicContact CD1-CD1 4.38Å; F189-I192 PolarHBondContact O-N 3.32Å; I192-A194 PolarHBondContact O-N 2.84Å; I192-I195 PolarHBondContact O-N 3.4Å; I192-L196 HydrophobicContact CG2-CD1 4.19Å; I192-L196 WeakPolarHBondContact O-CG 3.34Å; I192-L196 PolarHBondContact O-N 3.41Å |
| 193 | V | 91.9 | Very high | 80.3 | Confident | 64 Ų | 64 | 58.2 Ų | 58.2 | 39% | 0.388 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 179 | 175.1 | 0 | 0 | 0 | 0 | 111.1 | T143 F189 V191 I195 L196 Q197 | T143-V193 HydrophobicContact CG2-CB 4.38Å; T143-V193 HydrophobicContact CG2-CG1 4.02Å; F189-V193 WeakPolarHBondContact O-CG2 3.33Å; F189-V193 PolarHBondContact O-N 2.96Å; V191-V193 VanDerWaalsContact C-N 3.34Å; V191-V193 PolarHBondContact O-N 3.33Å; V193-I195 PolarHBondContact O-N 2.89Å; V193-L196 PolarHBondContact O-N 3.04Å; V193-Q197 HydrophobicContact CG1-CG 4.41Å; V193-Q197 WeakPolarHBondContact O-CG 3.21Å; V193-Q197 PolarHBondContact O-N 3.46Å |
| 194 | A | 89.8 | Confident | 77.8 | Confident | 0 Ų | 0 | 65.1 Ų | 65.1 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | M107 A140 V144 G190 V191 I192 Q197 V198 | M107-A194 HydrophobicContact CE-CB 3.87Å; A140-A194 HydrophobicContact CB-CB 4.18Å; V144-A194 HydrophobicContact CB-CB 4.06Å; G190-A194 WeakPolarHBondContact O-CB 3.42Å; G190-A194 PolarHBondContact O-N 2.71Å; V191-A194 PolarHBondContact O-N 3.34Å; I192-A194 PolarHBondContact O-N 2.84Å; A194-Q197 PolarHBondContact O-N 3.21Å; A194-V198 WeakPolarHBondContact O-CG2 3.3Å; A194-V198 PolarHBondContact O-N 3.48Å |
| 195 | I | 87.1 | Confident | 75.5 | Confident | 41 Ų | 41 | 69.2 Ų | 69.2 | 21% | 0.21 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -62.1 | -45 | 174.7 | -69 | 170.8 | 0 | 0 | 0 | 110.5 | M107 V191 I192 V193 Q197 V198 M199 L245 | M107-I195 HydrophobicContact CE-CG1 3.74Å; M107-I195 HydrophobicContact SD-CD1 4.03Å; M107-I195 HydrophobicContact SD-CG1 3.61Å; V191-I195 HydrophobicContact CG1-CD1 3.83Å; V191-I195 HydrophobicContact CG1-CG1 4.43Å; V191-I195 WeakPolarHBondContact O-CG1 3.27Å; V191-I195 PolarHBondContact O-N 2.89Å; I192-I195 PolarHBondContact O-N 3.4Å; V193-I195 PolarHBondContact O-N 2.89Å; I195-Q197 VanDerWaalsContact C-N 3.32Å; I195-Q197 PolarHBondContact O-N 3.1Å; I195-V198 PolarHBondContact O-N 3Å; I195-M199 HydrophobicContact CG2-CE 4.03Å; I195-M199 HydrophobicContact CG2-CG 3.99Å; I195-M199 HydrophobicContact CG2-SD 3.38Å; I195-M199 WeakPolarHBondContact CG2-SD 3.38Å; I195-M199 VanDerWaalsContact O-CB 3.29Å; I195-M199 WeakPolarHBondContact O-CB 3.27Å; I195-M199 VanDerWaalsContact O-CG 3.27Å; I195-M199 WeakPolarHBondContact O-CG 3.26Å; I195-M199 PolarHBondContact O-N 3.36Å; I195-L245 HydrophobicContact CD1-CD1 4.38Å |
| 196 | L | 86.6 | Confident | 73.5 | Confident | 115 Ų | 115 | 71.2 Ų | 71.2 | 60% | 0.602 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -63.3 | -35.5 | 178.4 | -72.5 | 176.6 | 0 | 0 | 0 | 113.3 | I192 V193 V198 M199 | I192-L196 HydrophobicContact CG2-CD1 4.19Å; I192-L196 WeakPolarHBondContact O-CG 3.34Å; I192-L196 PolarHBondContact O-N 3.41Å; V193-L196 PolarHBondContact O-N 3.04Å; L196-V198 VanDerWaalsContact C-N 3.29Å; L196-V198 PolarHBondContact O-N 2.84Å; L196-M199 VanDerWaalsContact O-O 3.1Å |
| 197 | Q | 86.4 | Confident | 70.7 | Confident | 71 Ų | 71 | 69.7 Ų | 69.7 | 33% | 0.332 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.8 | -33.9 | 177.7 | -74.9 | 174.5 | 10.3 | 0 | 0 | 112.4 | S136 G139 A140 T143 V193 A194 I195 | S136-Q197 PolarHBondContact OG-O 3.4Å; G139-Q197 PolarHBondContact O-OE1 3.43Å; A140-Q197 HydrophobicContact CB-CB 4.33Å; A140-Q197 VanDerWaalsContact N-OE1 3.07Å; T143-Q197 PolarHBondContact OG1-NE2 3Å; V193-Q197 HydrophobicContact CG1-CG 4.41Å; V193-Q197 WeakPolarHBondContact O-CG 3.21Å; V193-Q197 PolarHBondContact O-N 3.46Å; A194-Q197 PolarHBondContact O-N 3.21Å; I195-Q197 VanDerWaalsContact C-N 3.32Å; I195-Q197 PolarHBondContact O-N 3.1Å |
| 198 | V | 82.9 | Confident | 68.3 | Low | 25 Ų | 25 | 74.6 Ų | 74.6 | 15% | 0.152 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -90.6 | -24.8 | -178.1 | -171.9 | 0 | 0 | 0 | 0 | 111.7 | I111 M114 A140 A194 I195 L196 N200 | I111-V198 HydrophobicContact CG1-CG2 4.49Å; M114-V198 HydrophobicContact CE-CG1 3.95Å; M114-V198 HydrophobicContact SD-CB 4.41Å; M114-V198 HydrophobicContact SD-CG1 3.15Å; M114-V198 WeakPolarHBondContact SD-CG1 3.29Å; A140-V198 HydrophobicContact CB-CG2 3.34Å; A194-V198 WeakPolarHBondContact O-CG2 3.3Å; A194-V198 PolarHBondContact O-N 3.48Å; I195-V198 PolarHBondContact O-N 3Å; L196-V198 VanDerWaalsContact C-N 3.29Å; L196-V198 PolarHBondContact O-N 2.84Å; V198-N200 PolarHBondContact O-N 3.43Å |
| 199 | M | 74.1 | Confident | 65.6 | Low | 75 Ų | 75 | 76.8 Ų | 76.8 | 37% | 0.369 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -83 | 96.1 | 172.1 | -72.9 | -176.1 | 152 | 0 | 0 | 111.1 | I195 L196 P239 | I195-M199 HydrophobicContact CG2-CE 4.03Å; I195-M199 HydrophobicContact CG2-CG 3.99Å; I195-M199 HydrophobicContact CG2-SD 3.38Å; I195-M199 WeakPolarHBondContact CG2-SD 3.38Å; I195-M199 VanDerWaalsContact O-CB 3.29Å; I195-M199 WeakPolarHBondContact O-CB 3.27Å; I195-M199 VanDerWaalsContact O-CG 3.27Å; I195-M199 WeakPolarHBondContact O-CG 3.26Å; I195-M199 PolarHBondContact O-N 3.36Å; L196-M199 VanDerWaalsContact O-O 3.1Å; M199-P239 HydrophobicContact CE-CB 4.3Å; M199-P239 HydrophobicContact CE-CG 3.88Å |
| 200 | N | 58.8 | Low | 62.9 | Low | 80 Ų | 80 | 75.4 Ų | 75.4 | 43% | 0.428 | 45% | 0.451 | S | S | . | . | trans | -77.5 | 137.9 | 176.1 | -131.4 | 1.3 | 0 | 0 | 0 | 111.6 | V198 L202 | V198-N200 PolarHBondContact O-N 3.43Å; N200-L202 VanDerWaalsContact C-N 3.3Å; N200-L202 PolarHBondContact O-N 2.93Å | ||
| 201 | P | 41.2 | Very low | 60.6 | Low | 121 Ų | 121 | 81.6 Ų | 81.6 | 79% | 0.786 | 48% | 0.478 | S | S | * | . | S | Bend | trans | -80.7 | 4.6 | -178.9 | 30.3 | -33.9 | 0 | 0 | 0 | 115.4 | ||
| 202 | L | 38.1 | Very low | 58.1 | Low | 135 Ų | 135 | 85 Ų | 85 | 71% | 0.707 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -98.2 | 105.3 | 172.4 | -64.7 | 171.2 | 0 | 0 | 0 | 107.5 | N200 E204 | N200-L202 VanDerWaalsContact C-N 3.3Å; N200-L202 PolarHBondContact O-N 2.93Å; L202-E204 PolarHBondContact O-N 3.2Å |
| 203 | G | 41.2 | Very low | 56 | Low | 91 Ų | 91 | 84.5 Ų | 84.5 | 94% | 0.938 | 50% | 0.504 | S | S | * | . | trans | -64.7 | 53.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 204 | E | 39.7 | Very low | 53.9 | Low | 151 Ų | 151 | 85.2 Ų | 85.2 | 71% | 0.706 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -117.3 | 130.5 | 164.3 | -72.7 | -158.8 | 149.3 | 0 | 0 | 109.9 | L202 L206 | L202-E204 PolarHBondContact O-N 3.2Å; E204-L206 PolarHBondContact O-N 3.49Å |
| 205 | P | 41.8 | Very low | 51.9 | Low | 90 Ų | 90 | 89.1 Ų | 89.1 | 58% | 0.584 | 53% | 0.529 | S | S | * | . | trans | -57.3 | 133.4 | 175.5 | 24.1 | -31.5 | 0 | 0 | 0 | 109.6 | R129 C207 | R129-P205 PolarHBondContact NH1-O 2.93Å; P205-C207 PolarHBondContact O-N 2.85Å | ||
| 206 | L | 47.2 | Very low | 49.8 | Very low | 70 Ų | 70 | 91.6 Ų | 91.6 | 37% | 0.366 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -69.7 | 16.4 | -176.8 | -88.8 | 102.1 | 0 | 0 | 0 | 114.7 | R129 A133 E204 | R129-L206 HydrophobicContact CG-CB 4.33Å; R129-L206 HydrophobicContact CG-CD2 3.71Å; R129-L206 HydrophobicContact CG-CG 3.96Å; R129-L206 PolarHBondContact NE-O 3.47Å; R129-L206 PolarHBondContact NH2-O 3.49Å; A133-L206 HydrophobicContact CB-CD2 4.13Å; E204-L206 PolarHBondContact O-N 3.49Å |
| 207 | C | 35.8 | Very low | 47.8 | Very low | 42 Ų | 42 | 91.3 Ų | 91.3 | 28% | 0.284 | 54% | 0.541 | S | S | . | . | S | Bend | trans | -147.7 | 144.1 | 170 | -74.3 | 0 | 0 | 0 | 0 | 109.7 | P205 C209 | P205-C207 PolarHBondContact O-N 2.85Å; C207-C209 PolarHBondContact O-N 2.64Å |
| 208 | P | 38.2 | Very low | 45.8 | Very low | 104 Ų | 104 | 92.5 Ų | 92.5 | 68% | 0.675 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -74.1 | 124.3 | 161.5 | 11.5 | 10.3 | 0 | 0 | 0 | 106.6 | R129 | R129-P208 VanDerWaalsContact NH2-CD 3.32Š|
| 209 | C | 31.9 | Very low | 44 | Very low | 109 Ų | 109 | 97.9 Ų | 97.9 | 74% | 0.736 | 57% | 0.573 | S | S | * | * | S | Bend | trans | 85.1 | 157.7 | 172.3 | -44.7 | 0 | 0 | 0 | 0 | 116.3 | C207 | C207-C209 PolarHBondContact O-N 2.64Š|
| 210 | P | 36 | Very low | 42.4 | Very low | 108 Ų | 108 | 101.6 Ų | 101.6 | 70% | 0.701 | 59% | 0.587 | S | S | * | * | -96.7 | 136.3 | -86.4 | 24.6 | -9.5 | 0 | 0 | 0 | 110.1 | P212 | P210-P212 WeakPolarHBondContact O-CD 3.42Å; P210-P212 VanDerWaalsContact O-CG 3.27Å; P210-P212 WeakPolarHBondContact O-CG 3.34Å | |||
| 211 | Q | 42.7 | Very low | 41.5 | Very low | 134 Ų | 134 | 103.7 Ų | 103.7 | 63% | 0.626 | 60% | 0.597 | S | S | * | * | trans | -51.9 | 112.9 | 173.5 | -71.2 | 176 | -58.2 | 0 | 0 | 111.3 | T215 | Q211-T215 PolarHBondContact O-OG1 3.1Š| ||
| 212 | P | 38.3 | Very low | 41.5 | Very low | 78 Ų | 78 | 107 Ų | 107 | 51% | 0.506 | 60% | 0.599 | S | S | . | * | trans | -105.2 | -4.7 | 171.4 | 14.8 | 8.5 | 0 | 0 | 0 | 112 | P210 L216 | P210-P212 WeakPolarHBondContact O-CD 3.42Å; P210-P212 VanDerWaalsContact O-CG 3.27Å; P210-P212 WeakPolarHBondContact O-CG 3.34Å; P212-L216 WeakPolarHBondContact O-CB 3.2Å | ||
| 213 | S | 47 | Very low | 41.1 | Very low | 70 Ų | 70 | 105.5 Ų | 105.5 | 49% | 0.49 | 60% | 0.599 | S | S | . | * | S | Bend | trans | -97.6 | -37.5 | -170.4 | 55 | 0 | 0 | 0 | 0 | 114.2 | L217 | S213-L217 WeakPolarHBondContact O-CB 3.26Å; S213-L217 PolarHBondContact O-N 3.19Å |
| 214 | L | 46.4 | Very low | 40.5 | Very low | 80 Ų | 80 | 104.4 Ų | 104.4 | 42% | 0.419 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -85.3 | -36.9 | -178.3 | -168.1 | 65.4 | 0 | 0 | 0 | 113.5 | L218 P240 | L214-L218 HydrophobicContact CG-CD1 4.44Å; L214-L218 WeakPolarHBondContact O-CB 3.28Å; L214-L218 PolarHBondContact O-N 3.08Å; L214-P240 HydrophobicContact CD1-CG 4.25Å |
| 215 | T | 48 | Very low | 40.2 | Very low | 81 Ų | 81 | 103.8 Ų | 103.8 | 50% | 0.497 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -67.8 | -40 | 175.3 | 39 | 0 | 0 | 0 | 0 | 111.7 | Q211 L218 E219 | Q211-T215 PolarHBondContact O-OG1 3.1Å; T215-L218 PolarHBondContact O-N 3.38Å; T215-E219 WeakPolarHBondContact O-CB 3.13Å; T215-E219 PolarHBondContact O-N 3.43Å |
| 216 | L | 43.7 | Very low | 40.1 | Very low | 94 Ų | 94 | 103.9 Ų | 103.9 | 49% | 0.492 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -76.2 | -31.6 | -178.9 | -151.9 | 144.2 | 0 | 0 | 0 | 112.4 | P212 K220 | P212-L216 WeakPolarHBondContact O-CB 3.2Å; L216-K220 HydrophobicContact CD2-CG 4.26Å; L216-K220 VanDerWaalsContact O-CB 3.31Å; L216-K220 WeakPolarHBondContact O-CB 3.24Å; L216-K220 WeakPolarHBondContact O-CG 3.15Å; L216-K220 PolarHBondContact O-N 3.14Å |
| 217 | L | 44.8 | Very low | 39.5 | Very low | 108 Ų | 108 | 107.2 Ų | 107.2 | 57% | 0.565 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -70.6 | -38 | 168.2 | -93 | 168.3 | 0 | 0 | 0 | 112.4 | S213 K220 L221 | S213-L217 WeakPolarHBondContact O-CB 3.26Å; S213-L217 PolarHBondContact O-N 3.19Å; L217-K220 PolarHBondContact O-N 3.26Å; L217-L221 VanDerWaalsContact O-CB 3.3Å; L217-L221 WeakPolarHBondContact O-CB 3.41Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.4Å |
| 218 | L | 44.8 | Very low | 39.4 | Very low | 97 Ų | 97 | 111.1 Ų | 111.1 | 51% | 0.508 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -65.8 | -37.6 | 172.7 | -91.4 | 163.8 | 0 | 0 | 0 | 111.8 | L214 T215 L221 K222 | L214-L218 HydrophobicContact CG-CD1 4.44Å; L214-L218 WeakPolarHBondContact O-CB 3.28Å; L214-L218 PolarHBondContact O-N 3.08Å; T215-L218 PolarHBondContact O-N 3.38Å; L218-L221 PolarHBondContact O-N 3.26Å; L218-K222 VanDerWaalsContact O-CB 3.26Å; L218-K222 WeakPolarHBondContact O-CB 3.3Å; L218-K222 PolarHBondContact O-N 3.09Å |
| 219 | E | 44.5 | Very low | 39.3 | Very low | 137 Ų | 137 | 112 Ų | 112 | 64% | 0.64 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70.1 | -39.2 | 175.5 | -160.1 | 163.7 | -158.6 | 0 | 0 | 112 | T215 K222 C223 | T215-E219 WeakPolarHBondContact O-CB 3.13Å; T215-E219 PolarHBondContact O-N 3.43Å; E219-K222 PolarHBondContact O-N 3.34Å; E219-C223 PolarHBondContact O-N 3.39Å |
| 220 | K | 40.1 | Very low | 39.2 | Very low | 153 Ų | 153 | 113.5 Ų | 113.5 | 67% | 0.665 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -65.8 | -35 | 172 | -73 | -85.7 | -176.6 | -177.4 | 0 | 113 | L216 L217 | L216-K220 HydrophobicContact CD2-CG 4.26Å; L216-K220 VanDerWaalsContact O-CB 3.31Å; L216-K220 WeakPolarHBondContact O-CB 3.24Å; L216-K220 WeakPolarHBondContact O-CG 3.15Å; L216-K220 PolarHBondContact O-N 3.14Å; L217-K220 PolarHBondContact O-N 3.26Å |
| 221 | L | 40 | Very low | 39.1 | Very low | 124 Ų | 124 | 114.6 Ų | 114.6 | 65% | 0.649 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -75.9 | -31.8 | 174.1 | -82.2 | 159.9 | 0 | 0 | 0 | 112.4 | L217 L218 C223 S224 | L217-L221 VanDerWaalsContact O-CB 3.3Å; L217-L221 WeakPolarHBondContact O-CB 3.41Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.4Å; L218-L221 PolarHBondContact O-N 3.26Å; L221-C223 VanDerWaalsContact C-N 3.29Å; L221-C223 PolarHBondContact O-N 3.03Å; L221-S224 PolarHBondContact O-N 3.35Å |
| 222 | K | 40.9 | Very low | 38.5 | Very low | 190 Ų | 190 | 115.6 Ų | 115.6 | 83% | 0.826 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -71 | -23.3 | 176.2 | -146.4 | 159 | -169.2 | 179.4 | 0 | 113.1 | L218 E219 | L218-K222 VanDerWaalsContact O-CB 3.26Å; L218-K222 WeakPolarHBondContact O-CB 3.3Å; L218-K222 PolarHBondContact O-N 3.09Å; E219-K222 PolarHBondContact O-N 3.34Å |
| 223 | C | 30.3 | Very low | 38.2 | Very low | 104 Ų | 104 | 117.2 Ų | 117.2 | 70% | 0.703 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | 2.2 | 175.8 | -87 | 0 | 0 | 0 | 0 | 115.2 | E219 L221 P225 | E219-C223 PolarHBondContact O-N 3.39Å; L221-C223 VanDerWaalsContact C-N 3.29Å; L221-C223 PolarHBondContact O-N 3.03Å; C223-P225 WeakPolarHBondContact O-CD 3.33Å |
| 224 | S | 28.3 | Very low | 37.8 | Very low | 69 Ų | 69 | 119.6 Ų | 119.6 | 48% | 0.483 | 67% | 0.67 | S | S | . | * | trans | -87.1 | 114.4 | 173.4 | -157.2 | 0 | 0 | 0 | 0 | 110.1 | L221 S226 | L221-S224 PolarHBondContact O-N 3.35Å; S224-S226 PolarHBondContact O-N 3.08Å | ||
| 225 | P | 33.7 | Very low | 37.1 | Very low | 138 Ų | 138 | 125 Ų | 125 | 90% | 0.896 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | 16.6 | -167.9 | -14.7 | 29.7 | 0 | 0 | 0 | 116.2 | C223 | C223-P225 WeakPolarHBondContact O-CD 3.33Š|
| 226 | S | 39.4 | Very low | 36.4 | Very low | 92 Ų | 92 | 130.2 Ų | 130.2 | 64% | 0.643 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.3 | 16.1 | -161.8 | 56.5 | 0 | 0 | 0 | 0 | 117.2 | S224 | S224-S226 PolarHBondContact O-N 3.08Š|
| 227 | L | 34.9 | Very low | 36 | Very low | 140 Ų | 140 | 131.9 Ų | 131.9 | 73% | 0.733 | 72% | 0.718 | S | S | * | * | trans | -136.7 | 120.3 | 174.1 | -143.7 | 73.8 | 0 | 0 | 0 | 114.2 | I229 | L227-I229 HydrophobicContact CD2-CD1 4.13Å; L227-I229 PolarHBondContact O-N 3.32Å | ||
| 228 | P | 33.6 | Very low | 35.6 | Very low | 123 Ų | 123 | 130.1 Ų | 130.1 | 80% | 0.799 | 71% | 0.713 | S | S | * | * | trans | -89.4 | 87.7 | 179.7 | 35 | -29.1 | 0 | 0 | 0 | 109.5 | ||||
| 229 | I | 36.9 | Very low | 35.4 | Very low | 123 Ų | 123 | 128 Ų | 128 | 63% | 0.631 | 71% | 0.705 | S | S | * | * | trans | -139.7 | 100.9 | 166.2 | -52.5 | 175.8 | 0 | 0 | 0 | 108.7 | L227 I231 | L227-I229 HydrophobicContact CD2-CD1 4.13Å; L227-I229 PolarHBondContact O-N 3.32Å; I229-I231 HydrophobicContact CG2-CG1 4.18Å; I229-I231 PolarHBondContact O-N 3.36Å | ||
| 230 | T | 28.2 | Very low | 35.1 | Very low | 141 Ų | 141 | 125.1 Ų | 125.1 | 87% | 0.865 | 70% | 0.698 | S | S | * | * | trans | -66.8 | 122.2 | 166.8 | -8.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 231 | I | 33.8 | Very low | 35.3 | Very low | 131 Ų | 131 | 121.5 Ų | 121.5 | 67% | 0.672 | 68% | 0.683 | S | S | * | * | trans | -112.6 | 108.9 | 172.7 | -58 | -179.5 | 0 | 0 | 0 | 107.9 | I229 | I229-I231 HydrophobicContact CG2-CG1 4.18Å; I229-I231 PolarHBondContact O-N 3.36Å | ||
| 232 | D | 30.5 | Very low | 35 | Very low | 154 Ų | 154 | 121.1 Ų | 121.1 | 82% | 0.824 | 68% | 0.677 | S | S | * | * | trans | -76.3 | 127.4 | 166.9 | -82 | -40.2 | 0 | 0 | 0 | 110.5 | ||||
| 233 | S | 32.4 | Very low | 34.9 | Very low | 112 Ų | 112 | 118.8 Ų | 118.8 | 78% | 0.783 | 67% | 0.668 | S | S | * | * | S | Bend | trans | 16.5 | 157.7 | 156.2 | -88.7 | 0 | 0 | 0 | 0 | 124.2 | K235 | S233-K235 PolarHBondContact O-N 3.36Š|
| 234 | P | 39.4 | Very low | 35.3 | Very low | 121 Ų | 121 | 118.5 Ų | 118.5 | 79% | 0.786 | 66% | 0.66 | S | S | * | * | S | Bend | -102.6 | 90.4 | -128.3 | 37.7 | -33.4 | 0 | 0 | 0 | 113.7 | |||
| 235 | K | 31.2 | Very low | 35.9 | Very low | 194 Ų | 194 | 118.6 Ų | 118.6 | 84% | 0.843 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -142 | 118.7 | 156.6 | -69.4 | -173.5 | -179.4 | 173.1 | 0 | 107.6 | S233 | S233-K235 PolarHBondContact O-N 3.36Š|
| 236 | Q | 34 | Very low | 36.3 | Very low | 190 Ų | 190 | 115 Ų | 115 | 89% | 0.888 | 63% | 0.63 | S | S | * | * | trans | 70.2 | 71.5 | -173.5 | -74.9 | 149.3 | -57 | 0 | 0 | 115.8 | P238 | Q236-P238 WeakPolarHBondContact O-CD 3.31Š| ||
| 237 | L | 33.7 | Very low | 36.1 | Very low | 129 Ų | 129 | 117.6 Ų | 117.6 | 68% | 0.675 | 63% | 0.63 | S | S | * | * | trans | -92.6 | 109.7 | 150.9 | -161.1 | 72.9 | 0 | 0 | 0 | 107.3 | ||||
| 238 | P | 36.3 | Very low | 36.5 | Very low | 71 Ų | 71 | 112.2 Ų | 112.2 | 46% | 0.461 | 60% | 0.603 | S | S | . | * | trans | -62.4 | 143.9 | 170 | 26.3 | -30.7 | 0 | 0 | 0 | 108.5 | Q236 F242 | Q236-P238 WeakPolarHBondContact O-CD 3.31Å; P238-F242 HydrophobicContact CB-CB 4.28Å | ||
| 239 | P | 40.6 | Very low | 36.6 | Very low | 51 Ų | 51 | 109.5 Ų | 109.5 | 33% | 0.331 | 59% | 0.587 | S | S | . | * | trans | -57.3 | 145.9 | -176.4 | 22.9 | -32.2 | 0 | 0 | 0 | 110 | M199 H241 F242 | M199-P239 HydrophobicContact CE-CB 4.3Å; M199-P239 HydrophobicContact CE-CG 3.88Å; P239-H241 PolarHBondContact O-N 3.35Å; P239-F242 HydrophobicContact CG-CD2 4.5Å; P239-F242 WeakPolarHBondContact O-CB 3.48Å; P239-F242 PolarHBondContact O-N 3.48Å | ||
| 240 | P | 39.6 | Very low | 36.6 | Very low | 78 Ų | 78 | 112.3 Ų | 112.3 | 51% | 0.506 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -57.4 | -18.5 | -178.8 | 22.2 | -32.9 | 0 | 0 | 0 | 113.5 | L214 F242 H243 | L214-P240 HydrophobicContact CD1-CG 4.25Å; P240-F242 VanDerWaalsContact C-N 3.25Å; P240-F242 PolarHBondContact O-N 3.41Å; P240-H243 PolarHBondContact O-N 3.46Å |
| 241 | H | 43.6 | Very low | 37.2 | Very low | 76 Ų | 76 | 110.1 Ų | 110.1 | 35% | 0.352 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.3 | -26.8 | 170.8 | -58.1 | -69.8 | 0 | 0 | 0 | 114 | P239 H243 L244 L245 | P239-H241 PolarHBondContact O-N 3.35Å; H241-H243 VanDerWaalsContact C-N 3.32Å; H241-L244 PolarHBondContact O-N 2.72Å; H241-L245 PolarHBondContact O-N 2.86Å |
| 242 | F | 34.2 | Very low | 37.6 | Very low | 116 Ų | 116 | 105.6 Ų | 105.6 | 51% | 0.509 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -69.8 | -30.5 | 175.6 | -124.7 | -93 | 0 | 0 | 0 | 111.8 | P238 P239 P240 L245 V246 | P238-F242 HydrophobicContact CB-CB 4.28Å; P239-F242 HydrophobicContact CG-CD2 4.5Å; P239-F242 WeakPolarHBondContact O-CB 3.48Å; P239-F242 PolarHBondContact O-N 3.48Å; P240-F242 VanDerWaalsContact C-N 3.25Å; P240-F242 PolarHBondContact O-N 3.41Å; F242-L245 PolarHBondContact O-N 2.84Å; F242-V246 HydrophobicContact CD1-CG2 4.27Å; F242-V246 WeakPolarHBondContact O-CB 3.44Å; F242-V246 WeakPolarHBondContact O-CG2 3.32Å; F242-V246 PolarHBondContact O-N 3.12Å |
| 243 | H | 38.7 | Very low | 37.9 | Very low | 141 Ų | 141 | 102.5 Ų | 102.5 | 65% | 0.653 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.1 | -35.3 | 176.1 | -102.8 | -90.4 | 0 | 0 | 0 | 112.2 | P240 H241 F247 | P240-H243 PolarHBondContact O-N 3.46Å; H241-H243 VanDerWaalsContact C-N 3.32Å; H243-F247 VanDerWaalsContact O-CB 3.3Å; H243-F247 WeakPolarHBondContact O-CB 3.29Å; H243-F247 PolarHBondContact O-N 2.95Å |
| 244 | L | 39.5 | Very low | 38.1 | Very low | 99 Ų | 99 | 100.6 Ų | 100.6 | 52% | 0.518 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -71 | -38.4 | 175.9 | -134.7 | 83.5 | 0 | 0 | 0 | 111.9 | I106 H241 F247 S248 | I106-L244 HydrophobicContact CD1-CD2 4.31Å; I106-L244 HydrophobicContact CG1-CD2 4.2Å; I106-L244 HydrophobicContact CG2-CD2 3.92Å; H241-L244 PolarHBondContact O-N 2.72Å; L244-F247 PolarHBondContact O-N 2.75Å; L244-S248 WeakPolarHBondContact O-CB 3.43Å; L244-S248 PolarHBondContact O-N 3.08Å |
| 245 | L | 39.6 | Very low | 38.2 | Very low | 71 Ų | 71 | 99.2 Ų | 99.2 | 37% | 0.372 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.4 | -41.1 | 174.8 | -154 | 99.2 | 0 | 0 | 0 | 111.3 | V191 I195 H241 F242 F247 S248 C249 | V191-L245 HydrophobicContact CG1-CD1 4.26Å; I195-L245 HydrophobicContact CD1-CD1 4.38Å; H241-L245 PolarHBondContact O-N 2.86Å; F242-L245 PolarHBondContact O-N 2.84Å; L245-F247 VanDerWaalsContact C-N 3.32Å; L245-S248 PolarHBondContact O-N 3Å; L245-C249 WeakPolarHBondContact O-CB 3.42Å; L245-C249 PolarHBondContact O-N 3.37Å |
| 246 | V | 41.8 | Very low | 38.9 | Very low | 62 Ų | 62 | 93.3 Ų | 93.3 | 38% | 0.376 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -68.3 | -30.8 | 172.9 | 171.2 | 0 | 0 | 0 | 0 | 111.4 | F242 R250 | F242-V246 HydrophobicContact CD1-CG2 4.27Å; F242-V246 WeakPolarHBondContact O-CB 3.44Å; F242-V246 WeakPolarHBondContact O-CG2 3.32Å; F242-V246 PolarHBondContact O-N 3.12Å; V246-R250 HydrophobicContact CG1-CG 4.39Å; V246-R250 WeakPolarHBondContact O-CB 3.48Å; V246-R250 WeakPolarHBondContact O-CG 3.46Å; V246-R250 PolarHBondContact O-N 2.94Å |
| 247 | F | 36.2 | Very low | 38.7 | Very low | 147 Ų | 147 | 94 Ų | 94 | 65% | 0.645 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -71.7 | -42.3 | 173.8 | -148.4 | -89.3 | 0 | 0 | 0 | 111.5 | H243 L244 L245 R250 L251 | H243-F247 VanDerWaalsContact O-CB 3.3Å; H243-F247 WeakPolarHBondContact O-CB 3.29Å; H243-F247 PolarHBondContact O-N 2.95Å; L244-F247 PolarHBondContact O-N 2.75Å; L245-F247 VanDerWaalsContact C-N 3.32Å; F247-R250 PolarHBondContact O-N 2.87Å; F247-L251 VanDerWaalsContact O-CB 3.24Å; F247-L251 WeakPolarHBondContact O-CB 3.43Å; F247-L251 PolarHBondContact O-N 3.34Å |
| 248 | S | 42.9 | Very low | 38.6 | Very low | 26 Ų | 26 | 98 Ų | 98 | 18% | 0.182 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -65.9 | -40.7 | 173.9 | -165.6 | 0 | 0 | 0 | 0 | 111.1 | L244 L245 L251 F252 | L244-S248 WeakPolarHBondContact O-CB 3.43Å; L244-S248 PolarHBondContact O-N 3.08Å; L245-S248 PolarHBondContact O-N 3Å; S248-L251 PolarHBondContact O-N 3.28Å; S248-F252 VanDerWaalsContact O-CB 3.22Å; S248-F252 WeakPolarHBondContact O-CB 3.13Å; S248-F252 PolarHBondContact O-N 3.31Å |
| 249 | C | 36 | Very low | 38.8 | Very low | 66 Ų | 66 | 105.3 Ų | 105.3 | 45% | 0.446 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.5 | -38.9 | 174.8 | -159.1 | 0 | 0 | 0 | 0 | 112.1 | L245 F252 L253 | L245-C249 WeakPolarHBondContact O-CB 3.42Å; L245-C249 PolarHBondContact O-N 3.37Å; C249-F252 PolarHBondContact O-N 3.47Å; C249-L253 VanDerWaalsContact O-CB 3.32Å; C249-L253 WeakPolarHBondContact O-CB 3.11Å; C249-L253 WeakPolarHBondContact O-CD1 3.43Å; C249-L253 PolarHBondContact O-N 2.93Å; C249-L253 VanDerWaalsContact SG-CD1 3.58Å |
| 250 | R | 37.3 | Very low | 38.7 | Very low | 182 Ų | 182 | 108 Ų | 108 | 69% | 0.687 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68.6 | -34.8 | 171.4 | -86.4 | -178 | 174.4 | -119.1 | 1.1 | 112.6 | V246 F247 S254 | V246-R250 HydrophobicContact CG1-CG 4.39Å; V246-R250 WeakPolarHBondContact O-CB 3.48Å; V246-R250 WeakPolarHBondContact O-CG 3.46Å; V246-R250 PolarHBondContact O-N 2.94Å; F247-R250 PolarHBondContact O-N 2.87Å; R250-S254 WeakPolarHBondContact O-CA 3.3Å; R250-S254 WeakPolarHBondContact O-CB 3.4Å; R250-S254 PolarHBondContact O-N 3.41Å; R250-S254 PolarHBondContact O-OG 3.43Å |
| 251 | L | 39.6 | Very low | 38.6 | Very low | 96 Ų | 96 | 109.6 Ų | 109.6 | 50% | 0.503 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.3 | -42.3 | 174.5 | -162.3 | 76.1 | 0 | 0 | 0 | 109.9 | F247 S248 S254 L255 | F247-L251 VanDerWaalsContact O-CB 3.24Å; F247-L251 WeakPolarHBondContact O-CB 3.43Å; F247-L251 PolarHBondContact O-N 3.34Å; S248-L251 PolarHBondContact O-N 3.28Å; L251-S254 PolarHBondContact O-N 2.87Å; L251-L255 HydrophobicContact CG-CD1 4.22Å; L251-L255 VanDerWaalsContact O-CB 3.3Å; L251-L255 WeakPolarHBondContact O-CB 3.35Å; L251-L255 WeakPolarHBondContact O-CD1 3.38Å; L251-L255 WeakPolarHBondContact O-CG 2.91Å; L251-L255 PolarHBondContact O-N 3.44Å |
| 252 | F | 43.3 | Very low | 38.4 | Very low | 35 Ų | 35 | 111.4 Ų | 111.4 | 15% | 0.154 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -64.9 | -45.9 | 175.7 | -158 | -97.5 | 0 | 0 | 0 | 112.1 | F96 A99 S248 C249 L255 I256 | F96-F252 AromaticContact CD1-CE2 3.59Å; F96-F252 HydrophobicContact CD1-CE2 3.59Å; F96-F252 AromaticContact CD1-CZ 3.61Å; F96-F252 HydrophobicContact CD1-CZ 3.61Å; F96-F252 HydrophobicContact CE1-CE1 4.11Å; F96-F252 AromaticContact CE1-CE2 3.63Å; F96-F252 HydrophobicContact CE1-CE2 3.63Å; F96-F252 AromaticContact CE1-CZ 3.37Å; F96-F252 HydrophobicContact CE1-CZ 3.37Å; A99-F252 HydrophobicContact CB-CE2 4.37Å; S248-F252 VanDerWaalsContact O-CB 3.22Å; S248-F252 WeakPolarHBondContact O-CB 3.13Å; S248-F252 PolarHBondContact O-N 3.31Å; C249-F252 PolarHBondContact O-N 3.47Å; F252-L255 PolarHBondContact O-N 3.46Å; F252-I256 HydrophobicContact CD1-CD1 3.56Å; F252-I256 HydrophobicContact CE1-CD1 3.65Å; F252-I256 HydrophobicContact CG-CD1 4.48Å; F252-I256 WeakPolarHBondContact O-CD1 3.26Å; F252-I256 VanDerWaalsContact O-CG1 3.25Å; F252-I256 WeakPolarHBondContact O-CG1 3.38Å; F252-I256 PolarHBondContact O-N 3.41Å |
| 253 | L | 36.8 | Very low | 38.6 | Very low | 90 Ų | 90 | 111.2 Ų | 111.2 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.5 | -36.5 | 174 | -91.4 | 114 | 0 | 0 | 0 | 112.7 | C249 I256 W257 | C249-L253 VanDerWaalsContact O-CB 3.32Å; C249-L253 WeakPolarHBondContact O-CB 3.11Å; C249-L253 WeakPolarHBondContact O-CD1 3.43Å; C249-L253 PolarHBondContact O-N 2.93Å; C249-L253 VanDerWaalsContact SG-CD1 3.58Å; L253-I256 PolarHBondContact O-N 3.27Å; L253-W257 WeakPolarHBondContact O-CB 3.31Å; L253-W257 PolarHBondContact O-N 2.86Å |
| 254 | S | 35.2 | Very low | 38.6 | Very low | 71 Ų | 71 | 109.3 Ų | 109.3 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.7 | -34.8 | 174.3 | -75.1 | 0 | 0 | 0 | 0 | 112.1 | R250 L251 W257 Y258 | R250-S254 WeakPolarHBondContact O-CA 3.3Å; R250-S254 WeakPolarHBondContact O-CB 3.4Å; R250-S254 PolarHBondContact O-N 3.41Å; R250-S254 PolarHBondContact O-OG 3.43Å; L251-S254 PolarHBondContact O-N 2.87Å; S254-W257 PolarHBondContact O-N 3.17Å; S254-Y258 WeakPolarHBondContact O-CB 3.27Å; S254-Y258 PolarHBondContact O-N 3.5Å |
| 255 | L | 42 | Very low | 38.5 | Very low | 93 Ų | 93 | 110 Ų | 110 | 49% | 0.487 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.9 | -34.3 | 173.5 | -85.4 | 156.1 | 0 | 0 | 0 | 112.2 | L251 F252 | L251-L255 HydrophobicContact CG-CD1 4.22Å; L251-L255 VanDerWaalsContact O-CB 3.3Å; L251-L255 WeakPolarHBondContact O-CB 3.35Å; L251-L255 WeakPolarHBondContact O-CD1 3.38Å; L251-L255 WeakPolarHBondContact O-CG 2.91Å; L251-L255 PolarHBondContact O-N 3.44Å; F252-L255 PolarHBondContact O-N 3.46Å |
| 256 | I | 45 | Very low | 38.5 | Very low | 70 Ų | 70 | 112.8 Ų | 112.8 | 36% | 0.359 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -73.5 | -30.5 | 175.2 | -71.6 | 163.7 | 0 | 0 | 0 | 112.2 | F252 L253 | F252-I256 HydrophobicContact CD1-CD1 3.56Å; F252-I256 HydrophobicContact CE1-CD1 3.65Å; F252-I256 HydrophobicContact CG-CD1 4.48Å; F252-I256 WeakPolarHBondContact O-CD1 3.26Å; F252-I256 VanDerWaalsContact O-CG1 3.25Å; F252-I256 WeakPolarHBondContact O-CG1 3.38Å; F252-I256 PolarHBondContact O-N 3.41Å; L253-I256 PolarHBondContact O-N 3.27Å |
| 257 | W | 30.3 | Very low | 38.2 | Very low | 205 Ų | 205 | 116.7 Ų | 116.7 | 78% | 0.777 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -94 | -6 | -177.3 | -93.5 | 87.2 | 0 | 0 | 0 | 115.5 | L253 S254 | L253-W257 WeakPolarHBondContact O-CB 3.31Å; L253-W257 PolarHBondContact O-N 2.86Å; S254-W257 PolarHBondContact O-N 3.17Å |
| 258 | Y | 32.8 | Very low | 38.4 | Very low | 213 Ų | 213 | 114.2 Ų | 114.2 | 84% | 0.835 | 54% | 0.536 | S | S | * | . | trans | -96.5 | 5.5 | 178.7 | -119.6 | -92.3 | 0 | 0 | 0 | 114.7 | S254 | S254-Y258 WeakPolarHBondContact O-CB 3.27Å; S254-Y258 PolarHBondContact O-N 3.5Å | ||
| 259 | H | 39 | Very low | 37.9 | Very low | 223 Ų | 223 | 122.2 Ų | 122.2 | 100% | 1.032 | 57% | 0.568 | S | S | * | * | trans | -131.4 | 0 | 175.3 | -98.1 | -53.5 | 0 | 0 | 0 | 111.6 |
Retrieved 259 of 259 residues in 120.1 ms
(Link to these results)