| 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 | 46 | Very low | 57.3 | Low | 203 Ų | 203 | 107.7 Ų | 107.7 | 100% | 1 | 57% | 0.569 | S | S | * | * | 0 | -48.6 | 0 | -80.2 | -171.7 | -165.3 | 0 | 0 | 113.5 | S3 L4 V5 | M1-S3 PolarHBondContact O-N 3.06Å; M1-L4 WeakPolarHBondContact O-CB 3.27Å; M1-L4 PolarHBondContact O-N 2.84Å; M1-V5 PolarHBondContact O-N 3.49Å; M1-V5 VanDerWaalsContact O-N 3.07Å | |||
| 2 | A | 42.9 | Very low | 59.4 | Low | 74 Ų | 74 | 102 Ų | 102 | 61% | 0.612 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -54.1 | -44.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114 | L4 V5 D6 | A2-L4 VanDerWaalsContact C-N 3.29Å; A2-L4 PolarHBondContact O-N 3.47Å; A2-V5 PolarHBondContact O-N 3.47Å; A2-D6 WeakPolarHBondContact O-CB 3.41Å; A2-D6 PolarHBondContact O-N 3Å |
| 3 | S | 55.3 | Low | 61.5 | Low | 93 Ų | 93 | 106.9 Ų | 106.9 | 65% | 0.65 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62 | -30.6 | 175.5 | 140.3 | 0 | 0 | 0 | 0 | 114 | M1 R7 | M1-S3 PolarHBondContact O-N 3.06Å; S3-R7 WeakPolarHBondContact O-CB 3.26Å; S3-R7 PolarHBondContact O-N 3.27Å; S3-R7 VanDerWaalsContact O-N 3.1Å |
| 4 | L | 54.6 | Low | 63.3 | Low | 115 Ų | 115 | 102.6 Ų | 102.6 | 60% | 0.602 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -78.3 | -40.7 | 179.6 | -119.1 | 148.1 | 0 | 0 | 0 | 111.2 | M1 A2 R7 M8 | M1-L4 WeakPolarHBondContact O-CB 3.27Å; M1-L4 PolarHBondContact O-N 2.84Å; A2-L4 VanDerWaalsContact C-N 3.29Å; A2-L4 PolarHBondContact O-N 3.47Å; L4-R7 WeakPolarHBondContact O-CB 3.45Å; L4-R7 PolarHBondContact O-N 3.11Å; L4-M8 WeakPolarHBondContact O-CG 3.34Å; L4-M8 PolarHBondContact O-N 3.25Å |
| 5 | V | 55.1 | Low | 65 | Low | 76 Ų | 76 | 99.5 Ų | 99.5 | 46% | 0.461 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.2 | -40.9 | 174.6 | 175.1 | 0 | 0 | 0 | 0 | 111.1 | M1 A2 R7 M8 R9 | M1-V5 PolarHBondContact O-N 3.49Å; M1-V5 VanDerWaalsContact O-N 3.07Å; A2-V5 PolarHBondContact O-N 3.47Å; V5-R7 VanDerWaalsContact C-N 3.32Å; V5-R7 PolarHBondContact O-N 3.14Å; V5-M8 PolarHBondContact O-N 2.82Å; V5-R9 WeakPolarHBondContact O-CB 3.48Å; V5-R9 WeakPolarHBondContact O-CG 3.45Å; V5-R9 PolarHBondContact O-N 2.89Å |
| 6 | D | 56 | Low | 66.6 | Low | 102 Ų | 102 | 97.1 Ų | 97.1 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.1 | -34.4 | 173.9 | -77.8 | -24.4 | 0 | 0 | 0 | 112.3 | A2 R9 G10 | A2-D6 WeakPolarHBondContact O-CB 3.41Å; A2-D6 PolarHBondContact O-N 3Å; D6-R9 PolarHBondContact O-N 3.45Å; D6-G10 PolarHBondContact O-N 3.21Å |
| 7 | R | 56.8 | Low | 68 | Low | 92 Ų | 92 | 92.2 Ų | 92.2 | 35% | 0.347 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.7 | -45.8 | 173.5 | -132.7 | 171.1 | 175.7 | 178.1 | -3.4 | 112.1 | S3 L4 V5 G10 H11 E303 | S3-R7 WeakPolarHBondContact O-CB 3.26Å; S3-R7 PolarHBondContact O-N 3.27Å; S3-R7 VanDerWaalsContact O-N 3.1Å; L4-R7 WeakPolarHBondContact O-CB 3.45Å; L4-R7 PolarHBondContact O-N 3.11Å; V5-R7 VanDerWaalsContact C-N 3.32Å; V5-R7 PolarHBondContact O-N 3.14Å; R7-G10 PolarHBondContact O-N 3.35Å; R7-H11 PolarHBondContact O-N 3.17Å; R7-E303 IonicContact NH2-OE1 2.72Å |
| 8 | M | 58.5 | Low | 69.4 | Low | 130 Ų | 130 | 89.1 Ų | 89.1 | 64% | 0.64 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.5 | -41.3 | 176.1 | -74.6 | 176.8 | 52.6 | 0 | 0 | 111.5 | L4 V5 G12 | L4-M8 WeakPolarHBondContact O-CG 3.34Å; L4-M8 PolarHBondContact O-N 3.25Å; V5-M8 PolarHBondContact O-N 2.82Å; M8-G12 PolarHBondContact O-N 2.72Å |
| 9 | R | 61.6 | Low | 70.6 | Confident | 174 Ų | 174 | 89.8 Ų | 89.8 | 66% | 0.657 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.9 | -41.1 | 173.3 | -81.6 | -179.6 | 166.4 | -174.9 | -3.9 | 112.1 | V5 D6 R13 | V5-R9 WeakPolarHBondContact O-CB 3.48Å; V5-R9 WeakPolarHBondContact O-CG 3.45Å; V5-R9 PolarHBondContact O-N 2.89Å; D6-R9 PolarHBondContact O-N 3.45Å; R9-R13 VanDerWaalsContact O-CG 3.24Å; R9-R13 WeakPolarHBondContact O-CG 3.37Å; R9-R13 PolarHBondContact O-N 2.98Å |
| 10 | G | 68.5 | Low | 71.8 | Confident | 29 Ų | 29 | 90 Ų | 90 | 30% | 0.299 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.8 | -49 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | D6 R7 R13 I14 | D6-G10 PolarHBondContact O-N 3.21Å; R7-G10 PolarHBondContact O-N 3.35Å; G10-R13 PolarHBondContact O-N 3.47Å; G10-I14 PolarHBondContact O-N 3.34Å |
| 11 | H | 75 | Confident | 72.9 | Confident | 97 Ų | 97 | 85.7 Ų | 85.7 | 45% | 0.449 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.3 | -39.4 | 177.3 | -64.5 | 156.5 | 0 | 0 | 0 | 112.4 | R7 R13 I14 A15 | R7-H11 PolarHBondContact O-N 3.17Å; H11-R13 PolarHBondContact O-N 2.78Å; H11-I14 PolarHBondContact O-N 3.07Å; H11-A15 WeakPolarHBondContact O-CB 3.33Å; H11-A15 PolarHBondContact O-N 3.18Å |
| 12 | G | 82.1 | Confident | 75.1 | Confident | 39 Ų | 39 | 76.8 Ų | 76.8 | 40% | 0.402 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -61.7 | -40.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | M8 A15 A16 | M8-G12 PolarHBondContact O-N 2.72Å; G12-A15 PolarHBondContact O-N 3.4Å; G12-A16 WeakPolarHBondContact O-CB 3.48Å; G12-A16 PolarHBondContact O-N 3.2Å |
| 13 | R | 86.8 | Confident | 77.5 | Confident | 166 Ų | 166 | 78 Ų | 78 | 63% | 0.626 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -63.4 | -43.7 | 175.6 | -74.5 | 172.3 | 69 | -173.4 | 2.5 | 112.4 | R9 G10 H11 A16 G17 W243 | R9-R13 VanDerWaalsContact O-CG 3.24Å; R9-R13 WeakPolarHBondContact O-CG 3.37Å; R9-R13 PolarHBondContact O-N 2.98Å; G10-R13 PolarHBondContact O-N 3.47Å; H11-R13 PolarHBondContact O-N 2.78Å; R13-A16 PolarHBondContact O-N 2.78Å; R13-G17 PolarHBondContact O-N 3.2Å; R13-W243 WeakPolarHBondContact O-CH2 3.32Å |
| 14 | I | 87.4 | Confident | 79.3 | Confident | 47 Ų | 47 | 74.3 Ų | 74.3 | 24% | 0.241 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64.8 | -46.6 | 177.6 | -65.2 | 168.8 | 0 | 0 | 0 | 110 | G10 H11 A16 G17 L18 W243 T248 | G10-I14 PolarHBondContact O-N 3.34Å; H11-I14 PolarHBondContact O-N 3.07Å; I14-A16 VanDerWaalsContact C-N 3.35Å; I14-A16 PolarHBondContact O-N 3.15Å; I14-G17 PolarHBondContact O-N 3.25Å; I14-L18 HydrophobicContact CG2-CD1 4.11Å; I14-L18 HydrophobicContact CG2-CG 4.32Å; I14-L18 VanDerWaalsContact O-CG 3.31Å; I14-L18 WeakPolarHBondContact O-CG 3.44Å; I14-L18 PolarHBondContact O-N 2.9Å; I14-W243 HydrophobicContact CG1-CH2 4.42Å; I14-T248 HydrophobicContact CD1-CG2 4.18Å; I14-T248 HydrophobicContact CG1-CG2 4.48Å; I14-T248 HydrophobicContact CG2-CG2 3.79Å |
| 15 | A | 88.2 | Confident | 81.1 | Confident | 56 Ų | 56 | 69.7 Ų | 69.7 | 46% | 0.463 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -59.7 | -43.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | H11 G12 L18 L19 | H11-A15 WeakPolarHBondContact O-CB 3.33Å; H11-A15 PolarHBondContact O-N 3.18Å; G12-A15 PolarHBondContact O-N 3.4Å; A15-L18 PolarHBondContact O-N 2.86Å; A15-L19 WeakPolarHBondContact O-CB 3.44Å; A15-L19 PolarHBondContact O-N 3.45Å |
| 16 | A | 90.4 | Very high | 82.6 | Confident | 60 Ų | 60 | 68.5 Ų | 68.5 | 50% | 0.496 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | G12 R13 I14 L19 F20 | G12-A16 WeakPolarHBondContact O-CB 3.48Å; G12-A16 PolarHBondContact O-N 3.2Å; R13-A16 PolarHBondContact O-N 2.78Å; I14-A16 VanDerWaalsContact C-N 3.35Å; I14-A16 PolarHBondContact O-N 3.15Å; A16-L19 PolarHBondContact O-N 2.93Å; A16-F20 WeakPolarHBondContact O-CB 3.29Å; A16-F20 PolarHBondContact O-N 3.42Å |
| 17 | G | 91.1 | Very high | 84.3 | Confident | 15 Ų | 15 | 66.8 Ų | 66.8 | 16% | 0.155 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.8 | -39.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | R13 I14 N21 | R13-G17 PolarHBondContact O-N 3.2Å; I14-G17 PolarHBondContact O-N 3.25Å; G17-N21 VanDerWaalsContact O-CB 3.26Å; G17-N21 WeakPolarHBondContact O-CB 3.23Å; G17-N21 PolarHBondContact O-N 3.39Å |
| 18 | L | 92.1 | Very high | 85.9 | Confident | 36 Ų | 36 | 63.2 Ų | 63.2 | 19% | 0.188 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.1 | -50.4 | 172.6 | -68.7 | 174 | 0 | 0 | 0 | 110.6 | I14 A15 F20 N21 L22 I244 F256 | I14-L18 HydrophobicContact CG2-CD1 4.11Å; I14-L18 HydrophobicContact CG2-CG 4.32Å; I14-L18 VanDerWaalsContact O-CG 3.31Å; I14-L18 WeakPolarHBondContact O-CG 3.44Å; I14-L18 PolarHBondContact O-N 2.9Å; A15-L18 PolarHBondContact O-N 2.86Å; L18-F20 PolarHBondContact O-N 3.16Å; L18-N21 CarbonylContact O-C 3.54Å; L18-N21 PolarHBondContact O-N 2.68Å; L18-N21 VanDerWaalsContact O-N 3.15Å; L18-L22 PolarHBondContact O-N 2.85Å; L18-I244 HydrophobicContact CD2-CD1 3.85Å; L18-I244 HydrophobicContact CD2-CG1 4.03Å; L18-I244 HydrophobicContact CD2-CG2 3.84Å; L18-F256 HydrophobicContact CB-CD2 4.39Å; L18-F256 HydrophobicContact CB-CE1 4.14Å; L18-F256 HydrophobicContact CB-CE2 3.86Å; L18-F256 HydrophobicContact CB-CZ 3.72Å; L18-F256 HydrophobicContact CD1-CD2 4.5Å; L18-F256 HydrophobicContact CD2-CB 4.18Å; L18-F256 HydrophobicContact CD2-CD1 3.56Å; L18-F256 HydrophobicContact CD2-CD2 3.93Å; L18-F256 HydrophobicContact CD2-CE1 3.78Å; L18-F256 HydrophobicContact CD2-CE2 4.18Å; L18-F256 HydrophobicContact CD2-CG 3.63Å; L18-F256 HydrophobicContact CD2-CZ 4.11Å; L18-F256 HydrophobicContact CG-CE2 4.45Å; L18-F256 HydrophobicContact CG-CZ 4.49Å; L18-F256 WeakPolarHBondContact O-CE1 3.48Å; L18-F256 WeakPolarHBondContact O-CZ 3.39Å |
| 19 | L | 92.7 | Very high | 87.3 | Confident | 102 Ų | 102 | 61.6 Ų | 61.6 | 53% | 0.534 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -60.1 | -44.9 | 179.3 | -177.5 | 63.5 | 0 | 0 | 0 | 112 | A15 A16 N21 L22 L23 | A15-L19 WeakPolarHBondContact O-CB 3.44Å; A15-L19 PolarHBondContact O-N 3.45Å; A16-L19 PolarHBondContact O-N 2.93Å; L19-N21 VanDerWaalsContact C-N 3.33Å; L19-N21 PolarHBondContact O-N 3.22Å; L19-L22 HydrophobicContact CD1-CD2 4.38Å; L19-L22 WeakPolarHBondContact O-CB 3.32Å; L19-L22 PolarHBondContact O-N 3.31Å; L19-L23 HydrophobicContact CG-CD1 4.49Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 2.87Å |
| 20 | F | 94.7 | Very high | 88.4 | Confident | 94 Ų | 94 | 58.9 Ų | 58.9 | 41% | 0.412 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57.2 | -48.9 | 173.9 | 177.6 | -101.3 | 0 | 0 | 0 | 110.9 | A16 L18 L22 L23 V24 M236 | A16-F20 WeakPolarHBondContact O-CB 3.29Å; A16-F20 PolarHBondContact O-N 3.42Å; L18-F20 PolarHBondContact O-N 3.16Å; F20-L22 VanDerWaalsContact C-N 3.3Å; F20-L22 PolarHBondContact O-N 2.96Å; F20-L23 PolarHBondContact O-N 3.41Å; F20-V24 HydrophobicContact CD1-CG2 4.44Å; F20-V24 HydrophobicContact CD2-CG1 4.3Å; F20-V24 HydrophobicContact CE1-CG1 4.11Å; F20-V24 HydrophobicContact CE1-CG2 4.29Å; F20-V24 HydrophobicContact CE2-CG1 3.83Å; F20-V24 HydrophobicContact CZ-CG1 3.74Å; F20-V24 WeakPolarHBondContact O-CG2 3.47Å; F20-V24 PolarHBondContact O-N 3.18Å; F20-M236 HydrophobicContact CE1-CB 4.12Å; F20-M236 HydrophobicContact CZ-CB 3.96Å; F20-M236 HydrophobicContact CZ-CG 4.21Å; F20-M236 HydrophobicContact CZ-SD 3.96Å |
| 21 | N | 95 | Very high | 89.4 | Confident | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.8 | -33.2 | 177.7 | -176.2 | -109.5 | 0 | 0 | 0 | 112.7 | G17 L18 L19 S25 S240 I244 F256 K260 | G17-N21 VanDerWaalsContact O-CB 3.26Å; G17-N21 WeakPolarHBondContact O-CB 3.23Å; G17-N21 PolarHBondContact O-N 3.39Å; L18-N21 CarbonylContact O-C 3.54Å; L18-N21 PolarHBondContact O-N 2.68Å; L18-N21 VanDerWaalsContact O-N 3.15Å; L19-N21 VanDerWaalsContact C-N 3.33Å; L19-N21 PolarHBondContact O-N 3.22Å; N21-S25 WeakPolarHBondContact O-CB 3.42Å; N21-S25 PolarHBondContact O-N 3.44Å; N21-S25 VanDerWaalsContact O-N 3.09Å; N21-S25 PolarHBondContact O-OG 3.31Å; N21-S240 PolarHBondContact ND2-OG 3.25Å; N21-I244 HydrophobicContact CB-CD1 3.46Å; N21-I244 VanDerWaalsContact CB-CD1 3.46Å; N21-F256 HydrophobicContact CB-CE1 4.32Å; N21-K260 PolarHBondContact O-NZ 3Å; N21-K260 WeakPolarHBondContact OD1-CE 3.14Å; N21-K260 PolarHBondContact OD1-NZ 3.03Å |
| 22 | L | 92.5 | Very high | 90.2 | Very high | 15 Ų | 15 | 55.7 Ų | 55.7 | 8% | 0.079 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.9 | -54.4 | 172.5 | 176.5 | 67.6 | 0 | 0 | 0 | 110.6 | L18 L19 F20 S25 I26 F256 K260 I263 | L18-L22 PolarHBondContact O-N 2.85Å; L19-L22 HydrophobicContact CD1-CD2 4.38Å; L19-L22 WeakPolarHBondContact O-CB 3.32Å; L19-L22 PolarHBondContact O-N 3.31Å; F20-L22 VanDerWaalsContact C-N 3.3Å; F20-L22 PolarHBondContact O-N 2.96Å; L22-S25 PolarHBondContact O-N 2.85Å; L22-I26 HydrophobicContact CD1-CD1 3.8Å; L22-I26 HydrophobicContact CD1-CG1 4.34Å; L22-I26 HydrophobicContact CG-CD1 3.93Å; L22-I26 WeakPolarHBondContact O-CG1 3.17Å; L22-I26 PolarHBondContact O-N 3.43Å; L22-F256 HydrophobicContact CB-CZ 3.98Å; L22-K260 HydrophobicContact CD1-CB 3.95Å; L22-K260 HydrophobicContact CD1-CD 3.83Å; L22-K260 HydrophobicContact CD1-CG 3.63Å; L22-I263 HydrophobicContact CD1-CD1 4.49Å; L22-I263 HydrophobicContact CD2-CD1 3.89Å |
| 23 | L | 92.3 | Very high | 90.2 | Very high | 100 Ų | 100 | 60.7 Ų | 60.7 | 52% | 0.524 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.3 | -53.6 | -176.7 | -66.7 | 173.2 | 0 | 0 | 0 | 111.6 | L19 F20 S25 I26 C27 | L19-L23 HydrophobicContact CG-CD1 4.49Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 2.87Å; F20-L23 PolarHBondContact O-N 3.41Å; L23-S25 VanDerWaalsContact C-N 3.28Å; L23-S25 PolarHBondContact O-N 3.04Å; L23-I26 PolarHBondContact O-N 2.81Å; L23-I26 VanDerWaalsContact O-N 3.13Å; L23-C27 PolarHBondContact O-N 3.28Å; L23-C27 PolarHBondContact O-SG 2.84Å |
| 24 | V | 94.4 | Very high | 90.3 | Very high | 15 Ų | 15 | 57.7 Ų | 57.7 | 9% | 0.091 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.3 | -31.2 | -179.6 | -60.3 | 0 | 0 | 0 | 0 | 112.6 | F20 I28 I233 M236 V237 | F20-V24 HydrophobicContact CD1-CG2 4.44Å; F20-V24 HydrophobicContact CD2-CG1 4.3Å; F20-V24 HydrophobicContact CE1-CG1 4.11Å; F20-V24 HydrophobicContact CE1-CG2 4.29Å; F20-V24 HydrophobicContact CE2-CG1 3.83Å; F20-V24 HydrophobicContact CZ-CG1 3.74Å; F20-V24 WeakPolarHBondContact O-CG2 3.47Å; F20-V24 PolarHBondContact O-N 3.18Å; V24-I28 WeakPolarHBondContact O-CG2 3.3Å; V24-I28 PolarHBondContact O-N 3.48Å; V24-I233 HydrophobicContact CB-CG2 4.28Å; V24-I233 WeakPolarHBondContact O-CG2 3.23Å; V24-M236 HydrophobicContact CG1-CB 4.37Å; V24-M236 HydrophobicContact CG1-SD 4.45Å; V24-V237 HydrophobicContact CB-CG2 3.95Å; V24-V237 HydrophobicContact CG2-CB 4.5Å; V24-V237 HydrophobicContact CG2-CG2 3.68Å |
| 25 | S | 91.1 | Very high | 90.4 | Very high | 19 Ų | 19 | 55.4 Ų | 55.4 | 13% | 0.133 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -71 | -33.9 | 174.2 | -63.4 | 0 | 0 | 0 | 0 | 112.8 | N21 L22 L23 I28 V29 K260 | N21-S25 WeakPolarHBondContact O-CB 3.42Å; N21-S25 PolarHBondContact O-N 3.44Å; N21-S25 VanDerWaalsContact O-N 3.09Å; N21-S25 PolarHBondContact O-OG 3.31Å; L22-S25 PolarHBondContact O-N 2.85Å; L23-S25 VanDerWaalsContact C-N 3.28Å; L23-S25 PolarHBondContact O-N 3.04Å; S25-I28 VanDerWaalsContact O-CG2 3.28Å; S25-I28 WeakPolarHBondContact O-CG2 3.42Å; S25-V29 VanDerWaalsContact O-CG2 3.23Å; S25-V29 WeakPolarHBondContact O-CG2 3.4Å; S25-V29 PolarHBondContact O-N 3.36Å; S25-K260 PolarHBondContact OG-NZ 3.49Å |
| 26 | I | 87.8 | Confident | 90.3 | Very high | 50 Ų | 50 | 58.8 Ų | 58.8 | 26% | 0.256 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -69.5 | -46.8 | 174.2 | -68.8 | 168.9 | 0 | 0 | 0 | 109.3 | L22 L23 I28 V29 F30 | L22-I26 HydrophobicContact CD1-CD1 3.8Å; L22-I26 HydrophobicContact CD1-CG1 4.34Å; L22-I26 HydrophobicContact CG-CD1 3.93Å; L22-I26 WeakPolarHBondContact O-CG1 3.17Å; L22-I26 PolarHBondContact O-N 3.43Å; L23-I26 PolarHBondContact O-N 2.81Å; L23-I26 VanDerWaalsContact O-N 3.13Å; I26-I28 PolarHBondContact O-N 3.38Å; I26-V29 PolarHBondContact O-N 3.17Å; I26-F30 HydrophobicContact CG2-CD2 3.7Å; I26-F30 HydrophobicContact CG2-CE2 3.49Å; I26-F30 VanDerWaalsContact CG2-CE2 3.49Å; I26-F30 VanDerWaalsContact O-CD2 3.27Å; I26-F30 WeakPolarHBondContact O-CD2 3.29Å; I26-F30 PolarHBondContact O-N 2.87Å |
| 27 | C | 90.6 | Very high | 90.1 | Very high | 67 Ų | 67 | 60.5 Ų | 60.5 | 45% | 0.453 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -56 | -47.1 | 178 | -66.3 | 0 | 0 | 0 | 0 | 112.2 | L23 V29 F30 L31 I233 | L23-C27 PolarHBondContact O-N 3.28Å; L23-C27 PolarHBondContact O-SG 2.84Å; C27-V29 VanDerWaalsContact C-N 3.35Å; C27-V29 PolarHBondContact O-N 3.43Å; C27-F30 PolarHBondContact O-N 3Å; C27-L31 VanDerWaalsContact O-CB 3.31Å; C27-L31 WeakPolarHBondContact O-CB 3.48Å; C27-L31 PolarHBondContact O-N 3.26Å; C27-I233 HydrophobicContact CB-CD1 4.33Å; C27-I233 HydrophobicContact CB-CG2 4.41Å |
| 28 | I | 91.9 | Very high | 90 | Very high | 17 Ų | 17 | 65.5 Ų | 65.5 | 9% | 0.087 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.2 | -36 | -179.2 | -162.8 | 168.6 | 0 | 0 | 0 | 112.5 | V24 S25 I26 L31 N32 I233 A234 V237 | V24-I28 WeakPolarHBondContact O-CG2 3.3Å; V24-I28 PolarHBondContact O-N 3.48Å; S25-I28 VanDerWaalsContact O-CG2 3.28Å; S25-I28 WeakPolarHBondContact O-CG2 3.42Å; I26-I28 PolarHBondContact O-N 3.38Å; I28-L31 PolarHBondContact O-N 2.82Å; I28-N32 VanDerWaalsContact O-CB 3.26Å; I28-N32 WeakPolarHBondContact O-CB 3.25Å; I28-N32 PolarHBondContact O-N 3.32Å; I28-N32 PolarHBondContact O-OD1 3.29Å; I28-I233 HydrophobicContact CB-CG2 3.83Å; I28-I233 HydrophobicContact CG1-CG2 4.43Å; I28-A234 HydrophobicContact CD1-CB 3.57Å; I28-V237 HydrophobicContact CB-CG2 4.34Å; I28-V237 HydrophobicContact CD1-CG2 4.29Å; I28-V237 HydrophobicContact CG2-CG2 3.98Å |
| 29 | V | 86.6 | Confident | 89.7 | Confident | 95 Ų | 95 | 66.1 Ų | 66.1 | 58% | 0.576 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.5 | -46.3 | 178.6 | 167.6 | 0 | 0 | 0 | 0 | 110.5 | S25 I26 C27 K33 | S25-V29 VanDerWaalsContact O-CG2 3.23Å; S25-V29 WeakPolarHBondContact O-CG2 3.4Å; S25-V29 PolarHBondContact O-N 3.36Å; I26-V29 PolarHBondContact O-N 3.17Å; C27-V29 VanDerWaalsContact C-N 3.35Å; C27-V29 PolarHBondContact O-N 3.43Å; V29-K33 WeakPolarHBondContact O-CB 3.19Å; V29-K33 PolarHBondContact O-N 3.24Å |
| 30 | F | 85.1 | Confident | 89.3 | Confident | 117 Ų | 117 | 63 Ų | 63 | 51% | 0.513 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.2 | -43.1 | 177 | -75.5 | -64.5 | 0 | 0 | 0 | 112.2 | I26 C27 K33 W34 | I26-F30 HydrophobicContact CG2-CD2 3.7Å; I26-F30 HydrophobicContact CG2-CE2 3.49Å; I26-F30 VanDerWaalsContact CG2-CE2 3.49Å; I26-F30 VanDerWaalsContact O-CD2 3.27Å; I26-F30 WeakPolarHBondContact O-CD2 3.29Å; I26-F30 PolarHBondContact O-N 2.87Å; C27-F30 PolarHBondContact O-N 3Å; F30-K33 PolarHBondContact O-N 3.43Å; F30-W34 WeakPolarHBondContact O-CB 3.32Å; F30-W34 PolarHBondContact O-N 2.89Å |
| 31 | L | 89.9 | Confident | 88.9 | Confident | 22 Ų | 22 | 58.9 Ų | 58.9 | 12% | 0.115 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.9 | -43.5 | -179.9 | -173.8 | 59.5 | 0 | 0 | 0 | 111.8 | C27 I28 K33 W34 I35 M226 L229 S230 I233 | C27-L31 VanDerWaalsContact O-CB 3.31Å; C27-L31 WeakPolarHBondContact O-CB 3.48Å; C27-L31 PolarHBondContact O-N 3.26Å; I28-L31 PolarHBondContact O-N 2.82Å; L31-K33 PolarHBondContact O-N 3.32Å; L31-W34 PolarHBondContact O-N 3.43Å; L31-I35 HydrophobicContact CD1-CD1 4.32Å; L31-I35 HydrophobicContact CG-CD1 3.99Å; L31-I35 WeakPolarHBondContact O-CB 3.25Å; L31-I35 VanDerWaalsContact O-CG1 3.27Å; L31-I35 WeakPolarHBondContact O-CG1 3.35Å; L31-I35 PolarHBondContact O-N 2.94Å; L31-M226 HydrophobicContact CD1-CE 3.37Å; L31-M226 HydrophobicContact CD1-SD 4.48Å; L31-L229 HydrophobicContact CD2-CD2 4.41Å; L31-L229 HydrophobicContact CD2-CG 4.24Å; L31-S230 VanDerWaalsContact CD2-CA 3.46Å; L31-I233 HydrophobicContact CD2-CD1 3.77Å |
| 32 | N | 91.1 | Very high | 88.5 | Confident | 38 Ų | 38 | 59.5 Ų | 59.5 | 20% | 0.203 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.4 | -44 | 175.7 | -69.4 | -0.9 | 0 | 0 | 0 | 111.3 | I28 W34 I35 Y36 L46 H50 | I28-N32 VanDerWaalsContact O-CB 3.26Å; I28-N32 WeakPolarHBondContact O-CB 3.25Å; I28-N32 PolarHBondContact O-N 3.32Å; I28-N32 PolarHBondContact O-OD1 3.29Å; N32-W34 VanDerWaalsContact C-N 3.31Å; N32-W34 PolarHBondContact O-N 3.45Å; N32-I35 PolarHBondContact O-N 2.96Å; N32-Y36 WeakPolarHBondContact O-CB 3.48Å; N32-Y36 PolarHBondContact O-N 3.27Å; N32-L46 HydrophobicContact CB-CD2 4.05Å; N32-H50 PolarHBondContact OD1-CE1 3.37Å |
| 33 | K | 83.5 | Confident | 88.2 | Confident | 143 Ų | 143 | 61.6 Ų | 61.6 | 62% | 0.622 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -60.5 | -43.2 | 175.8 | -175.4 | 177.8 | -179.1 | -178.9 | 0 | 111.2 | V29 F30 L31 Y36 V37 | V29-K33 WeakPolarHBondContact O-CB 3.19Å; V29-K33 PolarHBondContact O-N 3.24Å; F30-K33 PolarHBondContact O-N 3.43Å; L31-K33 PolarHBondContact O-N 3.32Å; K33-Y36 PolarHBondContact O-N 3.47Å; K33-V37 HydrophobicContact CG-CG2 4.35Å; K33-V37 WeakPolarHBondContact O-CB 3.25Å; K33-V37 VanDerWaalsContact O-CG2 3.3Å; K33-V37 WeakPolarHBondContact O-CG2 3.43Å; K33-V37 PolarHBondContact O-N 2.83Å |
| 34 | W | 87.3 | Confident | 87.9 | Confident | 103 Ų | 103 | 57.3 Ų | 57.3 | 39% | 0.39 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 178.8 | -173.2 | 92 | 0 | 0 | 0 | 111.6 | F30 L31 N32 Y36 V37 H38 H39 M226 | F30-W34 WeakPolarHBondContact O-CB 3.32Å; F30-W34 PolarHBondContact O-N 2.89Å; L31-W34 PolarHBondContact O-N 3.43Å; N32-W34 VanDerWaalsContact C-N 3.31Å; N32-W34 PolarHBondContact O-N 3.45Å; W34-Y36 VanDerWaalsContact C-N 3.33Å; W34-Y36 PolarHBondContact O-N 3.35Å; W34-V37 PolarHBondContact O-N 3.32Å; W34-H38 AromaticContact CD1-CD2 3.23Å; W34-H38 AromaticContact CD1-NE2 3.53Å; W34-H38 HydrophobicContact CD2-CB 4.46Å; W34-H38 AromaticContact CD2-CD2 3.81Å; W34-H38 AromaticContact CE2-CD2 3.52Å; W34-H38 AromaticContact CE2-CG 3.95Å; W34-H38 AromaticContact CG-CD2 3.64Å; W34-H38 HydrophobicContact CZ2-CB 4.3Å; W34-H38 AromaticContact NE1-CD2 3.13Å; W34-H38 PolarHBondContact NE1-CD2 3.38Å; W34-H38 AromaticContact NE1-CG 3.92Å; W34-H38 AromaticContact NE1-NE2 3.38Å; W34-H38 PolarHBondContact NE1-NE2 3.38Å; W34-H38 WeakPolarHBondContact O-CB 3.44Å; W34-H38 PolarHBondContact O-CD2 2.85Å; W34-H38 PolarHBondContact O-N 3.49Å; W34-H39 AromaticContact CH2-NE2 3.33Å; W34-H39 VanDerWaalsContact CH2-NE2 3.33Å; W34-H39 WeakPolarHBondContact CH2-NE2 3.36Å; W34-H39 AromaticContact CZ3-CD2 3.44Å; W34-H39 VanDerWaalsContact CZ3-CD2 3.44Å; W34-H39 WeakPolarHBondContact CZ3-CD2 3.28Å; W34-H39 AromaticContact CZ3-NE2 3.18Å; W34-H39 WeakPolarHBondContact CZ3-NE2 3.32Å; W34-M226 HydrophobicContact CD2-CE 4.13Å; W34-M226 HydrophobicContact CE3-CE 3.41Å; W34-M226 VanDerWaalsContact CE3-CE 3.41Å; W34-M226 HydrophobicContact CH2-CE 3.92Å; W34-M226 HydrophobicContact CH2-CG 4.3Å; W34-M226 HydrophobicContact CZ3-CB 4.16Å; W34-M226 HydrophobicContact CZ3-CE 3.29Å; W34-M226 HydrophobicContact CZ3-CG 3.72Å; W34-M226 HydrophobicContact CZ3-SD 4.3Å |
| 35 | I | 89.8 | Confident | 87.6 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.9 | -45.2 | 175.3 | -72.1 | 166.2 | 0 | 0 | 0 | 110.7 | L31 N32 H39 G40 F41 M226 V227 | L31-I35 HydrophobicContact CD1-CD1 4.32Å; L31-I35 HydrophobicContact CG-CD1 3.99Å; L31-I35 WeakPolarHBondContact O-CB 3.25Å; L31-I35 VanDerWaalsContact O-CG1 3.27Å; L31-I35 WeakPolarHBondContact O-CG1 3.35Å; L31-I35 PolarHBondContact O-N 2.94Å; N32-I35 PolarHBondContact O-N 2.96Å; I35-H39 WeakPolarHBondContact O-CA 3.36Å; I35-H39 VanDerWaalsContact O-CB 3.3Å; I35-H39 WeakPolarHBondContact O-CB 3.35Å; I35-H39 PolarHBondContact O-N 2.97Å; I35-G40 PolarHBondContact O-N 3.39Å; I35-F41 HydrophobicContact CG2-CB 3.56Å; I35-F41 HydrophobicContact CG2-CG 4.32Å; I35-M226 HydrophobicContact CD1-CB 4.35Å; I35-M226 HydrophobicContact CG1-CB 4.12Å; I35-V227 HydrophobicContact CD1-CG2 4.48Å; I35-V227 HydrophobicContact CG2-CG2 4.11Å |
| 36 | Y | 87 | Confident | 87.6 | Confident | 127 Ų | 127 | 55.8 Ų | 55.8 | 50% | 0.498 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 178.6 | -177.1 | -94.4 | 0 | 0 | 0 | 112.2 | N32 K33 W34 G40 N43 | N32-Y36 WeakPolarHBondContact O-CB 3.48Å; N32-Y36 PolarHBondContact O-N 3.27Å; K33-Y36 PolarHBondContact O-N 3.47Å; W34-Y36 VanDerWaalsContact C-N 3.33Å; W34-Y36 PolarHBondContact O-N 3.35Å; Y36-G40 WeakPolarHBondContact O-CA 3.37Å; Y36-G40 PolarHBondContact O-N 2.9Å; Y36-N43 WeakPolarHBondContact CD2-ND2 3.17Å |
| 37 | V | 86.4 | Confident | 87.8 | Confident | 96 Ų | 96 | 54.9 Ų | 54.9 | 58% | 0.582 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -75.2 | -40.2 | -175.5 | 172.6 | 0 | 0 | 0 | 0 | 112.9 | K33 W34 | K33-V37 HydrophobicContact CG-CG2 4.35Å; K33-V37 WeakPolarHBondContact O-CB 3.25Å; K33-V37 VanDerWaalsContact O-CG2 3.3Å; K33-V37 WeakPolarHBondContact O-CG2 3.43Å; K33-V37 PolarHBondContact O-N 2.83Å; W34-V37 PolarHBondContact O-N 3.32Å |
| 38 | H | 87.4 | Confident | 88 | Confident | 119 Ų | 119 | 52.4 Ų | 52.4 | 55% | 0.551 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -93 | -28.8 | -174.4 | -71 | -76.6 | 0 | 0 | 0 | 114.1 | W34 | W34-H38 AromaticContact CD1-CD2 3.23Å; W34-H38 AromaticContact CD1-NE2 3.53Å; W34-H38 HydrophobicContact CD2-CB 4.46Å; W34-H38 AromaticContact CD2-CD2 3.81Å; W34-H38 AromaticContact CE2-CD2 3.52Å; W34-H38 AromaticContact CE2-CG 3.95Å; W34-H38 AromaticContact CG-CD2 3.64Å; W34-H38 HydrophobicContact CZ2-CB 4.3Å; W34-H38 AromaticContact NE1-CD2 3.13Å; W34-H38 PolarHBondContact NE1-CD2 3.38Å; W34-H38 AromaticContact NE1-CG 3.92Å; W34-H38 AromaticContact NE1-NE2 3.38Å; W34-H38 PolarHBondContact NE1-NE2 3.38Å; W34-H38 WeakPolarHBondContact O-CB 3.44Å; W34-H38 PolarHBondContact O-CD2 2.85Å; W34-H38 PolarHBondContact O-N 3.49Å |
| 39 | H | 85.8 | Confident | 88 | Confident | 49 Ų | 49 | 53 Ų | 53 | 23% | 0.227 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -110.3 | -20.4 | 179.4 | -62.5 | -58.9 | 0 | 0 | 0 | 112.8 | W34 I35 F41 W219 A223 | W34-H39 AromaticContact CH2-NE2 3.33Å; W34-H39 VanDerWaalsContact CH2-NE2 3.33Å; W34-H39 WeakPolarHBondContact CH2-NE2 3.36Å; W34-H39 AromaticContact CZ3-CD2 3.44Å; W34-H39 VanDerWaalsContact CZ3-CD2 3.44Å; W34-H39 WeakPolarHBondContact CZ3-CD2 3.28Å; W34-H39 AromaticContact CZ3-NE2 3.18Å; W34-H39 WeakPolarHBondContact CZ3-NE2 3.32Å; I35-H39 WeakPolarHBondContact O-CA 3.36Å; I35-H39 VanDerWaalsContact O-CB 3.3Å; I35-H39 WeakPolarHBondContact O-CB 3.35Å; I35-H39 PolarHBondContact O-N 2.97Å; H39-F41 PolarHBondContact O-N 3.02Å; H39-W219 VanDerWaalsContact O-CZ3 3.27Å; H39-W219 WeakPolarHBondContact O-CZ3 3.34Å; H39-A223 HydrophobicContact CB-CB 4.04Å |
| 40 | G | 85.2 | Confident | 88.4 | Confident | 38 Ų | 38 | 49 Ų | 49 | 39% | 0.392 | 24% | 0.242 | S | C | . | . | trans | 73.6 | 16.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | I35 Y36 | I35-G40 PolarHBondContact O-N 3.39Å; Y36-G40 WeakPolarHBondContact O-CA 3.37Å; Y36-G40 PolarHBondContact O-N 2.9Å | ||
| 41 | F | 86.1 | Confident | 88.9 | Confident | 6 Ų | 6 | 43.7 Ų | 43.7 | 3% | 0.026 | 22% | 0.219 | C | C | . | . | trans | -68.6 | 131.1 | 179.2 | -163 | -82.9 | 0 | 0 | 0 | 110.2 | I35 H39 L46 V49 W219 V227 | I35-F41 HydrophobicContact CG2-CB 3.56Å; I35-F41 HydrophobicContact CG2-CG 4.32Å; H39-F41 PolarHBondContact O-N 3.02Å; F41-L46 HydrophobicContact CD1-CB 3.89Å; F41-L46 HydrophobicContact CD1-CD1 4.02Å; F41-L46 HydrophobicContact CD1-CG 4.48Å; F41-L46 HydrophobicContact CE1-CB 3.92Å; F41-L46 HydrophobicContact CE1-CD1 4.08Å; F41-V49 HydrophobicContact CZ-CG2 4.44Å; F41-W219 HydrophobicContact CB-CH2 4.05Å; F41-W219 HydrophobicContact CB-CZ2 4.43Å; F41-W219 HydrophobicContact CB-CZ3 4.31Å; F41-W219 AromaticContact CD2-CD2 3.79Å; F41-W219 HydrophobicContact CD2-CD2 3.79Å; F41-W219 AromaticContact CD2-CE2 3.43Å; F41-W219 VanDerWaalsContact CD2-CE2 3.43Å; F41-W219 HydrophobicContact CD2-CE3 4.11Å; F41-W219 HydrophobicContact CD2-CG 4.47Å; F41-W219 AromaticContact CD2-CH2 3.85Å; F41-W219 HydrophobicContact CD2-CH2 3.85Å; F41-W219 AromaticContact CD2-CZ2 3.45Å; F41-W219 HydrophobicContact CD2-CZ2 3.45Å; F41-W219 VanDerWaalsContact CD2-CZ2 3.45Å; F41-W219 HydrophobicContact CD2-CZ3 4.15Å; F41-W219 AromaticContact CD2-NE1 3.92Å; F41-W219 HydrophobicContact CE2-CD2 4.17Å; F41-W219 AromaticContact CE2-CE2 3.64Å; F41-W219 HydrophobicContact CE2-CG 4.46Å; F41-W219 AromaticContact CE2-CZ2 3.95Å; F41-W219 HydrophobicContact CE2-CZ2 3.95Å; F41-W219 AromaticContact CE2-NE1 3.61Å; F41-W219 HydrophobicContact CG-CH2 4.28Å; F41-W219 HydrophobicContact CG-CZ2 4.16Å; F41-V227 HydrophobicContact CD1-CG2 4.31Å; F41-V227 HydrophobicContact CD2-CG2 3.95Å; F41-V227 HydrophobicContact CE2-CG2 4.17Å; F41-V227 HydrophobicContact CG-CG2 4.03Å; F41-V227 HydrophobicContact CZ-CG1 4.45Å; F41-V227 HydrophobicContact CZ-CG2 4.45Å | ||
| 42 | P | 86.9 | Confident | 89.1 | Confident | 13 Ų | 13 | 45.1 Ų | 45.1 | 8% | 0.084 | 23% | 0.228 | C | C | . | . | trans | -80.9 | 148.3 | -168.7 | 37.7 | -41.7 | 0 | 0 | 0 | 112.1 | L46 E207 G213 | P42-L46 WeakPolarHBondContact O-CB 3.35Å; P42-L46 PolarHBondContact O-N 3.42Å; P42-E207 VanDerWaalsContact CB-CD 3.47Å; P42-E207 HydrophobicContact CB-CG 4.23Å; P42-E207 WeakPolarHBondContact CB-OE2 3.43Å; P42-G213 WeakPolarHBondContact CD-O 3.3Å; P42-G213 WeakPolarHBondContact CG-O 3.5Å | ||
| 43 | N | 85.4 | Confident | 89.4 | Confident | 59 Ų | 59 | 44.3 Ų | 44.3 | 32% | 0.316 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -75.3 | -36 | -162.7 | -72 | -47.2 | 0 | 0 | 0 | 114.2 | Y36 L46 T47 E207 | Y36-N43 WeakPolarHBondContact CD2-ND2 3.17Å; N43-L46 WeakPolarHBondContact O-CB 3.48Å; N43-L46 PolarHBondContact O-N 2.89Å; N43-T47 PolarHBondContact O-N 3.27Å; N43-T47 PolarHBondContact O-OG1 2.95Å; N43-E207 PolarHBondContact N-OE1 2.9Å; N43-E207 VanDerWaalsContact N-OE1 3.14Å |
| 44 | M | 85.8 | Confident | 90 | Very high | 11 Ų | 11 | 37.5 Ų | 37.5 | 5% | 0.054 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -71.7 | -41.7 | 177.2 | -60 | -158.7 | -168.5 | 0 | 0 | 110.8 | L46 T47 L48 N92 V203 F206 E207 | M44-L46 VanDerWaalsContact C-N 3.26Å; M44-L46 PolarHBondContact O-N 3.09Å; M44-T47 WeakPolarHBondContact O-CB 2.74Å; M44-T47 PolarHBondContact O-N 3.11Å; M44-T47 VanDerWaalsContact O-N 3.14Å; M44-L48 PolarHBondContact O-N 2.76Å; M44-N92 HydrophobicContact CE-CB 3.83Å; M44-V203 HydrophobicContact CB-CG2 4.11Å; M44-F206 HydrophobicContact CE-CB 3.71Å; M44-F206 HydrophobicContact CE-CD1 4.12Å; M44-F206 HydrophobicContact CE-CD2 4.09Å; M44-F206 HydrophobicContact CE-CG 3.7Å; M44-F206 HydrophobicContact SD-CB 3.76Å; M44-F206 HydrophobicContact SD-CD2 3.92Å; M44-F206 HydrophobicContact SD-CG 3.96Å; M44-E207 HydrophobicContact CB-CG 4.41Å; M44-E207 WeakPolarHBondContact CB-OE1 3.48Å; M44-E207 PolarHBondContact N-OE1 3.04Å |
| 45 | S | 89.9 | Confident | 90.4 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.3 | -37 | 172.3 | -56.2 | 0 | 0 | 0 | 0 | 111.5 | T47 L48 V49 V203 E207 | S45-T47 VanDerWaalsContact C-N 3.31Å; S45-T47 PolarHBondContact O-N 2.7Å; S45-L48 WeakPolarHBondContact O-CB 3.48Å; S45-L48 PolarHBondContact O-N 3.49Å; S45-V49 WeakPolarHBondContact O-CG2 3.41Å; S45-V49 PolarHBondContact O-N 3.35Å; S45-V203 WeakPolarHBondContact OG-CG1 3.43Å; S45-E207 WeakPolarHBondContact CB-OE2 3.33Å; S45-E207 PolarHBondContact N-OE2 3.47Å; S45-E207 PolarHBondContact OG-OE2 3.32Å |
| 46 | L | 91.2 | Very high | 90.7 | Very high | 2 Ų | 2 | 40.1 Ų | 40.1 | 1% | 0.01 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.7 | -42.1 | 175.3 | -171.5 | 61.3 | 0 | 0 | 0 | 110.9 | N32 F41 P42 N43 M44 L48 V49 H50 V227 | N32-L46 HydrophobicContact CB-CD2 4.05Å; F41-L46 HydrophobicContact CD1-CB 3.89Å; F41-L46 HydrophobicContact CD1-CD1 4.02Å; F41-L46 HydrophobicContact CD1-CG 4.48Å; F41-L46 HydrophobicContact CE1-CB 3.92Å; F41-L46 HydrophobicContact CE1-CD1 4.08Å; P42-L46 WeakPolarHBondContact O-CB 3.35Å; P42-L46 PolarHBondContact O-N 3.42Å; N43-L46 WeakPolarHBondContact O-CB 3.48Å; N43-L46 PolarHBondContact O-N 2.89Å; M44-L46 VanDerWaalsContact C-N 3.26Å; M44-L46 PolarHBondContact O-N 3.09Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 3.28Å; L46-V49 PolarHBondContact O-N 3.38Å; L46-H50 PolarHBondContact O-CD2 3.07Å; L46-H50 VanDerWaalsContact O-CD2 3.28Å; L46-H50 PolarHBondContact O-N 3.02Å; L46-V227 HydrophobicContact CD1-CB 4.42Å; L46-V227 HydrophobicContact CD1-CG1 3.93Å; L46-V227 HydrophobicContact CD1-CG2 4.09Å |
| 47 | T | 91.8 | Very high | 91 | Very high | 31 Ų | 31 | 34.9 Ų | 34.9 | 19% | 0.19 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.4 | -39.1 | 175.2 | -53.8 | 0 | 0 | 0 | 0 | 111.6 | N43 M44 S45 H50 F51 F84 V88 L199 | N43-T47 PolarHBondContact O-N 3.27Å; N43-T47 PolarHBondContact O-OG1 2.95Å; M44-T47 WeakPolarHBondContact O-CB 2.74Å; M44-T47 PolarHBondContact O-N 3.11Å; M44-T47 VanDerWaalsContact O-N 3.14Å; S45-T47 VanDerWaalsContact C-N 3.31Å; S45-T47 PolarHBondContact O-N 2.7Å; T47-H50 WeakPolarHBondContact O-CB 3.1Å; T47-H50 PolarHBondContact O-N 3.36Å; T47-F51 HydrophobicContact CG2-CD2 4.27Å; T47-F51 HydrophobicContact CG2-CE2 4.47Å; T47-F51 WeakPolarHBondContact O-CD2 3.23Å; T47-F51 PolarHBondContact O-N 2.92Å; T47-F51 VanDerWaalsContact O-N 3.12Å; T47-F84 HydrophobicContact CG2-CZ 4.22Å; T47-V88 HydrophobicContact CG2-CG1 4.19Å; T47-V88 HydrophobicContact CG2-CG2 3.98Å; T47-L199 HydrophobicContact CG2-CD1 4.06Å |
| 48 | L | 93 | Very high | 91.4 | Very high | 15 Ų | 15 | 30.3 Ų | 30.3 | 8% | 0.079 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.4 | -50.4 | 173.3 | -177.8 | 162.8 | 0 | 0 | 0 | 110.8 | M44 S45 L46 H50 F51 V52 L199 L200 V203 I215 | M44-L48 PolarHBondContact O-N 2.76Å; S45-L48 WeakPolarHBondContact O-CB 3.48Å; S45-L48 PolarHBondContact O-N 3.49Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 3.28Å; L48-H50 VanDerWaalsContact C-N 3.31Å; L48-H50 PolarHBondContact O-N 3.45Å; L48-F51 PolarHBondContact O-N 3.22Å; L48-F51 VanDerWaalsContact O-N 3.16Å; L48-V52 HydrophobicContact CD2-CG2 4.01Å; L48-V52 WeakPolarHBondContact O-CG2 3.32Å; L48-V52 PolarHBondContact O-N 3.27Å; L48-L199 HydrophobicContact CB-CB 4.39Å; L48-L199 HydrophobicContact CD1-CB 4.42Å; L48-L199 HydrophobicContact CG-CB 4.5Å; L48-L200 VanDerWaalsContact CD1-CA 3.48Å; L48-L200 HydrophobicContact CD1-CB 3.81Å; L48-L200 HydrophobicContact CD1-CD1 3.79Å; L48-L200 HydrophobicContact CD1-CG 4.42Å; L48-V203 HydrophobicContact CD1-CG2 4.2Å; L48-I215 HydrophobicContact CD1-CD1 4.27Å; L48-I215 HydrophobicContact CD2-CD1 4.31Å |
| 49 | V | 93.3 | Very high | 91.7 | Very high | 30 Ų | 30 | 28.9 Ų | 28.9 | 18% | 0.182 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.7 | -41.5 | 178.5 | 177 | 0 | 0 | 0 | 0 | 111.1 | F41 S45 L46 F51 V52 V53 V227 | F41-V49 HydrophobicContact CZ-CG2 4.44Å; S45-V49 WeakPolarHBondContact O-CG2 3.41Å; S45-V49 PolarHBondContact O-N 3.35Å; L46-V49 PolarHBondContact O-N 3.38Å; V49-F51 VanDerWaalsContact C-N 3.29Å; V49-F51 PolarHBondContact O-N 3.4Å; V49-V52 PolarHBondContact O-N 2.98Å; V49-V53 HydrophobicContact CG1-CG2 4.12Å; V49-V53 WeakPolarHBondContact O-CG2 3.46Å; V49-V53 PolarHBondContact O-N 3.48Å; V49-V227 HydrophobicContact CB-CG1 4.3Å; V49-V227 HydrophobicContact CG1-CG1 3.74Å; V49-V227 HydrophobicContact CG2-CG1 4.47Å |
| 50 | H | 95.4 | Very high | 92.1 | Very high | 11 Ų | 11 | 31.2 Ų | 31.2 | 5% | 0.051 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -56 | -41.8 | 175.5 | -72.4 | 177.5 | 0 | 0 | 0 | 112.8 | N32 L46 T47 L48 T54 S230 A234 | N32-H50 PolarHBondContact OD1-CE1 3.37Å; L46-H50 PolarHBondContact O-CD2 3.07Å; L46-H50 VanDerWaalsContact O-CD2 3.28Å; L46-H50 PolarHBondContact O-N 3.02Å; T47-H50 WeakPolarHBondContact O-CB 3.1Å; T47-H50 PolarHBondContact O-N 3.36Å; L48-H50 VanDerWaalsContact C-N 3.31Å; L48-H50 PolarHBondContact O-N 3.45Å; H50-T54 VanDerWaalsContact O-CB 3.3Å; H50-T54 WeakPolarHBondContact O-CB 3.39Å; H50-T54 PolarHBondContact O-N 3.07Å; H50-T54 PolarHBondContact O-OG1 3.44Å; H50-S230 PolarHBondContact NE2-OG 2.86Å; H50-A234 HydrophobicContact CB-CB 3.5Å; H50-A234 VanDerWaalsContact CB-CB 3.5Å |
| 51 | F | 94.4 | Very high | 92.5 | Very high | 5 Ų | 5 | 30.4 Ų | 30.4 | 2% | 0.022 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -74.6 | -34.3 | 178.9 | -90.4 | -95.5 | 0 | 0 | 0 | 113.1 | T47 L48 V49 T54 W55 F84 L188 A192 | T47-F51 HydrophobicContact CG2-CD2 4.27Å; T47-F51 HydrophobicContact CG2-CE2 4.47Å; T47-F51 WeakPolarHBondContact O-CD2 3.23Å; T47-F51 PolarHBondContact O-N 2.92Å; T47-F51 VanDerWaalsContact O-N 3.12Å; L48-F51 PolarHBondContact O-N 3.22Å; L48-F51 VanDerWaalsContact O-N 3.16Å; V49-F51 VanDerWaalsContact C-N 3.29Å; V49-F51 PolarHBondContact O-N 3.4Å; F51-T54 PolarHBondContact O-N 3.45Å; F51-W55 PolarHBondContact O-N 2.84Å; F51-F84 HydrophobicContact CD1-CE1 4.24Å; F51-F84 HydrophobicContact CD1-CZ 4.43Å; F51-F84 AromaticContact CD2-CE1 3.91Å; F51-F84 HydrophobicContact CD2-CE1 3.91Å; F51-F84 AromaticContact CD2-CZ 3.64Å; F51-F84 HydrophobicContact CD2-CZ 3.64Å; F51-F84 HydrophobicContact CE1-CD1 4.42Å; F51-F84 AromaticContact CE1-CE1 3.97Å; F51-F84 HydrophobicContact CE1-CE1 3.97Å; F51-F84 HydrophobicContact CE1-CE2 4.15Å; F51-F84 AromaticContact CE1-CZ 3.87Å; F51-F84 HydrophobicContact CE1-CZ 3.87Å; F51-F84 AromaticContact CE2-CE1 3.64Å; F51-F84 HydrophobicContact CE2-CE1 3.64Å; F51-F84 AromaticContact CE2-CE2 3.56Å; F51-F84 HydrophobicContact CE2-CE2 3.56Å; F51-F84 AromaticContact CE2-CZ 2.96Å; F51-F84 HydrophobicContact CE2-CZ 2.96Å; F51-F84 HydrophobicContact CG-CE1 4.21Å; F51-F84 HydrophobicContact CG-CZ 4.34Å; F51-F84 HydrophobicContact CZ-CD1 4.36Å; F51-F84 HydrophobicContact CZ-CD2 4.01Å; F51-F84 AromaticContact CZ-CE1 3.66Å; F51-F84 HydrophobicContact CZ-CE1 3.66Å; F51-F84 AromaticContact CZ-CE2 3.27Å; F51-F84 HydrophobicContact CZ-CE2 3.27Å; F51-F84 AromaticContact CZ-CZ 3.09Å; F51-F84 HydrophobicContact CZ-CZ 3.09Å; F51-L188 HydrophobicContact CE1-CD1 4.47Å; F51-A192 HydrophobicContact CD1-CB 3.95Å |
| 52 | V | 95.4 | Very high | 92.8 | Very high | 51 Ų | 51 | 32.4 Ų | 32.4 | 31% | 0.309 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -62.3 | -48.5 | 170.2 | 173.5 | 0 | 0 | 0 | 0 | 110.6 | L48 V49 T54 W55 L56 | L48-V52 HydrophobicContact CD2-CG2 4.01Å; L48-V52 WeakPolarHBondContact O-CG2 3.32Å; L48-V52 PolarHBondContact O-N 3.27Å; V49-V52 PolarHBondContact O-N 2.98Å; V52-T54 VanDerWaalsContact C-N 3.31Å; V52-T54 PolarHBondContact O-N 2.85Å; V52-W55 PolarHBondContact O-N 3.39Å; V52-L56 HydrophobicContact CG1-CD1 4.2Å; V52-L56 WeakPolarHBondContact O-CG 3.45Å; V52-L56 PolarHBondContact O-N 3.11Å |
| 53 | V | 95.9 | Very high | 93 | Very high | 21 Ų | 21 | 38.4 Ų | 38.4 | 13% | 0.127 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -65.4 | -35.4 | 177.4 | 177.9 | 0 | 0 | 0 | 0 | 111.4 | V49 L56 G57 L228 G231 | V49-V53 HydrophobicContact CG1-CG2 4.12Å; V49-V53 WeakPolarHBondContact O-CG2 3.46Å; V49-V53 PolarHBondContact O-N 3.48Å; V53-L56 PolarHBondContact O-N 3.38Å; V53-G57 PolarHBondContact O-N 3.37Å; V53-L228 HydrophobicContact CG2-CD2 4.36Å; V53-G231 VanDerWaalsContact CG1-C 3.4Å; V53-G231 WeakPolarHBondContact CG1-O 3.48Å |
| 54 | T | 95.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.3 | -45.7 | 173.1 | -62.4 | 0 | 0 | 0 | 0 | 111.3 | H50 F51 V52 G57 L58 L188 A192 F235 N238 | H50-T54 VanDerWaalsContact O-CB 3.3Å; H50-T54 WeakPolarHBondContact O-CB 3.39Å; H50-T54 PolarHBondContact O-N 3.07Å; H50-T54 PolarHBondContact O-OG1 3.44Å; F51-T54 PolarHBondContact O-N 3.45Å; V52-T54 VanDerWaalsContact C-N 3.31Å; V52-T54 PolarHBondContact O-N 2.85Å; T54-G57 PolarHBondContact O-N 3.39Å; T54-L58 HydrophobicContact CG2-CD1 4.31Å; T54-L58 WeakPolarHBondContact O-CG 3.27Å; T54-L58 PolarHBondContact O-N 3.01Å; T54-L188 HydrophobicContact CG2-CD1 4.2Å; T54-L188 HydrophobicContact CG2-CD2 3.71Å; T54-L188 HydrophobicContact CG2-CG 3.89Å; T54-A192 HydrophobicContact CG2-CB 4.31Å; T54-F235 HydrophobicContact CG2-CD2 4.15Å; T54-F235 WeakPolarHBondContact OG1-CA 3.42Å; T54-N238 HydrophobicContact CG2-CB 4.13Å; T54-N238 PolarHBondContact OG1-ND2 3.44Å; T54-N238 VanDerWaalsContact OG1-ND2 3.07Å |
| 55 | W | 95.8 | Very high | 93.6 | Very high | 83 Ų | 83 | 47.6 Ų | 47.6 | 31% | 0.314 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -64 | -45.4 | 176 | 174.4 | 71.2 | 0 | 0 | 0 | 112 | F51 V52 G57 L58 Y59 Y189 A192 P193 | F51-W55 PolarHBondContact O-N 2.84Å; V52-W55 PolarHBondContact O-N 3.39Å; W55-G57 VanDerWaalsContact C-N 3.35Å; W55-G57 PolarHBondContact O-N 3.12Å; W55-L58 PolarHBondContact O-N 3.49Å; W55-Y59 WeakPolarHBondContact O-CB 3.12Å; W55-Y59 PolarHBondContact O-N 2.96Å; W55-Y189 AromaticContact NE1-CE2 3.96Å; W55-A192 HydrophobicContact CB-CB 4.12Å; W55-P193 HydrophobicContact CD2-CB 4.41Å; W55-P193 HydrophobicContact CG-CB 4.04Å; W55-P193 HydrophobicContact CG-CG 4.13Å |
| 56 | L | 96 | Very high | 93.5 | Very high | 76 Ų | 76 | 52.2 Ų | 52.2 | 40% | 0.398 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 176.3 | -71 | 173.1 | 0 | 0 | 0 | 112 | V52 V53 L58 Y59 I60 | V52-L56 HydrophobicContact CG1-CD1 4.2Å; V52-L56 WeakPolarHBondContact O-CG 3.45Å; V52-L56 PolarHBondContact O-N 3.11Å; V53-L56 PolarHBondContact O-N 3.38Å; L56-L58 PolarHBondContact O-N 2.82Å; L56-Y59 WeakPolarHBondContact O-CB 3.2Å; L56-Y59 PolarHBondContact O-N 3.34Å; L56-I60 WeakPolarHBondContact O-CG1 3.4Å; L56-I60 PolarHBondContact O-N 2.76Å |
| 57 | G | 94.9 | Very high | 93.5 | Very high | 16 Ų | 16 | 52.8 Ų | 52.8 | 17% | 0.165 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.2 | -45.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | V53 T54 W55 I60 C61 | V53-G57 PolarHBondContact O-N 3.37Å; T54-G57 PolarHBondContact O-N 3.39Å; W55-G57 VanDerWaalsContact C-N 3.35Å; W55-G57 PolarHBondContact O-N 3.12Å; G57-I60 PolarHBondContact O-N 2.99Å; G57-C61 PolarHBondContact O-N 3.03Å; G57-C61 PolarHBondContact O-SG 3.03Å |
| 58 | L | 94.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -67.8 | -34.8 | 175.9 | -69.1 | 170.7 | 0 | 0 | 0 | 112.9 | T54 W55 L56 I60 C61 Q62 F67 M185 L188 Y189 F235 | T54-L58 HydrophobicContact CG2-CD1 4.31Å; T54-L58 WeakPolarHBondContact O-CG 3.27Å; T54-L58 PolarHBondContact O-N 3.01Å; W55-L58 PolarHBondContact O-N 3.49Å; L56-L58 PolarHBondContact O-N 2.82Å; L58-I60 VanDerWaalsContact C-N 3.34Å; L58-C61 PolarHBondContact O-N 3.06Å; L58-Q62 WeakPolarHBondContact O-CB 3.42Å; L58-Q62 PolarHBondContact O-N 2.89Å; L58-F67 HydrophobicContact CD2-CE1 4.37Å; L58-F67 WeakPolarHBondContact O-CE1 3.14Å; L58-M185 HydrophobicContact CD2-CB 3.99Å; L58-M185 HydrophobicContact CD2-CG 4.15Å; L58-L188 HydrophobicContact CD1-CB 3.81Å; L58-L188 HydrophobicContact CD1-CD2 3.98Å; L58-L188 HydrophobicContact CD1-CG 3.65Å; L58-Y189 HydrophobicContact CB-CD2 3.8Å; L58-F235 HydrophobicContact CD2-CE2 3.76Å; L58-F235 HydrophobicContact CG-CD2 4.39Å; L58-F235 HydrophobicContact CG-CE2 3.8Å |
| 59 | Y | 93.7 | Very high | 92.6 | Very high | 90 Ų | 90 | 56.4 Ų | 56.4 | 35% | 0.353 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.3 | -40.7 | 173.8 | 178.6 | -101.9 | 0 | 0 | 0 | 111.7 | W55 L56 Q62 K63 Y189 | W55-Y59 WeakPolarHBondContact O-CB 3.12Å; W55-Y59 PolarHBondContact O-N 2.96Å; L56-Y59 WeakPolarHBondContact O-CB 3.2Å; L56-Y59 PolarHBondContact O-N 3.34Å; Y59-Q62 WeakPolarHBondContact O-CB 3.47Å; Y59-Q62 PolarHBondContact O-N 3.33Å; Y59-K63 HydrophobicContact CE1-CG 4.22Å; Y59-K63 WeakPolarHBondContact O-CG 3.28Å; Y59-K63 PolarHBondContact O-N 2.94Å; Y59-K63 WeakPolarHBondContact OH-CE 3.39Å; Y59-Y189 HydrophobicContact CD2-CE2 4.42Å |
| 60 | I | 94.1 | Very high | 92.2 | Very high | 98 Ų | 98 | 59.2 Ų | 59.2 | 50% | 0.503 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.6 | -46.4 | 172.1 | -64.9 | 167 | 0 | 0 | 0 | 110.1 | L56 G57 L58 Q62 K63 L64 | L56-I60 WeakPolarHBondContact O-CG1 3.4Å; L56-I60 PolarHBondContact O-N 2.76Å; G57-I60 PolarHBondContact O-N 2.99Å; L58-I60 VanDerWaalsContact C-N 3.34Å; I60-Q62 VanDerWaalsContact C-N 3.26Å; I60-Q62 PolarHBondContact O-N 2.93Å; I60-K63 PolarHBondContact O-N 3.42Å; I60-L64 HydrophobicContact CG2-CD1 3.91Å; I60-L64 HydrophobicContact CG2-CG 4.34Å; I60-L64 WeakPolarHBondContact O-CG 3.28Å; I60-L64 PolarHBondContact O-N 3.24Å |
| 61 | C | 92.9 | Very high | 91.7 | Very high | 21 Ų | 21 | 64 Ų | 64 | 14% | 0.142 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -58.8 | -37.2 | 176.9 | -67.8 | 0 | 0 | 0 | 0 | 112.8 | G57 L58 L64 D65 I66 F67 | G57-C61 PolarHBondContact O-N 3.03Å; G57-C61 PolarHBondContact O-SG 3.03Å; L58-C61 PolarHBondContact O-N 3.06Å; C61-L64 PolarHBondContact O-N 3.49Å; C61-D65 PolarHBondContact O-N 3.25Å; C61-I66 HydrophobicContact CB-CB 4.18Å; C61-I66 HydrophobicContact CB-CD1 3.99Å; C61-I66 HydrophobicContact CB-CG1 4.49Å; C61-I66 VanDerWaalsContact O-CB 3.32Å; C61-I66 WeakPolarHBondContact O-CB 3.45Å; C61-I66 PolarHBondContact O-N 3Å; C61-F67 HydrophobicContact CB-CD1 4.2Å; C61-F67 HydrophobicContact CB-CE1 3.92Å |
| 62 | Q | 92.8 | Very high | 91.3 | Very high | 48 Ų | 48 | 64.4 Ų | 64.4 | 22% | 0.224 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -63.6 | -45.3 | 173.2 | 179 | -164.7 | -5.7 | 0 | 0 | 111.3 | L58 Y59 I60 L64 D65 F67 P69 Y189 | L58-Q62 WeakPolarHBondContact O-CB 3.42Å; L58-Q62 PolarHBondContact O-N 2.89Å; Y59-Q62 WeakPolarHBondContact O-CB 3.47Å; Y59-Q62 PolarHBondContact O-N 3.33Å; I60-Q62 VanDerWaalsContact C-N 3.26Å; I60-Q62 PolarHBondContact O-N 2.93Å; Q62-L64 PolarHBondContact O-N 2.88Å; Q62-D65 PolarHBondContact O-N 2.97Å; Q62-F67 HydrophobicContact CB-CE1 4.05Å; Q62-F67 HydrophobicContact CB-CZ 3.93Å; Q62-P69 VanDerWaalsContact CD-CG 3.45Å; Q62-P69 HydrophobicContact CG-CG 3.66Å; Q62-P69 VanDerWaalsContact NE2-CG 3.32Å; Q62-Y189 PolarHBondContact OE1-OH 3.17Å |
| 63 | K | 91.6 | Very high | 90.8 | Very high | 138 Ų | 138 | 64.6 Ų | 64.6 | 60% | 0.6 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -66 | -24 | 178.4 | -74.9 | -68.7 | -173.2 | 179.7 | 0 | 113.5 | Y59 I60 D65 | Y59-K63 HydrophobicContact CE1-CG 4.22Å; Y59-K63 WeakPolarHBondContact O-CG 3.28Å; Y59-K63 PolarHBondContact O-N 2.94Å; Y59-K63 WeakPolarHBondContact OH-CE 3.39Å; I60-K63 PolarHBondContact O-N 3.42Å; K63-D65 VanDerWaalsContact C-N 3.29Å |
| 64 | L | 93.5 | Very high | 90.1 | Very high | 117 Ų | 117 | 67.8 Ų | 67.8 | 61% | 0.613 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | 11.3 | 173.5 | -63.9 | 176 | 0 | 0 | 0 | 113 | I60 C61 Q62 I66 | I60-L64 HydrophobicContact CG2-CD1 3.91Å; I60-L64 HydrophobicContact CG2-CG 4.34Å; I60-L64 WeakPolarHBondContact O-CG 3.28Å; I60-L64 PolarHBondContact O-N 3.24Å; C61-L64 PolarHBondContact O-N 3.49Å; Q62-L64 PolarHBondContact O-N 2.88Å; L64-I66 HydrophobicContact CB-CD1 4.21Å; L64-I66 HydrophobicContact CB-CG1 4.03Å; L64-I66 HydrophobicContact CD1-CD1 4.42Å; L64-I66 PolarHBondContact O-N 3.48Å; L64-I66 VanDerWaalsContact O-N 3.07Å |
| 65 | D | 89 | Confident | 89.5 | Confident | 147 Ų | 147 | 72.1 Ų | 72.1 | 79% | 0.786 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.7 | 26 | -179.4 | -64.3 | -48.1 | 0 | 0 | 0 | 114.6 | C61 Q62 K63 F67 | C61-D65 PolarHBondContact O-N 3.25Å; Q62-D65 PolarHBondContact O-N 2.97Å; K63-D65 VanDerWaalsContact C-N 3.29Å; D65-F67 VanDerWaalsContact C-N 3.25Å; D65-F67 PolarHBondContact O-N 3.44Å |
| 66 | I | 89.3 | Confident | 88.9 | Confident | 97 Ų | 97 | 72.3 Ų | 72.3 | 50% | 0.497 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -67.6 | -30.7 | 176.3 | -61.2 | 179.1 | 0 | 0 | 0 | 110.6 | C61 L64 M185 | C61-I66 HydrophobicContact CB-CB 4.18Å; C61-I66 HydrophobicContact CB-CD1 3.99Å; C61-I66 HydrophobicContact CB-CG1 4.49Å; C61-I66 VanDerWaalsContact O-CB 3.32Å; C61-I66 WeakPolarHBondContact O-CB 3.45Å; C61-I66 PolarHBondContact O-N 3Å; L64-I66 HydrophobicContact CB-CD1 4.21Å; L64-I66 HydrophobicContact CB-CG1 4.03Å; L64-I66 HydrophobicContact CD1-CD1 4.42Å; L64-I66 PolarHBondContact O-N 3.48Å; L64-I66 VanDerWaalsContact O-N 3.07Å; I66-M185 HydrophobicContact CG2-CE 4.32Å; I66-M185 HydrophobicContact CG2-SD 4.12Å |
| 67 | F | 89.6 | Confident | 88.6 | Confident | 13 Ų | 13 | 68.8 Ų | 68.8 | 6% | 0.057 | 38% | 0.384 | C | S | . | . | S | Bend | trans | -150.4 | 150.7 | 171.4 | 73.8 | -82.1 | 0 | 0 | 0 | 111.2 | L58 C61 Q62 D65 P69 M185 Q186 Y189 | L58-F67 HydrophobicContact CD2-CE1 4.37Å; L58-F67 WeakPolarHBondContact O-CE1 3.14Å; C61-F67 HydrophobicContact CB-CD1 4.2Å; C61-F67 HydrophobicContact CB-CE1 3.92Å; Q62-F67 HydrophobicContact CB-CE1 4.05Å; Q62-F67 HydrophobicContact CB-CZ 3.93Å; D65-F67 VanDerWaalsContact C-N 3.25Å; D65-F67 PolarHBondContact O-N 3.44Å; F67-P69 HydrophobicContact CE2-CG 4.2Å; F67-M185 HydrophobicContact CB-SD 4.21Å; F67-M185 HydrophobicContact CD1-CB 3.97Å; F67-M185 HydrophobicContact CD1-CG 4.48Å; F67-M185 HydrophobicContact CD1-SD 3.75Å; F67-M185 HydrophobicContact CD2-CB 4.35Å; F67-M185 HydrophobicContact CE1-CB 4.19Å; F67-M185 HydrophobicContact CG-CB 4.05Å; F67-M185 HydrophobicContact CG-SD 4.2Å; F67-M185 HydrophobicContact CZ-CB 4.49Å; F67-Q186 HydrophobicContact CD2-CG 3.77Å; F67-Q186 HydrophobicContact CE2-CG 4.23Å; F67-Y189 HydrophobicContact CZ-CD2 4.14Å; F67-Y189 HydrophobicContact CZ-CG 4.24Å |
| 68 | A | 84.8 | Confident | 88.4 | Confident | 76 Ų | 76 | 72.1 Ų | 72.1 | 63% | 0.628 | 40% | 0.398 | S | S | * | . | P | Polyproline II helix | trans | -93.9 | 124.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | K70 Q186 | A68-K70 PolarHBondContact O-N 2.96Å; A68-Q186 PolarHBondContact O-NE2 3.22Å |
| 69 | P | 81.2 | Confident | 88.3 | Confident | 47 Ų | 47 | 76.6 Ų | 76.6 | 31% | 0.305 | 42% | 0.421 | S | S | . | . | P | Polyproline II helix | trans | -65.7 | 135.1 | 175.8 | -14.7 | 26.6 | 0 | 0 | 0 | 110.9 | Q62 F67 | Q62-P69 VanDerWaalsContact CD-CG 3.45Å; Q62-P69 HydrophobicContact CG-CG 3.66Å; Q62-P69 VanDerWaalsContact NE2-CG 3.32Å; F67-P69 HydrophobicContact CE2-CG 4.2Å |
| 70 | K | 86.2 | Confident | 88.2 | Confident | 88 Ų | 88 | 72.4 Ų | 72.4 | 38% | 0.383 | 41% | 0.405 | S | S | . | . | P | Polyproline II helix | trans | -95.4 | 134.9 | 169.3 | -169.6 | -179.7 | -172.8 | 179.9 | 0 | 108.1 | A68 L72 L180 Q181 V182 Y190 | A68-K70 PolarHBondContact O-N 2.96Å; K70-L72 WeakPolarHBondContact O-CG 3.34Å; K70-L72 PolarHBondContact O-N 3.42Å; K70-L180 PolarHBondContact NZ-O 2.83Å; K70-Q181 PolarHBondContact NZ-O 3.45Å; K70-Q181 VanDerWaalsContact NZ-O 3.14Å; K70-V182 HydrophobicContact CB-CG1 4.15Å; K70-V182 HydrophobicContact CD-CG1 3.73Å; K70-Y190 WeakPolarHBondContact O-CE2 3.24Å; K70-Y190 PolarHBondContact O-OH 3.47Å |
| 71 | S | 84.2 | Confident | 88.2 | Confident | 113 Ų | 113 | 67.7 Ų | 67.7 | 79% | 0.79 | 38% | 0.381 | S | S | * | . | P | Polyproline II helix | trans | -62.1 | 123.4 | 174.7 | -175.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 72 | L | 85.7 | Confident | 88.2 | Confident | 12 Ų | 12 | 71.2 Ų | 71.2 | 6% | 0.063 | 40% | 0.397 | C | S | . | . | trans | -121.8 | 138 | 179.4 | -60.4 | -179.9 | 0 | 0 | 0 | 110.6 | K70 P74 L77 L180 V182 Y190 | K70-L72 WeakPolarHBondContact O-CG 3.34Å; K70-L72 PolarHBondContact O-N 3.42Å; L72-P74 WeakPolarHBondContact O-CD 3.25Å; L72-L77 HydrophobicContact CB-CD1 4Å; L72-L77 HydrophobicContact CD1-CD1 4.13Å; L72-L180 HydrophobicContact CD1-CD1 4.27Å; L72-L180 HydrophobicContact CD2-CB 4.01Å; L72-L180 HydrophobicContact CD2-CD1 4.12Å; L72-L180 HydrophobicContact CD2-CG 4.47Å; L72-V182 HydrophobicContact CD1-CG1 4.15Å; L72-V182 HydrophobicContact CD2-CG1 3.73Å; L72-V182 HydrophobicContact CG-CG1 4.41Å; L72-Y190 HydrophobicContact CB-CD2 4.37Å; L72-Y190 HydrophobicContact CB-CE2 4.49Å; L72-Y190 HydrophobicContact CD1-CD2 3.72Å; L72-Y190 HydrophobicContact CD1-CE2 4.19Å; L72-Y190 HydrophobicContact CD1-CG 4.49Å; L72-Y190 HydrophobicContact CG-CD2 4.15Å; L72-Y190 HydrophobicContact CG-CE2 4.18Å | ||
| 73 | P | 84.7 | Confident | 88.3 | Confident | 55 Ų | 55 | 69.3 Ų | 69.3 | 36% | 0.357 | 39% | 0.389 | S | S | . | . | trans | -67.3 | 121.8 | 175.5 | 26.5 | -32.3 | 0 | 0 | 0 | 110.1 | S75 K76 | P73-S75 PolarHBondContact O-N 2.9Å; P73-K76 HydrophobicContact CB-CG 4.48Å; P73-K76 HydrophobicContact CG-CB 4.1Å; P73-K76 HydrophobicContact CG-CD 3.72Å; P73-K76 HydrophobicContact CG-CG 3.77Å; P73-K76 PolarHBondContact O-N 3.41Å; P73-K76 VanDerWaalsContact O-N 3.11Å | ||
| 74 | P | 82.6 | Confident | 88.3 | Confident | 88 Ų | 88 | 63 Ų | 63 | 57% | 0.571 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -58.8 | -32 | -177.5 | -25.8 | 34.5 | 0 | 0 | 0 | 113.3 | L72 K76 L77 L78 M194 | L72-P74 WeakPolarHBondContact O-CD 3.25Å; P74-K76 VanDerWaalsContact C-N 3.26Å; P74-K76 PolarHBondContact O-N 3.44Å; P74-L77 CarbonylContact O-C 3.58Å; P74-L77 PolarHBondContact O-N 2.86Å; P74-L78 PolarHBondContact O-N 3.29Å; P74-M194 HydrophobicContact CB-CE 4.08Å |
| 75 | S | 83.6 | Confident | 88.3 | Confident | 91 Ų | 91 | 58 Ų | 58 | 64% | 0.636 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -58.9 | -34.8 | 178.3 | 56.6 | 0 | 0 | 0 | 0 | 113.2 | P73 L77 | P73-S75 PolarHBondContact O-N 2.9Å; S75-L77 VanDerWaalsContact C-N 3.27Å; S75-L77 PolarHBondContact O-N 3.42Å |
| 76 | K | 82.5 | Confident | 88.4 | Confident | 87 Ų | 87 | 51.8 Ų | 51.8 | 38% | 0.378 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -74.9 | -18.6 | 177.5 | -68.8 | -164.9 | 174.4 | -161.9 | 0 | 113.1 | P73 P74 K176 E179 L180 | P73-K76 HydrophobicContact CB-CG 4.48Å; P73-K76 HydrophobicContact CG-CB 4.1Å; P73-K76 HydrophobicContact CG-CD 3.72Å; P73-K76 HydrophobicContact CG-CG 3.77Å; P73-K76 PolarHBondContact O-N 3.41Å; P73-K76 VanDerWaalsContact O-N 3.11Å; P74-K76 VanDerWaalsContact C-N 3.26Å; P74-K76 PolarHBondContact O-N 3.44Å; K76-K176 WeakPolarHBondContact O-CE 2.98Å; K76-E179 IonicContact NZ-OE1 2.84Å; K76-E179 PolarHBondContact NZ-OE1 2.87Å; K76-L180 HydrophobicContact CD-CD2 3.81Å |
| 77 | L | 89.4 | Confident | 88.6 | Confident | 2 Ų | 2 | 49.5 Ų | 49.5 | 1% | 0.01 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -99.2 | -23 | -179.8 | -61.1 | 176.8 | 0 | 0 | 0 | 112.3 | L72 P74 S75 L79 L80 A81 L180 L187 Y190 M194 | L72-L77 HydrophobicContact CB-CD1 4Å; L72-L77 HydrophobicContact CD1-CD1 4.13Å; P74-L77 CarbonylContact O-C 3.58Å; P74-L77 PolarHBondContact O-N 2.86Å; S75-L77 VanDerWaalsContact C-N 3.27Å; S75-L77 PolarHBondContact O-N 3.42Å; L77-L79 VanDerWaalsContact C-N 3.29Å; L77-L79 PolarHBondContact O-N 3.32Å; L77-L80 HydrophobicContact CD2-CD2 4.49Å; L77-L80 WeakPolarHBondContact O-CA 2.96Å; L77-L80 WeakPolarHBondContact O-CB 3.24Å; L77-L80 PolarHBondContact O-N 2.87Å; L77-A81 PolarHBondContact O-N 3Å; L77-L180 HydrophobicContact CD2-CD1 4.21Å; L77-L187 HydrophobicContact CD2-CD1 3.45Å; L77-L187 VanDerWaalsContact CD2-CD1 3.45Å; L77-Y190 HydrophobicContact CD1-CG 4.08Å; L77-M194 HydrophobicContact CB-SD 4.48Å |
| 78 | L | 91.2 | Very high | 88.6 | Confident | 86 Ų | 86 | 49.1 Ų | 49.1 | 45% | 0.45 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -53.7 | -45.8 | 177.4 | -171 | 71.1 | 0 | 0 | 0 | 112.4 | P74 L80 A81 L82 M194 M198 | P74-L78 PolarHBondContact O-N 3.29Å; L78-L80 VanDerWaalsContact C-N 3.31Å; L78-L80 PolarHBondContact O-N 3.38Å; L78-A81 PolarHBondContact O-N 2.89Å; L78-L82 VanDerWaalsContact O-CB 3.29Å; L78-L82 WeakPolarHBondContact O-CB 3.39Å; L78-L82 PolarHBondContact O-N 3.42Å; L78-M194 WeakPolarHBondContact CA-SD 3.31Å; L78-M194 HydrophobicContact CB-SD 4.15Å; L78-M194 HydrophobicContact CD1-CE 4.47Å; L78-M194 HydrophobicContact CD1-CG 4.48Å; L78-M194 HydrophobicContact CD1-SD 3.86Å; L78-M198 HydrophobicContact CD1-CE 3.47Å; L78-M198 VanDerWaalsContact CD1-CE 3.47Å; L78-M198 HydrophobicContact CG-CE 4.19Å |
| 79 | L | 91.3 | Very high | 88.9 | Confident | 94 Ų | 94 | 46.2 Ų | 46.2 | 49% | 0.492 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68.9 | -32.2 | -179.7 | -165.2 | 65.1 | 0 | 0 | 0 | 112.2 | L77 L82 S83 W172 | L77-L79 VanDerWaalsContact C-N 3.29Å; L77-L79 PolarHBondContact O-N 3.32Å; L79-L82 HydrophobicContact CD1-CD2 4.41Å; L79-S83 PolarHBondContact O-N 3.14Å; L79-S83 PolarHBondContact O-OG 3.5Å; L79-W172 HydrophobicContact CB-CZ3 4.39Å; L79-W172 HydrophobicContact CD1-CH2 4.06Å; L79-W172 HydrophobicContact CD1-CZ3 4.28Å; L79-W172 HydrophobicContact CD2-CH2 3.37Å; L79-W172 HydrophobicContact CD2-CZ2 3.61Å; L79-W172 HydrophobicContact CD2-CZ3 3.93Å; L79-W172 HydrophobicContact CG-CE3 4.28Å; L79-W172 HydrophobicContact CG-CH2 3.4Å; L79-W172 VanDerWaalsContact CG-CH2 3.4Å; L79-W172 HydrophobicContact CG-CZ2 4.14Å; L79-W172 HydrophobicContact CG-CZ3 3.48Å; L79-W172 VanDerWaalsContact CG-CZ3 3.48Å; L79-W172 WeakPolarHBondContact O-CZ3 3.36Å |
| 80 | L | 93.1 | Very high | 89.5 | Confident | 2 Ų | 2 | 46.7 Ų | 46.7 | 1% | 0.01 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -70.1 | -41.5 | 173.7 | 178 | 67.3 | 0 | 0 | 0 | 111.6 | L77 L78 S83 F84 Y169 W172 V173 L187 Q191 | L77-L80 HydrophobicContact CD2-CD2 4.49Å; L77-L80 WeakPolarHBondContact O-CA 2.96Å; L77-L80 WeakPolarHBondContact O-CB 3.24Å; L77-L80 PolarHBondContact O-N 2.87Å; L78-L80 VanDerWaalsContact C-N 3.31Å; L78-L80 PolarHBondContact O-N 3.38Å; L80-S83 PolarHBondContact O-OG 2.99Å; L80-F84 PolarHBondContact O-N 3.49Å; L80-Y169 HydrophobicContact CD1-CD2 3.69Å; L80-Y169 HydrophobicContact CD1-CE2 3.86Å; L80-Y169 HydrophobicContact CG-CE2 4.46Å; L80-W172 HydrophobicContact CD1-CB 3.68Å; L80-V173 HydrophobicContact CD1-CG2 3.9Å; L80-L187 HydrophobicContact CD2-CD1 4.11Å; L80-L187 HydrophobicContact CD2-CD2 4.14Å; L80-L187 HydrophobicContact CD2-CG 4.22Å; L80-Q191 HydrophobicContact CD2-CB 4.35Å; L80-Q191 HydrophobicContact CD2-CG 4.11Å; L80-Q191 HydrophobicContact CG-CG 4.15Å |
| 81 | A | 93.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -67.8 | -37.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | L77 L78 F84 C85 M194 S195 M198 | L77-A81 PolarHBondContact O-N 3Å; L78-A81 PolarHBondContact O-N 2.89Å; A81-F84 WeakPolarHBondContact O-CB 3.36Å; A81-F84 PolarHBondContact O-N 3.3Å; A81-C85 PolarHBondContact O-N 3.11Å; A81-M194 HydrophobicContact CB-CB 3.9Å; A81-M194 HydrophobicContact CB-CG 3.55Å; A81-M194 HydrophobicContact CB-SD 3.65Å; A81-S195 VanDerWaalsContact CA-OG 3.28Å; A81-S195 WeakPolarHBondContact CA-OG 3.46Å; A81-S195 WeakPolarHBondContact CB-OG 3.26Å; A81-S195 PolarHBondContact O-OG 3.18Å; A81-M198 HydrophobicContact CB-SD 3.95Å |
| 82 | L | 93.4 | Very high | 89.9 | Confident | 94 Ų | 94 | 39.8 Ų | 39.8 | 49% | 0.492 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.5 | -45.1 | 175.7 | -176.9 | 65.7 | 0 | 0 | 0 | 111.4 | L78 L79 F84 C85 G86 M198 | L78-L82 VanDerWaalsContact O-CB 3.29Å; L78-L82 WeakPolarHBondContact O-CB 3.39Å; L78-L82 PolarHBondContact O-N 3.42Å; L79-L82 HydrophobicContact CD1-CD2 4.41Å; L82-F84 VanDerWaalsContact C-N 3.29Å; L82-F84 PolarHBondContact O-N 3.04Å; L82-C85 PolarHBondContact O-N 2.81Å; L82-G86 PolarHBondContact O-N 2.98Å; L82-M198 HydrophobicContact CB-CE 4.11Å; L82-M198 HydrophobicContact CB-SD 4.22Å; L82-M198 HydrophobicContact CD1-CE 4.23Å; L82-M198 HydrophobicContact CD1-SD 4.44Å |
| 83 | S | 93.9 | Very high | 90.1 | Very high | 8 Ų | 8 | 40.1 Ų | 40.1 | 6% | 0.056 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.6 | -34.2 | 175.2 | 60.9 | 0 | 0 | 0 | 0 | 112.1 | L79 L80 G86 F87 V165 | L79-S83 PolarHBondContact O-N 3.14Å; L79-S83 PolarHBondContact O-OG 3.5Å; L80-S83 PolarHBondContact O-OG 2.99Å; S83-G86 PolarHBondContact O-N 3Å; S83-F87 VanDerWaalsContact O-CB 3.24Å; S83-F87 WeakPolarHBondContact O-CB 3.32Å; S83-F87 PolarHBondContact O-N 2.66Å; S83-V165 WeakPolarHBondContact O-CG1 3.1Å |
| 84 | F | 92.9 | Very high | 90.3 | Very high | 6 Ų | 6 | 37.6 Ų | 37.6 | 3% | 0.026 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.9 | -47.5 | 170.5 | 175.7 | -96.6 | 0 | 0 | 0 | 112.1 | T47 F51 L80 A81 L82 G86 F87 V88 Y169 S195 L199 | T47-F84 HydrophobicContact CG2-CZ 4.22Å; F51-F84 HydrophobicContact CD1-CE1 4.24Å; F51-F84 HydrophobicContact CD1-CZ 4.43Å; F51-F84 AromaticContact CD2-CE1 3.91Å; F51-F84 HydrophobicContact CD2-CE1 3.91Å; F51-F84 AromaticContact CD2-CZ 3.64Å; F51-F84 HydrophobicContact CD2-CZ 3.64Å; F51-F84 HydrophobicContact CE1-CD1 4.42Å; F51-F84 AromaticContact CE1-CE1 3.97Å; F51-F84 HydrophobicContact CE1-CE1 3.97Å; F51-F84 HydrophobicContact CE1-CE2 4.15Å; F51-F84 AromaticContact CE1-CZ 3.87Å; F51-F84 HydrophobicContact CE1-CZ 3.87Å; F51-F84 AromaticContact CE2-CE1 3.64Å; F51-F84 HydrophobicContact CE2-CE1 3.64Å; F51-F84 AromaticContact CE2-CE2 3.56Å; F51-F84 HydrophobicContact CE2-CE2 3.56Å; F51-F84 AromaticContact CE2-CZ 2.96Å; F51-F84 HydrophobicContact CE2-CZ 2.96Å; F51-F84 HydrophobicContact CG-CE1 4.21Å; F51-F84 HydrophobicContact CG-CZ 4.34Å; F51-F84 HydrophobicContact CZ-CD1 4.36Å; F51-F84 HydrophobicContact CZ-CD2 4.01Å; F51-F84 AromaticContact CZ-CE1 3.66Å; F51-F84 HydrophobicContact CZ-CE1 3.66Å; F51-F84 AromaticContact CZ-CE2 3.27Å; F51-F84 HydrophobicContact CZ-CE2 3.27Å; F51-F84 AromaticContact CZ-CZ 3.09Å; F51-F84 HydrophobicContact CZ-CZ 3.09Å; L80-F84 PolarHBondContact O-N 3.49Å; A81-F84 WeakPolarHBondContact O-CB 3.36Å; A81-F84 PolarHBondContact O-N 3.3Å; L82-F84 VanDerWaalsContact C-N 3.29Å; L82-F84 PolarHBondContact O-N 3.04Å; F84-G86 PolarHBondContact O-N 3.34Å; F84-F87 AromaticContact CD2-CD1 3.94Å; F84-F87 HydrophobicContact CD2-CD1 3.94Å; F84-F87 HydrophobicContact CD2-CE1 4.45Å; F84-F87 AromaticContact CE2-CD1 3.94Å; F84-F87 HydrophobicContact CE2-CD1 3.94Å; F84-F87 HydrophobicContact CE2-CE1 4.07Å; F84-F87 WeakPolarHBondContact O-CB 3.3Å; F84-F87 PolarHBondContact O-N 3.29Å; F84-V88 HydrophobicContact CD1-CG2 4.38Å; F84-V88 HydrophobicContact CE1-CG2 3.74Å; F84-V88 HydrophobicContact CE2-CG2 3.92Å; F84-V88 HydrophobicContact CZ-CG2 3.42Å; F84-V88 VanDerWaalsContact CZ-CG2 3.42Å; F84-V88 WeakPolarHBondContact O-CG2 3.36Å; F84-V88 PolarHBondContact O-N 3.01Å; F84-Y169 HydrophobicContact CB-CD2 3.9Å; F84-Y169 HydrophobicContact CB-CE2 3.7Å; F84-Y169 HydrophobicContact CD2-CE1 4.06Å; F84-Y169 AromaticContact CD2-CE2 3.96Å; F84-Y169 HydrophobicContact CD2-CE2 3.96Å; F84-Y169 AromaticContact CD2-CZ 3.64Å; F84-Y169 HydrophobicContact CG-CE2 4.26Å; F84-S195 VanDerWaalsContact CD1-CB 3.41Å; F84-S195 VanDerWaalsContact CD1-OG 3.28Å; F84-S195 WeakPolarHBondContact CD1-OG 3.37Å; F84-L199 HydrophobicContact CE1-CD1 3.83Å |
| 85 | C | 92.1 | Very high | 90.5 | Very high | 13 Ų | 13 | 37.1 Ų | 37.1 | 9% | 0.088 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.1 | -45.9 | 178 | -171.9 | 0 | 0 | 0 | 0 | 111.5 | A81 L82 F87 V88 V89 M198 | A81-C85 PolarHBondContact O-N 3.11Å; L82-C85 PolarHBondContact O-N 2.81Å; C85-F87 VanDerWaalsContact C-N 3.31Å; C85-F87 PolarHBondContact O-N 2.91Å; C85-V88 PolarHBondContact O-N 3.34Å; C85-V89 WeakPolarHBondContact O-CG2 3.42Å; C85-V89 PolarHBondContact O-N 3.45Å; C85-M198 HydrophobicContact CB-CB 4.19Å |
| 86 | G | 92.4 | Very high | 90.7 | Very high | 15 Ų | 15 | 39.9 Ų | 39.9 | 16% | 0.155 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L82 S83 F84 V89 F90 | L82-G86 PolarHBondContact O-N 2.98Å; S83-G86 PolarHBondContact O-N 3Å; F84-G86 PolarHBondContact O-N 3.34Å; G86-V89 PolarHBondContact O-N 3.03Å; G86-F90 WeakPolarHBondContact O-CB 3.37Å; G86-F90 WeakPolarHBondContact O-CD2 3.4Å; G86-F90 PolarHBondContact O-N 3.42Å |
| 87 | F | 93.1 | Very high | 90.9 | Very high | 50 Ų | 50 | 38 Ų | 38 | 22% | 0.219 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.5 | -51.3 | 173.6 | 152 | -111.2 | 0 | 0 | 0 | 110.4 | S83 F84 C85 V89 T91 V165 T166 | S83-F87 VanDerWaalsContact O-CB 3.24Å; S83-F87 WeakPolarHBondContact O-CB 3.32Å; S83-F87 PolarHBondContact O-N 2.66Å; F84-F87 AromaticContact CD2-CD1 3.94Å; F84-F87 HydrophobicContact CD2-CD1 3.94Å; F84-F87 HydrophobicContact CD2-CE1 4.45Å; F84-F87 AromaticContact CE2-CD1 3.94Å; F84-F87 HydrophobicContact CE2-CD1 3.94Å; F84-F87 HydrophobicContact CE2-CE1 4.07Å; F84-F87 WeakPolarHBondContact O-CB 3.3Å; F84-F87 PolarHBondContact O-N 3.29Å; C85-F87 VanDerWaalsContact C-N 3.31Å; C85-F87 PolarHBondContact O-N 2.91Å; F87-V89 PolarHBondContact O-N 2.89Å; F87-T91 HydrophobicContact CD2-CG2 3.59Å; F87-T91 HydrophobicContact CE2-CG2 3.75Å; F87-T91 VanDerWaalsContact O-CB 3.26Å; F87-T91 WeakPolarHBondContact O-CB 3.29Å; F87-T91 VanDerWaalsContact O-CG2 3.23Å; F87-T91 WeakPolarHBondContact O-CG2 3.22Å; F87-T91 PolarHBondContact O-N 3.4Å; F87-T91 PolarHBondContact O-OG1 2.97Å; F87-V165 HydrophobicContact CB-CG1 4.09Å; F87-V165 VanDerWaalsContact N-CG1 3.25Å; F87-T166 HydrophobicContact CD2-CG2 4.1Å; F87-T166 WeakPolarHBondContact CD2-OG1 3.38Å; F87-T166 HydrophobicContact CE2-CG2 4.19Å |
| 88 | V | 89.8 | Confident | 90.9 | Very high | 5 Ų | 5 | 38.7 Ų | 38.7 | 3% | 0.03 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.9 | -50.8 | 178.9 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | T47 F84 C85 T91 N92 L199 | T47-V88 HydrophobicContact CG2-CG1 4.19Å; T47-V88 HydrophobicContact CG2-CG2 3.98Å; F84-V88 HydrophobicContact CD1-CG2 4.38Å; F84-V88 HydrophobicContact CE1-CG2 3.74Å; F84-V88 HydrophobicContact CE2-CG2 3.92Å; F84-V88 HydrophobicContact CZ-CG2 3.42Å; F84-V88 VanDerWaalsContact CZ-CG2 3.42Å; F84-V88 WeakPolarHBondContact O-CG2 3.36Å; F84-V88 PolarHBondContact O-N 3.01Å; C85-V88 PolarHBondContact O-N 3.34Å; V88-T91 PolarHBondContact O-OG1 3.35Å; V88-N92 WeakPolarHBondContact O-CB 3.32Å; V88-N92 PolarHBondContact O-N 2.85Å; V88-N92 VanDerWaalsContact O-N 3.12Å; V88-N92 PolarHBondContact O-ND2 3.29Å; V88-L199 HydrophobicContact CB-CD2 4.12Å; V88-L199 HydrophobicContact CG1-CD2 3.92Å |
| 89 | V | 90.8 | Very high | 90.8 | Very high | 15 Ų | 15 | 36 Ų | 36 | 9% | 0.091 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.8 | -55.7 | -176.3 | 171.4 | 0 | 0 | 0 | 0 | 111.5 | C85 G86 F87 T91 N92 L93 A202 F206 | C85-V89 WeakPolarHBondContact O-CG2 3.42Å; C85-V89 PolarHBondContact O-N 3.45Å; G86-V89 PolarHBondContact O-N 3.03Å; F87-V89 PolarHBondContact O-N 2.89Å; V89-T91 PolarHBondContact O-N 3.11Å; V89-N92 PolarHBondContact O-N 3.46Å; V89-L93 HydrophobicContact CG1-CD1 3.76Å; V89-L93 HydrophobicContact CG1-CG 4.42Å; V89-L93 WeakPolarHBondContact O-CB 3.46Å; V89-L93 WeakPolarHBondContact O-CG 3.23Å; V89-L93 PolarHBondContact O-N 3.24Å; V89-A202 HydrophobicContact CG2-CB 4.38Å; V89-F206 HydrophobicContact CG1-CE1 4.16Å; V89-F206 HydrophobicContact CG1-CE2 3.68Å; V89-F206 HydrophobicContact CG1-CZ 3.43Å; V89-F206 VanDerWaalsContact CG1-CZ 3.43Å; V89-F206 HydrophobicContact CG2-CE2 4Å |
| 90 | F | 92.7 | Very high | 90.5 | Very high | 56 Ų | 56 | 36.9 Ų | 36.9 | 25% | 0.246 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -68.8 | -32.6 | -174.5 | -67.7 | -56.3 | 0 | 0 | 0 | 113.1 | G86 L93 S94 F158 L161 V165 | G86-F90 WeakPolarHBondContact O-CB 3.37Å; G86-F90 WeakPolarHBondContact O-CD2 3.4Å; G86-F90 PolarHBondContact O-N 3.42Å; F90-L93 HydrophobicContact CD1-CD1 4.48Å; F90-S94 VanDerWaalsContact O-CB 3.26Å; F90-S94 WeakPolarHBondContact O-CB 3.41Å; F90-S94 PolarHBondContact O-N 3.09Å; F90-F158 HydrophobicContact CD1-CD1 4.14Å; F90-L161 HydrophobicContact CB-CB 4.4Å; F90-L161 HydrophobicContact CD1-CB 3.97Å; F90-L161 HydrophobicContact CD1-CD1 4.05Å; F90-L161 HydrophobicContact CD2-CB 4.1Å; F90-L161 HydrophobicContact CE1-CB 4.26Å; F90-L161 HydrophobicContact CE1-CD1 3.65Å; F90-L161 HydrophobicContact CE2-CB 4.39Å; F90-L161 HydrophobicContact CG-CB 3.9Å; F90-L161 HydrophobicContact CZ-CB 4.46Å; F90-L161 HydrophobicContact CZ-CD1 4.02Å; F90-V165 HydrophobicContact CD2-CG2 4.08Å; F90-V165 HydrophobicContact CE2-CG2 4.3Å |
| 91 | T | 90.9 | Very high | 90 | Very high | 13 Ų | 13 | 36.9 Ų | 36.9 | 8% | 0.08 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -73.1 | -36.4 | 176.6 | 60 | 0 | 0 | 0 | 0 | 112.5 | F87 V88 V89 S94 L95 Y103 | F87-T91 HydrophobicContact CD2-CG2 3.59Å; F87-T91 HydrophobicContact CE2-CG2 3.75Å; F87-T91 VanDerWaalsContact O-CB 3.26Å; F87-T91 WeakPolarHBondContact O-CB 3.29Å; F87-T91 VanDerWaalsContact O-CG2 3.23Å; F87-T91 WeakPolarHBondContact O-CG2 3.22Å; F87-T91 PolarHBondContact O-N 3.4Å; F87-T91 PolarHBondContact O-OG1 2.97Å; V88-T91 PolarHBondContact O-OG1 3.35Å; V89-T91 PolarHBondContact O-N 3.11Å; T91-S94 PolarHBondContact O-N 3.44Å; T91-L95 WeakPolarHBondContact O-CB 3.44Å; T91-L95 PolarHBondContact O-N 2.94Å; T91-Y103 WeakPolarHBondContact O-CE2 2.98Å |
| 92 | N | 88.9 | Confident | 89.7 | Confident | 43 Ų | 43 | 37 Ų | 37 | 23% | 0.23 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67.7 | -43.4 | 172.7 | -80.1 | -67.2 | 0 | 0 | 0 | 111.5 | M44 V88 V89 S94 L95 Q96 | M44-N92 HydrophobicContact CE-CB 3.83Å; V88-N92 WeakPolarHBondContact O-CB 3.32Å; V88-N92 PolarHBondContact O-N 2.85Å; V88-N92 VanDerWaalsContact O-N 3.12Å; V88-N92 PolarHBondContact O-ND2 3.29Å; V89-N92 PolarHBondContact O-N 3.46Å; N92-S94 VanDerWaalsContact C-N 3.31Å; N92-S94 PolarHBondContact O-N 3Å; N92-L95 PolarHBondContact O-N 3.35Å; N92-L95 VanDerWaalsContact O-N 3.15Å; N92-Q96 WeakPolarHBondContact O-CB 3.49Å; N92-Q96 PolarHBondContact O-N 3.42Å |
| 93 | L | 88.9 | Confident | 89.5 | Confident | 19 Ų | 19 | 33.9 Ų | 33.9 | 10% | 0.099 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.8 | -40.2 | 174.3 | -72.9 | 173.4 | 0 | 0 | 0 | 112.1 | V89 F90 Q96 N97 F158 F206 | V89-L93 HydrophobicContact CG1-CD1 3.76Å; V89-L93 HydrophobicContact CG1-CG 4.42Å; V89-L93 WeakPolarHBondContact O-CB 3.46Å; V89-L93 WeakPolarHBondContact O-CG 3.23Å; V89-L93 PolarHBondContact O-N 3.24Å; F90-L93 HydrophobicContact CD1-CD1 4.48Å; L93-Q96 PolarHBondContact O-N 3.19Å; L93-N97 WeakPolarHBondContact O-CB 3.24Å; L93-N97 PolarHBondContact O-N 2.86Å; L93-N97 PolarHBondContact O-ND2 2.88Å; L93-F158 HydrophobicContact CB-CB 4.23Å; L93-F158 HydrophobicContact CB-CD1 4.17Å; L93-F158 HydrophobicContact CB-CD2 3.89Å; L93-F158 HydrophobicContact CB-CE2 4.24Å; L93-F158 HydrophobicContact CB-CG 3.86Å; L93-F158 HydrophobicContact CD1-CD1 4.05Å; L93-F158 HydrophobicContact CD1-CE1 3.82Å; L93-F158 HydrophobicContact CD1-CZ 4.11Å; L93-F206 HydrophobicContact CD1-CE1 3.88Å; L93-F206 HydrophobicContact CD1-CZ 4.31Å; L93-F206 HydrophobicContact CD2-CD1 4.11Å; L93-F206 HydrophobicContact CD2-CE1 3.91Å; L93-F206 HydrophobicContact CG-CE1 4.2Å |
| 94 | S | 90.3 | Very high | 89.2 | Confident | 2 Ų | 2 | 35.6 Ų | 35.6 | 1% | 0.014 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.1 | -44.8 | 173.8 | 178.9 | 0 | 0 | 0 | 0 | 111.4 | F90 T91 N92 Q96 N97 N98 A159 | F90-S94 VanDerWaalsContact O-CB 3.26Å; F90-S94 WeakPolarHBondContact O-CB 3.41Å; F90-S94 PolarHBondContact O-N 3.09Å; T91-S94 PolarHBondContact O-N 3.44Å; N92-S94 VanDerWaalsContact C-N 3.31Å; N92-S94 PolarHBondContact O-N 3Å; S94-Q96 VanDerWaalsContact C-N 3.29Å; S94-Q96 PolarHBondContact O-N 3.31Å; S94-N97 PolarHBondContact O-N 3.41Å; S94-N98 WeakPolarHBondContact O-CB 3.45Å; S94-N98 PolarHBondContact O-N 3.23Å; S94-N98 PolarHBondContact O-ND2 3.03Å; S94-N98 VanDerWaalsContact O-ND2 3.16Å; S94-N98 PolarHBondContact OG-ND2 2.87Å; S94-A159 WeakPolarHBondContact OG-CB 3.48Å |
| 95 | L | 86.8 | Confident | 89 | Confident | 78 Ų | 78 | 37 Ų | 37 | 41% | 0.408 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.3 | -34.6 | 178.1 | -172.2 | 67.2 | 0 | 0 | 0 | 112.4 | T91 N92 Y103 | T91-L95 WeakPolarHBondContact O-CB 3.44Å; T91-L95 PolarHBondContact O-N 2.94Å; N92-L95 PolarHBondContact O-N 3.35Å; N92-L95 VanDerWaalsContact O-N 3.15Å; L95-Y103 HydrophobicContact CB-CD2 4.04Å; L95-Y103 HydrophobicContact CB-CE2 4Å; L95-Y103 HydrophobicContact CD1-CD1 3.97Å; L95-Y103 HydrophobicContact CD1-CD2 4.1Å; L95-Y103 HydrophobicContact CD1-CE1 4.21Å; L95-Y103 HydrophobicContact CD1-CE2 4.34Å; L95-Y103 HydrophobicContact CD1-CG 3.89Å |
| 96 | Q | 86.9 | Confident | 88.9 | Confident | 149 Ų | 149 | 37.1 Ų | 37.1 | 70% | 0.696 | 19% | 0.192 | S | C | * | . | H | α-helix | trans | -72.3 | -35.4 | 177.5 | -175.3 | -178.8 | -1 | 0 | 0 | 112.6 | N92 L93 S94 | N92-Q96 WeakPolarHBondContact O-CB 3.49Å; N92-Q96 PolarHBondContact O-N 3.42Å; L93-Q96 PolarHBondContact O-N 3.19Å; S94-Q96 VanDerWaalsContact C-N 3.29Å; S94-Q96 PolarHBondContact O-N 3.31Å |
| 97 | N | 86.7 | Confident | 88.8 | Confident | 47 Ų | 47 | 40.3 Ų | 40.3 | 25% | 0.251 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -100.3 | -10.4 | -172.5 | -72.3 | -84.3 | 0 | 0 | 0 | 114.3 | L93 S94 N152 F158 | L93-N97 WeakPolarHBondContact O-CB 3.24Å; L93-N97 PolarHBondContact O-N 2.86Å; L93-N97 PolarHBondContact O-ND2 2.88Å; S94-N97 PolarHBondContact O-N 3.41Å; N97-N152 PolarHBondContact O-ND2 3.49Å; N97-F158 HydrophobicContact CB-CD2 4.34Å |
| 98 | N | 89.5 | Confident | 88.6 | Confident | 17 Ų | 17 | 38 Ų | 38 | 9% | 0.091 | 19% | 0.192 | C | C | . | . | S | Bend | trans | -119.8 | 159.6 | 179.2 | -66.4 | -54.1 | 0 | 0 | 0 | 111.4 | S94 T102 G155 | S94-N98 WeakPolarHBondContact O-CB 3.45Å; S94-N98 PolarHBondContact O-N 3.23Å; S94-N98 PolarHBondContact O-ND2 3.03Å; S94-N98 VanDerWaalsContact O-ND2 3.16Å; S94-N98 PolarHBondContact OG-ND2 2.87Å; N98-T102 HydrophobicContact CB-CG2 4Å; N98-G155 PolarHBondContact ND2-O 2.98Å; N98-G155 VanDerWaalsContact OD1-CA 3.3Å; N98-G155 WeakPolarHBondContact OD1-CA 3.28Å |
| 99 | T | 88.3 | Confident | 88.6 | Confident | 31 Ų | 31 | 41.6 Ų | 41.6 | 19% | 0.19 | 21% | 0.209 | C | C | . | . | trans | -66.5 | 160.8 | 165.3 | 56.7 | 0 | 0 | 0 | 0 | 111.1 | G101 T102 Y103 D148 K150 | T99-G101 VanDerWaalsContact C-N 3.26Å; T99-G101 PolarHBondContact O-N 3.02Å; T99-T102 PolarHBondContact O-N 2.86Å; T99-T102 PolarHBondContact OG1-N 3.12Å; T99-T102 PolarHBondContact OG1-OG1 3.47Å; T99-T102 VanDerWaalsContact OG1-OG1 3.12Å; T99-Y103 WeakPolarHBondContact O-CB 3.31Å; T99-Y103 PolarHBondContact O-N 3.34Å; T99-D148 WeakPolarHBondContact CB-O 3.38Å; T99-D148 WeakPolarHBondContact CG2-O 3.34Å; T99-D148 PolarHBondContact OG1-O 3.4Å; T99-K150 HydrophobicContact CG2-CB 3.83Å; T99-K150 HydrophobicContact CG2-CD 3.88Å; T99-K150 HydrophobicContact CG2-CG 3.89Å; T99-K150 PolarHBondContact OG1-N 2.78Å | ||
| 100 | I | 85.3 | Confident | 88.8 | Confident | 111 Ų | 111 | 41 Ų | 41 | 57% | 0.569 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -59.6 | -42.3 | 179.6 | -63.1 | 166.1 | 0 | 0 | 0 | 109.6 | Y103 Q104 D148 | I100-Y103 WeakPolarHBondContact O-CB 3.3Å; I100-Y103 PolarHBondContact O-N 2.97Å; I100-Q104 HydrophobicContact CG2-CG 4.29Å; I100-Q104 VanDerWaalsContact O-CG 3.3Å; I100-Q104 WeakPolarHBondContact O-CG 3.23Å; I100-Q104 PolarHBondContact O-N 3.05Å; I100-D148 PolarHBondContact N-OD2 3.47Å |
| 101 | G | 84.3 | Confident | 88.8 | Confident | 2 Ų | 2 | 38.4 Ų | 38.4 | 2% | 0.021 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.7 | -48.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | T99 Y103 Q104 L105 D148 | T99-G101 VanDerWaalsContact C-N 3.26Å; T99-G101 PolarHBondContact O-N 3.02Å; G101-Y103 VanDerWaalsContact C-N 3.31Å; G101-Y103 PolarHBondContact O-N 3.4Å; G101-Q104 PolarHBondContact O-N 3.02Å; G101-L105 WeakPolarHBondContact O-CB 3.41Å; G101-L105 PolarHBondContact O-N 3.06Å; G101-D148 PolarHBondContact N-OD2 3.4Å |
| 102 | T | 86.2 | Confident | 88.9 | Confident | 4 Ų | 4 | 39.5 Ų | 39.5 | 3% | 0.025 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.1 | -39.3 | 176.4 | -61.9 | 0 | 0 | 0 | 0 | 111.4 | N98 T99 L105 A106 K150 M156 | N98-T102 HydrophobicContact CB-CG2 4Å; T99-T102 PolarHBondContact O-N 2.86Å; T99-T102 PolarHBondContact OG1-N 3.12Å; T99-T102 PolarHBondContact OG1-OG1 3.47Å; T99-T102 VanDerWaalsContact OG1-OG1 3.12Å; T102-L105 PolarHBondContact O-N 3.31Å; T102-A106 PolarHBondContact O-N 3.22Å; T102-K150 PolarHBondContact OG1-N 3.31Å; T102-K150 VanDerWaalsContact OG1-N 3.15Å; T102-K150 PolarHBondContact OG1-O 2.82Å; T102-M156 HydrophobicContact CG2-SD 3.96Å |
| 103 | Y | 88.8 | Confident | 89.1 | Confident | 27 Ų | 27 | 39 Ų | 39 | 11% | 0.106 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.8 | -43.1 | 175.1 | 174.4 | -94.4 | 0 | 0 | 0 | 112.8 | T91 L95 T99 I100 G101 A106 K107 | T91-Y103 WeakPolarHBondContact O-CE2 2.98Å; L95-Y103 HydrophobicContact CB-CD2 4.04Å; L95-Y103 HydrophobicContact CB-CE2 4Å; L95-Y103 HydrophobicContact CD1-CD1 3.97Å; L95-Y103 HydrophobicContact CD1-CD2 4.1Å; L95-Y103 HydrophobicContact CD1-CE1 4.21Å; L95-Y103 HydrophobicContact CD1-CE2 4.34Å; L95-Y103 HydrophobicContact CD1-CG 3.89Å; T99-Y103 WeakPolarHBondContact O-CB 3.31Å; T99-Y103 PolarHBondContact O-N 3.34Å; I100-Y103 WeakPolarHBondContact O-CB 3.3Å; I100-Y103 PolarHBondContact O-N 2.97Å; G101-Y103 VanDerWaalsContact C-N 3.31Å; G101-Y103 PolarHBondContact O-N 3.4Å; Y103-A106 PolarHBondContact O-N 3.36Å; Y103-K107 HydrophobicContact CD1-CD 4.22Å; Y103-K107 HydrophobicContact CE1-CD 3.53Å; Y103-K107 HydrophobicContact CE1-CG 4.28Å; Y103-K107 VanDerWaalsContact CZ-CE 3.4Å; Y103-K107 PolarHBondContact O-N 2.86Å; Y103-K107 WeakPolarHBondContact OH-CE 3.47Å; Y103-K107 PolarHBondContact OH-NZ 2.97Å |
| 104 | Q | 87.4 | Confident | 89.4 | Confident | 44 Ų | 44 | 38 Ų | 38 | 21% | 0.206 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -66.6 | -40.3 | 177.1 | -66.3 | -59.6 | -9.7 | 0 | 0 | 111.7 | I100 G101 A106 K107 A108 V141 F261 | I100-Q104 HydrophobicContact CG2-CG 4.29Å; I100-Q104 VanDerWaalsContact O-CG 3.3Å; I100-Q104 WeakPolarHBondContact O-CG 3.23Å; I100-Q104 PolarHBondContact O-N 3.05Å; G101-Q104 PolarHBondContact O-N 3.02Å; Q104-A106 VanDerWaalsContact C-N 3.35Å; Q104-A106 PolarHBondContact O-N 3.22Å; Q104-K107 WeakPolarHBondContact O-CB 3.41Å; Q104-K107 PolarHBondContact O-N 3.3Å; Q104-A108 PolarHBondContact O-N 3.23Å; Q104-V141 HydrophobicContact CB-CG1 4.43Å; Q104-F261 HydrophobicContact CG-CE2 4.05Å; Q104-F261 HydrophobicContact CG-CZ 4.11Å |
| 105 | L | 88.8 | Confident | 89.6 | Confident | 36 Ų | 36 | 38.3 Ų | 38.3 | 19% | 0.188 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.5 | -45.4 | 174.8 | -178.2 | 58.9 | 0 | 0 | 0 | 111.4 | G101 T102 K107 A108 M109 V141 I142 V149 | G101-L105 WeakPolarHBondContact O-CB 3.41Å; G101-L105 PolarHBondContact O-N 3.06Å; T102-L105 PolarHBondContact O-N 3.31Å; L105-K107 PolarHBondContact O-N 3Å; L105-A108 WeakPolarHBondContact O-CB 3.44Å; L105-A108 PolarHBondContact O-N 3.42Å; L105-M109 PolarHBondContact O-N 3.07Å; L105-V141 HydrophobicContact CD1-CG1 4.42Å; L105-I142 HydrophobicContact CD1-CD1 4.27Å; L105-I142 HydrophobicContact CD1-CG1 3.45Å; L105-I142 VanDerWaalsContact CD1-CG1 3.45Å; L105-I142 HydrophobicContact CD2-CG1 4.46Å; L105-V149 HydrophobicContact CD2-CG2 4.49Å |
| 106 | A | 90.8 | Very high | 89.9 | Confident | 15 Ų | 15 | 36.4 Ų | 36.4 | 12% | 0.124 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.8 | -47.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | T102 Y103 Q104 A108 M109 A159 V163 | T102-A106 PolarHBondContact O-N 3.22Å; Y103-A106 PolarHBondContact O-N 3.36Å; Q104-A106 VanDerWaalsContact C-N 3.35Å; Q104-A106 PolarHBondContact O-N 3.22Å; A106-A108 VanDerWaalsContact C-N 3.26Å; A106-A108 PolarHBondContact O-N 2.83Å; A106-M109 WeakPolarHBondContact O-CB 3.28Å; A106-M109 PolarHBondContact O-N 3.28Å; A106-A159 HydrophobicContact CB-CB 3.8Å; A106-V163 HydrophobicContact CB-CG2 4Å; A106-V163 WeakPolarHBondContact O-CG2 3.12Å |
| 107 | K | 89.3 | Confident | 90.2 | Very high | 82 Ų | 82 | 30.5 Ų | 30.5 | 36% | 0.357 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -57.5 | -36.6 | 175.9 | -88.8 | -173 | 160.6 | 172 | 0 | 113.2 | Y103 Q104 L105 M109 T110 | Y103-K107 HydrophobicContact CD1-CD 4.22Å; Y103-K107 HydrophobicContact CE1-CD 3.53Å; Y103-K107 HydrophobicContact CE1-CG 4.28Å; Y103-K107 VanDerWaalsContact CZ-CE 3.4Å; Y103-K107 PolarHBondContact O-N 2.86Å; Y103-K107 WeakPolarHBondContact OH-CE 3.47Å; Y103-K107 PolarHBondContact OH-NZ 2.97Å; Q104-K107 WeakPolarHBondContact O-CB 3.41Å; Q104-K107 PolarHBondContact O-N 3.3Å; L105-K107 PolarHBondContact O-N 3Å; K107-M109 VanDerWaalsContact C-N 3.25Å; K107-M109 PolarHBondContact O-N 3.41Å; K107-T110 WeakPolarHBondContact O-CB 3.26Å; K107-T110 PolarHBondContact O-N 3.21Å; K107-T110 VanDerWaalsContact O-N 3.09Å; K107-T110 PolarHBondContact O-OG1 3.47Å |
| 108 | A | 89.5 | Confident | 90.6 | Very high | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.008 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.5 | -33.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q104 L105 A106 T110 T111 P112 V141 | Q104-A108 PolarHBondContact O-N 3.23Å; L105-A108 WeakPolarHBondContact O-CB 3.44Å; L105-A108 PolarHBondContact O-N 3.42Å; A106-A108 VanDerWaalsContact C-N 3.26Å; A106-A108 PolarHBondContact O-N 2.83Å; A108-T110 PolarHBondContact O-N 3.44Å; A108-T111 PolarHBondContact O-N 3.37Å; A108-P112 WeakPolarHBondContact O-CD 3.17Å; A108-V141 HydrophobicContact CB-CB 3.98Å; A108-V141 HydrophobicContact CB-CG1 3.85Å; A108-V141 HydrophobicContact CB-CG2 3.85Å |
| 109 | M | 90.5 | Very high | 90.6 | Very high | 81 Ų | 81 | 29.6 Ų | 29.6 | 40% | 0.399 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -68.8 | -14.6 | 175.6 | -61.9 | -56.7 | -63.8 | 0 | 0 | 113.9 | L105 A106 K107 T111 P112 V113 T138 V163 | L105-M109 PolarHBondContact O-N 3.07Å; A106-M109 WeakPolarHBondContact O-CB 3.28Å; A106-M109 PolarHBondContact O-N 3.28Å; K107-M109 VanDerWaalsContact C-N 3.25Å; K107-M109 PolarHBondContact O-N 3.41Å; M109-T111 PolarHBondContact O-N 3.38Å; M109-P112 HydrophobicContact CE-CG 4.05Å; M109-P112 VanDerWaalsContact O-CD 3.23Å; M109-P112 WeakPolarHBondContact O-CD 3.48Å; M109-P112 VanDerWaalsContact O-CG 3.31Å; M109-P112 WeakPolarHBondContact O-CG 3.46Å; M109-P112 HydrophobicContact SD-CG 4.31Å; M109-V113 WeakPolarHBondContact O-CG2 3.47Å; M109-V113 PolarHBondContact O-N 3.02Å; M109-T138 HydrophobicContact SD-CG2 4.27Å; M109-V163 HydrophobicContact CB-CG1 4.29Å |
| 110 | T | 94.1 | Very high | 90.8 | Very high | 4 Ų | 4 | 35.6 Ų | 35.6 | 3% | 0.025 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -56.2 | -39.3 | 175.4 | -48.7 | 0 | 0 | 0 | 0 | 111.8 | K107 A108 V113 I114 T166 S167 N254 | K107-T110 WeakPolarHBondContact O-CB 3.26Å; K107-T110 PolarHBondContact O-N 3.21Å; K107-T110 VanDerWaalsContact O-N 3.09Å; K107-T110 PolarHBondContact O-OG1 3.47Å; A108-T110 PolarHBondContact O-N 3.44Å; T110-V113 PolarHBondContact O-N 2.84Å; T110-I114 HydrophobicContact CG2-CD1 3.87Å; T110-I114 HydrophobicContact CG2-CG1 4.4Å; T110-I114 WeakPolarHBondContact O-CB 3.24Å; T110-I114 WeakPolarHBondContact O-CG1 3.36Å; T110-I114 PolarHBondContact O-N 3.46Å; T110-T166 HydrophobicContact CG2-CG2 3.75Å; T110-S167 VanDerWaalsContact CG2-OG 3.29Å; T110-S167 WeakPolarHBondContact CG2-OG 3.37Å; T110-S167 PolarHBondContact O-OG 3.43Å; T110-N254 WeakPolarHBondContact CG2-OD1 3.39Å |
| 111 | T | 92.5 | Very high | 91.2 | Very high | 1 Ų | 1 | 34.9 Ų | 34.9 | 1% | 0.006 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65.2 | -54.4 | -179.6 | -45.6 | 0 | 0 | 0 | 0 | 113.1 | A108 M109 V113 I114 I115 L134 V251 N254 M255 H258 | A108-T111 PolarHBondContact O-N 3.37Å; M109-T111 PolarHBondContact O-N 3.38Å; T111-V113 PolarHBondContact O-N 3.05Å; T111-I114 WeakPolarHBondContact O-CB 3.45Å; T111-I114 PolarHBondContact O-N 3.06Å; T111-I114 VanDerWaalsContact O-N 3.11Å; T111-I115 HydrophobicContact CG2-CD1 4.15Å; T111-I115 PolarHBondContact O-N 3.43Å; T111-L134 HydrophobicContact CG2-CD2 3.72Å; T111-V251 HydrophobicContact CG2-CG1 3.85Å; T111-N254 HydrophobicContact CG2-CB 4.46Å; T111-N254 WeakPolarHBondContact OG1-CB 3.3Å; T111-M255 HydrophobicContact CG2-CE 3.19Å; T111-H258 PolarHBondContact OG1-NE2 2.96Å |
| 112 | P | 92.4 | Very high | 91.4 | Very high | 35 Ų | 35 | 39 Ų | 39 | 23% | 0.227 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -57.2 | -38.2 | 176.1 | 8.5 | -18.8 | 0 | 0 | 0 | 112.6 | A108 M109 I115 A116 L134 | A108-P112 WeakPolarHBondContact O-CD 3.17Å; M109-P112 HydrophobicContact CE-CG 4.05Å; M109-P112 VanDerWaalsContact O-CD 3.23Å; M109-P112 WeakPolarHBondContact O-CD 3.48Å; M109-P112 VanDerWaalsContact O-CG 3.31Å; M109-P112 WeakPolarHBondContact O-CG 3.46Å; M109-P112 HydrophobicContact SD-CG 4.31Å; P112-I115 PolarHBondContact O-N 3.37Å; P112-A116 WeakPolarHBondContact O-CB 3.32Å; P112-A116 PolarHBondContact O-N 3.39Å; P112-L134 HydrophobicContact CB-CD1 4.13Å |
| 113 | V | 95 | Very high | 91.5 | Very high | 32 Ų | 32 | 46.2 Ų | 46.2 | 19% | 0.194 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.6 | -39.4 | 176 | 175.8 | 0 | 0 | 0 | 0 | 111.7 | M109 T110 T111 I115 A116 I117 V163 L164 S167 | M109-V113 WeakPolarHBondContact O-CG2 3.47Å; M109-V113 PolarHBondContact O-N 3.02Å; T110-V113 PolarHBondContact O-N 2.84Å; T111-V113 PolarHBondContact O-N 3.05Å; V113-I115 PolarHBondContact O-N 2.79Å; V113-A116 PolarHBondContact O-N 3.31Å; V113-I117 HydrophobicContact CG1-CD1 3.84Å; V113-I117 HydrophobicContact CG1-CG1 4.4Å; V113-I117 VanDerWaalsContact O-CG1 3.28Å; V113-I117 WeakPolarHBondContact O-CG1 3.38Å; V113-I117 PolarHBondContact O-N 2.92Å; V113-V163 HydrophobicContact CB-CG1 4.27Å; V113-V163 HydrophobicContact CG2-CG1 3.84Å; V113-L164 HydrophobicContact CG1-CD2 3.99Å; V113-S167 WeakPolarHBondContact CB-OG 3.24Å; V113-S167 WeakPolarHBondContact CG1-OG 3.45Å |
| 114 | I | 95 | Very high | 91.3 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.8 | -45.6 | 172.9 | -74.5 | 167.3 | 0 | 0 | 0 | 111 | T110 T111 A116 I117 Q118 Q170 V171 P250 V251 N254 | T110-I114 HydrophobicContact CG2-CD1 3.87Å; T110-I114 HydrophobicContact CG2-CG1 4.4Å; T110-I114 WeakPolarHBondContact O-CB 3.24Å; T110-I114 WeakPolarHBondContact O-CG1 3.36Å; T110-I114 PolarHBondContact O-N 3.46Å; T111-I114 WeakPolarHBondContact O-CB 3.45Å; T111-I114 PolarHBondContact O-N 3.06Å; T111-I114 VanDerWaalsContact O-N 3.11Å; I114-A116 VanDerWaalsContact C-N 3.31Å; I114-A116 PolarHBondContact O-N 2.93Å; I114-I117 PolarHBondContact O-N 3.37Å; I114-Q118 HydrophobicContact CG2-CG 4.32Å; I114-Q118 WeakPolarHBondContact O-CB 3.45Å; I114-Q118 WeakPolarHBondContact O-CG 3.39Å; I114-Q118 PolarHBondContact O-N 3.5Å; I114-Q170 HydrophobicContact CD1-CB 4.35Å; I114-Q170 VanDerWaalsContact CD1-OE1 3.22Å; I114-V171 HydrophobicContact CB-CG2 4.35Å; I114-V171 HydrophobicContact CG1-CG2 4.19Å; I114-V171 HydrophobicContact CG2-CG2 3.84Å; I114-P250 HydrophobicContact CD1-CB 4.46Å; I114-P250 HydrophobicContact CG2-CB 3.97Å; I114-V251 HydrophobicContact CG2-CG2 3.53Å; I114-N254 WeakPolarHBondContact CD1-ND2 3.48Å |
| 115 | I | 92.8 | Very high | 91.2 | Very high | 7 Ų | 7 | 54.4 Ų | 54.4 | 4% | 0.036 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.8 | -43.3 | 178.7 | -72.5 | 166 | 0 | 0 | 0 | 109.9 | T111 P112 V113 Q118 T119 F126 L134 V251 | T111-I115 HydrophobicContact CG2-CD1 4.15Å; T111-I115 PolarHBondContact O-N 3.43Å; P112-I115 PolarHBondContact O-N 3.37Å; V113-I115 PolarHBondContact O-N 2.79Å; I115-Q118 PolarHBondContact O-N 3.25Å; I115-T119 VanDerWaalsContact O-CB 3.32Å; I115-T119 WeakPolarHBondContact O-CB 3.3Å; I115-T119 PolarHBondContact O-N 3.42Å; I115-T119 PolarHBondContact O-OG1 3.49Å; I115-F126 HydrophobicContact CG2-CB 4.43Å; I115-F126 HydrophobicContact CG2-CD2 3.84Å; I115-F126 HydrophobicContact CG2-CE2 4.29Å; I115-F126 HydrophobicContact CG2-CG 4.1Å; I115-L134 HydrophobicContact CD1-CD1 3.64Å; I115-L134 HydrophobicContact CD1-CD2 4Å; I115-L134 HydrophobicContact CD1-CG 4.26Å; I115-V251 HydrophobicContact CD1-CG1 4.16Å; I115-V251 HydrophobicContact CG1-CG1 4.29Å; I115-V251 HydrophobicContact CG1-CG2 3.81Å |
| 116 | A | 93.8 | Very high | 91 | Very high | 39 Ų | 39 | 54.6 Ų | 54.6 | 32% | 0.322 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.7 | -51.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | P112 V113 I114 Q118 T119 F120 | P112-A116 WeakPolarHBondContact O-CB 3.32Å; P112-A116 PolarHBondContact O-N 3.39Å; V113-A116 PolarHBondContact O-N 3.31Å; I114-A116 VanDerWaalsContact C-N 3.31Å; I114-A116 PolarHBondContact O-N 2.93Å; A116-Q118 VanDerWaalsContact C-N 3.33Å; A116-Q118 PolarHBondContact O-N 2.81Å; A116-T119 PolarHBondContact O-N 2.87Å; A116-T119 VanDerWaalsContact O-N 3.16Å; A116-F120 HydrophobicContact CB-CD2 4.23Å; A116-F120 HydrophobicContact CB-CE2 4.26Å; A116-F120 WeakPolarHBondContact O-CD2 3.44Å; A116-F120 PolarHBondContact O-N 2.93Å |
| 117 | I | 94.6 | Very high | 90.8 | Very high | 24 Ų | 24 | 55.7 Ų | 55.7 | 12% | 0.123 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59 | -44.6 | 178 | -67.5 | 165.2 | 0 | 0 | 0 | 110.9 | V113 I114 T119 C121 Y122 L168 V171 | V113-I117 HydrophobicContact CG1-CD1 3.84Å; V113-I117 HydrophobicContact CG1-CG1 4.4Å; V113-I117 VanDerWaalsContact O-CG1 3.28Å; V113-I117 WeakPolarHBondContact O-CG1 3.38Å; V113-I117 PolarHBondContact O-N 2.92Å; I114-I117 PolarHBondContact O-N 3.37Å; I117-T119 VanDerWaalsContact C-N 3.31Å; I117-T119 PolarHBondContact O-N 3.28Å; I117-C121 HydrophobicContact CG2-CB 4.44Å; I117-C121 WeakPolarHBondContact O-CA 3.23Å; I117-C121 VanDerWaalsContact O-CB 3.23Å; I117-C121 WeakPolarHBondContact O-CB 3.42Å; I117-C121 PolarHBondContact O-N 3.32Å; I117-Y122 HydrophobicContact CG2-CD2 4.45Å; I117-Y122 HydrophobicContact CG2-CE2 4.31Å; I117-L168 HydrophobicContact CD1-CD2 3.92Å; I117-L168 HydrophobicContact CD1-CG 4.04Å; I117-L168 HydrophobicContact CG2-CD2 4.43Å; I117-V171 HydrophobicContact CB-CG2 4.47Å; I117-V171 HydrophobicContact CG2-CB 4.35Å; I117-V171 HydrophobicContact CG2-CG1 4.04Å; I117-V171 HydrophobicContact CG2-CG2 4.15Å |
| 118 | Q | 93.3 | Very high | 90.7 | Very high | 6 Ų | 6 | 56.2 Ų | 56.2 | 3% | 0.028 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.9 | -31.7 | 179.6 | -71.7 | -168.1 | -49.4 | 0 | 0 | 112.6 | I114 I115 A116 Y122 Q123 K124 F126 V171 | I114-Q118 HydrophobicContact CG2-CG 4.32Å; I114-Q118 WeakPolarHBondContact O-CB 3.45Å; I114-Q118 WeakPolarHBondContact O-CG 3.39Å; I114-Q118 PolarHBondContact O-N 3.5Å; I115-Q118 PolarHBondContact O-N 3.25Å; A116-Q118 VanDerWaalsContact C-N 3.33Å; A116-Q118 PolarHBondContact O-N 2.81Å; Q118-Y122 CarbonylContact O-C 3.34Å; Q118-Y122 WeakPolarHBondContact O-CA 3.24Å; Q118-Y122 WeakPolarHBondContact O-CB 3.35Å; Q118-Y122 PolarHBondContact O-N 3.34Å; Q118-Q123 PolarHBondContact O-N 3.07Å; Q118-K124 HydrophobicContact CB-CB 4.35Å; Q118-K124 HydrophobicContact CB-CD 4.41Å; Q118-K124 WeakPolarHBondContact O-CB 3.15Å; Q118-K124 PolarHBondContact O-N 2.96Å; Q118-F126 HydrophobicContact CB-CE2 3.75Å; Q118-F126 HydrophobicContact CB-CZ 4.03Å; Q118-V171 HydrophobicContact CG-CG1 4.19Å; Q118-V171 HydrophobicContact CG-CG2 3.86Å |
| 119 | T | 90.9 | Very high | 90.7 | Very high | 40 Ų | 40 | 63.4 Ų | 63.4 | 25% | 0.245 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -73.9 | -52.8 | 177 | -53.4 | 0 | 0 | 0 | 0 | 111.1 | I115 A116 I117 Q123 K124 | I115-T119 VanDerWaalsContact O-CB 3.32Å; I115-T119 WeakPolarHBondContact O-CB 3.3Å; I115-T119 PolarHBondContact O-N 3.42Å; I115-T119 PolarHBondContact O-OG1 3.49Å; A116-T119 PolarHBondContact O-N 2.87Å; A116-T119 VanDerWaalsContact O-N 3.16Å; I117-T119 VanDerWaalsContact C-N 3.31Å; I117-T119 PolarHBondContact O-N 3.28Å; T119-Q123 VanDerWaalsContact O-CA 3.27Å; T119-Q123 WeakPolarHBondContact O-CA 3.32Å; T119-Q123 PolarHBondContact O-N 3.01Å; T119-K124 WeakPolarHBondContact CA-O 3.45Å |
| 120 | F | 92.8 | Very high | 90.5 | Very high | 157 Ų | 157 | 59.8 Ų | 59.8 | 69% | 0.689 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -78.9 | -43.1 | -173.8 | -65.2 | -64 | 0 | 0 | 0 | 113.3 | A116 Q123 | A116-F120 HydrophobicContact CB-CD2 4.23Å; A116-F120 HydrophobicContact CB-CE2 4.26Å; A116-F120 WeakPolarHBondContact O-CD2 3.44Å; A116-F120 PolarHBondContact O-N 2.93Å; F120-Q123 PolarHBondContact O-NE2 3.49Å |
| 121 | C | 91.8 | Very high | 90.3 | Very high | 96 Ų | 96 | 63.5 Ų | 63.5 | 65% | 0.649 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -29 | -174.5 | -54.2 | 0 | 0 | 0 | 0 | 113.3 | I117 | I117-C121 HydrophobicContact CG2-CB 4.44Å; I117-C121 WeakPolarHBondContact O-CA 3.23Å; I117-C121 VanDerWaalsContact O-CB 3.23Å; I117-C121 WeakPolarHBondContact O-CB 3.42Å; I117-C121 PolarHBondContact O-N 3.32Å |
| 122 | Y | 90 | Very high | 90.2 | Very high | 89 Ų | 89 | 68.1 Ų | 68.1 | 35% | 0.349 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.3 | 4.3 | -176.4 | -67.4 | -89.4 | 0 | 0 | 0 | 113.7 | I117 Q118 K124 V171 W172 A175 | I117-Y122 HydrophobicContact CG2-CD2 4.45Å; I117-Y122 HydrophobicContact CG2-CE2 4.31Å; Q118-Y122 CarbonylContact O-C 3.34Å; Q118-Y122 WeakPolarHBondContact O-CA 3.24Å; Q118-Y122 WeakPolarHBondContact O-CB 3.35Å; Q118-Y122 PolarHBondContact O-N 3.34Å; Y122-K124 PolarHBondContact O-N 3.29Å; Y122-K124 VanDerWaalsContact O-N 3.07Å; Y122-V171 HydrophobicContact CD2-CG1 3.87Å; Y122-V171 HydrophobicContact CE2-CG1 3.35Å; Y122-W172 PolarHBondContact OH-NE1 2.68Å; Y122-A175 HydrophobicContact CE1-CB 3.68Å |
| 123 | Q | 87.6 | Confident | 90.1 | Very high | 155 Ų | 155 | 66.6 Ų | 66.6 | 72% | 0.724 | 34% | 0.342 | S | S | * | . | trans | 53.1 | 31.6 | 176.9 | -59.3 | -64.4 | -43.7 | 0 | 0 | 113.1 | Q118 T119 F120 | Q118-Q123 PolarHBondContact O-N 3.07Å; T119-Q123 VanDerWaalsContact O-CA 3.27Å; T119-Q123 WeakPolarHBondContact O-CA 3.32Å; T119-Q123 PolarHBondContact O-N 3.01Å; F120-Q123 PolarHBondContact O-NE2 3.49Å | ||
| 124 | K | 85.6 | Confident | 89.8 | Confident | 105 Ų | 105 | 66 Ų | 66 | 46% | 0.457 | 34% | 0.338 | S | S | . | . | trans | -82.9 | 127.8 | 174.7 | -65.6 | -162.8 | 176.4 | -174 | 0 | 109.8 | Q118 T119 Y122 F126 | Q118-K124 HydrophobicContact CB-CB 4.35Å; Q118-K124 HydrophobicContact CB-CD 4.41Å; Q118-K124 WeakPolarHBondContact O-CB 3.15Å; Q118-K124 PolarHBondContact O-N 2.96Å; T119-K124 WeakPolarHBondContact CA-O 3.45Å; Y122-K124 PolarHBondContact O-N 3.29Å; Y122-K124 VanDerWaalsContact O-N 3.07Å; K124-F126 HydrophobicContact CB-CE2 3.92Å; K124-F126 HydrophobicContact CB-CZ 4.39Å | ||
| 125 | T | 83.8 | Confident | 89.6 | Confident | 137 Ų | 137 | 70.5 Ų | 70.5 | 84% | 0.84 | 36% | 0.361 | S | S | * | . | trans | -85.7 | 126.7 | 174.7 | 56.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 126 | F | 85.1 | Confident | 89.5 | Confident | 41 Ų | 41 | 71.2 Ų | 71.2 | 18% | 0.18 | 37% | 0.366 | C | S | . | . | trans | -110.6 | 132.3 | 167.5 | -64.7 | -89.3 | 0 | 0 | 0 | 108.6 | I115 Q118 K124 I130 Q131 V251 | I115-F126 HydrophobicContact CG2-CB 4.43Å; I115-F126 HydrophobicContact CG2-CD2 3.84Å; I115-F126 HydrophobicContact CG2-CE2 4.29Å; I115-F126 HydrophobicContact CG2-CG 4.1Å; Q118-F126 HydrophobicContact CB-CE2 3.75Å; Q118-F126 HydrophobicContact CB-CZ 4.03Å; K124-F126 HydrophobicContact CB-CE2 3.92Å; K124-F126 HydrophobicContact CB-CZ 4.39Å; F126-I130 HydrophobicContact CD1-CG2 4.27Å; F126-Q131 HydrophobicContact CB-CG 4.44Å; F126-V251 HydrophobicContact CE1-CG2 4.22Å; F126-V251 HydrophobicContact CZ-CG2 4.29Å | ||
| 127 | S | 87.5 | Confident | 89.3 | Confident | 38 Ų | 38 | 69.5 Ų | 69.5 | 27% | 0.266 | 35% | 0.351 | S | S | . | . | trans | -61.8 | 145.1 | 174.1 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | R129 I130 Q131 E301 | S127-R129 PolarHBondContact O-N 3.41Å; S127-R129 VanDerWaalsContact O-N 3.09Å; S127-R129 PolarHBondContact OG-N 2.95Å; S127-I130 WeakPolarHBondContact O-CB 3.34Å; S127-I130 PolarHBondContact O-N 2.98Å; S127-Q131 PolarHBondContact O-N 3.21Å; S127-Q131 VanDerWaalsContact O-N 3.11Å; S127-E301 WeakPolarHBondContact CB-OE1 3.4Å; S127-E301 PolarHBondContact OG-OE1 3.44Å | ||
| 128 | T | 86.6 | Confident | 88.9 | Confident | 93 Ų | 93 | 69.8 Ų | 69.8 | 57% | 0.571 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -53.4 | -32.2 | 173 | -41.9 | 0 | 0 | 0 | 0 | 111.2 | I130 Q131 L132 | T128-I130 PolarHBondContact O-N 2.62Å; T128-Q131 PolarHBondContact O-N 3.1Å; T128-L132 HydrophobicContact CG2-CD1 4.37Å; T128-L132 HydrophobicContact CG2-CG 4.39Å; T128-L132 WeakPolarHBondContact O-CB 3.49Å; T128-L132 VanDerWaalsContact O-CG 3.24Å; T128-L132 WeakPolarHBondContact O-CG 3.44Å; T128-L132 PolarHBondContact O-N 3.34Å |
| 129 | R | 88.8 | Confident | 88.8 | Confident | 151 Ų | 151 | 73.8 Ų | 73.8 | 57% | 0.57 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -61.6 | -43.7 | 176.3 | -62.6 | -177.4 | -177.1 | 179.9 | -0.4 | 112.1 | S127 L132 T133 F297 | S127-R129 PolarHBondContact O-N 3.41Å; S127-R129 VanDerWaalsContact O-N 3.09Å; S127-R129 PolarHBondContact OG-N 2.95Å; R129-L132 PolarHBondContact O-N 3.4Å; R129-T133 VanDerWaalsContact O-CG2 3.26Å; R129-T133 WeakPolarHBondContact O-CG2 3.45Å; R129-T133 PolarHBondContact O-N 3.29Å; R129-F297 HydrophobicContact CB-CD1 4.29Å; R129-F297 HydrophobicContact CB-CD2 3.96Å; R129-F297 HydrophobicContact CB-CE1 4.5Å; R129-F297 HydrophobicContact CB-CE2 4.17Å; R129-F297 HydrophobicContact CB-CG 4.03Å; R129-F297 HydrophobicContact CB-CZ 4.44Å |
| 130 | I | 87 | Confident | 88.6 | Confident | 6 Ų | 6 | 71.9 Ų | 71.9 | 3% | 0.031 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -66.8 | -37.5 | 175.8 | -70.4 | 179.7 | 0 | 0 | 0 | 111.1 | F126 S127 T128 T133 Y294 F297 E301 | F126-I130 HydrophobicContact CD1-CG2 4.27Å; S127-I130 WeakPolarHBondContact O-CB 3.34Å; S127-I130 PolarHBondContact O-N 2.98Å; T128-I130 PolarHBondContact O-N 2.62Å; I130-T133 PolarHBondContact O-N 2.97Å; I130-T133 PolarHBondContact O-OG1 3.29Å; I130-Y294 HydrophobicContact CG2-CD2 3.85Å; I130-Y294 HydrophobicContact CG2-CE2 3.62Å; I130-F297 HydrophobicContact CG1-CB 4.15Å; I130-E301 WeakPolarHBondContact CD1-OE2 3.46Å |
| 131 | Q | 88.9 | Confident | 88.2 | Confident | 81 Ų | 81 | 64.6 Ų | 64.6 | 38% | 0.379 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.4 | -39.3 | 176.7 | -66.2 | 177.9 | -22.7 | 0 | 0 | 111.6 | F126 S127 T128 T133 L134 | F126-Q131 HydrophobicContact CB-CG 4.44Å; S127-Q131 PolarHBondContact O-N 3.21Å; S127-Q131 VanDerWaalsContact O-N 3.11Å; T128-Q131 PolarHBondContact O-N 3.1Å; Q131-T133 PolarHBondContact O-N 2.93Å; Q131-L134 VanDerWaalsContact O-CB 3.28Å; Q131-L134 WeakPolarHBondContact O-CB 3.37Å; Q131-L134 VanDerWaalsContact O-CG 3.3Å; Q131-L134 WeakPolarHBondContact O-CG 3.38Å; Q131-L134 PolarHBondContact O-N 2.92Å; Q131-L134 VanDerWaalsContact O-N 3.12Å |
| 132 | L | 90.6 | Very high | 88 | Confident | 98 Ų | 98 | 63.2 Ų | 63.2 | 51% | 0.513 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64.3 | -26.9 | 177.6 | -72.6 | 173 | 0 | 0 | 0 | 112.8 | T128 R129 L134 I135 P136 | T128-L132 HydrophobicContact CG2-CD1 4.37Å; T128-L132 HydrophobicContact CG2-CG 4.39Å; T128-L132 WeakPolarHBondContact O-CB 3.49Å; T128-L132 VanDerWaalsContact O-CG 3.24Å; T128-L132 WeakPolarHBondContact O-CG 3.44Å; T128-L132 PolarHBondContact O-N 3.34Å; R129-L132 PolarHBondContact O-N 3.4Å; L132-L134 PolarHBondContact O-N 3.41Å; L132-I135 HydrophobicContact CD2-CD1 3.68Å; L132-I135 WeakPolarHBondContact O-CB 3.38Å; L132-I135 PolarHBondContact O-N 3.12Å; L132-P136 VanDerWaalsContact O-CD 3.24Å; L132-P136 WeakPolarHBondContact O-CD 3.45Å |
| 133 | T | 91.1 | Very high | 87.9 | Confident | 4 Ų | 4 | 61.7 Ų | 61.7 | 3% | 0.025 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69 | -14.8 | 176.2 | 71.6 | 0 | 0 | 0 | 0 | 113.3 | R129 I130 Q131 I135 P136 I137 A293 F297 | R129-T133 VanDerWaalsContact O-CG2 3.26Å; R129-T133 WeakPolarHBondContact O-CG2 3.45Å; R129-T133 PolarHBondContact O-N 3.29Å; I130-T133 PolarHBondContact O-N 2.97Å; I130-T133 PolarHBondContact O-OG1 3.29Å; Q131-T133 PolarHBondContact O-N 2.93Å; T133-I135 VanDerWaalsContact C-N 3.3Å; T133-P136 WeakPolarHBondContact O-CD 3.23Å; T133-P136 WeakPolarHBondContact O-CG 3.42Å; T133-I137 WeakPolarHBondContact O-CD1 3.37Å; T133-I137 WeakPolarHBondContact O-CG1 3.26Å; T133-A293 HydrophobicContact CG2-CB 3.77Å; T133-F297 HydrophobicContact CG2-CD2 3.65Å; T133-F297 HydrophobicContact CG2-CE2 3.91Å |
| 134 | L | 88.6 | Confident | 87.7 | Confident | 20 Ų | 20 | 55 Ų | 55 | 11% | 0.105 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -71.6 | -27 | 174.6 | -55.3 | 178.3 | 0 | 0 | 0 | 112.4 | T111 P112 I115 Q131 L132 I137 T138 M255 | T111-L134 HydrophobicContact CG2-CD2 3.72Å; P112-L134 HydrophobicContact CB-CD1 4.13Å; I115-L134 HydrophobicContact CD1-CD1 3.64Å; I115-L134 HydrophobicContact CD1-CD2 4Å; I115-L134 HydrophobicContact CD1-CG 4.26Å; Q131-L134 VanDerWaalsContact O-CB 3.28Å; Q131-L134 WeakPolarHBondContact O-CB 3.37Å; Q131-L134 VanDerWaalsContact O-CG 3.3Å; Q131-L134 WeakPolarHBondContact O-CG 3.38Å; Q131-L134 PolarHBondContact O-N 2.92Å; Q131-L134 VanDerWaalsContact O-N 3.12Å; L132-L134 PolarHBondContact O-N 3.41Å; L134-I137 PolarHBondContact O-N 2.62Å; L134-T138 WeakPolarHBondContact O-CB 3.2Å; L134-T138 PolarHBondContact O-N 3.02Å; L134-T138 PolarHBondContact O-OG1 3.48Å; L134-M255 HydrophobicContact CD2-CE 3.67Å |
| 135 | I | 90.4 | Very high | 87.5 | Confident | 93 Ų | 93 | 50.3 Ų | 50.3 | 48% | 0.477 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.3 | -58.1 | -179.8 | -59.9 | 173.1 | 0 | 0 | 0 | 110.8 | L132 T133 I137 T138 L139 | L132-I135 HydrophobicContact CD2-CD1 3.68Å; L132-I135 WeakPolarHBondContact O-CB 3.38Å; L132-I135 PolarHBondContact O-N 3.12Å; T133-I135 VanDerWaalsContact C-N 3.3Å; I135-I137 VanDerWaalsContact C-N 3.26Å; I135-I137 PolarHBondContact O-N 2.61Å; I135-T138 PolarHBondContact O-N 3.11Å; I135-L139 HydrophobicContact CG2-CD1 3.89Å; I135-L139 HydrophobicContact CG2-CG 4.41Å; I135-L139 WeakPolarHBondContact O-CB 3.4Å; I135-L139 WeakPolarHBondContact O-CG 3.32Å; I135-L139 PolarHBondContact O-N 2.87Å |
| 136 | P | 91.6 | Very high | 87.4 | Confident | 22 Ų | 22 | 50.7 Ų | 50.7 | 14% | 0.143 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.9 | -31.5 | 178.8 | 24.6 | -34.6 | 0 | 0 | 0 | 112.8 | L132 T133 G140 C286 F289 | L132-P136 VanDerWaalsContact O-CD 3.24Å; L132-P136 WeakPolarHBondContact O-CD 3.45Å; T133-P136 WeakPolarHBondContact O-CD 3.23Å; T133-P136 WeakPolarHBondContact O-CG 3.42Å; P136-G140 PolarHBondContact O-N 3.46Å; P136-C286 PolarHBondContact O-SG 2.6Å; P136-F289 HydrophobicContact CB-CD1 4.21Å; P136-F289 HydrophobicContact CG-CD1 4.33Å |
| 137 | I | 88.7 | Confident | 87.1 | Confident | 3 Ų | 3 | 57.2 Ų | 57.2 | 2% | 0.015 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.5 | -48.4 | 175.8 | -64.3 | 170.3 | 0 | 0 | 0 | 110.8 | T133 L134 I135 G140 V141 M255 T287 I291 | T133-I137 WeakPolarHBondContact O-CD1 3.37Å; T133-I137 WeakPolarHBondContact O-CG1 3.26Å; L134-I137 PolarHBondContact O-N 2.62Å; I135-I137 VanDerWaalsContact C-N 3.26Å; I135-I137 PolarHBondContact O-N 2.61Å; I137-G140 PolarHBondContact O-N 3.24Å; I137-V141 WeakPolarHBondContact O-CG2 3.26Å; I137-V141 PolarHBondContact O-N 3.34Å; I137-M255 HydrophobicContact CD1-CE 3.65Å; I137-M255 HydrophobicContact CD1-SD 3.31Å; I137-M255 WeakPolarHBondContact CD1-SD 3.46Å; I137-T287 HydrophobicContact CG2-CG2 4.43Å; I137-I291 HydrophobicContact CD1-CG1 4.2Å; I137-I291 HydrophobicContact CG1-CG1 4.45Å |
| 138 | T | 87.3 | Confident | 86.7 | Confident | 30 Ų | 30 | 58.6 Ų | 58.6 | 18% | 0.184 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.3 | -43.9 | -179 | -50.7 | 0 | 0 | 0 | 0 | 110.5 | M109 L134 I135 G140 V141 I142 | M109-T138 HydrophobicContact SD-CG2 4.27Å; L134-T138 WeakPolarHBondContact O-CB 3.2Å; L134-T138 PolarHBondContact O-N 3.02Å; L134-T138 PolarHBondContact O-OG1 3.48Å; I135-T138 PolarHBondContact O-N 3.11Å; T138-G140 VanDerWaalsContact C-N 3.33Å; T138-G140 PolarHBondContact O-N 3.18Å; T138-V141 PolarHBondContact O-N 2.88Å; T138-I142 HydrophobicContact CG2-CD1 4.18Å; T138-I142 VanDerWaalsContact O-CG1 3.3Å; T138-I142 WeakPolarHBondContact O-CG1 3.21Å; T138-I142 PolarHBondContact O-N 3.27Å |
| 139 | L | 89.7 | Confident | 86.4 | Confident | 91 Ų | 91 | 56 Ų | 56 | 48% | 0.476 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -59.2 | -43.7 | 173.7 | -71.5 | 174.8 | 0 | 0 | 0 | 111.8 | I135 V141 I142 L143 | I135-L139 HydrophobicContact CG2-CD1 3.89Å; I135-L139 HydrophobicContact CG2-CG 4.41Å; I135-L139 WeakPolarHBondContact O-CB 3.4Å; I135-L139 WeakPolarHBondContact O-CG 3.32Å; I135-L139 PolarHBondContact O-N 2.87Å; L139-V141 VanDerWaalsContact C-N 3.35Å; L139-V141 PolarHBondContact O-N 3.48Å; L139-I142 PolarHBondContact O-N 2.72Å; L139-L143 WeakPolarHBondContact O-CG 3.45Å; L139-L143 PolarHBondContact O-N 3.36Å |
| 140 | G | 87.7 | Confident | 86 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.8 | -41.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | P136 I137 T138 L143 N144 G283 T287 | P136-G140 PolarHBondContact O-N 3.46Å; I137-G140 PolarHBondContact O-N 3.24Å; T138-G140 VanDerWaalsContact C-N 3.33Å; T138-G140 PolarHBondContact O-N 3.18Å; G140-L143 PolarHBondContact O-N 2.92Å; G140-N144 WeakPolarHBondContact O-CB 3.26Å; G140-N144 PolarHBondContact O-N 3.09Å; G140-N144 PolarHBondContact O-ND2 3.44Å; G140-N144 VanDerWaalsContact O-ND2 3.15Å; G140-G283 VanDerWaalsContact CA-O 3.3Å; G140-G283 WeakPolarHBondContact CA-O 3.34Å; G140-G283 VanDerWaalsContact O-CA 3.26Å; G140-G283 WeakPolarHBondContact O-CA 3.41Å; G140-T287 WeakPolarHBondContact CA-OG1 3.22Å |
| 141 | V | 85.2 | Confident | 85.5 | Confident | 3 Ų | 3 | 62.9 Ų | 62.9 | 2% | 0.018 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -68.4 | -38.5 | 175.8 | 176.2 | 0 | 0 | 0 | 0 | 112 | Q104 L105 A108 I137 T138 L139 N144 S145 | Q104-V141 HydrophobicContact CB-CG1 4.43Å; L105-V141 HydrophobicContact CD1-CG1 4.42Å; A108-V141 HydrophobicContact CB-CB 3.98Å; A108-V141 HydrophobicContact CB-CG1 3.85Å; A108-V141 HydrophobicContact CB-CG2 3.85Å; I137-V141 WeakPolarHBondContact O-CG2 3.26Å; I137-V141 PolarHBondContact O-N 3.34Å; T138-V141 PolarHBondContact O-N 2.88Å; L139-V141 VanDerWaalsContact C-N 3.35Å; L139-V141 PolarHBondContact O-N 3.48Å; V141-N144 PolarHBondContact O-N 3.36Å; V141-S145 WeakPolarHBondContact O-CB 3.48Å; V141-S145 PolarHBondContact O-N 3.36Å; V141-S145 VanDerWaalsContact O-N 3.14Å; V141-S145 PolarHBondContact O-OG 3.37Å |
| 142 | I | 86.7 | Confident | 85.3 | Confident | 68 Ų | 68 | 62.2 Ų | 62.2 | 35% | 0.349 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.2 | -48.3 | 174.3 | -69.1 | 166.7 | 0 | 0 | 0 | 110.3 | L105 T138 L139 N144 S145 Y146 | L105-I142 HydrophobicContact CD1-CD1 4.27Å; L105-I142 HydrophobicContact CD1-CG1 3.45Å; L105-I142 VanDerWaalsContact CD1-CG1 3.45Å; L105-I142 HydrophobicContact CD2-CG1 4.46Å; T138-I142 HydrophobicContact CG2-CD1 4.18Å; T138-I142 VanDerWaalsContact O-CG1 3.3Å; T138-I142 WeakPolarHBondContact O-CG1 3.21Å; T138-I142 PolarHBondContact O-N 3.27Å; L139-I142 PolarHBondContact O-N 2.72Å; I142-N144 VanDerWaalsContact C-N 3.34Å; I142-N144 PolarHBondContact O-N 2.97Å; I142-S145 CarbonylContact O-C 3.47Å; I142-S145 PolarHBondContact O-N 3.49Å; I142-S145 VanDerWaalsContact O-N 3.08Å; I142-Y146 WeakPolarHBondContact O-CA 3.13Å; I142-Y146 PolarHBondContact O-N 3.06Å |
| 143 | L | 88.3 | Confident | 85.3 | Confident | 56 Ų | 56 | 66 Ų | 66 | 29% | 0.293 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.7 | -42.5 | 178.7 | -72.3 | 173.8 | 0 | 0 | 0 | 112.2 | L139 G140 S145 Y146 L282 | L139-L143 WeakPolarHBondContact O-CG 3.45Å; L139-L143 PolarHBondContact O-N 3.36Å; G140-L143 PolarHBondContact O-N 2.92Å; L143-S145 PolarHBondContact O-N 3.48Å; L143-Y146 PolarHBondContact O-N 3.38Å; L143-L282 HydrophobicContact CD1-CB 4.28Å |
| 144 | N | 83.2 | Confident | 85.3 | Confident | 15 Ų | 15 | 69.9 Ų | 69.9 | 8% | 0.08 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60.8 | -29.1 | 175.5 | -80.5 | -35.3 | 0 | 0 | 0 | 113.3 | G140 V141 I142 F261 Q280 | G140-N144 WeakPolarHBondContact O-CB 3.26Å; G140-N144 PolarHBondContact O-N 3.09Å; G140-N144 PolarHBondContact O-ND2 3.44Å; G140-N144 VanDerWaalsContact O-ND2 3.15Å; V141-N144 PolarHBondContact O-N 3.36Å; I142-N144 VanDerWaalsContact C-N 3.34Å; I142-N144 PolarHBondContact O-N 2.97Å; N144-F261 HydrophobicContact CB-CE1 4.42Å; N144-Q280 WeakPolarHBondContact OD1-CA 3.5Å; N144-Q280 PolarHBondContact OD1-O 2.99Å |
| 145 | S | 81 | Confident | 85.4 | Confident | 6 Ų | 6 | 68.9 Ų | 68.9 | 4% | 0.042 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -107.8 | 2.6 | -171.9 | -49.6 | 0 | 0 | 0 | 0 | 113.1 | V141 I142 L143 Y147 D148 V149 | V141-S145 WeakPolarHBondContact O-CB 3.48Å; V141-S145 PolarHBondContact O-N 3.36Å; V141-S145 VanDerWaalsContact O-N 3.14Å; V141-S145 PolarHBondContact O-OG 3.37Å; I142-S145 CarbonylContact O-C 3.47Å; I142-S145 PolarHBondContact O-N 3.49Å; I142-S145 VanDerWaalsContact O-N 3.08Å; L143-S145 PolarHBondContact O-N 3.48Å; S145-Y147 VanDerWaalsContact C-N 3.31Å; S145-Y147 PolarHBondContact O-N 3.32Å; S145-Y147 VanDerWaalsContact O-N 3.14Å; S145-D148 PolarHBondContact O-N 3.39Å; S145-V149 WeakPolarHBondContact O-CG2 3.31Å; S145-V149 PolarHBondContact O-N 3.21Å |
| 146 | Y | 80.9 | Confident | 85.4 | Confident | 145 Ų | 145 | 68.2 Ų | 68.2 | 57% | 0.569 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | -43.5 | -165 | -175.8 | -97 | 0 | 0 | 0 | 114 | I142 L143 | I142-Y146 WeakPolarHBondContact O-CA 3.13Å; I142-Y146 PolarHBondContact O-N 3.06Å; L143-Y146 PolarHBondContact O-N 3.38Å |
| 147 | Y | 80.3 | Confident | 85.5 | Confident | 178 Ų | 178 | 70 Ų | 70 | 70% | 0.698 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86 | -10.5 | -179.5 | -63.9 | -67.6 | 0 | 0 | 0 | 114.3 | S145 N279 | S145-Y147 VanDerWaalsContact C-N 3.31Å; S145-Y147 PolarHBondContact O-N 3.32Å; S145-Y147 VanDerWaalsContact O-N 3.14Å; Y147-N279 WeakPolarHBondContact CE2-ND2 3.37Å; Y147-N279 PolarHBondContact OH-ND2 3.26Å |
| 148 | D | 78.4 | Confident | 85.8 | Confident | 68 Ų | 68 | 71.7 Ų | 71.7 | 36% | 0.364 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106 | -10.1 | -176.1 | -165.9 | 33.3 | 0 | 0 | 0 | 112.3 | T99 I100 G101 S145 K150 | T99-D148 WeakPolarHBondContact CB-O 3.38Å; T99-D148 WeakPolarHBondContact CG2-O 3.34Å; T99-D148 PolarHBondContact OG1-O 3.4Å; I100-D148 PolarHBondContact N-OD2 3.47Å; G101-D148 PolarHBondContact N-OD2 3.4Å; S145-D148 PolarHBondContact O-N 3.39Å; D148-K150 PolarHBondContact O-N 2.82Å |
| 149 | V | 79.4 | Confident | 86.1 | Confident | 38 Ų | 38 | 70.6 Ų | 70.6 | 23% | 0.23 | 33% | 0.333 | C | S | . | . | trans | -70.9 | 118.5 | 178 | 171 | 0 | 0 | 0 | 0 | 110.5 | L105 S145 F151 | L105-V149 HydrophobicContact CD2-CG2 4.49Å; S145-V149 WeakPolarHBondContact O-CG2 3.31Å; S145-V149 PolarHBondContact O-N 3.21Å; V149-F151 HydrophobicContact CG1-CD2 4.36Å; V149-F151 HydrophobicContact CG1-CE1 4.01Å; V149-F151 HydrophobicContact CG1-CE2 3.75Å; V149-F151 HydrophobicContact CG1-CZ 3.55Å | ||
| 150 | K | 81.3 | Confident | 86.3 | Confident | 145 Ų | 145 | 68.8 Ų | 68.8 | 63% | 0.63 | 33% | 0.331 | S | S | * | . | trans | -125 | 137.9 | 166.2 | -63.7 | -177.7 | -177.7 | 176.6 | 0 | 108.9 | T99 T102 D148 | T99-K150 HydrophobicContact CG2-CB 3.83Å; T99-K150 HydrophobicContact CG2-CD 3.88Å; T99-K150 HydrophobicContact CG2-CG 3.89Å; T99-K150 PolarHBondContact OG1-N 2.78Å; T102-K150 PolarHBondContact OG1-N 3.31Å; T102-K150 VanDerWaalsContact OG1-N 3.15Å; T102-K150 PolarHBondContact OG1-O 2.82Å; D148-K150 PolarHBondContact O-N 2.82Å | ||
| 151 | F | 77.3 | Confident | 86.7 | Confident | 157 Ų | 157 | 72 Ų | 72 | 69% | 0.689 | 35% | 0.348 | S | S | * | . | trans | -94.9 | 119.3 | 179.9 | -64.2 | -72.7 | 0 | 0 | 0 | 110.1 | V149 M156 | V149-F151 HydrophobicContact CG1-CD2 4.36Å; V149-F151 HydrophobicContact CG1-CE1 4.01Å; V149-F151 HydrophobicContact CG1-CE2 3.75Å; V149-F151 HydrophobicContact CG1-CZ 3.55Å; F151-M156 HydrophobicContact CD1-CE 4.48Å; F151-M156 HydrophobicContact CD1-CG 4.38Å; F151-M156 HydrophobicContact CD1-SD 3.99Å; F151-M156 HydrophobicContact CE1-SD 4.41Å | ||
| 152 | N | 84.5 | Confident | 87.2 | Confident | 66 Ų | 66 | 72 Ų | 72 | 35% | 0.353 | 35% | 0.348 | S | S | . | . | trans | -118.3 | 124.6 | 169.1 | 174.9 | 7.3 | 0 | 0 | 0 | 107.4 | N97 L154 G155 M156 | N97-N152 PolarHBondContact O-ND2 3.49Å; N152-L154 PolarHBondContact O-N 3.24Å; N152-L154 PolarHBondContact OD1-N 3.47Å; N152-G155 CarbonylContact O-C 3.59Å; N152-G155 PolarHBondContact O-N 3.22Å; N152-M156 WeakPolarHBondContact O-CB 3.3Å; N152-M156 VanDerWaalsContact O-CG 3.23Å; N152-M156 WeakPolarHBondContact O-CG 3.3Å; N152-M156 PolarHBondContact O-N 3.32Å | ||
| 153 | F | 89.3 | Confident | 87.6 | Confident | 177 Ų | 177 | 69.4 Ų | 69.4 | 78% | 0.776 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -57.5 | -48.4 | -177 | 179.9 | -100.3 | 0 | 0 | 0 | 112.1 | G155 M156 V157 | F153-G155 PolarHBondContact O-N 2.95Å; F153-M156 PolarHBondContact O-N 3.18Å; F153-V157 HydrophobicContact CE1-CG2 4.16Å; F153-V157 HydrophobicContact CZ-CG2 4.22Å; F153-V157 WeakPolarHBondContact O-CG2 3.01Å; F153-V157 PolarHBondContact O-N 3.45Å |
| 154 | L | 91.5 | Very high | 88 | Confident | 86 Ų | 86 | 70.9 Ų | 70.9 | 45% | 0.45 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.3 | -44.6 | 178.7 | -176.3 | 67.9 | 0 | 0 | 0 | 111.2 | N152 M156 V157 F158 | N152-L154 PolarHBondContact O-N 3.24Å; N152-L154 PolarHBondContact OD1-N 3.47Å; L154-M156 VanDerWaalsContact C-N 3.3Å; L154-M156 PolarHBondContact O-N 3.26Å; L154-V157 PolarHBondContact O-N 3.28Å; L154-F158 HydrophobicContact CD1-CE2 3.89Å; L154-F158 HydrophobicContact CD1-CZ 3.95Å; L154-F158 HydrophobicContact CD2-CE2 3.96Å; L154-F158 HydrophobicContact CG-CD2 4.13Å; L154-F158 HydrophobicContact CG-CE2 3.58Å; L154-F158 HydrophobicContact CG-CZ 4.17Å; L154-F158 WeakPolarHBondContact O-CD2 3.33Å; L154-F158 PolarHBondContact O-N 3.49Å |
| 155 | G | 90 | Very high | 88.6 | Confident | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -59.8 | -38.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | N98 N152 F153 F158 A159 | N98-G155 PolarHBondContact ND2-O 2.98Å; N98-G155 VanDerWaalsContact OD1-CA 3.3Å; N98-G155 WeakPolarHBondContact OD1-CA 3.28Å; N152-G155 CarbonylContact O-C 3.59Å; N152-G155 PolarHBondContact O-N 3.22Å; F153-G155 PolarHBondContact O-N 2.95Å; G155-F158 PolarHBondContact O-N 3.46Å; G155-A159 VanDerWaalsContact O-CB 3.3Å; G155-A159 WeakPolarHBondContact O-CB 3.45Å; G155-A159 PolarHBondContact O-N 3.25Å |
| 156 | M | 90.9 | Very high | 89.3 | Confident | 79 Ų | 79 | 71.6 Ų | 71.6 | 39% | 0.389 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -67.7 | -36.7 | 176.8 | -74.4 | -64.1 | -65.3 | 0 | 0 | 112.3 | T102 F151 N152 F153 L154 A159 A160 | T102-M156 HydrophobicContact CG2-SD 3.96Å; F151-M156 HydrophobicContact CD1-CE 4.48Å; F151-M156 HydrophobicContact CD1-CG 4.38Å; F151-M156 HydrophobicContact CD1-SD 3.99Å; F151-M156 HydrophobicContact CE1-SD 4.41Å; N152-M156 WeakPolarHBondContact O-CB 3.3Å; N152-M156 VanDerWaalsContact O-CG 3.23Å; N152-M156 WeakPolarHBondContact O-CG 3.3Å; N152-M156 PolarHBondContact O-N 3.32Å; F153-M156 PolarHBondContact O-N 3.18Å; L154-M156 VanDerWaalsContact C-N 3.3Å; L154-M156 PolarHBondContact O-N 3.26Å; M156-A159 PolarHBondContact O-N 2.92Å; M156-A160 WeakPolarHBondContact O-CB 3.36Å; M156-A160 PolarHBondContact O-N 3.38Å |
| 157 | V | 94.9 | Very high | 90 | Very high | 60 Ų | 60 | 64.7 Ų | 64.7 | 36% | 0.364 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.9 | -48.2 | 172.5 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | F153 L154 A159 A160 L161 | F153-V157 HydrophobicContact CE1-CG2 4.16Å; F153-V157 HydrophobicContact CZ-CG2 4.22Å; F153-V157 WeakPolarHBondContact O-CG2 3.01Å; F153-V157 PolarHBondContact O-N 3.45Å; L154-V157 PolarHBondContact O-N 3.28Å; V157-A159 VanDerWaalsContact C-N 3.31Å; V157-A159 PolarHBondContact O-N 2.94Å; V157-A160 PolarHBondContact O-N 3.44Å; V157-L161 HydrophobicContact CG1-CD1 4.11Å; V157-L161 WeakPolarHBondContact O-CG 3.31Å; V157-L161 PolarHBondContact O-N 3.37Å |
| 158 | F | 93.6 | Very high | 90.8 | Very high | 38 Ų | 38 | 58.9 Ų | 58.9 | 17% | 0.167 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.2 | -37.6 | 175.9 | -66.7 | -42.3 | 0 | 0 | 0 | 112.6 | F90 L93 N97 L154 G155 G162 | F90-F158 HydrophobicContact CD1-CD1 4.14Å; L93-F158 HydrophobicContact CB-CB 4.23Å; L93-F158 HydrophobicContact CB-CD1 4.17Å; L93-F158 HydrophobicContact CB-CD2 3.89Å; L93-F158 HydrophobicContact CB-CE2 4.24Å; L93-F158 HydrophobicContact CB-CG 3.86Å; L93-F158 HydrophobicContact CD1-CD1 4.05Å; L93-F158 HydrophobicContact CD1-CE1 3.82Å; L93-F158 HydrophobicContact CD1-CZ 4.11Å; N97-F158 HydrophobicContact CB-CD2 4.34Å; L154-F158 HydrophobicContact CD1-CE2 3.89Å; L154-F158 HydrophobicContact CD1-CZ 3.95Å; L154-F158 HydrophobicContact CD2-CE2 3.96Å; L154-F158 HydrophobicContact CG-CD2 4.13Å; L154-F158 HydrophobicContact CG-CE2 3.58Å; L154-F158 HydrophobicContact CG-CZ 4.17Å; L154-F158 WeakPolarHBondContact O-CD2 3.33Å; L154-F158 PolarHBondContact O-N 3.49Å; G155-F158 PolarHBondContact O-N 3.46Å; F158-G162 PolarHBondContact O-N 2.88Å |
| 159 | A | 93.2 | Very high | 91.6 | Very high | 6 Ų | 6 | 56.4 Ų | 56.4 | 5% | 0.05 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | S94 A106 G155 M156 V157 G162 V163 | S94-A159 WeakPolarHBondContact OG-CB 3.48Å; A106-A159 HydrophobicContact CB-CB 3.8Å; G155-A159 VanDerWaalsContact O-CB 3.3Å; G155-A159 WeakPolarHBondContact O-CB 3.45Å; G155-A159 PolarHBondContact O-N 3.25Å; M156-A159 PolarHBondContact O-N 2.92Å; V157-A159 VanDerWaalsContact C-N 3.31Å; V157-A159 PolarHBondContact O-N 2.94Å; A159-G162 PolarHBondContact O-N 3.4Å; A159-V163 VanDerWaalsContact O-CG2 3.26Å; A159-V163 WeakPolarHBondContact O-CG2 3.43Å; A159-V163 PolarHBondContact O-N 2.95Å |
| 160 | A | 94.8 | Very high | 92.4 | Very high | 53 Ų | 53 | 55.5 Ų | 55.5 | 44% | 0.438 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.2 | -47.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | M156 V157 G162 V163 L164 | M156-A160 WeakPolarHBondContact O-CB 3.36Å; M156-A160 PolarHBondContact O-N 3.38Å; V157-A160 PolarHBondContact O-N 3.44Å; A160-G162 VanDerWaalsContact C-N 3.34Å; A160-G162 PolarHBondContact O-N 3.23Å; A160-V163 PolarHBondContact O-N 2.9Å; A160-L164 WeakPolarHBondContact O-CG 3.41Å; A160-L164 PolarHBondContact O-N 2.94Å |
| 161 | L | 96 | Very high | 93.1 | Very high | 67 Ų | 67 | 48.7 Ų | 48.7 | 35% | 0.351 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.7 | -43.6 | 174.7 | -69 | 174 | 0 | 0 | 0 | 111.4 | F90 V157 V163 L164 V165 | F90-L161 HydrophobicContact CB-CB 4.4Å; F90-L161 HydrophobicContact CD1-CB 3.97Å; F90-L161 HydrophobicContact CD1-CD1 4.05Å; F90-L161 HydrophobicContact CD2-CB 4.1Å; F90-L161 HydrophobicContact CE1-CB 4.26Å; F90-L161 HydrophobicContact CE1-CD1 3.65Å; F90-L161 HydrophobicContact CE2-CB 4.39Å; F90-L161 HydrophobicContact CG-CB 3.9Å; F90-L161 HydrophobicContact CZ-CB 4.46Å; F90-L161 HydrophobicContact CZ-CD1 4.02Å; V157-L161 HydrophobicContact CG1-CD1 4.11Å; V157-L161 WeakPolarHBondContact O-CG 3.31Å; V157-L161 PolarHBondContact O-N 3.37Å; L161-V163 PolarHBondContact O-N 2.93Å; L161-L164 PolarHBondContact O-N 2.73Å; L161-V165 WeakPolarHBondContact O-CB 3.43Å; L161-V165 VanDerWaalsContact O-CG2 3.3Å; L161-V165 WeakPolarHBondContact O-CG2 3.23Å; L161-V165 PolarHBondContact O-N 3.2Å |
| 162 | G | 95.3 | Very high | 93.9 | Very high | 3 Ų | 3 | 43.4 Ų | 43.4 | 3% | 0.031 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.2 | -46.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F158 A159 A160 T166 | F158-G162 PolarHBondContact O-N 2.88Å; A159-G162 PolarHBondContact O-N 3.4Å; A160-G162 VanDerWaalsContact C-N 3.34Å; A160-G162 PolarHBondContact O-N 3.23Å; G162-T166 WeakPolarHBondContact O-CB 3.38Å; G162-T166 PolarHBondContact O-N 2.95Å; G162-T166 PolarHBondContact O-OG1 2.94Å |
| 163 | V | 95.8 | Very high | 94.4 | Very high | 14 Ų | 14 | 40.2 Ų | 40.2 | 9% | 0.085 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.4 | -51.3 | 176.6 | 170.2 | 0 | 0 | 0 | 0 | 110.9 | A106 M109 V113 A159 A160 L161 V165 T166 S167 | A106-V163 HydrophobicContact CB-CG2 4Å; A106-V163 WeakPolarHBondContact O-CG2 3.12Å; M109-V163 HydrophobicContact CB-CG1 4.29Å; V113-V163 HydrophobicContact CB-CG1 4.27Å; V113-V163 HydrophobicContact CG2-CG1 3.84Å; A159-V163 VanDerWaalsContact O-CG2 3.26Å; A159-V163 WeakPolarHBondContact O-CG2 3.43Å; A159-V163 PolarHBondContact O-N 2.95Å; A160-V163 PolarHBondContact O-N 2.9Å; L161-V163 PolarHBondContact O-N 2.93Å; V163-V165 PolarHBondContact O-N 3.47Å; V163-T166 PolarHBondContact O-N 3.36Å; V163-S167 WeakPolarHBondContact O-CB 3.35Å; V163-S167 PolarHBondContact O-N 2.82Å; V163-S167 PolarHBondContact O-OG 3.33Å |
| 164 | L | 96.5 | Very high | 94.6 | Very high | 88 Ų | 88 | 32.6 Ų | 32.6 | 46% | 0.461 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -57.8 | -49 | -179.7 | -71.5 | 174.2 | 0 | 0 | 0 | 111.9 | V113 A160 L161 S167 L168 | V113-L164 HydrophobicContact CG1-CD2 3.99Å; A160-L164 WeakPolarHBondContact O-CG 3.41Å; A160-L164 PolarHBondContact O-N 2.94Å; L161-L164 PolarHBondContact O-N 2.73Å; L164-S167 PolarHBondContact O-N 2.85Å; L164-L168 WeakPolarHBondContact O-CB 3.36Å; L164-L168 WeakPolarHBondContact O-CG 3.46Å; L164-L168 PolarHBondContact O-N 3.04Å |
| 165 | V | 95.8 | Very high | 94.7 | Very high | 25 Ų | 25 | 29.5 Ų | 29.5 | 15% | 0.152 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.2 | -38.4 | -178.4 | 178.8 | 0 | 0 | 0 | 0 | 111.4 | S83 F87 F90 L161 V163 L168 Y169 | S83-V165 WeakPolarHBondContact O-CG1 3.1Å; F87-V165 HydrophobicContact CB-CG1 4.09Å; F87-V165 VanDerWaalsContact N-CG1 3.25Å; F90-V165 HydrophobicContact CD2-CG2 4.08Å; F90-V165 HydrophobicContact CE2-CG2 4.3Å; L161-V165 WeakPolarHBondContact O-CB 3.43Å; L161-V165 VanDerWaalsContact O-CG2 3.3Å; L161-V165 WeakPolarHBondContact O-CG2 3.23Å; L161-V165 PolarHBondContact O-N 3.2Å; V163-V165 PolarHBondContact O-N 3.47Å; V165-L168 PolarHBondContact O-N 3.25Å; V165-Y169 VanDerWaalsContact O-CB 3.26Å; V165-Y169 WeakPolarHBondContact O-CB 3.34Å; V165-Y169 PolarHBondContact O-N 3.41Å |
| 166 | T | 95.2 | Very high | 94.9 | Very high | 11 Ų | 11 | 31 Ų | 31 | 7% | 0.067 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.3 | -47.1 | 173.8 | -56.4 | 0 | 0 | 0 | 0 | 111 | F87 T110 G162 V163 Y169 Q170 | F87-T166 HydrophobicContact CD2-CG2 4.1Å; F87-T166 WeakPolarHBondContact CD2-OG1 3.38Å; F87-T166 HydrophobicContact CE2-CG2 4.19Å; T110-T166 HydrophobicContact CG2-CG2 3.75Å; G162-T166 WeakPolarHBondContact O-CB 3.38Å; G162-T166 PolarHBondContact O-N 2.95Å; G162-T166 PolarHBondContact O-OG1 2.94Å; V163-T166 PolarHBondContact O-N 3.36Å; T166-Y169 PolarHBondContact O-N 3.2Å; T166-Q170 WeakPolarHBondContact O-CG 3.37Å; T166-Q170 PolarHBondContact O-N 3Å |
| 167 | S | 96.3 | Very high | 95 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -63 | -45.5 | 179.2 | -63.5 | 0 | 0 | 0 | 0 | 111.7 | T110 V113 V163 L164 Q170 V171 | T110-S167 VanDerWaalsContact CG2-OG 3.29Å; T110-S167 WeakPolarHBondContact CG2-OG 3.37Å; T110-S167 PolarHBondContact O-OG 3.43Å; V113-S167 WeakPolarHBondContact CB-OG 3.24Å; V113-S167 WeakPolarHBondContact CG1-OG 3.45Å; V163-S167 WeakPolarHBondContact O-CB 3.35Å; V163-S167 PolarHBondContact O-N 2.82Å; V163-S167 PolarHBondContact O-OG 3.33Å; L164-S167 PolarHBondContact O-N 2.85Å; S167-Q170 PolarHBondContact O-N 3.21Å; S167-V171 WeakPolarHBondContact O-CB 3.41Å; S167-V171 VanDerWaalsContact O-CG2 3.25Å; S167-V171 WeakPolarHBondContact O-CG2 3.38Å; S167-V171 PolarHBondContact O-N 3.4Å |
| 168 | L | 96 | Very high | 94.8 | Very high | 56 Ų | 56 | 32 Ų | 32 | 29% | 0.293 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -60.4 | -48.7 | 175.6 | -76 | 169.4 | 0 | 0 | 0 | 111.8 | I117 L164 V165 Q170 V171 W172 | I117-L168 HydrophobicContact CD1-CD2 3.92Å; I117-L168 HydrophobicContact CD1-CG 4.04Å; I117-L168 HydrophobicContact CG2-CD2 4.43Å; L164-L168 WeakPolarHBondContact O-CB 3.36Å; L164-L168 WeakPolarHBondContact O-CG 3.46Å; L164-L168 PolarHBondContact O-N 3.04Å; V165-L168 PolarHBondContact O-N 3.25Å; L168-Q170 PolarHBondContact O-N 3.46Å; L168-V171 PolarHBondContact O-N 3.03Å; L168-W172 HydrophobicContact CB-CZ3 4.47Å; L168-W172 HydrophobicContact CD2-CZ2 4.16Å; L168-W172 WeakPolarHBondContact O-CB 3.47Å; L168-W172 PolarHBondContact O-N 3.37Å |
| 169 | Y | 95.7 | Very high | 94.7 | Very high | 15 Ų | 15 | 34.4 Ų | 34.4 | 6% | 0.059 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -55 | -53.1 | 178.4 | 169.7 | -115.6 | 0 | 0 | 0 | 111 | L80 F84 V165 T166 V171 W172 V173 Y242 | L80-Y169 HydrophobicContact CD1-CD2 3.69Å; L80-Y169 HydrophobicContact CD1-CE2 3.86Å; L80-Y169 HydrophobicContact CG-CE2 4.46Å; F84-Y169 HydrophobicContact CB-CD2 3.9Å; F84-Y169 HydrophobicContact CB-CE2 3.7Å; F84-Y169 HydrophobicContact CD2-CE1 4.06Å; F84-Y169 AromaticContact CD2-CE2 3.96Å; F84-Y169 HydrophobicContact CD2-CE2 3.96Å; F84-Y169 AromaticContact CD2-CZ 3.64Å; F84-Y169 HydrophobicContact CG-CE2 4.26Å; V165-Y169 VanDerWaalsContact O-CB 3.26Å; V165-Y169 WeakPolarHBondContact O-CB 3.34Å; V165-Y169 PolarHBondContact O-N 3.41Å; T166-Y169 PolarHBondContact O-N 3.2Å; Y169-V171 PolarHBondContact O-N 3.45Å; Y169-W172 PolarHBondContact O-N 3.32Å; Y169-W172 VanDerWaalsContact O-N 3.17Å; Y169-V173 HydrophobicContact CD2-CG2 4.04Å; Y169-V173 HydrophobicContact CE1-CG2 4.19Å; Y169-V173 HydrophobicContact CE2-CG2 3.57Å; Y169-V173 WeakPolarHBondContact O-CG2 3.45Å; Y169-V173 PolarHBondContact O-N 3.07Å; Y169-Y242 VanDerWaalsContact OH-CE2 3.24Å; Y169-Y242 WeakPolarHBondContact OH-CE2 3.37Å; Y169-Y242 PolarHBondContact OH-OH 3.09Å |
| 170 | Q | 95.7 | Very high | 94.6 | Very high | 19 Ų | 19 | 35 Ų | 35 | 9% | 0.089 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.9 | -36.5 | -177.4 | -67.3 | 177.2 | 7.5 | 0 | 0 | 112.9 | I114 T166 S167 L168 V173 G174 P250 N254 | I114-Q170 HydrophobicContact CD1-CB 4.35Å; I114-Q170 VanDerWaalsContact CD1-OE1 3.22Å; T166-Q170 WeakPolarHBondContact O-CG 3.37Å; T166-Q170 PolarHBondContact O-N 3Å; S167-Q170 PolarHBondContact O-N 3.21Å; L168-Q170 PolarHBondContact O-N 3.46Å; Q170-V173 PolarHBondContact O-N 2.84Å; Q170-G174 PolarHBondContact O-N 3.12Å; Q170-P250 HydrophobicContact CB-CB 4.26Å; Q170-P250 WeakPolarHBondContact O-CG 3.46Å; Q170-N254 PolarHBondContact OE1-ND2 3.03Å |
| 171 | V | 95.8 | Very high | 94.4 | Very high | 2 Ų | 2 | 38.5 Ų | 38.5 | 1% | 0.012 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.3 | -44.9 | 172.5 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | I114 I117 Q118 Y122 S167 L168 Y169 G174 A175 | I114-V171 HydrophobicContact CB-CG2 4.35Å; I114-V171 HydrophobicContact CG1-CG2 4.19Å; I114-V171 HydrophobicContact CG2-CG2 3.84Å; I117-V171 HydrophobicContact CB-CG2 4.47Å; I117-V171 HydrophobicContact CG2-CB 4.35Å; I117-V171 HydrophobicContact CG2-CG1 4.04Å; I117-V171 HydrophobicContact CG2-CG2 4.15Å; Q118-V171 HydrophobicContact CG-CG1 4.19Å; Q118-V171 HydrophobicContact CG-CG2 3.86Å; Y122-V171 HydrophobicContact CD2-CG1 3.87Å; Y122-V171 HydrophobicContact CE2-CG1 3.35Å; S167-V171 WeakPolarHBondContact O-CB 3.41Å; S167-V171 VanDerWaalsContact O-CG2 3.25Å; S167-V171 WeakPolarHBondContact O-CG2 3.38Å; S167-V171 PolarHBondContact O-N 3.4Å; L168-V171 PolarHBondContact O-N 3.03Å; Y169-V171 PolarHBondContact O-N 3.45Å; V171-G174 PolarHBondContact O-N 2.87Å; V171-A175 VanDerWaalsContact O-CB 3.25Å; V171-A175 WeakPolarHBondContact O-CB 3.5Å; V171-A175 PolarHBondContact O-N 3.47Å |
| 172 | W | 95.7 | Very high | 94.2 | Very high | 46 Ų | 46 | 35.9 Ų | 35.9 | 17% | 0.174 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -68.5 | -35.2 | 178.2 | -71.8 | -19.6 | 0 | 0 | 0 | 113.5 | L79 L80 Y122 L168 Y169 G174 A175 K176 | L79-W172 HydrophobicContact CB-CZ3 4.39Å; L79-W172 HydrophobicContact CD1-CH2 4.06Å; L79-W172 HydrophobicContact CD1-CZ3 4.28Å; L79-W172 HydrophobicContact CD2-CH2 3.37Å; L79-W172 HydrophobicContact CD2-CZ2 3.61Å; L79-W172 HydrophobicContact CD2-CZ3 3.93Å; L79-W172 HydrophobicContact CG-CE3 4.28Å; L79-W172 HydrophobicContact CG-CH2 3.4Å; L79-W172 VanDerWaalsContact CG-CH2 3.4Å; L79-W172 HydrophobicContact CG-CZ2 4.14Å; L79-W172 HydrophobicContact CG-CZ3 3.48Å; L79-W172 VanDerWaalsContact CG-CZ3 3.48Å; L79-W172 WeakPolarHBondContact O-CZ3 3.36Å; L80-W172 HydrophobicContact CD1-CB 3.68Å; Y122-W172 PolarHBondContact OH-NE1 2.68Å; L168-W172 HydrophobicContact CB-CZ3 4.47Å; L168-W172 HydrophobicContact CD2-CZ2 4.16Å; L168-W172 WeakPolarHBondContact O-CB 3.47Å; L168-W172 PolarHBondContact O-N 3.37Å; Y169-W172 PolarHBondContact O-N 3.32Å; Y169-W172 VanDerWaalsContact O-N 3.17Å; W172-G174 VanDerWaalsContact C-N 3.28Å; W172-G174 PolarHBondContact O-N 3.23Å; W172-A175 PolarHBondContact O-N 3.16Å; W172-K176 WeakPolarHBondContact O-CB 3.3Å; W172-K176 VanDerWaalsContact O-CG 3.25Å; W172-K176 WeakPolarHBondContact O-CG 3.28Å; W172-K176 PolarHBondContact O-N 3.43Å |
| 173 | V | 95.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -55.4 | -47.4 | 172.1 | 170.4 | 0 | 0 | 0 | 0 | 110.2 | L80 Y169 Q170 Q177 Y242 I245 | L80-V173 HydrophobicContact CD1-CG2 3.9Å; Y169-V173 HydrophobicContact CD2-CG2 4.04Å; Y169-V173 HydrophobicContact CE1-CG2 4.19Å; Y169-V173 HydrophobicContact CE2-CG2 3.57Å; Y169-V173 WeakPolarHBondContact O-CG2 3.45Å; Y169-V173 PolarHBondContact O-N 3.07Å; Q170-V173 PolarHBondContact O-N 2.84Å; V173-Q177 WeakPolarHBondContact O-CG 3.47Å; V173-Q177 PolarHBondContact O-N 3.44Å; V173-Y242 HydrophobicContact CG1-CD1 3.78Å; V173-Y242 HydrophobicContact CG1-CD2 4.19Å; V173-Y242 HydrophobicContact CG1-CE1 3.86Å; V173-Y242 HydrophobicContact CG1-CE2 4.28Å; V173-Y242 HydrophobicContact CG1-CG 3.93Å; V173-Y242 HydrophobicContact CG2-CE1 4.1Å; V173-Y242 HydrophobicContact CG2-CE2 4.15Å; V173-I245 HydrophobicContact CB-CD1 4.45Å; V173-I245 HydrophobicContact CB-CG2 4.33Å; V173-I245 HydrophobicContact CG1-CB 4.19Å; V173-I245 HydrophobicContact CG1-CD1 4.09Å; V173-I245 HydrophobicContact CG1-CG2 3.95Å |
| 174 | G | 93.3 | Very high | 93.9 | Very high | 16 Ų | 16 | 38.6 Ų | 38.6 | 17% | 0.165 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -71.5 | -45.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q170 V171 W172 H178 | Q170-G174 PolarHBondContact O-N 3.12Å; V171-G174 PolarHBondContact O-N 2.87Å; W172-G174 VanDerWaalsContact C-N 3.28Å; W172-G174 PolarHBondContact O-N 3.23Å; G174-H178 PolarHBondContact O-N 3.49Å |
| 175 | A | 93 | Very high | 93.7 | Very high | 21 Ų | 21 | 36.8 Ų | 36.8 | 17% | 0.174 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.8 | -40.7 | -177 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y122 V171 W172 H178 E179 | Y122-A175 HydrophobicContact CE1-CB 3.68Å; V171-A175 VanDerWaalsContact O-CB 3.25Å; V171-A175 WeakPolarHBondContact O-CB 3.5Å; V171-A175 PolarHBondContact O-N 3.47Å; W172-A175 PolarHBondContact O-N 3.16Å; A175-H178 PolarHBondContact O-N 2.69Å; A175-E179 WeakPolarHBondContact O-CB 3.45Å; A175-E179 PolarHBondContact O-N 2.83Å |
| 176 | K | 93.4 | Very high | 93.6 | Very high | 32 Ų | 32 | 36.8 Ų | 36.8 | 14% | 0.139 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -71.1 | -33.4 | -179.3 | -68.8 | -64.7 | -180 | -165.8 | 0 | 113 | K76 W172 H178 E179 L180 L187 | K76-K176 WeakPolarHBondContact O-CE 2.98Å; W172-K176 WeakPolarHBondContact O-CB 3.3Å; W172-K176 VanDerWaalsContact O-CG 3.25Å; W172-K176 WeakPolarHBondContact O-CG 3.28Å; W172-K176 PolarHBondContact O-N 3.43Å; K176-H178 VanDerWaalsContact C-N 3.27Å; K176-H178 PolarHBondContact O-N 2.94Å; K176-E179 WeakPolarHBondContact CD-OE2 3.43Å; K176-E179 IonicContact NZ-OE1 3.77Å; K176-E179 PolarHBondContact NZ-OE1 2.87Å; K176-E179 IonicContact NZ-OE2 3.49Å; K176-E179 PolarHBondContact NZ-OE2 3.38Å; K176-L180 HydrophobicContact CB-CD1 4.31Å; K176-L180 HydrophobicContact CD-CD1 4.26Å; K176-L180 VanDerWaalsContact O-CB 3.26Å; K176-L180 WeakPolarHBondContact O-CB 3.44Å; K176-L180 WeakPolarHBondContact O-CG 3.34Å; K176-L180 PolarHBondContact O-N 2.97Å; K176-L187 HydrophobicContact CB-CD1 4.12Å; K176-L187 HydrophobicContact CB-CD2 4.13Å |
| 177 | Q | 94.2 | Very high | 93.6 | Very high | 15 Ų | 15 | 36.3 Ų | 36.3 | 7% | 0.07 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.8 | -42.7 | 171.3 | -72.3 | -176.7 | 48.4 | 0 | 0 | 111 | V173 Q181 V182 S184 L187 Y242 G246 | V173-Q177 WeakPolarHBondContact O-CG 3.47Å; V173-Q177 PolarHBondContact O-N 3.44Å; Q177-Q181 WeakPolarHBondContact O-CA 3.5Å; Q177-Q181 PolarHBondContact O-N 2.95Å; Q177-V182 PolarHBondContact O-N 2.89Å; Q177-S184 PolarHBondContact OE1-OG 3.31Å; Q177-L187 HydrophobicContact CG-CB 4.27Å; Q177-L187 HydrophobicContact CG-CD2 3.54Å; Q177-Y242 PolarHBondContact NE2-O 2.9Å; Q177-G246 VanDerWaalsContact OE1-CA 3.3Å |
| 178 | H | 90.9 | Very high | 93.5 | Very high | 144 Ų | 144 | 36.3 Ų | 36.3 | 67% | 0.667 | 18% | 0.181 | S | C | * | . | H | α-helix | trans | -76 | -45.6 | 177.8 | -171.1 | -85.3 | 0 | 0 | 0 | 113.5 | G174 A175 K176 L180 Q181 | G174-H178 PolarHBondContact O-N 3.49Å; A175-H178 PolarHBondContact O-N 2.69Å; K176-H178 VanDerWaalsContact C-N 3.27Å; K176-H178 PolarHBondContact O-N 2.94Å; H178-L180 PolarHBondContact O-N 3.4Å; H178-Q181 PolarHBondContact O-N 3.14Å; H178-Q181 PolarHBondContact O-NE2 3.42Å |
| 179 | E | 91.2 | Very high | 93.4 | Very high | 90 Ų | 90 | 35.1 Ų | 35.1 | 42% | 0.421 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -61.4 | -43.9 | -179.5 | -174.5 | -162.2 | 142.9 | 0 | 0 | 111.6 | K76 A175 K176 Q181 | K76-E179 IonicContact NZ-OE1 2.84Å; K76-E179 PolarHBondContact NZ-OE1 2.87Å; A175-E179 WeakPolarHBondContact O-CB 3.45Å; A175-E179 PolarHBondContact O-N 2.83Å; K176-E179 WeakPolarHBondContact CD-OE2 3.43Å; K176-E179 IonicContact NZ-OE1 3.77Å; K176-E179 PolarHBondContact NZ-OE1 2.87Å; K176-E179 IonicContact NZ-OE2 3.49Å; K176-E179 PolarHBondContact NZ-OE2 3.38Å; E179-Q181 VanDerWaalsContact C-N 3.34Å |
| 180 | L | 90.7 | Very high | 93.2 | Very high | 18 Ų | 18 | 37.8 Ų | 37.8 | 9% | 0.094 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.3 | -5.1 | -176.2 | -56.8 | 174.9 | 0 | 0 | 0 | 112.5 | K70 L72 K76 L77 K176 H178 V182 | K70-L180 PolarHBondContact NZ-O 2.83Å; L72-L180 HydrophobicContact CD1-CD1 4.27Å; L72-L180 HydrophobicContact CD2-CB 4.01Å; L72-L180 HydrophobicContact CD2-CD1 4.12Å; L72-L180 HydrophobicContact CD2-CG 4.47Å; K76-L180 HydrophobicContact CD-CD2 3.81Å; L77-L180 HydrophobicContact CD2-CD1 4.21Å; K176-L180 HydrophobicContact CB-CD1 4.31Å; K176-L180 HydrophobicContact CD-CD1 4.26Å; K176-L180 VanDerWaalsContact O-CB 3.26Å; K176-L180 WeakPolarHBondContact O-CB 3.44Å; K176-L180 WeakPolarHBondContact O-CG 3.34Å; K176-L180 PolarHBondContact O-N 2.97Å; H178-L180 PolarHBondContact O-N 3.4Å; L180-V182 HydrophobicContact CB-CG1 4.16Å; L180-V182 HydrophobicContact CB-CG2 4.02Å |
| 181 | Q | 91 | Very high | 93.1 | Very high | 126 Ų | 126 | 36.9 Ų | 36.9 | 59% | 0.589 | 18% | 0.179 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 51.2 | 57.2 | -175.6 | -62.6 | -71.7 | -46.5 | 0 | 0 | 110.2 | K70 Q177 H178 E179 | K70-Q181 PolarHBondContact NZ-O 3.45Å; K70-Q181 VanDerWaalsContact NZ-O 3.14Å; Q177-Q181 WeakPolarHBondContact O-CA 3.5Å; Q177-Q181 PolarHBondContact O-N 2.95Å; H178-Q181 PolarHBondContact O-N 3.14Å; H178-Q181 PolarHBondContact O-NE2 3.42Å; E179-Q181 VanDerWaalsContact C-N 3.34Å |
| 182 | V | 92.3 | Very high | 93 | Very high | 13 Ų | 13 | 36.8 Ų | 36.8 | 8% | 0.079 | 18% | 0.178 | C | C | . | . | trans | -127.6 | 150.9 | -179.5 | -67.3 | 0 | 0 | 0 | 0 | 111.3 | K70 L72 Q177 L180 Q186 L187 | K70-V182 HydrophobicContact CB-CG1 4.15Å; K70-V182 HydrophobicContact CD-CG1 3.73Å; L72-V182 HydrophobicContact CD1-CG1 4.15Å; L72-V182 HydrophobicContact CD2-CG1 3.73Å; L72-V182 HydrophobicContact CG-CG1 4.41Å; Q177-V182 PolarHBondContact O-N 2.89Å; L180-V182 HydrophobicContact CB-CG1 4.16Å; L180-V182 HydrophobicContact CB-CG2 4.02Å; V182-Q186 VanDerWaalsContact CA-OE1 3.23Å; V182-Q186 HydrophobicContact CB-CB 4.02Å; V182-Q186 VanDerWaalsContact CB-OE1 3.31Å; V182-Q186 HydrophobicContact CG1-CB 4.39Å; V182-L187 HydrophobicContact CG2-CB 4.08Å; V182-L187 HydrophobicContact CG2-CD1 4.46Å | ||
| 183 | N | 91.6 | Very high | 93 | Very high | 65 Ų | 65 | 36.6 Ų | 36.6 | 35% | 0.348 | 18% | 0.183 | S | C | . | . | trans | -79.2 | 171 | 171.9 | 74 | 35.3 | 0 | 0 | 0 | 111.5 | M185 Q186 L187 | N183-M185 VanDerWaalsContact C-N 3.33Å; N183-M185 PolarHBondContact O-N 3.05Å; N183-M185 WeakPolarHBondContact OD1-CB 3.36Å; N183-M185 PolarHBondContact OD1-N 3.45Å; N183-Q186 PolarHBondContact O-N 2.9Å; N183-Q186 WeakPolarHBondContact OD1-CB 3.19Å; N183-Q186 VanDerWaalsContact OD1-CG 3.32Å; N183-Q186 WeakPolarHBondContact OD1-CG 3.43Å; N183-Q186 PolarHBondContact OD1-N 2.94Å; N183-L187 PolarHBondContact O-N 2.7Å; N183-L187 VanDerWaalsContact O-N 3.11Å | ||
| 184 | S | 92.4 | Very high | 92.9 | Very high | 8 Ų | 8 | 38.7 Ų | 38.7 | 6% | 0.056 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.7 | -36.8 | -177.7 | -50 | 0 | 0 | 0 | 0 | 113.6 | Q177 L188 Y242 W243 | Q177-S184 PolarHBondContact OE1-OG 3.31Å; S184-L188 VanDerWaalsContact O-CB 3.27Å; S184-L188 WeakPolarHBondContact O-CB 3.45Å; S184-L188 PolarHBondContact O-N 2.86Å; S184-L188 VanDerWaalsContact O-N 3.12Å; S184-Y242 PolarHBondContact OG-O 2.8Å; S184-W243 VanDerWaalsContact OG-CA 3.25Å; S184-W243 WeakPolarHBondContact OG-CA 3.34Å; S184-W243 PolarHBondContact OG-N 3.26Å |
| 185 | M | 93.1 | Very high | 92.9 | Very high | 51 Ų | 51 | 37.9 Ų | 37.9 | 25% | 0.251 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -68.2 | -46.1 | 178.3 | -65.2 | 179.8 | -143.6 | 0 | 0 | 111.3 | L58 I66 F67 N183 L187 L188 Y189 L239 | L58-M185 HydrophobicContact CD2-CB 3.99Å; L58-M185 HydrophobicContact CD2-CG 4.15Å; I66-M185 HydrophobicContact CG2-CE 4.32Å; I66-M185 HydrophobicContact CG2-SD 4.12Å; F67-M185 HydrophobicContact CB-SD 4.21Å; F67-M185 HydrophobicContact CD1-CB 3.97Å; F67-M185 HydrophobicContact CD1-CG 4.48Å; F67-M185 HydrophobicContact CD1-SD 3.75Å; F67-M185 HydrophobicContact CD2-CB 4.35Å; F67-M185 HydrophobicContact CE1-CB 4.19Å; F67-M185 HydrophobicContact CG-CB 4.05Å; F67-M185 HydrophobicContact CG-SD 4.2Å; F67-M185 HydrophobicContact CZ-CB 4.49Å; N183-M185 VanDerWaalsContact C-N 3.33Å; N183-M185 PolarHBondContact O-N 3.05Å; N183-M185 WeakPolarHBondContact OD1-CB 3.36Å; N183-M185 PolarHBondContact OD1-N 3.45Å; M185-L187 PolarHBondContact O-N 2.79Å; M185-L188 PolarHBondContact O-N 3.28Å; M185-Y189 VanDerWaalsContact O-CB 3.23Å; M185-Y189 WeakPolarHBondContact O-CB 3.2Å; M185-Y189 PolarHBondContact O-N 3.02Å; M185-L239 HydrophobicContact CB-CD1 4.42Å; M185-L239 HydrophobicContact CG-CD1 3.47Å; M185-L239 VanDerWaalsContact CG-CD1 3.47Å |
| 186 | Q | 93.4 | Very high | 92.9 | Very high | 25 Ų | 25 | 37.6 Ų | 37.6 | 12% | 0.117 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.6 | -46.1 | 178.9 | -72.2 | 168.1 | -28.9 | 0 | 0 | 111.1 | F67 A68 V182 N183 Y189 Y190 | F67-Q186 HydrophobicContact CD2-CG 3.77Å; F67-Q186 HydrophobicContact CE2-CG 4.23Å; A68-Q186 PolarHBondContact O-NE2 3.22Å; V182-Q186 VanDerWaalsContact CA-OE1 3.23Å; V182-Q186 HydrophobicContact CB-CB 4.02Å; V182-Q186 VanDerWaalsContact CB-OE1 3.31Å; V182-Q186 HydrophobicContact CG1-CB 4.39Å; N183-Q186 PolarHBondContact O-N 2.9Å; N183-Q186 WeakPolarHBondContact OD1-CB 3.19Å; N183-Q186 VanDerWaalsContact OD1-CG 3.32Å; N183-Q186 WeakPolarHBondContact OD1-CG 3.43Å; N183-Q186 PolarHBondContact OD1-N 2.94Å; Q186-Y189 PolarHBondContact O-N 3.44Å; Q186-Y190 VanDerWaalsContact O-CD2 3.3Å; Q186-Y190 WeakPolarHBondContact O-CD2 3.46Å |
| 187 | L | 93.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.3 | -46.7 | 179.2 | -174 | 65.1 | 0 | 0 | 0 | 111.5 | L77 L80 K176 Q177 V182 N183 M185 Y189 Y190 Q191 Y242 | L77-L187 HydrophobicContact CD2-CD1 3.45Å; L77-L187 VanDerWaalsContact CD2-CD1 3.45Å; L80-L187 HydrophobicContact CD2-CD1 4.11Å; L80-L187 HydrophobicContact CD2-CD2 4.14Å; L80-L187 HydrophobicContact CD2-CG 4.22Å; K176-L187 HydrophobicContact CB-CD1 4.12Å; K176-L187 HydrophobicContact CB-CD2 4.13Å; Q177-L187 HydrophobicContact CG-CB 4.27Å; Q177-L187 HydrophobicContact CG-CD2 3.54Å; V182-L187 HydrophobicContact CG2-CB 4.08Å; V182-L187 HydrophobicContact CG2-CD1 4.46Å; N183-L187 PolarHBondContact O-N 2.7Å; N183-L187 VanDerWaalsContact O-N 3.11Å; M185-L187 PolarHBondContact O-N 2.79Å; L187-Y189 VanDerWaalsContact C-N 3.3Å; L187-Y189 PolarHBondContact O-N 2.95Å; L187-Y190 PolarHBondContact O-N 3.49Å; L187-Q191 WeakPolarHBondContact O-CB 3.45Å; L187-Q191 PolarHBondContact O-N 3.42Å; L187-Q191 VanDerWaalsContact O-N 3.07Å; L187-Y242 HydrophobicContact CB-CD1 4.4Å; L187-Y242 HydrophobicContact CB-CE1 4.44Å; L187-Y242 HydrophobicContact CD2-CD1 4.12Å; L187-Y242 HydrophobicContact CD2-CE1 3.85Å; L187-Y242 HydrophobicContact CG-CD1 4.4Å; L187-Y242 HydrophobicContact CG-CE1 4.01Å |
| 188 | L | 94.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.7 | -33.8 | -179.6 | -173.4 | 59 | 0 | 0 | 0 | 111.8 | F51 T54 L58 S184 M185 Y190 Q191 A192 N238 L239 Y242 | F51-L188 HydrophobicContact CE1-CD1 4.47Å; T54-L188 HydrophobicContact CG2-CD1 4.2Å; T54-L188 HydrophobicContact CG2-CD2 3.71Å; T54-L188 HydrophobicContact CG2-CG 3.89Å; L58-L188 HydrophobicContact CD1-CB 3.81Å; L58-L188 HydrophobicContact CD1-CD2 3.98Å; L58-L188 HydrophobicContact CD1-CG 3.65Å; S184-L188 VanDerWaalsContact O-CB 3.27Å; S184-L188 WeakPolarHBondContact O-CB 3.45Å; S184-L188 PolarHBondContact O-N 2.86Å; S184-L188 VanDerWaalsContact O-N 3.12Å; M185-L188 PolarHBondContact O-N 3.28Å; L188-Y190 VanDerWaalsContact C-N 3.31Å; L188-Y190 PolarHBondContact O-N 3.03Å; L188-Q191 VanDerWaalsContact CD1-OE1 3.28Å; L188-Q191 PolarHBondContact O-N 2.88Å; L188-A192 HydrophobicContact CD1-CB 4.36Å; L188-A192 WeakPolarHBondContact O-CB 3.3Å; L188-A192 PolarHBondContact O-N 2.75Å; L188-N238 HydrophobicContact CD1-CB 4.49Å; L188-N238 HydrophobicContact CD2-CB 3.92Å; L188-L239 HydrophobicContact CD2-CB 4.44Å; L188-Y242 HydrophobicContact CB-CD1 4.05Å; L188-Y242 HydrophobicContact CB-CE1 4.21Å; L188-Y242 HydrophobicContact CB-CG 4.42Å; L188-Y242 HydrophobicContact CD1-CD2 4.21Å; L188-Y242 HydrophobicContact CD1-CE1 4.2Å; L188-Y242 HydrophobicContact CD1-CE2 3.84Å |
| 189 | Y | 94.3 | Very high | 92.9 | Very high | 32 Ų | 32 | 33.3 Ų | 33.3 | 13% | 0.125 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.9 | -39.1 | 179.2 | 175.9 | -98.1 | 0 | 0 | 0 | 112.5 | W55 L58 Y59 Q62 F67 M185 Q186 L187 P193 | W55-Y189 AromaticContact NE1-CE2 3.96Å; L58-Y189 HydrophobicContact CB-CD2 3.8Å; Y59-Y189 HydrophobicContact CD2-CE2 4.42Å; Q62-Y189 PolarHBondContact OE1-OH 3.17Å; F67-Y189 HydrophobicContact CZ-CD2 4.14Å; F67-Y189 HydrophobicContact CZ-CG 4.24Å; M185-Y189 VanDerWaalsContact O-CB 3.23Å; M185-Y189 WeakPolarHBondContact O-CB 3.2Å; M185-Y189 PolarHBondContact O-N 3.02Å; Q186-Y189 PolarHBondContact O-N 3.44Å; L187-Y189 VanDerWaalsContact C-N 3.3Å; L187-Y189 PolarHBondContact O-N 2.95Å; Y189-P193 WeakPolarHBondContact O-CD 3.35Å; Y189-P193 WeakPolarHBondContact O-CG 3.31Å |
| 190 | Y | 92.8 | Very high | 92.9 | Very high | 70 Ų | 70 | 33.4 Ų | 33.4 | 28% | 0.275 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -87 | -32.9 | 177.2 | -70.3 | -78.2 | 0 | 0 | 0 | 113.4 | K70 L72 L77 Q186 L187 L188 | K70-Y190 WeakPolarHBondContact O-CE2 3.24Å; K70-Y190 PolarHBondContact O-OH 3.47Å; L72-Y190 HydrophobicContact CB-CD2 4.37Å; L72-Y190 HydrophobicContact CB-CE2 4.49Å; L72-Y190 HydrophobicContact CD1-CD2 3.72Å; L72-Y190 HydrophobicContact CD1-CE2 4.19Å; L72-Y190 HydrophobicContact CD1-CG 4.49Å; L72-Y190 HydrophobicContact CG-CD2 4.15Å; L72-Y190 HydrophobicContact CG-CE2 4.18Å; L77-Y190 HydrophobicContact CD1-CG 4.08Å; Q186-Y190 VanDerWaalsContact O-CD2 3.3Å; Q186-Y190 WeakPolarHBondContact O-CD2 3.46Å; L187-Y190 PolarHBondContact O-N 3.49Å; L188-Y190 VanDerWaalsContact C-N 3.31Å; L188-Y190 PolarHBondContact O-N 3.03Å |
| 191 | Q | 93.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -73.7 | -39.3 | -179.7 | 175.9 | -89.5 | -27.3 | 0 | 0 | 112.3 | L80 L187 L188 M194 S195 Y242 | L80-Q191 HydrophobicContact CD2-CB 4.35Å; L80-Q191 HydrophobicContact CD2-CG 4.11Å; L80-Q191 HydrophobicContact CG-CG 4.15Å; L187-Q191 WeakPolarHBondContact O-CB 3.45Å; L187-Q191 PolarHBondContact O-N 3.42Å; L187-Q191 VanDerWaalsContact O-N 3.07Å; L188-Q191 VanDerWaalsContact CD1-OE1 3.28Å; L188-Q191 PolarHBondContact O-N 2.88Å; Q191-M194 PolarHBondContact O-N 2.76Å; Q191-S195 PolarHBondContact NE2-OG 2.96Å; Q191-S195 WeakPolarHBondContact O-CB 3.4Å; Q191-S195 PolarHBondContact O-N 3.33Å; Q191-S195 PolarHBondContact O-OG 3.37Å; Q191-Y242 VanDerWaalsContact CD-OH 3.31Å; Q191-Y242 PolarHBondContact OE1-OH 3.48Å |
| 192 | A | 93.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.1 | -49.8 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | F51 T54 W55 L188 M194 S195 S196 | F51-A192 HydrophobicContact CD1-CB 3.95Å; T54-A192 HydrophobicContact CG2-CB 4.31Å; W55-A192 HydrophobicContact CB-CB 4.12Å; L188-A192 HydrophobicContact CD1-CB 4.36Å; L188-A192 WeakPolarHBondContact O-CB 3.3Å; L188-A192 PolarHBondContact O-N 2.75Å; A192-M194 VanDerWaalsContact C-N 3.32Å; A192-M194 PolarHBondContact O-N 2.67Å; A192-S195 PolarHBondContact O-N 2.86Å; A192-S196 PolarHBondContact O-N 3.43Å; A192-S196 PolarHBondContact O-OG 3.43Å |
| 193 | P | 93.7 | Very high | 92.6 | Very high | 42 Ų | 42 | 31.5 Ų | 31.5 | 27% | 0.273 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -69.1 | -30.6 | 179.4 | 27.4 | -35 | 0 | 0 | 0 | 112.6 | W55 Y189 S196 A197 | W55-P193 HydrophobicContact CD2-CB 4.41Å; W55-P193 HydrophobicContact CG-CB 4.04Å; W55-P193 HydrophobicContact CG-CG 4.13Å; Y189-P193 WeakPolarHBondContact O-CD 3.35Å; Y189-P193 WeakPolarHBondContact O-CG 3.31Å; P193-S196 WeakPolarHBondContact CA-OG 3.34Å; P193-S196 PolarHBondContact O-OG 3.14Å; P193-A197 WeakPolarHBondContact O-CB 3.46Å; P193-A197 PolarHBondContact O-N 3.32Å |
| 194 | M | 93.8 | Very high | 92.4 | Very high | 44 Ų | 44 | 31.7 Ų | 31.7 | 22% | 0.217 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -69.7 | -41 | 176.2 | -171.9 | 177.2 | -79 | 0 | 0 | 111.2 | P74 L77 L78 A81 Q191 A192 A197 M198 | P74-M194 HydrophobicContact CB-CE 4.08Å; L77-M194 HydrophobicContact CB-SD 4.48Å; L78-M194 WeakPolarHBondContact CA-SD 3.31Å; L78-M194 HydrophobicContact CB-SD 4.15Å; L78-M194 HydrophobicContact CD1-CE 4.47Å; L78-M194 HydrophobicContact CD1-CG 4.48Å; L78-M194 HydrophobicContact CD1-SD 3.86Å; A81-M194 HydrophobicContact CB-CB 3.9Å; A81-M194 HydrophobicContact CB-CG 3.55Å; A81-M194 HydrophobicContact CB-SD 3.65Å; Q191-M194 PolarHBondContact O-N 2.76Å; A192-M194 VanDerWaalsContact C-N 3.32Å; A192-M194 PolarHBondContact O-N 2.67Å; M194-A197 PolarHBondContact O-N 3.24Å; M194-M198 WeakPolarHBondContact O-CG 3.45Å; M194-M198 PolarHBondContact O-N 2.9Å |
| 195 | S | 93.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -69.1 | -38.2 | 175.8 | -79.8 | 0 | 0 | 0 | 0 | 113.3 | A81 F84 Q191 A192 A197 M198 L199 | A81-S195 VanDerWaalsContact CA-OG 3.28Å; A81-S195 WeakPolarHBondContact CA-OG 3.46Å; A81-S195 WeakPolarHBondContact CB-OG 3.26Å; A81-S195 PolarHBondContact O-OG 3.18Å; F84-S195 VanDerWaalsContact CD1-CB 3.41Å; F84-S195 VanDerWaalsContact CD1-OG 3.28Å; F84-S195 WeakPolarHBondContact CD1-OG 3.37Å; Q191-S195 PolarHBondContact NE2-OG 2.96Å; Q191-S195 WeakPolarHBondContact O-CB 3.4Å; Q191-S195 PolarHBondContact O-N 3.33Å; Q191-S195 PolarHBondContact O-OG 3.37Å; A192-S195 PolarHBondContact O-N 2.86Å; S195-A197 VanDerWaalsContact C-N 3.35Å; S195-M198 PolarHBondContact O-N 3.15Å; S195-L199 WeakPolarHBondContact O-CB 3.26Å; S195-L199 WeakPolarHBondContact O-CG 3.43Å; S195-L199 PolarHBondContact O-N 3.41Å |
| 196 | S | 93.3 | Very high | 91.8 | Very high | 15 Ų | 15 | 40.8 Ų | 40.8 | 11% | 0.105 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.7 | -38.4 | 173.6 | 62 | 0 | 0 | 0 | 0 | 111.8 | A192 P193 L199 L200 | A192-S196 PolarHBondContact O-N 3.43Å; A192-S196 PolarHBondContact O-OG 3.43Å; P193-S196 WeakPolarHBondContact CA-OG 3.34Å; P193-S196 PolarHBondContact O-OG 3.14Å; S196-L199 PolarHBondContact O-N 2.94Å; S196-L200 WeakPolarHBondContact O-CB 3.19Å; S196-L200 PolarHBondContact O-N 2.97Å |
| 197 | A | 93.7 | Very high | 91.4 | Very high | 55 Ų | 55 | 40.9 Ų | 40.9 | 46% | 0.455 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.1 | -42.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | P193 M194 S195 L200 V201 | P193-A197 WeakPolarHBondContact O-CB 3.46Å; P193-A197 PolarHBondContact O-N 3.32Å; M194-A197 PolarHBondContact O-N 3.24Å; S195-A197 VanDerWaalsContact C-N 3.35Å; A197-L200 WeakPolarHBondContact O-CB 3.04Å; A197-L200 PolarHBondContact O-N 2.9Å; A197-V201 PolarHBondContact O-N 2.77Å |
| 198 | M | 93 | Very high | 90.9 | Very high | 45 Ų | 45 | 44.3 Ų | 44.3 | 22% | 0.222 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65.3 | -42 | 174.8 | -74.3 | 178.6 | 155 | 0 | 0 | 112.3 | L78 A81 L82 C85 M194 S195 L200 V201 A202 | L78-M198 HydrophobicContact CD1-CE 3.47Å; L78-M198 VanDerWaalsContact CD1-CE 3.47Å; L78-M198 HydrophobicContact CG-CE 4.19Å; A81-M198 HydrophobicContact CB-SD 3.95Å; L82-M198 HydrophobicContact CB-CE 4.11Å; L82-M198 HydrophobicContact CB-SD 4.22Å; L82-M198 HydrophobicContact CD1-CE 4.23Å; L82-M198 HydrophobicContact CD1-SD 4.44Å; C85-M198 HydrophobicContact CB-CB 4.19Å; M194-M198 WeakPolarHBondContact O-CG 3.45Å; M194-M198 PolarHBondContact O-N 2.9Å; S195-M198 PolarHBondContact O-N 3.15Å; M198-L200 VanDerWaalsContact C-N 3.31Å; M198-L200 PolarHBondContact O-N 3.47Å; M198-V201 PolarHBondContact O-N 2.9Å; M198-A202 PolarHBondContact O-N 3.34Å |
| 199 | L | 90.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64.8 | -35.5 | 175.4 | -78.2 | 175.9 | 0 | 0 | 0 | 112 | T47 L48 F84 V88 S195 S196 V201 A202 V203 | T47-L199 HydrophobicContact CG2-CD1 4.06Å; L48-L199 HydrophobicContact CB-CB 4.39Å; L48-L199 HydrophobicContact CD1-CB 4.42Å; L48-L199 HydrophobicContact CG-CB 4.5Å; F84-L199 HydrophobicContact CE1-CD1 3.83Å; V88-L199 HydrophobicContact CB-CD2 4.12Å; V88-L199 HydrophobicContact CG1-CD2 3.92Å; S195-L199 WeakPolarHBondContact O-CB 3.26Å; S195-L199 WeakPolarHBondContact O-CG 3.43Å; S195-L199 PolarHBondContact O-N 3.41Å; S196-L199 PolarHBondContact O-N 2.94Å; L199-V201 PolarHBondContact O-N 3.01Å; L199-A202 PolarHBondContact O-N 2.81Å; L199-V203 WeakPolarHBondContact O-CB 3.32Å; L199-V203 VanDerWaalsContact O-CG2 3.23Å; L199-V203 WeakPolarHBondContact O-CG2 3.48Å; L199-V203 PolarHBondContact O-N 3.32Å |
| 200 | L | 91.6 | Very high | 89.7 | Confident | 92 Ų | 92 | 52 Ų | 52 | 48% | 0.482 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -59.4 | -34.5 | 175.9 | -174.7 | 63.9 | 0 | 0 | 0 | 111.8 | L48 S196 A197 M198 P204 | L48-L200 VanDerWaalsContact CD1-CA 3.48Å; L48-L200 HydrophobicContact CD1-CB 3.81Å; L48-L200 HydrophobicContact CD1-CD1 3.79Å; L48-L200 HydrophobicContact CD1-CG 4.42Å; S196-L200 WeakPolarHBondContact O-CB 3.19Å; S196-L200 PolarHBondContact O-N 2.97Å; A197-L200 WeakPolarHBondContact O-CB 3.04Å; A197-L200 PolarHBondContact O-N 2.9Å; M198-L200 VanDerWaalsContact C-N 3.31Å; M198-L200 PolarHBondContact O-N 3.47Å; L200-P204 WeakPolarHBondContact O-CD 3.38Å |
| 201 | V | 91 | Very high | 88.8 | Confident | 100 Ų | 100 | 50.6 Ų | 50.6 | 61% | 0.606 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -75.3 | -35.7 | 173.4 | 179.5 | 0 | 0 | 0 | 0 | 111.4 | A197 M198 L199 P204 F205 | A197-V201 PolarHBondContact O-N 2.77Å; M198-V201 PolarHBondContact O-N 2.9Å; L199-V201 PolarHBondContact O-N 3.01Å; V201-P204 WeakPolarHBondContact O-CD 3.5Å; V201-F205 HydrophobicContact CG1-CE2 4.45Å; V201-F205 WeakPolarHBondContact O-CD2 3.42Å; V201-F205 WeakPolarHBondContact O-CE2 3.48Å |
| 202 | A | 88.8 | Confident | 87.6 | Confident | 15 Ų | 15 | 59.3 Ų | 59.3 | 12% | 0.124 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -75.8 | -38.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | V89 M198 L199 F205 F206 | V89-A202 HydrophobicContact CG2-CB 4.38Å; M198-A202 PolarHBondContact O-N 3.34Å; L199-A202 PolarHBondContact O-N 2.81Å; A202-F205 WeakPolarHBondContact O-CB 3.48Å; A202-F205 PolarHBondContact O-N 3.36Å; A202-F206 VanDerWaalsContact O-CD2 3.3Å; A202-F206 WeakPolarHBondContact O-CD2 3.39Å |
| 203 | V | 88.7 | Confident | 86.6 | Confident | 3 Ų | 3 | 60.4 Ų | 60.4 | 2% | 0.018 | 34% | 0.336 | C | S | . | . | G | 310 helix | trans | -51.9 | -47.1 | -174.7 | 162.2 | 0 | 0 | 0 | 0 | 113.1 | M44 S45 L48 L199 F205 F206 E207 | M44-V203 HydrophobicContact CB-CG2 4.11Å; S45-V203 WeakPolarHBondContact OG-CG1 3.43Å; L48-V203 HydrophobicContact CD1-CG2 4.2Å; L199-V203 WeakPolarHBondContact O-CB 3.32Å; L199-V203 VanDerWaalsContact O-CG2 3.23Å; L199-V203 WeakPolarHBondContact O-CG2 3.48Å; L199-V203 PolarHBondContact O-N 3.32Å; V203-F205 PolarHBondContact O-N 3.16Å; V203-F206 PolarHBondContact O-N 3.01Å; V203-E207 HydrophobicContact CG1-CB 4.32Å; V203-E207 PolarHBondContact O-N 3.41Å |
| 204 | P | 87.5 | Confident | 86 | Confident | 68 Ų | 68 | 58.4 Ų | 58.4 | 44% | 0.442 | 32% | 0.323 | S | S | . | . | G | 310 helix | trans | -57.3 | -21.6 | 178.9 | -26.4 | 33.9 | 0 | 0 | 0 | 115.6 | L200 V201 V209 | L200-P204 WeakPolarHBondContact O-CD 3.38Å; V201-P204 WeakPolarHBondContact O-CD 3.5Å; P204-V209 HydrophobicContact CB-CG2 3.61Å; P204-V209 HydrophobicContact CG-CG2 3.71Å |
| 205 | F | 87.6 | Confident | 85.4 | Confident | 162 Ų | 162 | 57.5 Ų | 57.5 | 71% | 0.711 | 32% | 0.319 | S | S | * | . | G | 310 helix | trans | -83.1 | -17.7 | 178.5 | -62.5 | -79.2 | 0 | 0 | 0 | 113.3 | V201 A202 V203 | V201-F205 HydrophobicContact CG1-CE2 4.45Å; V201-F205 WeakPolarHBondContact O-CD2 3.42Å; V201-F205 WeakPolarHBondContact O-CE2 3.48Å; A202-F205 WeakPolarHBondContact O-CB 3.48Å; A202-F205 PolarHBondContact O-N 3.36Å; V203-F205 PolarHBondContact O-N 3.16Å |
| 206 | F | 84.3 | Confident | 84.9 | Confident | 88 Ų | 88 | 63.9 Ų | 63.9 | 39% | 0.386 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -121.2 | -24.1 | -174 | -62 | -74.1 | 0 | 0 | 0 | 113.6 | M44 V89 L93 A202 V203 | M44-F206 HydrophobicContact CE-CB 3.71Å; M44-F206 HydrophobicContact CE-CD1 4.12Å; M44-F206 HydrophobicContact CE-CD2 4.09Å; M44-F206 HydrophobicContact CE-CG 3.7Å; M44-F206 HydrophobicContact SD-CB 3.76Å; M44-F206 HydrophobicContact SD-CD2 3.92Å; M44-F206 HydrophobicContact SD-CG 3.96Å; V89-F206 HydrophobicContact CG1-CE1 4.16Å; V89-F206 HydrophobicContact CG1-CE2 3.68Å; V89-F206 HydrophobicContact CG1-CZ 3.43Å; V89-F206 VanDerWaalsContact CG1-CZ 3.43Å; V89-F206 HydrophobicContact CG2-CE2 4Å; L93-F206 HydrophobicContact CD1-CE1 3.88Å; L93-F206 HydrophobicContact CD1-CZ 4.31Å; L93-F206 HydrophobicContact CD2-CD1 4.11Å; L93-F206 HydrophobicContact CD2-CE1 3.91Å; L93-F206 HydrophobicContact CG-CE1 4.2Å; A202-F206 VanDerWaalsContact O-CD2 3.3Å; A202-F206 WeakPolarHBondContact O-CD2 3.39Å; V203-F206 PolarHBondContact O-N 3.01Å |
| 207 | E | 85.8 | Confident | 84.3 | Confident | 27 Ų | 27 | 63.7 Ų | 63.7 | 13% | 0.126 | 35% | 0.347 | C | S | . | . | S | Bend | trans | -135 | 147.2 | -176.4 | -61.5 | -178.7 | 161.3 | 0 | 0 | 110.3 | P42 N43 M44 S45 V203 V209 | P42-E207 VanDerWaalsContact CB-CD 3.47Å; P42-E207 HydrophobicContact CB-CG 4.23Å; P42-E207 WeakPolarHBondContact CB-OE2 3.43Å; N43-E207 PolarHBondContact N-OE1 2.9Å; N43-E207 VanDerWaalsContact N-OE1 3.14Å; M44-E207 HydrophobicContact CB-CG 4.41Å; M44-E207 WeakPolarHBondContact CB-OE1 3.48Å; M44-E207 PolarHBondContact N-OE1 3.04Å; S45-E207 WeakPolarHBondContact CB-OE2 3.33Å; S45-E207 PolarHBondContact N-OE2 3.47Å; S45-E207 PolarHBondContact OG-OE2 3.32Å; V203-E207 HydrophobicContact CG1-CB 4.32Å; V203-E207 PolarHBondContact O-N 3.41Å; E207-V209 PolarHBondContact O-N 2.98Å |
| 208 | P | 82.6 | Confident | 83.8 | Confident | 72 Ų | 72 | 66.5 Ų | 66.5 | 47% | 0.468 | 36% | 0.361 | S | S | . | . | trans | -61.4 | 138.8 | 174.1 | 25.5 | -32.2 | 0 | 0 | 0 | 110.4 | G214 | P208-G214 WeakPolarHBondContact O-CA 3.33Š| ||
| 209 | V | 81.9 | Confident | 83.6 | Confident | 36 Ų | 36 | 66.6 Ų | 66.6 | 22% | 0.218 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -86.1 | -41 | 179.2 | 180 | 0 | 0 | 0 | 0 | 111.1 | P204 E207 I215 F216 | P204-V209 HydrophobicContact CB-CG2 3.61Å; P204-V209 HydrophobicContact CG-CG2 3.71Å; E207-V209 PolarHBondContact O-N 2.98Å; V209-I215 HydrophobicContact CG1-CG2 4.21Å; V209-I215 PolarHBondContact O-N 2.92Å; V209-F216 HydrophobicContact CG1-CD2 3.76Å; V209-F216 HydrophobicContact CG1-CE2 4.13Å; V209-F216 PolarHBondContact O-N 3.18Å |
| 210 | F | 81.9 | Confident | 83.5 | Confident | 158 Ų | 158 | 69.1 Ų | 69.1 | 69% | 0.693 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -120.7 | 155.7 | -178.9 | -56.4 | -76.3 | 0 | 0 | 0 | 110.1 | F216 | F210-F216 HydrophobicContact CD1-CB 3.9Å; F210-F216 HydrophobicContact CD1-CD2 4.4Å; F210-F216 HydrophobicContact CE1-CB 4.08Å; F210-F216 AromaticContact CE1-CD2 3.95Å; F210-F216 HydrophobicContact CE1-CD2 3.95Å; F210-F216 HydrophobicContact CE1-CG 4.28Å; F210-F216 HydrophobicContact CZ-CD2 4.45Å |
| 211 | G | 73.2 | Confident | 83.5 | Confident | 41 Ų | 41 | 70.7 Ų | 70.7 | 42% | 0.423 | 39% | 0.389 | S | S | . | . | S | Bend | trans | 94.3 | -173.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | G213 G214 G217 | G211-G213 PolarHBondContact O-N 3.06Å; G211-G214 PolarHBondContact O-N 3.24Å; G211-G217 WeakPolarHBondContact O-CA 3.35Å |
| 212 | E | 70.1 | Confident | 83.4 | Confident | 182 Ų | 182 | 69.2 Ų | 69.2 | 85% | 0.85 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | 130.5 | 178.3 | -69.2 | -169.5 | 163.5 | 0 | 0 | 110.9 | G214 | E212-G214 VanDerWaalsContact C-N 3.26Å; E212-G214 PolarHBondContact O-N 3.36Å |
| 213 | G | 72.2 | Confident | 83.4 | Confident | 23 Ų | 23 | 68.6 Ų | 68.6 | 24% | 0.237 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 78 | 2.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115 | P42 G211 | P42-G213 WeakPolarHBondContact CD-O 3.3Å; P42-G213 WeakPolarHBondContact CG-O 3.5Å; G211-G213 PolarHBondContact O-N 3.06Å |
| 214 | G | 79.9 | Confident | 83.6 | Confident | 0 Ų | 0 | 72.2 Ų | 72.2 | 0% | 0 | 40% | 0.397 | C | S | . | . | S | Bend | trans | -92 | 159.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | P208 G211 E212 F216 G217 W219 | P208-G214 WeakPolarHBondContact O-CA 3.33Å; G211-G214 PolarHBondContact O-N 3.24Å; E212-G214 VanDerWaalsContact C-N 3.26Å; E212-G214 PolarHBondContact O-N 3.36Å; G214-F216 PolarHBondContact O-N 3.25Å; G214-F216 VanDerWaalsContact O-N 3.16Å; G214-G217 PolarHBondContact O-N 2.98Å; G214-W219 VanDerWaalsContact O-CE2 3.32Å; G214-W219 WeakPolarHBondContact O-CZ2 3.37Å; G214-W219 PolarHBondContact O-NE1 2.82Å |
| 215 | I | 81.1 | Confident | 83.8 | Confident | 26 Ų | 26 | 74.6 Ų | 74.6 | 13% | 0.133 | 41% | 0.406 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.8 | -34.8 | -178.3 | -166.3 | 171.5 | 0 | 0 | 0 | 112.7 | L48 V209 W219 | L48-I215 HydrophobicContact CD1-CD1 4.27Å; L48-I215 HydrophobicContact CD2-CD1 4.31Å; V209-I215 HydrophobicContact CG1-CG2 4.21Å; V209-I215 PolarHBondContact O-N 2.92Å; I215-W219 PolarHBondContact O-NE1 2.94Å |
| 216 | F | 83.1 | Confident | 84 | Confident | 134 Ų | 134 | 69 Ų | 69 | 59% | 0.588 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.1 | 28.2 | 173.9 | -60.2 | -69.1 | 0 | 0 | 0 | 113.2 | V209 F210 G214 | V209-F216 HydrophobicContact CG1-CD2 3.76Å; V209-F216 HydrophobicContact CG1-CE2 4.13Å; V209-F216 PolarHBondContact O-N 3.18Å; F210-F216 HydrophobicContact CD1-CB 3.9Å; F210-F216 HydrophobicContact CD1-CD2 4.4Å; F210-F216 HydrophobicContact CE1-CB 4.08Å; F210-F216 AromaticContact CE1-CD2 3.95Å; F210-F216 HydrophobicContact CE1-CD2 3.95Å; F210-F216 HydrophobicContact CE1-CG 4.28Å; F210-F216 HydrophobicContact CZ-CD2 4.45Å; G214-F216 PolarHBondContact O-N 3.25Å; G214-F216 VanDerWaalsContact O-N 3.16Å |
| 217 | G | 81.9 | Confident | 84.5 | Confident | 11 Ų | 11 | 65 Ų | 65 | 11% | 0.113 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -67.8 | 167.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G211 G214 W219 | G211-G217 WeakPolarHBondContact O-CA 3.35Å; G214-G217 PolarHBondContact O-N 2.98Å; G217-W219 PolarHBondContact O-N 3.43Å |
| 218 | P | 83.1 | Confident | 84.9 | Confident | 113 Ų | 113 | 68.4 Ų | 68.4 | 73% | 0.734 | 38% | 0.383 | S | S | * | . | trans | -74.2 | 74.7 | 178.1 | 32 | -35 | 0 | 0 | 0 | 111 | ||||
| 219 | W | 88.3 | Confident | 85.5 | Confident | 48 Ų | 48 | 69.2 Ų | 69.2 | 18% | 0.182 | 38% | 0.384 | C | S | . | . | trans | -77.1 | 134 | -177.6 | -61.5 | 115.7 | 0 | 0 | 0 | 112.2 | H39 F41 G214 I215 G217 A223 L224 | H39-W219 VanDerWaalsContact O-CZ3 3.27Å; H39-W219 WeakPolarHBondContact O-CZ3 3.34Å; F41-W219 HydrophobicContact CB-CH2 4.05Å; F41-W219 HydrophobicContact CB-CZ2 4.43Å; F41-W219 HydrophobicContact CB-CZ3 4.31Å; F41-W219 AromaticContact CD2-CD2 3.79Å; F41-W219 HydrophobicContact CD2-CD2 3.79Å; F41-W219 AromaticContact CD2-CE2 3.43Å; F41-W219 VanDerWaalsContact CD2-CE2 3.43Å; F41-W219 HydrophobicContact CD2-CE3 4.11Å; F41-W219 HydrophobicContact CD2-CG 4.47Å; F41-W219 AromaticContact CD2-CH2 3.85Å; F41-W219 HydrophobicContact CD2-CH2 3.85Å; F41-W219 AromaticContact CD2-CZ2 3.45Å; F41-W219 HydrophobicContact CD2-CZ2 3.45Å; F41-W219 VanDerWaalsContact CD2-CZ2 3.45Å; F41-W219 HydrophobicContact CD2-CZ3 4.15Å; F41-W219 AromaticContact CD2-NE1 3.92Å; F41-W219 HydrophobicContact CE2-CD2 4.17Å; F41-W219 AromaticContact CE2-CE2 3.64Å; F41-W219 HydrophobicContact CE2-CG 4.46Å; F41-W219 AromaticContact CE2-CZ2 3.95Å; F41-W219 HydrophobicContact CE2-CZ2 3.95Å; F41-W219 AromaticContact CE2-NE1 3.61Å; F41-W219 HydrophobicContact CG-CH2 4.28Å; F41-W219 HydrophobicContact CG-CZ2 4.16Å; G214-W219 VanDerWaalsContact O-CE2 3.32Å; G214-W219 WeakPolarHBondContact O-CZ2 3.37Å; G214-W219 PolarHBondContact O-NE1 2.82Å; I215-W219 PolarHBondContact O-NE1 2.94Å; G217-W219 PolarHBondContact O-N 3.43Å; W219-A223 HydrophobicContact CE3-CB 4.46Å; W219-L224 HydrophobicContact CB-CD1 4.43Å; W219-L224 HydrophobicContact CB-CD2 3.8Å; W219-L224 HydrophobicContact CB-CG 3.89Å; W219-L224 HydrophobicContact CG-CD2 4.25Å | ||
| 220 | S | 89.8 | Confident | 86.1 | Confident | 53 Ų | 53 | 67.5 Ų | 67.5 | 37% | 0.371 | 37% | 0.373 | S | S | . | . | trans | -66.6 | 154.4 | 171 | 70 | 0 | 0 | 0 | 0 | 111.1 | S222 A223 L224 | S220-S222 PolarHBondContact O-N 3.41Å; S220-S222 PolarHBondContact OG-OG 3.49Å; S220-A223 WeakPolarHBondContact O-CB 3.47Å; S220-A223 PolarHBondContact O-N 2.97Å; S220-A223 VanDerWaalsContact O-N 3.08Å; S220-A223 WeakPolarHBondContact OG-CB 3.46Å; S220-A223 PolarHBondContact OG-N 3.4Å; S220-A223 VanDerWaalsContact OG-N 3.13Å; S220-L224 PolarHBondContact O-N 3.28Å | ||
| 221 | V | 90.1 | Very high | 86.8 | Confident | 124 Ų | 124 | 60 Ų | 60 | 75% | 0.752 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -57.5 | -37.1 | 175.2 | -179.7 | 0 | 0 | 0 | 0 | 111.3 | L224 L225 | V221-L224 PolarHBondContact O-N 2.87Å; V221-L225 WeakPolarHBondContact O-CB 3.13Å; V221-L225 PolarHBondContact O-N 3.49Å |
| 222 | S | 89.8 | Confident | 87.9 | Confident | 69 Ų | 69 | 61.4 Ų | 61.4 | 48% | 0.483 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 175.8 | 53.9 | 0 | 0 | 0 | 0 | 112.6 | S220 L225 M226 | S220-S222 PolarHBondContact O-N 3.41Å; S220-S222 PolarHBondContact OG-OG 3.49Å; S222-L225 PolarHBondContact O-N 3.26Å; S222-M226 VanDerWaalsContact O-CG 3.3Å; S222-M226 WeakPolarHBondContact O-CG 3.35Å; S222-M226 PolarHBondContact O-N 2.81Å |
| 223 | A | 89.1 | Confident | 89.1 | Confident | 2 Ų | 2 | 54.1 Ų | 54.1 | 2% | 0.017 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63 | -46.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | H39 W219 S220 L225 M226 V227 | H39-A223 HydrophobicContact CB-CB 4.04Å; W219-A223 HydrophobicContact CE3-CB 4.46Å; S220-A223 WeakPolarHBondContact O-CB 3.47Å; S220-A223 PolarHBondContact O-N 2.97Å; S220-A223 VanDerWaalsContact O-N 3.08Å; S220-A223 WeakPolarHBondContact OG-CB 3.46Å; S220-A223 PolarHBondContact OG-N 3.4Å; S220-A223 VanDerWaalsContact OG-N 3.13Å; A223-L225 PolarHBondContact O-N 2.92Å; A223-M226 PolarHBondContact O-N 2.95Å; A223-V227 WeakPolarHBondContact O-CB 3.15Å; A223-V227 VanDerWaalsContact O-CG2 3.29Å; A223-V227 WeakPolarHBondContact O-CG2 3.38Å; A223-V227 PolarHBondContact O-N 3Å |
| 224 | L | 91.5 | Very high | 90.2 | Very high | 80 Ų | 80 | 53.1 Ų | 53.1 | 42% | 0.419 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.6 | -40.5 | 177.9 | -66.8 | 177.6 | 0 | 0 | 0 | 112.3 | W219 S220 V221 M226 V227 L228 | W219-L224 HydrophobicContact CB-CD1 4.43Å; W219-L224 HydrophobicContact CB-CD2 3.8Å; W219-L224 HydrophobicContact CB-CG 3.89Å; W219-L224 HydrophobicContact CG-CD2 4.25Å; S220-L224 PolarHBondContact O-N 3.28Å; V221-L224 PolarHBondContact O-N 2.87Å; L224-M226 VanDerWaalsContact C-N 3.35Å; L224-M226 PolarHBondContact O-N 3.02Å; L224-V227 PolarHBondContact O-N 3.25Å; L224-L228 WeakPolarHBondContact O-CB 3.29Å; L224-L228 WeakPolarHBondContact O-CG 3.34Å; L224-L228 PolarHBondContact O-N 3.44Å |
| 225 | L | 92.6 | Very high | 91 | Very high | 118 Ų | 118 | 54.6 Ų | 54.6 | 62% | 0.618 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -61.8 | -43.6 | 175.7 | -171 | 77.7 | 0 | 0 | 0 | 111.4 | V221 S222 A223 L228 L229 | V221-L225 WeakPolarHBondContact O-CB 3.13Å; V221-L225 PolarHBondContact O-N 3.49Å; S222-L225 PolarHBondContact O-N 3.26Å; A223-L225 PolarHBondContact O-N 2.92Å; L225-L228 PolarHBondContact O-N 3.34Å; L225-L229 WeakPolarHBondContact O-CB 3.31Å; L225-L229 PolarHBondContact O-N 2.92Å |
| 226 | M | 92.4 | Very high | 91.8 | Very high | 43 Ų | 43 | 56.8 Ų | 56.8 | 21% | 0.212 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67.5 | -38.9 | 178.3 | -70.3 | -66.5 | -78.6 | 0 | 0 | 111.8 | L31 W34 I35 S222 A223 L224 L229 S230 | L31-M226 HydrophobicContact CD1-CE 3.37Å; L31-M226 HydrophobicContact CD1-SD 4.48Å; W34-M226 HydrophobicContact CD2-CE 4.13Å; W34-M226 HydrophobicContact CE3-CE 3.41Å; W34-M226 VanDerWaalsContact CE3-CE 3.41Å; W34-M226 HydrophobicContact CH2-CE 3.92Å; W34-M226 HydrophobicContact CH2-CG 4.3Å; W34-M226 HydrophobicContact CZ3-CB 4.16Å; W34-M226 HydrophobicContact CZ3-CE 3.29Å; W34-M226 HydrophobicContact CZ3-CG 3.72Å; W34-M226 HydrophobicContact CZ3-SD 4.3Å; I35-M226 HydrophobicContact CD1-CB 4.35Å; I35-M226 HydrophobicContact CG1-CB 4.12Å; S222-M226 VanDerWaalsContact O-CG 3.3Å; S222-M226 WeakPolarHBondContact O-CG 3.35Å; S222-M226 PolarHBondContact O-N 2.81Å; A223-M226 PolarHBondContact O-N 2.95Å; L224-M226 VanDerWaalsContact C-N 3.35Å; L224-M226 PolarHBondContact O-N 3.02Å; M226-L229 PolarHBondContact O-N 3.15Å; M226-L229 HydrophobicContact SD-CD2 4.3Å; M226-S230 WeakPolarHBondContact O-CB 3.43Å; M226-S230 PolarHBondContact O-N 3.12Å |
| 227 | V | 93.8 | Very high | 92.3 | Very high | 6 Ų | 6 | 51 Ų | 51 | 4% | 0.036 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.9 | -45.9 | 171.9 | 168.1 | 0 | 0 | 0 | 0 | 110.8 | I35 F41 L46 V49 A223 L224 S230 G231 | I35-V227 HydrophobicContact CD1-CG2 4.48Å; I35-V227 HydrophobicContact CG2-CG2 4.11Å; F41-V227 HydrophobicContact CD1-CG2 4.31Å; F41-V227 HydrophobicContact CD2-CG2 3.95Å; F41-V227 HydrophobicContact CE2-CG2 4.17Å; F41-V227 HydrophobicContact CG-CG2 4.03Å; F41-V227 HydrophobicContact CZ-CG1 4.45Å; F41-V227 HydrophobicContact CZ-CG2 4.45Å; L46-V227 HydrophobicContact CD1-CB 4.42Å; L46-V227 HydrophobicContact CD1-CG1 3.93Å; L46-V227 HydrophobicContact CD1-CG2 4.09Å; V49-V227 HydrophobicContact CB-CG1 4.3Å; V49-V227 HydrophobicContact CG1-CG1 3.74Å; V49-V227 HydrophobicContact CG2-CG1 4.47Å; A223-V227 WeakPolarHBondContact O-CB 3.15Å; A223-V227 VanDerWaalsContact O-CG2 3.29Å; A223-V227 WeakPolarHBondContact O-CG2 3.38Å; A223-V227 PolarHBondContact O-N 3Å; L224-V227 PolarHBondContact O-N 3.25Å; V227-S230 PolarHBondContact O-N 3.25Å; V227-S230 PolarHBondContact O-OG 2.93Å; V227-G231 PolarHBondContact O-N 3.23Å |
| 228 | L | 94.4 | Very high | 93 | Very high | 97 Ų | 97 | 51.5 Ų | 51.5 | 51% | 0.508 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.6 | -44.3 | 176.2 | -74.2 | 175.2 | 0 | 0 | 0 | 112.3 | V53 L224 L225 S230 G231 V232 | V53-L228 HydrophobicContact CG2-CD2 4.36Å; L224-L228 WeakPolarHBondContact O-CB 3.29Å; L224-L228 WeakPolarHBondContact O-CG 3.34Å; L224-L228 PolarHBondContact O-N 3.44Å; L225-L228 PolarHBondContact O-N 3.34Å; L228-S230 VanDerWaalsContact C-N 3.29Å; L228-S230 PolarHBondContact O-N 3.31Å; L228-G231 WeakPolarHBondContact O-CA 3.2Å; L228-G231 PolarHBondContact O-N 3.43Å; L228-V232 PolarHBondContact O-N 3.03Å |
| 229 | L | 94.8 | Very high | 93.5 | Very high | 90 Ų | 90 | 47.9 Ų | 47.9 | 47% | 0.471 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -57.9 | -44 | 174.7 | -179.1 | 65.2 | 0 | 0 | 0 | 111 | L31 L225 M226 G231 V232 I233 | L31-L229 HydrophobicContact CD2-CD2 4.41Å; L31-L229 HydrophobicContact CD2-CG 4.24Å; L225-L229 WeakPolarHBondContact O-CB 3.31Å; L225-L229 PolarHBondContact O-N 2.92Å; M226-L229 PolarHBondContact O-N 3.15Å; M226-L229 HydrophobicContact SD-CD2 4.3Å; L229-G231 VanDerWaalsContact C-N 3.26Å; L229-G231 PolarHBondContact O-N 3.29Å; L229-V232 PolarHBondContact O-N 3.05Å; L229-V232 VanDerWaalsContact O-N 3.17Å; L229-I233 PolarHBondContact O-N 3.44Å; L229-I233 VanDerWaalsContact O-N 3.15Å |
| 230 | S | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.7 | -35.1 | 175.4 | 81.5 | 0 | 0 | 0 | 0 | 112.1 | L31 H50 M226 V227 L228 I233 A234 | L31-S230 VanDerWaalsContact CD2-CA 3.46Å; H50-S230 PolarHBondContact NE2-OG 2.86Å; M226-S230 WeakPolarHBondContact O-CB 3.43Å; M226-S230 PolarHBondContact O-N 3.12Å; V227-S230 PolarHBondContact O-N 3.25Å; V227-S230 PolarHBondContact O-OG 2.93Å; L228-S230 VanDerWaalsContact C-N 3.29Å; L228-S230 PolarHBondContact O-N 3.31Å; S230-I233 PolarHBondContact O-N 3.45Å; S230-A234 VanDerWaalsContact O-CB 3.31Å; S230-A234 WeakPolarHBondContact O-CB 3.34Å; S230-A234 PolarHBondContact O-N 3.25Å |
| 231 | G | 96 | Very high | 94.1 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.9 | -39 | 173 | 0 | 0 | 0 | 0 | 0 | 113.5 | V53 V227 L228 L229 A234 F235 | V53-G231 VanDerWaalsContact CG1-C 3.4Å; V53-G231 WeakPolarHBondContact CG1-O 3.48Å; V227-G231 PolarHBondContact O-N 3.23Å; L228-G231 WeakPolarHBondContact O-CA 3.2Å; L228-G231 PolarHBondContact O-N 3.43Å; L229-G231 VanDerWaalsContact C-N 3.26Å; L229-G231 PolarHBondContact O-N 3.29Å; G231-A234 WeakPolarHBondContact O-CB 3.49Å; G231-A234 PolarHBondContact O-N 3.13Å; G231-F235 PolarHBondContact O-N 3.16Å |
| 232 | V | 96.2 | Very high | 94.4 | Very high | 70 Ų | 70 | 38.9 Ų | 38.9 | 42% | 0.424 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65.3 | -43.1 | 175.2 | 178.2 | 0 | 0 | 0 | 0 | 110.9 | L228 L229 A234 F235 M236 | L228-V232 PolarHBondContact O-N 3.03Å; L229-V232 PolarHBondContact O-N 3.05Å; L229-V232 VanDerWaalsContact O-N 3.17Å; V232-A234 VanDerWaalsContact C-N 3.31Å; V232-A234 PolarHBondContact O-N 2.91Å; V232-F235 WeakPolarHBondContact O-CB 3.28Å; V232-F235 PolarHBondContact O-N 3.22Å; V232-M236 HydrophobicContact CG1-CE 4.38Å; V232-M236 PolarHBondContact O-N 2.93Å |
| 233 | I | 96.2 | Very high | 94.7 | Very high | 30 Ų | 30 | 38.7 Ų | 38.7 | 15% | 0.154 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.4 | -39.5 | 175.1 | -58.1 | 178.9 | 0 | 0 | 0 | 110.1 | V24 C27 I28 L31 L229 S230 F235 M236 V237 | V24-I233 HydrophobicContact CB-CG2 4.28Å; V24-I233 WeakPolarHBondContact O-CG2 3.23Å; C27-I233 HydrophobicContact CB-CD1 4.33Å; C27-I233 HydrophobicContact CB-CG2 4.41Å; I28-I233 HydrophobicContact CB-CG2 3.83Å; I28-I233 HydrophobicContact CG1-CG2 4.43Å; L31-I233 HydrophobicContact CD2-CD1 3.77Å; L229-I233 PolarHBondContact O-N 3.44Å; L229-I233 VanDerWaalsContact O-N 3.15Å; S230-I233 PolarHBondContact O-N 3.45Å; I233-F235 VanDerWaalsContact C-N 3.34Å; I233-F235 PolarHBondContact O-N 3.04Å; I233-M236 WeakPolarHBondContact O-CB 3.38Å; I233-M236 PolarHBondContact O-N 2.8Å; I233-M236 VanDerWaalsContact O-N 3.11Å; I233-V237 HydrophobicContact CG2-CG2 4.26Å; I233-V237 VanDerWaalsContact O-CG2 3.29Å; I233-V237 WeakPolarHBondContact O-CG2 3.48Å; I233-V237 PolarHBondContact O-N 3.28Å |
| 234 | A | 95.3 | Very high | 94.9 | Very high | 2 Ų | 2 | 38.7 Ų | 38.7 | 2% | 0.017 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.8 | -40.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | I28 H50 S230 G231 V232 M236 V237 N238 | I28-A234 HydrophobicContact CD1-CB 3.57Å; H50-A234 HydrophobicContact CB-CB 3.5Å; H50-A234 VanDerWaalsContact CB-CB 3.5Å; S230-A234 VanDerWaalsContact O-CB 3.31Å; S230-A234 WeakPolarHBondContact O-CB 3.34Å; S230-A234 PolarHBondContact O-N 3.25Å; G231-A234 WeakPolarHBondContact O-CB 3.49Å; G231-A234 PolarHBondContact O-N 3.13Å; V232-A234 VanDerWaalsContact C-N 3.31Å; V232-A234 PolarHBondContact O-N 2.91Å; A234-M236 VanDerWaalsContact C-N 3.33Å; A234-M236 PolarHBondContact O-N 3.33Å; A234-V237 PolarHBondContact O-N 2.87Å; A234-N238 WeakPolarHBondContact O-CB 3.07Å; A234-N238 VanDerWaalsContact O-CG 3.31Å; A234-N238 PolarHBondContact O-N 3.24Å; A234-N238 PolarHBondContact O-ND2 3.15Å |
| 235 | F | 96.6 | Very high | 95.1 | Very high | 31 Ų | 31 | 35 Ų | 35 | 14% | 0.136 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -55 | -48.8 | 170.9 | 161.7 | -108.6 | 0 | 0 | 0 | 111.4 | T54 L58 G231 V232 I233 V237 N238 L239 | T54-F235 HydrophobicContact CG2-CD2 4.15Å; T54-F235 WeakPolarHBondContact OG1-CA 3.42Å; L58-F235 HydrophobicContact CD2-CE2 3.76Å; L58-F235 HydrophobicContact CG-CD2 4.39Å; L58-F235 HydrophobicContact CG-CE2 3.8Å; G231-F235 PolarHBondContact O-N 3.16Å; V232-F235 WeakPolarHBondContact O-CB 3.28Å; V232-F235 PolarHBondContact O-N 3.22Å; I233-F235 VanDerWaalsContact C-N 3.34Å; I233-F235 PolarHBondContact O-N 3.04Å; F235-V237 PolarHBondContact O-N 3.17Å; F235-N238 PolarHBondContact O-N 3.28Å; F235-L239 HydrophobicContact CE2-CD2 4.34Å; F235-L239 HydrophobicContact CZ-CD2 4.03Å; F235-L239 VanDerWaalsContact O-CB 3.28Å; F235-L239 WeakPolarHBondContact O-CB 3.1Å; F235-L239 PolarHBondContact O-N 3.38Å |
| 236 | M | 96.6 | Very high | 95 | Very high | 72 Ų | 72 | 31.2 Ų | 31.2 | 36% | 0.355 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -63.1 | -41 | 177.9 | -64.9 | -178.4 | 177 | 0 | 0 | 112.5 | F20 V24 V232 I233 A234 S240 | F20-M236 HydrophobicContact CE1-CB 4.12Å; F20-M236 HydrophobicContact CZ-CB 3.96Å; F20-M236 HydrophobicContact CZ-CG 4.21Å; F20-M236 HydrophobicContact CZ-SD 3.96Å; V24-M236 HydrophobicContact CG1-CB 4.37Å; V24-M236 HydrophobicContact CG1-SD 4.45Å; V232-M236 HydrophobicContact CG1-CE 4.38Å; V232-M236 PolarHBondContact O-N 2.93Å; I233-M236 WeakPolarHBondContact O-CB 3.38Å; I233-M236 PolarHBondContact O-N 2.8Å; I233-M236 VanDerWaalsContact O-N 3.11Å; A234-M236 VanDerWaalsContact C-N 3.33Å; A234-M236 PolarHBondContact O-N 3.33Å; M236-S240 VanDerWaalsContact O-CB 3.3Å; M236-S240 WeakPolarHBondContact O-CB 3.29Å; M236-S240 PolarHBondContact O-N 3.41Å; M236-S240 PolarHBondContact O-OG 3.36Å |
| 237 | V | 95.3 | Very high | 94.9 | Very high | 13 Ų | 13 | 33.2 Ų | 33.2 | 8% | 0.079 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.3 | -53.4 | 176.1 | 172.6 | 0 | 0 | 0 | 0 | 110.2 | V24 I28 I233 A234 F235 L239 S240 I241 | V24-V237 HydrophobicContact CB-CG2 3.95Å; V24-V237 HydrophobicContact CG2-CB 4.5Å; V24-V237 HydrophobicContact CG2-CG2 3.68Å; I28-V237 HydrophobicContact CB-CG2 4.34Å; I28-V237 HydrophobicContact CD1-CG2 4.29Å; I28-V237 HydrophobicContact CG2-CG2 3.98Å; I233-V237 HydrophobicContact CG2-CG2 4.26Å; I233-V237 VanDerWaalsContact O-CG2 3.29Å; I233-V237 WeakPolarHBondContact O-CG2 3.48Å; I233-V237 PolarHBondContact O-N 3.28Å; A234-V237 PolarHBondContact O-N 2.87Å; F235-V237 PolarHBondContact O-N 3.17Å; V237-L239 PolarHBondContact O-N 3.4Å; V237-S240 PolarHBondContact O-N 2.88Å; V237-S240 PolarHBondContact O-OG 2.86Å; V237-I241 HydrophobicContact CG1-CD1 3.67Å; V237-I241 HydrophobicContact CG1-CG1 4.35Å; V237-I241 WeakPolarHBondContact O-CG1 3.44Å; V237-I241 PolarHBondContact O-N 3.35Å |
| 238 | N | 95.5 | Very high | 94.7 | Very high | 20 Ų | 20 | 34.7 Ų | 34.7 | 11% | 0.107 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.9 | -46.9 | -178.4 | -75.5 | -29.7 | 0 | 0 | 0 | 111.6 | T54 L188 A234 F235 S240 I241 Y242 | T54-N238 HydrophobicContact CG2-CB 4.13Å; T54-N238 PolarHBondContact OG1-ND2 3.44Å; T54-N238 VanDerWaalsContact OG1-ND2 3.07Å; L188-N238 HydrophobicContact CD1-CB 4.49Å; L188-N238 HydrophobicContact CD2-CB 3.92Å; A234-N238 WeakPolarHBondContact O-CB 3.07Å; A234-N238 VanDerWaalsContact O-CG 3.31Å; A234-N238 PolarHBondContact O-N 3.24Å; A234-N238 PolarHBondContact O-ND2 3.15Å; F235-N238 PolarHBondContact O-N 3.28Å; N238-S240 PolarHBondContact O-N 3.11Å; N238-I241 PolarHBondContact O-N 3.45Å; N238-Y242 WeakPolarHBondContact O-CD2 3.03Å; N238-Y242 PolarHBondContact O-N 3.5Å |
| 239 | L | 94.8 | Very high | 94.6 | Very high | 38 Ų | 38 | 30.9 Ų | 30.9 | 20% | 0.199 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.6 | -46.3 | 178.3 | 179.1 | 59.2 | 0 | 0 | 0 | 111.6 | M185 L188 F235 V237 I241 Y242 W243 | M185-L239 HydrophobicContact CB-CD1 4.42Å; M185-L239 HydrophobicContact CG-CD1 3.47Å; M185-L239 VanDerWaalsContact CG-CD1 3.47Å; L188-L239 HydrophobicContact CD2-CB 4.44Å; F235-L239 HydrophobicContact CE2-CD2 4.34Å; F235-L239 HydrophobicContact CZ-CD2 4.03Å; F235-L239 VanDerWaalsContact O-CB 3.28Å; F235-L239 WeakPolarHBondContact O-CB 3.1Å; F235-L239 PolarHBondContact O-N 3.38Å; V237-L239 PolarHBondContact O-N 3.4Å; L239-I241 PolarHBondContact O-N 2.98Å; L239-Y242 PolarHBondContact O-N 3.32Å; L239-W243 VanDerWaalsContact O-CB 3.32Å; L239-W243 WeakPolarHBondContact O-CB 3.47Å; L239-W243 PolarHBondContact O-N 3.07Å |
| 240 | S | 95.7 | Very high | 94.5 | Very high | 9 Ų | 9 | 26.8 Ų | 26.8 | 6% | 0.063 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -67.9 | -33.6 | 179.6 | 55.6 | 0 | 0 | 0 | 0 | 112.8 | N21 M236 V237 N238 W243 I244 | N21-S240 PolarHBondContact ND2-OG 3.25Å; M236-S240 VanDerWaalsContact O-CB 3.3Å; M236-S240 WeakPolarHBondContact O-CB 3.29Å; M236-S240 PolarHBondContact O-N 3.41Å; M236-S240 PolarHBondContact O-OG 3.36Å; V237-S240 PolarHBondContact O-N 2.88Å; V237-S240 PolarHBondContact O-OG 2.86Å; N238-S240 PolarHBondContact O-N 3.11Å; S240-W243 PolarHBondContact O-N 3.18Å; S240-I244 WeakPolarHBondContact O-CB 3.46Å; S240-I244 WeakPolarHBondContact O-CD1 3.3Å; S240-I244 WeakPolarHBondContact O-CG1 3.45Å; S240-I244 PolarHBondContact O-N 3.03Å |
| 241 | I | 94.9 | Very high | 94.3 | Very high | 25 Ų | 25 | 26.8 Ų | 26.8 | 13% | 0.128 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.9 | -51.8 | 172 | -68.7 | 168.9 | 0 | 0 | 0 | 110.6 | V237 N238 L239 W243 I244 I245 Y253 | V237-I241 HydrophobicContact CG1-CD1 3.67Å; V237-I241 HydrophobicContact CG1-CG1 4.35Å; V237-I241 WeakPolarHBondContact O-CG1 3.44Å; V237-I241 PolarHBondContact O-N 3.35Å; N238-I241 PolarHBondContact O-N 3.45Å; L239-I241 PolarHBondContact O-N 2.98Å; I241-W243 VanDerWaalsContact C-N 3.27Å; I241-W243 PolarHBondContact O-N 2.81Å; I241-I244 PolarHBondContact O-N 2.84Å; I241-I245 HydrophobicContact CG2-CD1 3.76Å; I241-I245 HydrophobicContact CG2-CG1 4.49Å; I241-I245 WeakPolarHBondContact O-CG1 3.38Å; I241-I245 PolarHBondContact O-N 2.64Å; I241-Y253 HydrophobicContact CB-CE2 4.23Å; I241-Y253 VanDerWaalsContact CD1-OH 3.31Å; I241-Y253 WeakPolarHBondContact CD1-OH 3.42Å; I241-Y253 HydrophobicContact CG1-CE2 3.78Å; I241-Y253 WeakPolarHBondContact CG1-OH 3.26Å; I241-Y253 HydrophobicContact CG2-CE1 4.17Å; I241-Y253 HydrophobicContact CG2-CE2 3.94Å |
| 242 | Y | 95.5 | Very high | 94.1 | Very high | 1 Ų | 1 | 28 Ų | 28 | 0% | 0.004 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.1 | -38.9 | -179.8 | -86.4 | -121.5 | 0 | 0 | 0 | 111.3 | Y169 V173 Q177 S184 L187 L188 Q191 N238 L239 G246 | Y169-Y242 VanDerWaalsContact OH-CE2 3.24Å; Y169-Y242 WeakPolarHBondContact OH-CE2 3.37Å; Y169-Y242 PolarHBondContact OH-OH 3.09Å; V173-Y242 HydrophobicContact CG1-CD1 3.78Å; V173-Y242 HydrophobicContact CG1-CD2 4.19Å; V173-Y242 HydrophobicContact CG1-CE1 3.86Å; V173-Y242 HydrophobicContact CG1-CE2 4.28Å; V173-Y242 HydrophobicContact CG1-CG 3.93Å; V173-Y242 HydrophobicContact CG2-CE1 4.1Å; V173-Y242 HydrophobicContact CG2-CE2 4.15Å; Q177-Y242 PolarHBondContact NE2-O 2.9Å; S184-Y242 PolarHBondContact OG-O 2.8Å; L187-Y242 HydrophobicContact CB-CD1 4.4Å; L187-Y242 HydrophobicContact CB-CE1 4.44Å; L187-Y242 HydrophobicContact CD2-CD1 4.12Å; L187-Y242 HydrophobicContact CD2-CE1 3.85Å; L187-Y242 HydrophobicContact CG-CD1 4.4Å; L187-Y242 HydrophobicContact CG-CE1 4.01Å; L188-Y242 HydrophobicContact CB-CD1 4.05Å; L188-Y242 HydrophobicContact CB-CE1 4.21Å; L188-Y242 HydrophobicContact CB-CG 4.42Å; L188-Y242 HydrophobicContact CD1-CD2 4.21Å; L188-Y242 HydrophobicContact CD1-CE1 4.2Å; L188-Y242 HydrophobicContact CD1-CE2 3.84Å; Q191-Y242 VanDerWaalsContact CD-OH 3.31Å; Q191-Y242 PolarHBondContact OE1-OH 3.48Å; N238-Y242 WeakPolarHBondContact O-CD2 3.03Å; N238-Y242 PolarHBondContact O-N 3.5Å; L239-Y242 PolarHBondContact O-N 3.32Å; Y242-G246 PolarHBondContact O-N 3.27Å |
| 243 | W | 95 | Very high | 94 | Very high | 66 Ų | 66 | 26.5 Ų | 26.5 | 25% | 0.25 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.6 | -46.7 | 176.4 | -172.6 | 88.6 | 0 | 0 | 0 | 112.3 | R13 I14 S184 L239 S240 I241 G246 N247 | R13-W243 WeakPolarHBondContact O-CH2 3.32Å; I14-W243 HydrophobicContact CG1-CH2 4.42Å; S184-W243 VanDerWaalsContact OG-CA 3.25Å; S184-W243 WeakPolarHBondContact OG-CA 3.34Å; S184-W243 PolarHBondContact OG-N 3.26Å; L239-W243 VanDerWaalsContact O-CB 3.32Å; L239-W243 WeakPolarHBondContact O-CB 3.47Å; L239-W243 PolarHBondContact O-N 3.07Å; S240-W243 PolarHBondContact O-N 3.18Å; I241-W243 VanDerWaalsContact C-N 3.27Å; I241-W243 PolarHBondContact O-N 2.81Å; W243-G246 PolarHBondContact O-N 3.45Å; W243-N247 VanDerWaalsContact CE2-ND2 3.34Å; W243-N247 PolarHBondContact NE1-ND2 3.27Å; W243-N247 WeakPolarHBondContact O-CB 3.32Å; W243-N247 PolarHBondContact O-N 3.15Å; W243-N247 PolarHBondContact O-ND2 2.9Å |
| 244 | I | 94.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.4 | -48.9 | 177.2 | -69.9 | 159.6 | 0 | 0 | 0 | 110.1 | L18 N21 S240 I241 G246 N247 T248 Y253 | L18-I244 HydrophobicContact CD2-CD1 3.85Å; L18-I244 HydrophobicContact CD2-CG1 4.03Å; L18-I244 HydrophobicContact CD2-CG2 3.84Å; N21-I244 HydrophobicContact CB-CD1 3.46Å; N21-I244 VanDerWaalsContact CB-CD1 3.46Å; S240-I244 WeakPolarHBondContact O-CB 3.46Å; S240-I244 WeakPolarHBondContact O-CD1 3.3Å; S240-I244 WeakPolarHBondContact O-CG1 3.45Å; S240-I244 PolarHBondContact O-N 3.03Å; I241-I244 PolarHBondContact O-N 2.84Å; I244-G246 VanDerWaalsContact C-N 3.34Å; I244-G246 PolarHBondContact O-N 3.04Å; I244-N247 PolarHBondContact O-N 2.89Å; I244-T248 WeakPolarHBondContact O-CB 3.47Å; I244-T248 PolarHBondContact O-N 3.12Å; I244-T248 PolarHBondContact O-OG1 3.43Å; I244-Y253 HydrophobicContact CB-CD2 4.46Å; I244-Y253 HydrophobicContact CG2-CD2 4.05Å |
| 245 | I | 94.8 | Very high | 93.6 | Very high | 4 Ų | 4 | 25.9 Ų | 25.9 | 2% | 0.021 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.4 | -42.8 | -178.8 | -67.7 | 172.7 | 0 | 0 | 0 | 110.9 | V173 I241 P250 Y253 | V173-I245 HydrophobicContact CB-CD1 4.45Å; V173-I245 HydrophobicContact CB-CG2 4.33Å; V173-I245 HydrophobicContact CG1-CB 4.19Å; V173-I245 HydrophobicContact CG1-CD1 4.09Å; V173-I245 HydrophobicContact CG1-CG2 3.95Å; I241-I245 HydrophobicContact CG2-CD1 3.76Å; I241-I245 HydrophobicContact CG2-CG1 4.49Å; I241-I245 WeakPolarHBondContact O-CG1 3.38Å; I241-I245 PolarHBondContact O-N 2.64Å; I245-P250 HydrophobicContact CG2-CG 4.03Å; I245-Y253 HydrophobicContact CD1-CD1 3.95Å; I245-Y253 HydrophobicContact CD1-CE1 4.48Å; I245-Y253 HydrophobicContact CD1-CG 4.07Å; I245-Y253 HydrophobicContact CG1-CD1 4.16Å; I245-Y253 HydrophobicContact CG1-CD2 4.3Å; I245-Y253 HydrophobicContact CG1-CG 3.77Å |
| 246 | G | 91 | Very high | 93.3 | Very high | 37 Ų | 37 | 25.3 Ų | 25.3 | 38% | 0.381 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -66.5 | -38.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q177 Y242 W243 I244 | Q177-G246 VanDerWaalsContact OE1-CA 3.3Å; Y242-G246 PolarHBondContact O-N 3.27Å; W243-G246 PolarHBondContact O-N 3.45Å; I244-G246 VanDerWaalsContact C-N 3.34Å; I244-G246 PolarHBondContact O-N 3.04Å |
| 247 | N | 89.8 | Confident | 93.1 | Very high | 86 Ų | 86 | 23.4 Ų | 23.4 | 46% | 0.46 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -88.9 | -13.9 | -179.3 | -71.4 | -88.8 | 0 | 0 | 0 | 113.6 | W243 I244 | W243-N247 VanDerWaalsContact CE2-ND2 3.34Å; W243-N247 PolarHBondContact NE1-ND2 3.27Å; W243-N247 WeakPolarHBondContact O-CB 3.32Å; W243-N247 PolarHBondContact O-N 3.15Å; W243-N247 PolarHBondContact O-ND2 2.9Å; I244-N247 PolarHBondContact O-N 2.89Å |
| 248 | T | 90.7 | Very high | 92.8 | Very high | 36 Ų | 36 | 23.6 Ų | 23.6 | 22% | 0.221 | 14% | 0.137 | C | C | . | . | S | Bend | trans | -124 | -101.4 | -178.9 | 67.9 | 0 | 0 | 0 | 0 | 111.8 | I14 I244 T252 | I14-T248 HydrophobicContact CD1-CG2 4.18Å; I14-T248 HydrophobicContact CG1-CG2 4.48Å; I14-T248 HydrophobicContact CG2-CG2 3.79Å; I244-T248 WeakPolarHBondContact O-CB 3.47Å; I244-T248 PolarHBondContact O-N 3.12Å; I244-T248 PolarHBondContact O-OG1 3.43Å; T248-T252 HydrophobicContact CG2-CG2 4.49Å |
| 249 | S | 91.5 | Very high | 92.6 | Very high | 18 Ų | 18 | 26 Ų | 26 | 13% | 0.126 | 15% | 0.147 | C | C | . | . | trans | -165.4 | 160.4 | 170.4 | 66.4 | 0 | 0 | 0 | 0 | 110.6 | V251 T252 Y253 K298 | S249-V251 PolarHBondContact O-N 3.27Å; S249-T252 PolarHBondContact O-N 3.37Å; S249-T252 VanDerWaalsContact O-N 3.14Å; S249-T252 PolarHBondContact OG-N 3.07Å; S249-T252 PolarHBondContact OG-OG1 3.19Å; S249-T252 VanDerWaalsContact OG-OG1 3.11Å; S249-Y253 PolarHBondContact O-N 3.28Å; S249-K298 PolarHBondContact OG-NZ 3.06Å | ||
| 250 | P | 93.1 | Very high | 92.3 | Very high | 4 Ų | 4 | 25.3 Ų | 25.3 | 3% | 0.026 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -55.4 | -39 | 172.2 | -24.9 | 33.6 | 0 | 0 | 0 | 112.8 | I114 Q170 I245 Y253 N254 | I114-P250 HydrophobicContact CD1-CB 4.46Å; I114-P250 HydrophobicContact CG2-CB 3.97Å; Q170-P250 HydrophobicContact CB-CB 4.26Å; Q170-P250 WeakPolarHBondContact O-CG 3.46Å; I245-P250 HydrophobicContact CG2-CG 4.03Å; P250-Y253 PolarHBondContact O-N 3.44Å; P250-N254 PolarHBondContact O-N 3.43Å; P250-N254 VanDerWaalsContact O-N 3.11Å; P250-N254 PolarHBondContact O-ND2 3.47Å |
| 251 | V | 92.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62.7 | -44.7 | 176.9 | -176.2 | 0 | 0 | 0 | 0 | 111.1 | T111 I114 I115 F126 S249 Y253 N254 M255 Y294 | T111-V251 HydrophobicContact CG2-CG1 3.85Å; I114-V251 HydrophobicContact CG2-CG2 3.53Å; I115-V251 HydrophobicContact CD1-CG1 4.16Å; I115-V251 HydrophobicContact CG1-CG1 4.29Å; I115-V251 HydrophobicContact CG1-CG2 3.81Å; F126-V251 HydrophobicContact CE1-CG2 4.22Å; F126-V251 HydrophobicContact CZ-CG2 4.29Å; S249-V251 PolarHBondContact O-N 3.27Å; V251-Y253 VanDerWaalsContact C-N 3.34Å; V251-Y253 PolarHBondContact O-N 3.5Å; V251-N254 PolarHBondContact O-N 2.91Å; V251-M255 VanDerWaalsContact O-CG 3.31Å; V251-M255 WeakPolarHBondContact O-CG 3.38Å; V251-M255 PolarHBondContact O-N 2.55Å; V251-Y294 HydrophobicContact CG1-CE2 3.69Å; V251-Y294 VanDerWaalsContact CG1-OH 3.24Å; V251-Y294 WeakPolarHBondContact CG1-OH 3.44Å |
| 252 | T | 91.6 | Very high | 91.5 | Very high | 25 Ų | 25 | 25.8 Ų | 25.8 | 15% | 0.153 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -66 | -36.6 | 178.8 | -63.5 | 0 | 0 | 0 | 0 | 112.4 | T248 S249 N254 M255 F256 Y294 K298 | T248-T252 HydrophobicContact CG2-CG2 4.49Å; S249-T252 PolarHBondContact O-N 3.37Å; S249-T252 VanDerWaalsContact O-N 3.14Å; S249-T252 PolarHBondContact OG-N 3.07Å; S249-T252 PolarHBondContact OG-OG1 3.19Å; S249-T252 VanDerWaalsContact OG-OG1 3.11Å; T252-N254 VanDerWaalsContact C-N 3.33Å; T252-N254 PolarHBondContact O-N 3.23Å; T252-M255 PolarHBondContact O-N 3.38Å; T252-F256 WeakPolarHBondContact O-CB 3.38Å; T252-F256 PolarHBondContact O-N 3.35Å; T252-Y294 PolarHBondContact OG1-OH 2.73Å; T252-K298 PolarHBondContact OG1-NZ 3.24Å |
| 253 | Y | 93.2 | Very high | 91.1 | Very high | 39 Ų | 39 | 28.6 Ų | 28.6 | 15% | 0.153 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.5 | -40.2 | 172.2 | 177.2 | -104.2 | 0 | 0 | 0 | 112.3 | I241 I244 I245 S249 P250 V251 F256 G257 | I241-Y253 HydrophobicContact CB-CE2 4.23Å; I241-Y253 VanDerWaalsContact CD1-OH 3.31Å; I241-Y253 WeakPolarHBondContact CD1-OH 3.42Å; I241-Y253 HydrophobicContact CG1-CE2 3.78Å; I241-Y253 WeakPolarHBondContact CG1-OH 3.26Å; I241-Y253 HydrophobicContact CG2-CE1 4.17Å; I241-Y253 HydrophobicContact CG2-CE2 3.94Å; I244-Y253 HydrophobicContact CB-CD2 4.46Å; I244-Y253 HydrophobicContact CG2-CD2 4.05Å; I245-Y253 HydrophobicContact CD1-CD1 3.95Å; I245-Y253 HydrophobicContact CD1-CE1 4.48Å; I245-Y253 HydrophobicContact CD1-CG 4.07Å; I245-Y253 HydrophobicContact CG1-CD1 4.16Å; I245-Y253 HydrophobicContact CG1-CD2 4.3Å; I245-Y253 HydrophobicContact CG1-CG 3.77Å; S249-Y253 PolarHBondContact O-N 3.28Å; P250-Y253 PolarHBondContact O-N 3.44Å; V251-Y253 VanDerWaalsContact C-N 3.34Å; V251-Y253 PolarHBondContact O-N 3.5Å; Y253-F256 WeakPolarHBondContact O-CB 3.48Å; Y253-F256 PolarHBondContact O-N 3.43Å; Y253-G257 PolarHBondContact O-N 3.08Å |
| 254 | N | 92.5 | Very high | 90.4 | Very high | 14 Ų | 14 | 29.2 Ų | 29.2 | 8% | 0.075 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -66.8 | -42.2 | 174.4 | -79.3 | -94.1 | 0 | 0 | 0 | 112.9 | T110 T111 I114 Q170 P250 V251 T252 F256 G257 H258 | T110-N254 WeakPolarHBondContact CG2-OD1 3.39Å; T111-N254 HydrophobicContact CG2-CB 4.46Å; T111-N254 WeakPolarHBondContact OG1-CB 3.3Å; I114-N254 WeakPolarHBondContact CD1-ND2 3.48Å; Q170-N254 PolarHBondContact OE1-ND2 3.03Å; P250-N254 PolarHBondContact O-N 3.43Å; P250-N254 VanDerWaalsContact O-N 3.11Å; P250-N254 PolarHBondContact O-ND2 3.47Å; V251-N254 PolarHBondContact O-N 2.91Å; T252-N254 VanDerWaalsContact C-N 3.33Å; T252-N254 PolarHBondContact O-N 3.23Å; N254-F256 PolarHBondContact O-N 3.43Å; N254-G257 WeakPolarHBondContact O-CA 3.36Å; N254-G257 PolarHBondContact O-N 3.26Å; N254-H258 PolarHBondContact O-CD2 3.02Å; N254-H258 VanDerWaalsContact O-CD2 3.24Å; N254-H258 PolarHBondContact O-N 3.14Å |
| 255 | M | 90.5 | Very high | 89.8 | Confident | 5 Ų | 5 | 31.2 Ų | 31.2 | 3% | 0.025 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -57.1 | -42.6 | 174.6 | -67.5 | -68.4 | 135.2 | 0 | 0 | 110.8 | T111 L134 I137 V251 T252 G257 H258 F259 I291 Y294 | T111-M255 HydrophobicContact CG2-CE 3.19Å; L134-M255 HydrophobicContact CD2-CE 3.67Å; I137-M255 HydrophobicContact CD1-CE 3.65Å; I137-M255 HydrophobicContact CD1-SD 3.31Å; I137-M255 WeakPolarHBondContact CD1-SD 3.46Å; V251-M255 VanDerWaalsContact O-CG 3.31Å; V251-M255 WeakPolarHBondContact O-CG 3.38Å; V251-M255 PolarHBondContact O-N 2.55Å; T252-M255 PolarHBondContact O-N 3.38Å; M255-G257 VanDerWaalsContact C-N 3.34Å; M255-H258 PolarHBondContact O-N 3.15Å; M255-F259 PolarHBondContact O-N 2.87Å; M255-I291 HydrophobicContact SD-CG1 4.46Å; M255-Y294 HydrophobicContact CB-CD1 4.31Å; M255-Y294 HydrophobicContact CB-CE1 4.38Å; M255-Y294 HydrophobicContact CG-CD1 3.68Å; M255-Y294 HydrophobicContact CG-CD2 4.33Å; M255-Y294 HydrophobicContact CG-CE1 3.72Å; M255-Y294 HydrophobicContact CG-CE2 4.35Å; M255-Y294 HydrophobicContact CG-CG 4Å; M255-Y294 HydrophobicContact SD-CD1 4.24Å; M255-Y294 HydrophobicContact SD-CD2 4.3Å; M255-Y294 HydrophobicContact SD-CG 4.01Å |
| 256 | F | 91.4 | Very high | 89.3 | Confident | 19 Ų | 19 | 36.7 Ų | 36.7 | 8% | 0.083 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.5 | -38.2 | 173.9 | -175.9 | -123.6 | 0 | 0 | 0 | 112.4 | L18 N21 L22 T252 Y253 N254 H258 F259 K260 | L18-F256 HydrophobicContact CB-CD2 4.39Å; L18-F256 HydrophobicContact CB-CE1 4.14Å; L18-F256 HydrophobicContact CB-CE2 3.86Å; L18-F256 HydrophobicContact CB-CZ 3.72Å; L18-F256 HydrophobicContact CD1-CD2 4.5Å; L18-F256 HydrophobicContact CD2-CB 4.18Å; L18-F256 HydrophobicContact CD2-CD1 3.56Å; L18-F256 HydrophobicContact CD2-CD2 3.93Å; L18-F256 HydrophobicContact CD2-CE1 3.78Å; L18-F256 HydrophobicContact CD2-CE2 4.18Å; L18-F256 HydrophobicContact CD2-CG 3.63Å; L18-F256 HydrophobicContact CD2-CZ 4.11Å; L18-F256 HydrophobicContact CG-CE2 4.45Å; L18-F256 HydrophobicContact CG-CZ 4.49Å; L18-F256 WeakPolarHBondContact O-CE1 3.48Å; L18-F256 WeakPolarHBondContact O-CZ 3.39Å; N21-F256 HydrophobicContact CB-CE1 4.32Å; L22-F256 HydrophobicContact CB-CZ 3.98Å; T252-F256 WeakPolarHBondContact O-CB 3.38Å; T252-F256 PolarHBondContact O-N 3.35Å; Y253-F256 WeakPolarHBondContact O-CB 3.48Å; Y253-F256 PolarHBondContact O-N 3.43Å; N254-F256 PolarHBondContact O-N 3.43Å; F256-H258 PolarHBondContact O-N 3.43Å; F256-F259 HydrophobicContact CD2-CB 4.5Å; F256-F259 HydrophobicContact CD2-CD1 4.04Å; F256-F259 AromaticContact CE2-CD1 3.92Å; F256-F259 HydrophobicContact CE2-CD1 3.92Å; F256-F259 HydrophobicContact CE2-CE1 4.49Å; F256-F259 WeakPolarHBondContact O-CB 3.35Å; F256-F259 PolarHBondContact O-N 3.14Å; F256-K260 HydrophobicContact CD1-CG 4.47Å; F256-K260 HydrophobicContact CE1-CD 4.26Å; F256-K260 HydrophobicContact CE1-CG 4.28Å; F256-K260 HydrophobicContact CZ-CG 4.3Å; F256-K260 VanDerWaalsContact O-CG 3.29Å; F256-K260 WeakPolarHBondContact O-CG 3.45Å; F256-K260 PolarHBondContact O-N 2.9Å |
| 257 | G | 90.7 | Very high | 88.8 | Confident | 31 Ų | 31 | 36 Ų | 36 | 32% | 0.32 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -56.2 | -46.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y253 N254 M255 F259 K260 F261 | Y253-G257 PolarHBondContact O-N 3.08Å; N254-G257 WeakPolarHBondContact O-CA 3.36Å; N254-G257 PolarHBondContact O-N 3.26Å; M255-G257 VanDerWaalsContact C-N 3.34Å; G257-F259 VanDerWaalsContact C-N 3.31Å; G257-F259 PolarHBondContact O-N 3.43Å; G257-K260 WeakPolarHBondContact O-CB 3.49Å; G257-K260 PolarHBondContact O-N 2.72Å; G257-F261 PolarHBondContact O-N 3.29Å |
| 258 | H | 90.3 | Very high | 88.1 | Confident | 17 Ų | 17 | 32.5 Ų | 32.5 | 8% | 0.079 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62 | -39.1 | 174.9 | -66.7 | -43.6 | 0 | 0 | 0 | 112 | T111 N254 M255 F256 F261 C262 T287 I291 | T111-H258 PolarHBondContact OG1-NE2 2.96Å; N254-H258 PolarHBondContact O-CD2 3.02Å; N254-H258 VanDerWaalsContact O-CD2 3.24Å; N254-H258 PolarHBondContact O-N 3.14Å; M255-H258 PolarHBondContact O-N 3.15Å; F256-H258 PolarHBondContact O-N 3.43Å; H258-F261 WeakPolarHBondContact O-CB 3.4Å; H258-F261 PolarHBondContact O-N 2.93Å; H258-C262 PolarHBondContact O-N 3.46Å; H258-C262 VanDerWaalsContact O-N 3.12Å; H258-C262 PolarHBondContact O-SG 3.02Å; H258-T287 HydrophobicContact CB-CG2 4.16Å; H258-I291 HydrophobicContact CB-CD1 3.86Å |
| 259 | F | 90.4 | Very high | 87.7 | Confident | 71 Ų | 71 | 36.2 Ų | 36.2 | 31% | 0.311 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -61.3 | -44.2 | 173.3 | -178.8 | -109.9 | 0 | 0 | 0 | 112.4 | M255 F256 G257 F261 C262 I263 L288 I291 | M255-F259 PolarHBondContact O-N 2.87Å; F256-F259 HydrophobicContact CD2-CB 4.5Å; F256-F259 HydrophobicContact CD2-CD1 4.04Å; F256-F259 AromaticContact CE2-CD1 3.92Å; F256-F259 HydrophobicContact CE2-CD1 3.92Å; F256-F259 HydrophobicContact CE2-CE1 4.49Å; F256-F259 WeakPolarHBondContact O-CB 3.35Å; F256-F259 PolarHBondContact O-N 3.14Å; G257-F259 VanDerWaalsContact C-N 3.31Å; G257-F259 PolarHBondContact O-N 3.43Å; F259-F261 VanDerWaalsContact C-N 3.27Å; F259-F261 PolarHBondContact O-N 3.43Å; F259-C262 PolarHBondContact O-N 2.83Å; F259-I263 HydrophobicContact CD1-CD1 3.85Å; F259-I263 HydrophobicContact CE1-CD1 3.28Å; F259-I263 HydrophobicContact CE1-CG1 4.28Å; F259-I263 HydrophobicContact CE2-CD1 4.28Å; F259-I263 HydrophobicContact CZ-CD1 3.54Å; F259-I263 HydrophobicContact CZ-CG1 4.23Å; F259-I263 PolarHBondContact O-N 3.46Å; F259-L288 HydrophobicContact CD2-CD2 3.74Å; F259-L288 HydrophobicContact CE2-CD2 4.01Å; F259-I291 HydrophobicContact CB-CD1 4.02Å |
| 260 | K | 88.8 | Confident | 87.2 | Confident | 24 Ų | 24 | 39.2 Ų | 39.2 | 10% | 0.104 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60 | -40.1 | 175.9 | -56.8 | -160.4 | -177.4 | 173.8 | 0 | 112.1 | N21 L22 S25 F256 G257 I263 T264 | N21-K260 PolarHBondContact O-NZ 3Å; N21-K260 WeakPolarHBondContact OD1-CE 3.14Å; N21-K260 PolarHBondContact OD1-NZ 3.03Å; L22-K260 HydrophobicContact CD1-CB 3.95Å; L22-K260 HydrophobicContact CD1-CD 3.83Å; L22-K260 HydrophobicContact CD1-CG 3.63Å; S25-K260 PolarHBondContact OG-NZ 3.49Å; F256-K260 HydrophobicContact CD1-CG 4.47Å; F256-K260 HydrophobicContact CE1-CD 4.26Å; F256-K260 HydrophobicContact CE1-CG 4.28Å; F256-K260 HydrophobicContact CZ-CG 4.3Å; F256-K260 VanDerWaalsContact O-CG 3.29Å; F256-K260 WeakPolarHBondContact O-CG 3.45Å; F256-K260 PolarHBondContact O-N 2.9Å; G257-K260 WeakPolarHBondContact O-CB 3.49Å; G257-K260 PolarHBondContact O-N 2.72Å; K260-I263 PolarHBondContact O-N 3.03Å; K260-T264 WeakPolarHBondContact O-CB 3.27Å; K260-T264 PolarHBondContact O-N 3.41Å; K260-T264 PolarHBondContact O-OG1 3.49Å |
| 261 | F | 85.6 | Confident | 86.4 | Confident | 41 Ų | 41 | 45.4 Ų | 45.4 | 18% | 0.18 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.2 | -47 | 178.6 | 177.8 | -111.8 | 0 | 0 | 0 | 111.1 | Q104 N144 G257 H258 F259 I263 T264 L265 | Q104-F261 HydrophobicContact CG-CE2 4.05Å; Q104-F261 HydrophobicContact CG-CZ 4.11Å; N144-F261 HydrophobicContact CB-CE1 4.42Å; G257-F261 PolarHBondContact O-N 3.29Å; H258-F261 WeakPolarHBondContact O-CB 3.4Å; H258-F261 PolarHBondContact O-N 2.93Å; F259-F261 VanDerWaalsContact C-N 3.27Å; F259-F261 PolarHBondContact O-N 3.43Å; F261-I263 PolarHBondContact O-N 2.92Å; F261-T264 PolarHBondContact O-N 2.93Å; F261-T264 VanDerWaalsContact O-N 3.16Å; F261-L265 HydrophobicContact CD1-CD1 4.1Å; F261-L265 HydrophobicContact CE1-CD1 3.51Å; F261-L265 HydrophobicContact CE1-CG 4.31Å; F261-L265 HydrophobicContact CE2-CD1 4.18Å; F261-L265 HydrophobicContact CE2-CD2 4.34Å; F261-L265 HydrophobicContact CE2-CG 4.16Å; F261-L265 HydrophobicContact CZ-CD1 3.56Å; F261-L265 HydrophobicContact CZ-CD2 4.29Å; F261-L265 HydrophobicContact CZ-CG 4.04Å; F261-L265 PolarHBondContact O-N 2.87Å |
| 262 | C | 87.9 | Confident | 85.6 | Confident | 3 Ų | 3 | 51.6 Ų | 51.6 | 2% | 0.02 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.2 | -45 | 174.3 | -66.8 | 0 | 0 | 0 | 0 | 112.8 | H258 F259 T264 L265 F266 I284 L288 | H258-C262 PolarHBondContact O-N 3.46Å; H258-C262 VanDerWaalsContact O-N 3.12Å; H258-C262 PolarHBondContact O-SG 3.02Å; F259-C262 PolarHBondContact O-N 2.83Å; C262-T264 VanDerWaalsContact C-N 3.3Å; C262-T264 PolarHBondContact O-N 3.45Å; C262-L265 PolarHBondContact O-N 3.36Å; C262-F266 WeakPolarHBondContact O-CB 3.21Å; C262-F266 PolarHBondContact O-N 3.41Å; C262-I284 HydrophobicContact CB-CG2 4.22Å; C262-L288 HydrophobicContact CB-CD2 4.17Å; C262-L288 HydrophobicContact CB-CG 4.48Å |
| 263 | I | 86.8 | Confident | 84.9 | Confident | 59 Ų | 59 | 59 Ų | 59 | 30% | 0.303 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.8 | -42 | 176.2 | -71.9 | 177.4 | 0 | 0 | 0 | 111.1 | L22 F259 K260 F261 F266 G267 | L22-I263 HydrophobicContact CD1-CD1 4.49Å; L22-I263 HydrophobicContact CD2-CD1 3.89Å; F259-I263 HydrophobicContact CD1-CD1 3.85Å; F259-I263 HydrophobicContact CE1-CD1 3.28Å; F259-I263 HydrophobicContact CE1-CG1 4.28Å; F259-I263 HydrophobicContact CE2-CD1 4.28Å; F259-I263 HydrophobicContact CZ-CD1 3.54Å; F259-I263 HydrophobicContact CZ-CG1 4.23Å; F259-I263 PolarHBondContact O-N 3.46Å; K260-I263 PolarHBondContact O-N 3.03Å; F261-I263 PolarHBondContact O-N 2.92Å; I263-F266 PolarHBondContact O-N 3.32Å; I263-G267 PolarHBondContact O-N 2.88Å |
| 264 | T | 81.7 | Confident | 84 | Confident | 79 Ų | 79 | 61.6 Ų | 61.6 | 49% | 0.485 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -65.9 | -43.2 | -178.1 | -54.6 | 0 | 0 | 0 | 0 | 110.9 | K260 F261 C262 G267 G268 | K260-T264 WeakPolarHBondContact O-CB 3.27Å; K260-T264 PolarHBondContact O-N 3.41Å; K260-T264 PolarHBondContact O-OG1 3.49Å; F261-T264 PolarHBondContact O-N 2.93Å; F261-T264 VanDerWaalsContact O-N 3.16Å; C262-T264 VanDerWaalsContact C-N 3.3Å; C262-T264 PolarHBondContact O-N 3.45Å; T264-G267 PolarHBondContact O-N 2.92Å; T264-G268 PolarHBondContact O-N 3.42Å |
| 265 | L | 81.8 | Confident | 83.3 | Confident | 43 Ų | 43 | 66.5 Ų | 66.5 | 23% | 0.225 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.2 | -45.9 | 175 | -71.9 | 179.1 | 0 | 0 | 0 | 112.1 | F261 C262 G268 Y269 I284 | F261-L265 HydrophobicContact CD1-CD1 4.1Å; F261-L265 HydrophobicContact CE1-CD1 3.51Å; F261-L265 HydrophobicContact CE1-CG 4.31Å; F261-L265 HydrophobicContact CE2-CD1 4.18Å; F261-L265 HydrophobicContact CE2-CD2 4.34Å; F261-L265 HydrophobicContact CE2-CG 4.16Å; F261-L265 HydrophobicContact CZ-CD1 3.56Å; F261-L265 HydrophobicContact CZ-CD2 4.29Å; F261-L265 HydrophobicContact CZ-CG 4.04Å; F261-L265 PolarHBondContact O-N 2.87Å; C262-L265 PolarHBondContact O-N 3.36Å; L265-G268 PolarHBondContact O-N 3.18Å; L265-Y269 PolarHBondContact O-N 2.87Å; L265-Y269 VanDerWaalsContact O-N 3.15Å; L265-I284 HydrophobicContact CB-CD1 4.06Å; L265-I284 HydrophobicContact CD1-CD1 4.43Å; L265-I284 HydrophobicContact CD1-CG1 4.33Å |
| 266 | F | 84 | Confident | 82.8 | Confident | 119 Ų | 119 | 68.7 Ų | 68.7 | 52% | 0.522 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.5 | -41.2 | 178.7 | -175.5 | -101.2 | 0 | 0 | 0 | 112.1 | C262 I263 G268 Y269 V270 | C262-F266 WeakPolarHBondContact O-CB 3.21Å; C262-F266 PolarHBondContact O-N 3.41Å; I263-F266 PolarHBondContact O-N 3.32Å; F266-G268 VanDerWaalsContact C-N 3.28Å; F266-G268 PolarHBondContact O-N 2.66Å; F266-Y269 WeakPolarHBondContact O-CB 3.29Å; F266-Y269 PolarHBondContact O-N 3.4Å; F266-V270 HydrophobicContact CD1-CG2 4.17Å; F266-V270 HydrophobicContact CE1-CG2 3.71Å; F266-V270 HydrophobicContact CE2-CG2 4.33Å; F266-V270 HydrophobicContact CZ-CG2 3.8Å; F266-V270 WeakPolarHBondContact O-CG2 3.49Å; F266-V270 PolarHBondContact O-N 3.03Å |
| 267 | G | 79.6 | Confident | 82.5 | Confident | 22 Ų | 22 | 69.6 Ų | 69.6 | 23% | 0.227 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -62.1 | -37 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I263 T264 V270 L271 | I263-G267 PolarHBondContact O-N 2.88Å; T264-G267 PolarHBondContact O-N 2.92Å; G267-V270 PolarHBondContact O-N 3.03Å; G267-L271 VanDerWaalsContact O-CB 3.25Å; G267-L271 WeakPolarHBondContact O-CB 3.16Å; G267-L271 WeakPolarHBondContact O-CG 3.27Å; G267-L271 PolarHBondContact O-N 3.24Å |
| 268 | G | 76.4 | Confident | 82.4 | Confident | 14 Ų | 14 | 74.5 Ų | 74.5 | 14% | 0.144 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -52.8 | -54.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T264 L265 F266 F272 | T264-G268 PolarHBondContact O-N 3.42Å; L265-G268 PolarHBondContact O-N 3.18Å; F266-G268 VanDerWaalsContact C-N 3.28Å; F266-G268 PolarHBondContact O-N 2.66Å; G268-F272 WeakPolarHBondContact O-CA 3.46Å; G268-F272 WeakPolarHBondContact O-CB 3.31Å; G268-F272 PolarHBondContact O-N 2.88Å |
| 269 | Y | 81.4 | Confident | 82.3 | Confident | 113 Ų | 113 | 75.5 Ų | 75.5 | 44% | 0.443 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59 | -49.5 | 176.7 | 174.1 | -106.4 | 0 | 0 | 0 | 113.4 | L265 F266 K273 D274 L276 | L265-Y269 PolarHBondContact O-N 2.87Å; L265-Y269 VanDerWaalsContact O-N 3.15Å; F266-Y269 WeakPolarHBondContact O-CB 3.29Å; F266-Y269 PolarHBondContact O-N 3.4Å; Y269-K273 WeakPolarHBondContact O-CA 3.46Å; Y269-K273 PolarHBondContact O-N 3.4Å; Y269-K273 VanDerWaalsContact O-N 3.1Å; Y269-D274 VanDerWaalsContact CD2-O 3.27Å; Y269-D274 WeakPolarHBondContact CD2-O 3.47Å; Y269-L276 VanDerWaalsContact CB-CD1 3.43Å; Y269-L276 HydrophobicContact CD1-CD1 3.93Å; Y269-L276 HydrophobicContact CD2-CB 4.01Å; Y269-L276 HydrophobicContact CD2-CD1 3.67Å; Y269-L276 HydrophobicContact CD2-CG 3.6Å; Y269-L276 HydrophobicContact CE2-CB 4.46Å; Y269-L276 HydrophobicContact CE2-CD1 4.43Å; Y269-L276 HydrophobicContact CE2-CG 4.47Å; Y269-L276 HydrophobicContact CG-CD1 3.39Å; Y269-L276 HydrophobicContact CG-CG 3.76Å |
| 270 | V | 81.7 | Confident | 82.1 | Confident | 82 Ų | 82 | 74.8 Ų | 74.8 | 50% | 0.497 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -69.4 | -41.2 | -174.7 | 174.5 | 0 | 0 | 0 | 0 | 111.8 | F266 G267 | F266-V270 HydrophobicContact CD1-CG2 4.17Å; F266-V270 HydrophobicContact CE1-CG2 3.71Å; F266-V270 HydrophobicContact CE2-CG2 4.33Å; F266-V270 HydrophobicContact CZ-CG2 3.8Å; F266-V270 WeakPolarHBondContact O-CG2 3.49Å; F266-V270 PolarHBondContact O-N 3.03Å; G267-V270 PolarHBondContact O-N 3.03Å |
| 271 | L | 75.7 | Confident | 82.1 | Confident | 134 Ų | 134 | 75.6 Ų | 75.6 | 70% | 0.702 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -88.6 | -42.4 | -172.4 | -64.6 | 172.4 | 0 | 0 | 0 | 113 | G267 | G267-L271 VanDerWaalsContact O-CB 3.25Å; G267-L271 WeakPolarHBondContact O-CB 3.16Å; G267-L271 WeakPolarHBondContact O-CG 3.27Å; G267-L271 PolarHBondContact O-N 3.24Å |
| 272 | F | 74.9 | Confident | 82.4 | Confident | 130 Ų | 130 | 77.8 Ų | 77.8 | 57% | 0.57 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -100.5 | -4.1 | -175.2 | -57 | -77.9 | 0 | 0 | 0 | 113.1 | G268 D274 | G268-F272 WeakPolarHBondContact O-CA 3.46Å; G268-F272 WeakPolarHBondContact O-CB 3.31Å; G268-F272 PolarHBondContact O-N 2.88Å; F272-D274 PolarHBondContact O-N 2.89Å |
| 273 | K | 77.1 | Confident | 82.6 | Confident | 181 Ų | 181 | 77.6 Ų | 77.6 | 79% | 0.787 | 41% | 0.411 | S | S | * | . | trans | 56.4 | 27 | -175.7 | -56.4 | -172.6 | 179.3 | -178 | 0 | 113 | Y269 | Y269-K273 WeakPolarHBondContact O-CA 3.46Å; Y269-K273 PolarHBondContact O-N 3.4Å; Y269-K273 VanDerWaalsContact O-N 3.1Å | ||
| 274 | D | 75.6 | Confident | 82.7 | Confident | 92 Ų | 92 | 75.5 Ų | 75.5 | 49% | 0.492 | 40% | 0.4 | S | S | . | . | P | Polyproline II helix | trans | -64.3 | 123.3 | 175.6 | -72.8 | -24.2 | 0 | 0 | 0 | 109.3 | Y269 F272 L276 | Y269-D274 VanDerWaalsContact CD2-O 3.27Å; Y269-D274 WeakPolarHBondContact CD2-O 3.47Å; F272-D274 PolarHBondContact O-N 2.89Å; D274-L276 PolarHBondContact O-N 3.25Å; D274-L276 VanDerWaalsContact O-N 3.11Å |
| 275 | P | 76.9 | Confident | 83.3 | Confident | 118 Ų | 118 | 77.1 Ų | 77.1 | 77% | 0.766 | 41% | 0.406 | S | S | * | . | P | Polyproline II helix | trans | -64.5 | 116.5 | -174.3 | 24.6 | -32.8 | 0 | 0 | 0 | 111.1 | S277 | P275-S277 PolarHBondContact O-N 3.45Š|
| 276 | L | 79.1 | Confident | 83.8 | Confident | 51 Ų | 51 | 76.7 Ų | 76.7 | 27% | 0.267 | 41% | 0.406 | S | S | . | . | P | Polyproline II helix | trans | -75.9 | 121.7 | 171.2 | -76.7 | 172.7 | 0 | 0 | 0 | 109.9 | Y269 D274 Q280 | Y269-L276 VanDerWaalsContact CB-CD1 3.43Å; Y269-L276 HydrophobicContact CD1-CD1 3.93Å; Y269-L276 HydrophobicContact CD2-CB 4.01Å; Y269-L276 HydrophobicContact CD2-CD1 3.67Å; Y269-L276 HydrophobicContact CD2-CG 3.6Å; Y269-L276 HydrophobicContact CE2-CB 4.46Å; Y269-L276 HydrophobicContact CE2-CD1 4.43Å; Y269-L276 HydrophobicContact CE2-CG 4.47Å; Y269-L276 HydrophobicContact CG-CD1 3.39Å; Y269-L276 HydrophobicContact CG-CG 3.76Å; D274-L276 PolarHBondContact O-N 3.25Å; D274-L276 VanDerWaalsContact O-N 3.11Å; L276-Q280 HydrophobicContact CD2-CB 4.11Å |
| 277 | S | 86.3 | Confident | 84.2 | Confident | 37 Ų | 37 | 71.1 Ų | 71.1 | 26% | 0.259 | 38% | 0.381 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 151.4 | 166.9 | 65.1 | 0 | 0 | 0 | 0 | 110.7 | P275 N279 Q280 A281 | P275-S277 PolarHBondContact O-N 3.45Å; S277-N279 PolarHBondContact O-N 2.88Å; S277-Q280 PolarHBondContact O-N 3.5Å; S277-Q280 WeakPolarHBondContact OG-CB 3.37Å; S277-Q280 VanDerWaalsContact OG-CD 3.24Å; S277-Q280 VanDerWaalsContact OG-CG 3.22Å; S277-Q280 WeakPolarHBondContact OG-CG 3.41Å; S277-Q280 PolarHBondContact OG-N 3.26Å; S277-Q280 PolarHBondContact OG-OE1 3Å; S277-A281 PolarHBondContact O-N 3.39Å |
| 278 | I | 87.8 | Confident | 84.8 | Confident | 135 Ų | 135 | 72.5 Ų | 72.5 | 69% | 0.692 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -55.7 | -38.3 | 175.6 | -65.4 | 166.4 | 0 | 0 | 0 | 110.6 | Q280 A281 L282 | I278-Q280 VanDerWaalsContact C-N 3.35Å; I278-Q280 PolarHBondContact O-N 2.85Å; I278-A281 PolarHBondContact O-N 3.25Å; I278-L282 HydrophobicContact CG2-CD1 4.09Å; I278-L282 HydrophobicContact CG2-CG 4.39Å; I278-L282 WeakPolarHBondContact O-CG 3.27Å; I278-L282 PolarHBondContact O-N 3.43Å |
| 279 | N | 88.1 | Confident | 85.7 | Confident | 38 Ų | 38 | 78.4 Ų | 78.4 | 20% | 0.203 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.2 | -40.3 | 177.1 | -66.4 | -14.6 | 0 | 0 | 0 | 112.3 | Y147 S277 G283 | Y147-N279 WeakPolarHBondContact CE2-ND2 3.37Å; Y147-N279 PolarHBondContact OH-ND2 3.26Å; S277-N279 PolarHBondContact O-N 2.88Å; N279-G283 PolarHBondContact O-N 3.45Å |
| 280 | Q | 87.1 | Confident | 86.2 | Confident | 55 Ų | 55 | 73 Ų | 73 | 26% | 0.257 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -68.4 | -39.7 | 175.7 | -73.4 | 163.4 | -36.2 | 0 | 0 | 112 | N144 L276 S277 I278 G283 I284 | N144-Q280 WeakPolarHBondContact OD1-CA 3.5Å; N144-Q280 PolarHBondContact OD1-O 2.99Å; L276-Q280 HydrophobicContact CD2-CB 4.11Å; S277-Q280 PolarHBondContact O-N 3.5Å; S277-Q280 WeakPolarHBondContact OG-CB 3.37Å; S277-Q280 VanDerWaalsContact OG-CD 3.24Å; S277-Q280 VanDerWaalsContact OG-CG 3.22Å; S277-Q280 WeakPolarHBondContact OG-CG 3.41Å; S277-Q280 PolarHBondContact OG-N 3.26Å; S277-Q280 PolarHBondContact OG-OE1 3Å; I278-Q280 VanDerWaalsContact C-N 3.35Å; I278-Q280 PolarHBondContact O-N 2.85Å; Q280-G283 PolarHBondContact O-N 3.4Å; Q280-I284 WeakPolarHBondContact O-CG1 3.45Å; Q280-I284 PolarHBondContact O-N 3.35Å |
| 281 | A | 88.5 | Confident | 86.6 | Confident | 41 Ų | 41 | 69.8 Ų | 69.8 | 34% | 0.339 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.3 | -47.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S277 I278 G283 I284 L285 | S277-A281 PolarHBondContact O-N 3.39Å; I278-A281 PolarHBondContact O-N 3.25Å; A281-G283 VanDerWaalsContact C-N 3.31Å; A281-G283 PolarHBondContact O-N 2.91Å; A281-I284 PolarHBondContact O-N 3.06Å; A281-L285 WeakPolarHBondContact O-CG 3.26Å; A281-L285 PolarHBondContact O-N 2.95Å; A281-L285 VanDerWaalsContact O-N 3.09Å |
| 282 | L | 91.8 | Very high | 87.3 | Confident | 87 Ų | 87 | 69.4 Ų | 69.4 | 46% | 0.455 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.3 | -39 | 174.5 | -69.2 | 175.7 | 0 | 0 | 0 | 112 | L143 I278 L285 C286 | L143-L282 HydrophobicContact CD1-CB 4.28Å; I278-L282 HydrophobicContact CG2-CD1 4.09Å; I278-L282 HydrophobicContact CG2-CG 4.39Å; I278-L282 WeakPolarHBondContact O-CG 3.27Å; I278-L282 PolarHBondContact O-N 3.43Å; L282-L285 PolarHBondContact O-N 3.44Å; L282-C286 WeakPolarHBondContact O-CB 3.32Å; L282-C286 PolarHBondContact O-N 3.42Å |
| 283 | G | 91.4 | Very high | 88.1 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.2 | -44.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | G140 N279 Q280 A281 T287 | G140-G283 VanDerWaalsContact CA-O 3.3Å; G140-G283 WeakPolarHBondContact CA-O 3.34Å; G140-G283 VanDerWaalsContact O-CA 3.26Å; G140-G283 WeakPolarHBondContact O-CA 3.41Å; N279-G283 PolarHBondContact O-N 3.45Å; Q280-G283 PolarHBondContact O-N 3.4Å; A281-G283 VanDerWaalsContact C-N 3.31Å; A281-G283 PolarHBondContact O-N 2.91Å; G283-T287 WeakPolarHBondContact O-CB 3.39Å; G283-T287 PolarHBondContact O-N 3.32Å; G283-T287 PolarHBondContact O-OG1 2.98Å |
| 284 | I | 90.8 | Very high | 88.8 | Confident | 15 Ų | 15 | 55.8 Ų | 55.8 | 8% | 0.077 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.4 | -50 | 173.6 | -69 | 166.3 | 0 | 0 | 0 | 110.6 | C262 L265 Q280 A281 C286 T287 L288 | C262-I284 HydrophobicContact CB-CG2 4.22Å; L265-I284 HydrophobicContact CB-CD1 4.06Å; L265-I284 HydrophobicContact CD1-CD1 4.43Å; L265-I284 HydrophobicContact CD1-CG1 4.33Å; Q280-I284 WeakPolarHBondContact O-CG1 3.45Å; Q280-I284 PolarHBondContact O-N 3.35Å; A281-I284 PolarHBondContact O-N 3.06Å; I284-C286 PolarHBondContact O-N 3.19Å; I284-T287 PolarHBondContact O-N 2.96Å; I284-L288 HydrophobicContact CG2-CD1 3.79Å; I284-L288 HydrophobicContact CG2-CG 4.26Å; I284-L288 WeakPolarHBondContact O-CB 3.49Å; I284-L288 VanDerWaalsContact O-CG 3.32Å; I284-L288 WeakPolarHBondContact O-CG 3.42Å; I284-L288 PolarHBondContact O-N 3.41Å |
| 285 | L | 92.8 | Very high | 89.3 | Confident | 113 Ų | 113 | 54.5 Ų | 54.5 | 59% | 0.592 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -59.9 | -45.1 | -179.5 | -69.7 | 174.2 | 0 | 0 | 0 | 112.2 | A281 L282 L288 F289 | A281-L285 WeakPolarHBondContact O-CG 3.26Å; A281-L285 PolarHBondContact O-N 2.95Å; A281-L285 VanDerWaalsContact O-N 3.09Å; L282-L285 PolarHBondContact O-N 3.44Å; L285-L288 PolarHBondContact O-N 2.77Å; L285-F289 WeakPolarHBondContact O-CB 3.19Å; L285-F289 PolarHBondContact O-N 3.43Å |
| 286 | C | 93.2 | Very high | 89.9 | Confident | 34 Ų | 34 | 54.7 Ų | 54.7 | 23% | 0.23 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 178.9 | -160.7 | 0 | 0 | 0 | 0 | 111.7 | P136 L282 I284 F289 G290 | P136-C286 PolarHBondContact O-SG 2.6Å; L282-C286 WeakPolarHBondContact O-CB 3.32Å; L282-C286 PolarHBondContact O-N 3.42Å; I284-C286 PolarHBondContact O-N 3.19Å; C286-F289 PolarHBondContact O-N 3.23Å; C286-G290 PolarHBondContact O-N 2.9Å |
| 287 | T | 92.5 | Very high | 90.4 | Very high | 1 Ų | 1 | 55 Ų | 55 | 1% | 0.006 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.1 | -47.6 | 177.2 | -54.8 | 0 | 0 | 0 | 0 | 111.5 | I137 G140 H258 G283 I284 F289 G290 I291 | I137-T287 HydrophobicContact CG2-CG2 4.43Å; G140-T287 WeakPolarHBondContact CA-OG1 3.22Å; H258-T287 HydrophobicContact CB-CG2 4.16Å; G283-T287 WeakPolarHBondContact O-CB 3.39Å; G283-T287 PolarHBondContact O-N 3.32Å; G283-T287 PolarHBondContact O-OG1 2.98Å; I284-T287 PolarHBondContact O-N 2.96Å; T287-F289 PolarHBondContact O-N 3.13Å; T287-G290 PolarHBondContact O-N 2.96Å; T287-I291 HydrophobicContact CG2-CD1 3.9Å; T287-I291 WeakPolarHBondContact O-CG1 3.39Å; T287-I291 PolarHBondContact O-N 3.43Å |
| 288 | L | 92.6 | Very high | 90.4 | Very high | 52 Ų | 52 | 55 Ų | 55 | 27% | 0.272 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.7 | -42.6 | 178.5 | -70.8 | 177.3 | 0 | 0 | 0 | 111.8 | F259 C262 I284 L285 G290 I291 L292 | F259-L288 HydrophobicContact CD2-CD2 3.74Å; F259-L288 HydrophobicContact CE2-CD2 4.01Å; C262-L288 HydrophobicContact CB-CD2 4.17Å; C262-L288 HydrophobicContact CB-CG 4.48Å; I284-L288 HydrophobicContact CG2-CD1 3.79Å; I284-L288 HydrophobicContact CG2-CG 4.26Å; I284-L288 WeakPolarHBondContact O-CB 3.49Å; I284-L288 VanDerWaalsContact O-CG 3.32Å; I284-L288 WeakPolarHBondContact O-CG 3.42Å; I284-L288 PolarHBondContact O-N 3.41Å; L285-L288 PolarHBondContact O-N 2.77Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.16Å; L288-I291 PolarHBondContact O-N 2.79Å; L288-L292 WeakPolarHBondContact O-CB 3.41Å; L288-L292 VanDerWaalsContact O-CG 3.32Å; L288-L292 WeakPolarHBondContact O-CG 3.22Å; L288-L292 PolarHBondContact O-N 3.32Å |
| 289 | F | 93.8 | Very high | 90.1 | Very high | 138 Ų | 138 | 52 Ų | 52 | 61% | 0.605 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -56.8 | -47.4 | 174.6 | 175.8 | -98.7 | 0 | 0 | 0 | 111.7 | P136 L285 C286 T287 I291 L292 A293 | P136-F289 HydrophobicContact CB-CD1 4.21Å; P136-F289 HydrophobicContact CG-CD1 4.33Å; L285-F289 WeakPolarHBondContact O-CB 3.19Å; L285-F289 PolarHBondContact O-N 3.43Å; C286-F289 PolarHBondContact O-N 3.23Å; T287-F289 PolarHBondContact O-N 3.13Å; F289-I291 PolarHBondContact O-N 3.41Å; F289-L292 PolarHBondContact O-N 2.97Å; F289-A293 WeakPolarHBondContact O-CB 3.47Å; F289-A293 PolarHBondContact O-N 2.87Å |
| 290 | G | 92.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.7 | -39.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | C286 T287 L288 Y294 | C286-G290 PolarHBondContact O-N 2.9Å; T287-G290 PolarHBondContact O-N 2.96Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.16Å; G290-Y294 WeakPolarHBondContact O-CB 3.18Å; G290-Y294 PolarHBondContact O-N 3.45Å |
| 291 | I | 91 | Very high | 89.8 | Confident | 14 Ų | 14 | 53.2 Ų | 53.2 | 7% | 0.072 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -67.4 | -41.9 | 177.2 | -66.7 | 165.2 | 0 | 0 | 0 | 111.5 | I137 M255 H258 F259 T287 L288 F289 Y294 T295 | I137-I291 HydrophobicContact CD1-CG1 4.2Å; I137-I291 HydrophobicContact CG1-CG1 4.45Å; M255-I291 HydrophobicContact SD-CG1 4.46Å; H258-I291 HydrophobicContact CB-CD1 3.86Å; F259-I291 HydrophobicContact CB-CD1 4.02Å; T287-I291 HydrophobicContact CG2-CD1 3.9Å; T287-I291 WeakPolarHBondContact O-CG1 3.39Å; T287-I291 PolarHBondContact O-N 3.43Å; L288-I291 PolarHBondContact O-N 2.79Å; F289-I291 PolarHBondContact O-N 3.41Å; I291-Y294 PolarHBondContact O-N 3.26Å; I291-T295 WeakPolarHBondContact O-CB 3.3Å; I291-T295 PolarHBondContact O-N 3.05Å; I291-T295 PolarHBondContact O-OG1 3.45Å |
| 292 | L | 90.8 | Very high | 89.3 | Confident | 125 Ų | 125 | 55.7 Ų | 55.7 | 65% | 0.654 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -64.3 | -45.6 | 176.7 | -71 | 174.3 | 0 | 0 | 0 | 111 | L288 F289 Y294 T295 H296 | L288-L292 WeakPolarHBondContact O-CB 3.41Å; L288-L292 VanDerWaalsContact O-CG 3.32Å; L288-L292 WeakPolarHBondContact O-CG 3.22Å; L288-L292 PolarHBondContact O-N 3.32Å; F289-L292 PolarHBondContact O-N 2.97Å; L292-Y294 VanDerWaalsContact C-N 3.34Å; L292-Y294 PolarHBondContact O-N 2.82Å; L292-T295 PolarHBondContact O-N 3.33Å; L292-H296 WeakPolarHBondContact O-CB 3.3Å; L292-H296 PolarHBondContact O-N 3.44Å |
| 293 | A | 91.6 | Very high | 88.7 | Confident | 20 Ų | 20 | 55.9 Ų | 55.9 | 17% | 0.165 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | T133 F289 T295 H296 F297 | T133-A293 HydrophobicContact CG2-CB 3.77Å; F289-A293 WeakPolarHBondContact O-CB 3.47Å; F289-A293 PolarHBondContact O-N 2.87Å; A293-T295 VanDerWaalsContact C-N 3.34Å; A293-T295 PolarHBondContact O-N 3.25Å; A293-H296 PolarHBondContact O-N 3.38Å; A293-F297 HydrophobicContact CB-CE2 4.22Å; A293-F297 WeakPolarHBondContact O-CD2 3.33Å; A293-F297 WeakPolarHBondContact O-CG 3.41Å; A293-F297 PolarHBondContact O-N 2.91Å |
| 294 | Y | 90.3 | Very high | 87.9 | Confident | 6 Ų | 6 | 57.5 Ų | 57.5 | 2% | 0.024 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58.9 | -47.9 | 177 | 172.7 | -91.6 | 0 | 0 | 0 | 111.1 | I130 V251 T252 M255 G290 I291 L292 H296 F297 K298 | I130-Y294 HydrophobicContact CG2-CD2 3.85Å; I130-Y294 HydrophobicContact CG2-CE2 3.62Å; V251-Y294 HydrophobicContact CG1-CE2 3.69Å; V251-Y294 VanDerWaalsContact CG1-OH 3.24Å; V251-Y294 WeakPolarHBondContact CG1-OH 3.44Å; T252-Y294 PolarHBondContact OG1-OH 2.73Å; M255-Y294 HydrophobicContact CB-CD1 4.31Å; M255-Y294 HydrophobicContact CB-CE1 4.38Å; M255-Y294 HydrophobicContact CG-CD1 3.68Å; M255-Y294 HydrophobicContact CG-CD2 4.33Å; M255-Y294 HydrophobicContact CG-CE1 3.72Å; M255-Y294 HydrophobicContact CG-CE2 4.35Å; M255-Y294 HydrophobicContact CG-CG 4Å; M255-Y294 HydrophobicContact SD-CD1 4.24Å; M255-Y294 HydrophobicContact SD-CD2 4.3Å; M255-Y294 HydrophobicContact SD-CG 4.01Å; G290-Y294 WeakPolarHBondContact O-CB 3.18Å; G290-Y294 PolarHBondContact O-N 3.45Å; I291-Y294 PolarHBondContact O-N 3.26Å; L292-Y294 VanDerWaalsContact C-N 3.34Å; L292-Y294 PolarHBondContact O-N 2.82Å; Y294-H296 PolarHBondContact O-N 3.09Å; Y294-F297 PolarHBondContact O-N 3.26Å; Y294-K298 HydrophobicContact CE1-CB 4.46Å; Y294-K298 HydrophobicContact CE1-CD 3.88Å; Y294-K298 VanDerWaalsContact O-CB 3.23Å; Y294-K298 WeakPolarHBondContact O-CB 3.4Å; Y294-K298 PolarHBondContact O-N 3.22Å |
| 295 | T | 87.7 | Confident | 87.1 | Confident | 65 Ų | 65 | 60.1 Ų | 60.1 | 40% | 0.399 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | -178.6 | -57.5 | 0 | 0 | 0 | 0 | 110.6 | I291 L292 A293 K298 L299 | I291-T295 WeakPolarHBondContact O-CB 3.3Å; I291-T295 PolarHBondContact O-N 3.05Å; I291-T295 PolarHBondContact O-OG1 3.45Å; L292-T295 PolarHBondContact O-N 3.33Å; A293-T295 VanDerWaalsContact C-N 3.34Å; A293-T295 PolarHBondContact O-N 3.25Å; T295-K298 PolarHBondContact O-N 3.02Å; T295-L299 HydrophobicContact CG2-CD1 4.02Å; T295-L299 WeakPolarHBondContact O-CB 3.39Å; T295-L299 VanDerWaalsContact O-CG 3.28Å; T295-L299 WeakPolarHBondContact O-CG 3.3Å; T295-L299 PolarHBondContact O-N 3.08Å |
| 296 | H | 88.2 | Confident | 85.8 | Confident | 122 Ų | 122 | 60.6 Ų | 60.6 | 57% | 0.565 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -61 | -50.4 | 177.4 | 178.9 | -94.6 | 0 | 0 | 0 | 112.3 | L292 A293 Y294 K298 L299 S300 | L292-H296 WeakPolarHBondContact O-CB 3.3Å; L292-H296 PolarHBondContact O-N 3.44Å; A293-H296 PolarHBondContact O-N 3.38Å; Y294-H296 PolarHBondContact O-N 3.09Å; H296-K298 PolarHBondContact O-N 2.94Å; H296-L299 PolarHBondContact O-N 3.13Å; H296-S300 WeakPolarHBondContact O-CB 3.44Å; H296-S300 PolarHBondContact O-N 2.99Å |
| 297 | F | 89.5 | Confident | 84.6 | Confident | 56 Ų | 56 | 64 Ų | 64 | 25% | 0.246 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -65.1 | -39.9 | 179.6 | -66.5 | -44 | 0 | 0 | 0 | 112.5 | R129 I130 T133 A293 Y294 L299 S300 E301 | R129-F297 HydrophobicContact CB-CD1 4.29Å; R129-F297 HydrophobicContact CB-CD2 3.96Å; R129-F297 HydrophobicContact CB-CE1 4.5Å; R129-F297 HydrophobicContact CB-CE2 4.17Å; R129-F297 HydrophobicContact CB-CG 4.03Å; R129-F297 HydrophobicContact CB-CZ 4.44Å; I130-F297 HydrophobicContact CG1-CB 4.15Å; T133-F297 HydrophobicContact CG2-CD2 3.65Å; T133-F297 HydrophobicContact CG2-CE2 3.91Å; A293-F297 HydrophobicContact CB-CE2 4.22Å; A293-F297 WeakPolarHBondContact O-CD2 3.33Å; A293-F297 WeakPolarHBondContact O-CG 3.41Å; A293-F297 PolarHBondContact O-N 2.91Å; Y294-F297 PolarHBondContact O-N 3.26Å; F297-L299 PolarHBondContact O-N 3.05Å; F297-S300 PolarHBondContact O-N 2.98Å; F297-E301 WeakPolarHBondContact O-CG 3.43Å; F297-E301 PolarHBondContact O-N 3.37Å |
| 298 | K | 86 | Confident | 83.5 | Confident | 39 Ų | 39 | 71.1 Ų | 71.1 | 17% | 0.17 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 176.6 | -172.1 | -177.9 | -176.6 | -168.7 | 0 | 111.8 | S249 T252 Y294 T295 H296 E301 Q302 | S249-K298 PolarHBondContact OG-NZ 3.06Å; T252-K298 PolarHBondContact OG1-NZ 3.24Å; Y294-K298 HydrophobicContact CE1-CB 4.46Å; Y294-K298 HydrophobicContact CE1-CD 3.88Å; Y294-K298 VanDerWaalsContact O-CB 3.23Å; Y294-K298 WeakPolarHBondContact O-CB 3.4Å; Y294-K298 PolarHBondContact O-N 3.22Å; T295-K298 PolarHBondContact O-N 3.02Å; H296-K298 PolarHBondContact O-N 2.94Å; K298-E301 PolarHBondContact O-N 3.42Å; K298-Q302 WeakPolarHBondContact O-CG 3.37Å; K298-Q302 PolarHBondContact O-N 2.93Å; K298-Q302 VanDerWaalsContact O-N 3.09Å |
| 299 | L | 83.1 | Confident | 82.3 | Confident | 71 Ų | 71 | 74.5 Ų | 74.5 | 37% | 0.372 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.1 | -44.3 | 177.5 | -73.4 | 171.3 | 0 | 0 | 0 | 111.2 | T295 H296 F297 E301 Q302 E303 | T295-L299 HydrophobicContact CG2-CD1 4.02Å; T295-L299 WeakPolarHBondContact O-CB 3.39Å; T295-L299 VanDerWaalsContact O-CG 3.28Å; T295-L299 WeakPolarHBondContact O-CG 3.3Å; T295-L299 PolarHBondContact O-N 3.08Å; H296-L299 PolarHBondContact O-N 3.13Å; F297-L299 PolarHBondContact O-N 3.05Å; L299-E301 VanDerWaalsContact C-N 3.34Å; L299-E301 PolarHBondContact O-N 2.89Å; L299-Q302 PolarHBondContact O-N 2.89Å; L299-E303 WeakPolarHBondContact O-CG 3.37Å; L299-E303 PolarHBondContact O-N 3.21Å |
| 300 | S | 83.9 | Confident | 80.8 | Confident | 56 Ų | 56 | 72 Ų | 72 | 39% | 0.392 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.7 | -40.8 | 177 | -176.5 | 0 | 0 | 0 | 0 | 112.6 | H296 F297 E303 G304 | H296-S300 WeakPolarHBondContact O-CB 3.44Å; H296-S300 PolarHBondContact O-N 2.99Å; F297-S300 PolarHBondContact O-N 2.98Å; S300-E303 PolarHBondContact O-N 2.91Å; S300-G304 PolarHBondContact O-N 3.44Å |
| 301 | E | 84.3 | Confident | 79 | Confident | 63 Ų | 63 | 79.5 Ų | 79.5 | 29% | 0.294 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -69.7 | -36 | 177.3 | -77.4 | 175.1 | -160.9 | 0 | 0 | 113.3 | S127 I130 F297 K298 L299 E303 S305 | S127-E301 WeakPolarHBondContact CB-OE1 3.4Å; S127-E301 PolarHBondContact OG-OE1 3.44Å; I130-E301 WeakPolarHBondContact CD1-OE2 3.46Å; F297-E301 WeakPolarHBondContact O-CG 3.43Å; F297-E301 PolarHBondContact O-N 3.37Å; K298-E301 PolarHBondContact O-N 3.42Å; L299-E301 VanDerWaalsContact C-N 3.34Å; L299-E301 PolarHBondContact O-N 2.89Å; E301-E303 VanDerWaalsContact C-N 3.31Å; E301-S305 WeakPolarHBondContact O-CB 3.38Å; E301-S305 PolarHBondContact O-N 3.35Å; E301-S305 PolarHBondContact O-OG 3.04Å |
| 302 | Q | 78.8 | Confident | 77 | Confident | 92 Ų | 92 | 88 Ų | 88 | 43% | 0.43 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.5 | -36.9 | 173.5 | -74.3 | -177.4 | -16.3 | 0 | 0 | 111.8 | K298 L299 K306 | K298-Q302 WeakPolarHBondContact O-CG 3.37Å; K298-Q302 PolarHBondContact O-N 2.93Å; K298-Q302 VanDerWaalsContact O-N 3.09Å; L299-Q302 PolarHBondContact O-N 2.89Å; Q302-K306 WeakPolarHBondContact O-CG 3.48Å; Q302-K306 PolarHBondContact O-N 3.3Å |
| 303 | E | 78.2 | Confident | 74.9 | Confident | 92 Ų | 92 | 91.6 Ų | 91.6 | 43% | 0.43 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.6 | -48.5 | 174.4 | -75.3 | 178.2 | 168.9 | 0 | 0 | 112.2 | R7 L299 S300 E301 S305 K306 N307 | R7-E303 IonicContact NH2-OE1 2.72Å; L299-E303 WeakPolarHBondContact O-CG 3.37Å; L299-E303 PolarHBondContact O-N 3.21Å; S300-E303 PolarHBondContact O-N 2.91Å; E301-E303 VanDerWaalsContact C-N 3.31Å; E303-S305 VanDerWaalsContact C-N 3.33Å; E303-S305 PolarHBondContact O-N 3.49Å; E303-K306 PolarHBondContact O-N 3.15Å; E303-N307 PolarHBondContact O-N 3.22Å |
| 304 | G | 74.3 | Confident | 74 | Confident | 34 Ų | 34 | 95.2 Ų | 95.2 | 35% | 0.351 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61 | -39.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | S300 K308 | S300-G304 PolarHBondContact O-N 3.44Å; G304-K308 WeakPolarHBondContact O-CG 3.27Å; G304-K308 PolarHBondContact O-N 3.45Å |
| 305 | S | 73.9 | Confident | 73.2 | Confident | 69 Ų | 69 | 99.8 Ų | 99.8 | 48% | 0.483 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.3 | -40.4 | 177.2 | -59.7 | 0 | 0 | 0 | 0 | 112.1 | E301 E303 K308 L309 | E301-S305 WeakPolarHBondContact O-CB 3.38Å; E301-S305 PolarHBondContact O-N 3.35Å; E301-S305 PolarHBondContact O-OG 3.04Å; E303-S305 VanDerWaalsContact C-N 3.33Å; E303-S305 PolarHBondContact O-N 3.49Å; S305-K308 PolarHBondContact O-N 2.86Å; S305-L309 PolarHBondContact O-N 3.38Å; S305-L309 VanDerWaalsContact O-N 3.15Å |
| 306 | K | 65.9 | Low | 72.4 | Confident | 124 Ų | 124 | 101.8 Ų | 101.8 | 54% | 0.539 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.1 | -40.8 | 177.4 | -77.1 | -179.5 | 177.6 | -174.2 | 0 | 112.4 | Q302 E303 K308 L309 A310 | Q302-K306 WeakPolarHBondContact O-CG 3.48Å; Q302-K306 PolarHBondContact O-N 3.3Å; E303-K306 PolarHBondContact O-N 3.15Å; K306-K308 VanDerWaalsContact C-N 3.3Å; K306-K308 PolarHBondContact O-N 2.89Å; K306-L309 PolarHBondContact O-N 3.13Å; K306-A310 PolarHBondContact O-N 2.92Å |
| 307 | N | 68.8 | Low | 71.4 | Confident | 104 Ų | 104 | 100.6 Ų | 100.6 | 56% | 0.556 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63 | -37.9 | 177 | -73 | -3.6 | 0 | 0 | 0 | 111.7 | E303 A310 Q311 | E303-N307 PolarHBondContact O-N 3.22Å; N307-A310 PolarHBondContact O-N 2.92Å; N307-Q311 WeakPolarHBondContact O-CB 3.2Å; N307-Q311 VanDerWaalsContact O-CG 3.29Å; N307-Q311 WeakPolarHBondContact O-CG 3.25Å; N307-Q311 PolarHBondContact O-N 3.4Å |
| 308 | K | 69.5 | Low | 70.3 | Confident | 152 Ų | 152 | 103.4 Ų | 103.4 | 66% | 0.661 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.7 | -36 | 173.8 | -72 | -178.7 | -178.6 | -174.5 | 0 | 113.2 | G304 S305 K306 R312 | G304-K308 WeakPolarHBondContact O-CG 3.27Å; G304-K308 PolarHBondContact O-N 3.45Å; S305-K308 PolarHBondContact O-N 2.86Å; K306-K308 VanDerWaalsContact C-N 3.3Å; K306-K308 PolarHBondContact O-N 2.89Å; K308-R312 PolarHBondContact O-N 3.1Å |
| 309 | L | 65.8 | Low | 69.3 | Low | 123 Ų | 123 | 107.7 Ų | 107.7 | 64% | 0.644 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -71.3 | -37.1 | 175.7 | -92.7 | 140.2 | 0 | 0 | 0 | 112.4 | S305 K306 Q311 R312 | S305-L309 PolarHBondContact O-N 3.38Å; S305-L309 VanDerWaalsContact O-N 3.15Å; K306-L309 PolarHBondContact O-N 3.13Å; L309-Q311 PolarHBondContact O-N 3.11Å; L309-R312 PolarHBondContact O-N 3.22Å |
| 310 | A | 62.8 | Low | 68.3 | Low | 85 Ų | 85 | 110.3 Ų | 110.3 | 70% | 0.702 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72 | -16.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | K306 N307 | K306-A310 PolarHBondContact O-N 2.92Å; N307-A310 PolarHBondContact O-N 2.92Å |
| 311 | Q | 55 | Low | 67.1 | Low | 157 Ų | 157 | 114.5 Ų | 114.5 | 73% | 0.734 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -0.5 | 178.9 | -72 | 176.7 | -8.2 | 0 | 0 | 113.6 | N307 L309 | N307-Q311 WeakPolarHBondContact O-CB 3.2Å; N307-Q311 VanDerWaalsContact O-CG 3.29Å; N307-Q311 WeakPolarHBondContact O-CG 3.25Å; N307-Q311 PolarHBondContact O-N 3.4Å; L309-Q311 PolarHBondContact O-N 3.11Å |
| 312 | R | 48.2 | Very low | 65.7 | Low | 194 Ų | 194 | 118.8 Ų | 118.8 | 73% | 0.732 | 63% | 0.629 | S | S | * | * | trans | -78.1 | 122 | 170.3 | -77.6 | -178.1 | 177.8 | -169 | -2.4 | 108.3 | K308 L309 | K308-R312 PolarHBondContact O-N 3.1Å; L309-R312 PolarHBondContact O-N 3.22Å | ||
| 313 | P | 46.7 | Very low | 64.5 | Low | 199 Ų | 199 | 121.2 Ų | 121.2 | 100% | 1.292 | 65% | 0.648 | S | S | * | * | trans | -63.7 | 0 | 178.9 | 27.8 | -34 | 0 | 0 | 0 | 112.2 |
Retrieved 313 of 313 residues in 1374.2 ms
(Link to these results)