| 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 | 57.7 | Low | 80.3 | Confident | 165 Ų | 165 | 85.4 Ų | 85.4 | 81% | 0.813 | 47% | 0.473 | S | S | * | . | 0 | 140.9 | 0 | -76.7 | 165.6 | 69.3 | 0 | 0 | 109.1 | A5 V6 L9 | M1-A5 HydrophobicContact CB-CB 4.14Å; M1-A5 HydrophobicContact CE-CB 3.99Å; M1-A5 HydrophobicContact CG-CB 4.5Å; M1-V6 HydrophobicContact CB-CG2 3.83Å; M1-V6 HydrophobicContact CE-CG2 4.2Å; M1-L9 HydrophobicContact CE-CB 4.3Å; M1-L9 HydrophobicContact CE-CD2 3.99Å | |||
| 2 | S | 72.2 | Confident | 81 | Confident | 84 Ų | 84 | 83.9 Ų | 83.9 | 59% | 0.587 | 46% | 0.458 | S | S | * | . | trans | -63.2 | 153.9 | 171.3 | 67.1 | 0 | 0 | 0 | 0 | 110.1 | G4 A5 V6 | S2-G4 PolarHBondContact O-N 3.02Å; S2-G4 VanDerWaalsContact O-N 3.15Å; S2-A5 WeakPolarHBondContact O-CB 3.33Å; S2-A5 PolarHBondContact O-N 3.21Å; S2-A5 PolarHBondContact OG-N 2.84Å; S2-V6 PolarHBondContact O-N 3.2Å; S2-V6 VanDerWaalsContact O-N 3.15Å | ||
| 3 | K | 77.3 | Confident | 81.9 | Confident | 197 Ų | 197 | 84.8 Ų | 84.8 | 86% | 0.857 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -51.9 | -38.1 | 176.8 | -70.8 | -176.7 | 178.6 | -179.8 | 0 | 111.9 | V6 F7 | K3-V6 PolarHBondContact O-N 3.21Å; K3-F7 PolarHBondContact O-N 3.28Å; K3-F7 VanDerWaalsContact O-N 3.12Å |
| 4 | G | 78.3 | Confident | 82.5 | Confident | 20 Ų | 20 | 83.1 Ų | 83.1 | 21% | 0.206 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | S2 V6 F7 L8 F121 | S2-G4 PolarHBondContact O-N 3.02Å; S2-G4 VanDerWaalsContact O-N 3.15Å; G4-V6 VanDerWaalsContact C-N 3.34Å; G4-V6 PolarHBondContact O-N 3Å; G4-F7 PolarHBondContact O-N 2.9Å; G4-L8 WeakPolarHBondContact O-CB 3.46Å; G4-L8 WeakPolarHBondContact O-CG 3.4Å; G4-L8 PolarHBondContact O-N 3.44Å; G4-F121 VanDerWaalsContact CA-CD1 3.44Å |
| 5 | A | 78.7 | Confident | 83 | Confident | 33 Ų | 33 | 79.3 Ų | 79.3 | 27% | 0.273 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.6 | -37.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M1 S2 L9 | M1-A5 HydrophobicContact CB-CB 4.14Å; M1-A5 HydrophobicContact CE-CB 3.99Å; M1-A5 HydrophobicContact CG-CB 4.5Å; S2-A5 WeakPolarHBondContact O-CB 3.33Å; S2-A5 PolarHBondContact O-N 3.21Å; S2-A5 PolarHBondContact OG-N 2.84Å; A5-L9 WeakPolarHBondContact O-CB 3.29Å; A5-L9 PolarHBondContact O-N 2.86Å |
| 6 | V | 81.9 | Confident | 83.4 | Confident | 83 Ų | 83 | 76.3 Ų | 76.3 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.6 | -42.1 | 176.3 | 178.2 | 0 | 0 | 0 | 0 | 111 | M1 S2 K3 G4 L9 G10 | M1-V6 HydrophobicContact CB-CG2 3.83Å; M1-V6 HydrophobicContact CE-CG2 4.2Å; S2-V6 PolarHBondContact O-N 3.2Å; S2-V6 VanDerWaalsContact O-N 3.15Å; K3-V6 PolarHBondContact O-N 3.21Å; G4-V6 VanDerWaalsContact C-N 3.34Å; G4-V6 PolarHBondContact O-N 3Å; V6-L9 PolarHBondContact O-N 3.45Å; V6-G10 PolarHBondContact O-N 2.8Å |
| 7 | F | 84.9 | Confident | 83.6 | Confident | 124 Ų | 124 | 76.2 Ų | 76.2 | 54% | 0.544 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -70.1 | -40.9 | 179 | -166 | -90.3 | 0 | 0 | 0 | 112.6 | K3 G4 L9 G10 I11 F121 | K3-F7 PolarHBondContact O-N 3.28Å; K3-F7 VanDerWaalsContact O-N 3.12Å; G4-F7 PolarHBondContact O-N 2.9Å; F7-L9 VanDerWaalsContact C-N 3.3Å; F7-L9 PolarHBondContact O-N 3.47Å; F7-G10 WeakPolarHBondContact O-CA 3.44Å; F7-G10 PolarHBondContact O-N 2.55Å; F7-G10 VanDerWaalsContact O-N 3.09Å; F7-I11 HydrophobicContact CD1-CD1 3.56Å; F7-I11 HydrophobicContact CD1-CG1 4.06Å; F7-I11 HydrophobicContact CE1-CD1 3.43Å; F7-I11 VanDerWaalsContact CE1-CD1 3.43Å; F7-I11 HydrophobicContact CE1-CG1 3.96Å; F7-I11 PolarHBondContact O-N 3.17Å; F7-F121 HydrophobicContact CB-CE1 3.99Å; F7-F121 HydrophobicContact CB-CZ 4.25Å; F7-F121 AromaticContact CD1-CE1 3.72Å; F7-F121 HydrophobicContact CD1-CE1 3.72Å; F7-F121 HydrophobicContact CD1-CE2 4.04Å; F7-F121 AromaticContact CD1-CZ 3.15Å; F7-F121 HydrophobicContact CD1-CZ 3.15Å; F7-F121 AromaticContact CE1-CZ 3.69Å; F7-F121 HydrophobicContact CE1-CZ 3.69Å; F7-F121 HydrophobicContact CG-CE1 4.17Å; F7-F121 HydrophobicContact CG-CZ 4.04Å |
| 8 | L | 86 | Confident | 83.8 | Confident | 59 Ų | 59 | 78.2 Ų | 78.2 | 31% | 0.309 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -56.4 | -44.7 | 170.9 | -83.5 | 174.2 | 0 | 0 | 0 | 111.7 | G4 G10 I11 F12 L117 F121 | G4-L8 WeakPolarHBondContact O-CB 3.46Å; G4-L8 WeakPolarHBondContact O-CG 3.4Å; G4-L8 PolarHBondContact O-N 3.44Å; L8-G10 VanDerWaalsContact C-N 3.31Å; L8-G10 PolarHBondContact O-N 3Å; L8-I11 PolarHBondContact O-N 2.79Å; L8-F12 WeakPolarHBondContact O-CB 3.33Å; L8-F12 PolarHBondContact O-N 3.42Å; L8-L117 HydrophobicContact CD2-CB 4.18Å; L8-L117 HydrophobicContact CD2-CD2 4.05Å; L8-F121 HydrophobicContact CD1-CB 3.64Å; L8-F121 HydrophobicContact CD1-CD2 3.97Å; L8-F121 HydrophobicContact CD1-CG 3.82Å; L8-F121 HydrophobicContact CD2-CB 4.44Å; L8-F121 HydrophobicContact CD2-CD2 3.21Å; L8-F121 HydrophobicContact CD2-CE2 3.69Å; L8-F121 HydrophobicContact CD2-CG 3.95Å; L8-F121 HydrophobicContact CG-CB 4Å; L8-F121 HydrophobicContact CG-CD1 4.25Å; L8-F121 HydrophobicContact CG-CD2 3.37Å; L8-F121 HydrophobicContact CG-CE2 3.96Å; L8-F121 HydrophobicContact CG-CG 3.57Å |
| 9 | L | 86.6 | Confident | 83.9 | Confident | 81 Ų | 81 | 74.8 Ų | 74.8 | 42% | 0.424 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -61.6 | -41.6 | 174.7 | -178.4 | 62.7 | 0 | 0 | 0 | 110.9 | M1 A5 V6 F7 F12 L13 | M1-L9 HydrophobicContact CE-CB 4.3Å; M1-L9 HydrophobicContact CE-CD2 3.99Å; A5-L9 WeakPolarHBondContact O-CB 3.29Å; A5-L9 PolarHBondContact O-N 2.86Å; V6-L9 PolarHBondContact O-N 3.45Å; F7-L9 VanDerWaalsContact C-N 3.3Å; F7-L9 PolarHBondContact O-N 3.47Å; L9-F12 PolarHBondContact O-N 3.45Å; L9-L13 HydrophobicContact CD1-CD1 4.32Å; L9-L13 HydrophobicContact CD1-CG 4.2Å; L9-L13 HydrophobicContact CG-CD1 4.06Å; L9-L13 HydrophobicContact CG-CG 4.36Å; L9-L13 WeakPolarHBondContact O-CB 3.06Å; L9-L13 VanDerWaalsContact O-CG 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.34Å; L9-L13 PolarHBondContact O-N 2.88Å |
| 10 | G | 89.7 | Confident | 84 | Confident | 40 Ų | 40 | 76.4 Ų | 76.4 | 41% | 0.412 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.7 | -46.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | V6 F7 L8 L13 A14 | V6-G10 PolarHBondContact O-N 2.8Å; F7-G10 WeakPolarHBondContact O-CA 3.44Å; F7-G10 PolarHBondContact O-N 2.55Å; F7-G10 VanDerWaalsContact O-N 3.09Å; L8-G10 VanDerWaalsContact C-N 3.31Å; L8-G10 PolarHBondContact O-N 3Å; G10-L13 PolarHBondContact O-N 2.99Å; G10-A14 WeakPolarHBondContact O-CB 3.39Å; G10-A14 PolarHBondContact O-N 3.21Å |
| 11 | I | 89.7 | Confident | 83.9 | Confident | 53 Ų | 53 | 78.2 Ų | 78.2 | 27% | 0.272 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 175.5 | -67.7 | 168.6 | 0 | 0 | 0 | 110.8 | F7 L8 A14 A15 F78 L117 F121 | F7-I11 HydrophobicContact CD1-CD1 3.56Å; F7-I11 HydrophobicContact CD1-CG1 4.06Å; F7-I11 HydrophobicContact CE1-CD1 3.43Å; F7-I11 VanDerWaalsContact CE1-CD1 3.43Å; F7-I11 HydrophobicContact CE1-CG1 3.96Å; F7-I11 PolarHBondContact O-N 3.17Å; L8-I11 PolarHBondContact O-N 2.79Å; I11-A14 PolarHBondContact O-N 2.95Å; I11-A15 WeakPolarHBondContact O-CB 3.26Å; I11-A15 PolarHBondContact O-N 3.39Å; I11-F78 HydrophobicContact CG2-CE1 4.34Å; I11-F78 HydrophobicContact CG2-CZ 4.2Å; I11-L117 HydrophobicContact CD1-CD2 3.65Å; I11-L117 HydrophobicContact CG2-CD2 4.17Å; I11-F121 HydrophobicContact CD1-CE2 4.17Å; I11-F121 HydrophobicContact CD1-CZ 4.45Å |
| 12 | F | 89.6 | Confident | 85.1 | Confident | 68 Ų | 68 | 72.4 Ų | 72.4 | 30% | 0.298 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.2 | -47.6 | 178.5 | 179.8 | -99.9 | 0 | 0 | 0 | 111.6 | L8 L9 A14 A15 C16 F74 F78 I80 | L8-F12 WeakPolarHBondContact O-CB 3.33Å; L8-F12 PolarHBondContact O-N 3.42Å; L9-F12 PolarHBondContact O-N 3.45Å; F12-A14 PolarHBondContact O-N 2.92Å; F12-A15 PolarHBondContact O-N 3.29Å; F12-C16 VanDerWaalsContact CE1-SG 3.59Å; F12-C16 WeakPolarHBondContact O-CB 3.31Å; F12-C16 PolarHBondContact O-N 2.88Å; F12-C16 PolarHBondContact O-SG 2.75Å; F12-C16 VanDerWaalsContact O-SG 3.34Å; F12-F74 HydrophobicContact CD2-CZ 4.09Å; F12-F74 HydrophobicContact CE2-CE1 4.07Å; F12-F74 HydrophobicContact CE2-CE2 4.28Å; F12-F74 AromaticContact CE2-CZ 3.43Å; F12-F74 HydrophobicContact CE2-CZ 3.43Å; F12-F74 VanDerWaalsContact CE2-CZ 3.43Å; F12-F74 AromaticContact CZ-CZ 3.92Å; F12-F74 HydrophobicContact CZ-CZ 3.92Å; F12-F78 HydrophobicContact CB-CD1 4.42Å; F12-F78 HydrophobicContact CB-CE1 3.9Å; F12-F78 HydrophobicContact CB-CZ 4.23Å; F12-F78 HydrophobicContact CD2-CB 4.33Å; F12-F78 AromaticContact CD2-CD1 3.61Å; F12-F78 HydrophobicContact CD2-CD1 3.61Å; F12-F78 AromaticContact CD2-CD2 3.82Å; F12-F78 HydrophobicContact CD2-CD2 3.82Å; F12-F78 AromaticContact CD2-CE1 3.76Å; F12-F78 HydrophobicContact CD2-CE1 3.76Å; F12-F78 AromaticContact CD2-CE2 3.97Å; F12-F78 HydrophobicContact CD2-CE2 3.97Å; F12-F78 AromaticContact CD2-CG 3.64Å; F12-F78 HydrophobicContact CD2-CG 3.64Å; F12-F78 AromaticContact CD2-CZ 3.94Å; F12-F78 HydrophobicContact CD2-CZ 3.94Å; F12-F78 HydrophobicContact CE2-CB 4.36Å; F12-F78 HydrophobicContact CE2-CD1 4.43Å; F12-F78 HydrophobicContact CE2-CD2 4.11Å; F12-F78 HydrophobicContact CE2-CG 4.05Å; F12-F78 HydrophobicContact CG-CE1 4.34Å; F12-I80 HydrophobicContact CE2-CD1 4.17Å |
| 13 | L | 91.9 | Very high | 85.4 | Confident | 95 Ų | 95 | 72.3 Ų | 72.3 | 50% | 0.497 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.4 | -40.2 | 177.1 | -68.9 | 175.2 | 0 | 0 | 0 | 111.8 | L9 G10 C16 S17 | L9-L13 HydrophobicContact CD1-CD1 4.32Å; L9-L13 HydrophobicContact CD1-CG 4.2Å; L9-L13 HydrophobicContact CG-CD1 4.06Å; L9-L13 HydrophobicContact CG-CG 4.36Å; L9-L13 WeakPolarHBondContact O-CB 3.06Å; L9-L13 VanDerWaalsContact O-CG 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.34Å; L9-L13 PolarHBondContact O-N 2.88Å; G10-L13 PolarHBondContact O-N 2.99Å; L13-C16 PolarHBondContact O-N 3.36Å; L13-S17 WeakPolarHBondContact O-CB 3.46Å; L13-S17 PolarHBondContact O-N 2.8Å; L13-S17 PolarHBondContact O-OG 3.02Å |
| 14 | A | 90.7 | Very high | 85.5 | Confident | 61 Ų | 61 | 67.6 Ų | 67.6 | 50% | 0.504 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | G10 I11 F12 S17 L18 | G10-A14 WeakPolarHBondContact O-CB 3.39Å; G10-A14 PolarHBondContact O-N 3.21Å; I11-A14 PolarHBondContact O-N 2.95Å; F12-A14 PolarHBondContact O-N 2.92Å; A14-S17 PolarHBondContact O-N 2.66Å; A14-L18 WeakPolarHBondContact O-CB 3.41Å; A14-L18 PolarHBondContact O-N 3.24Å |
| 15 | A | 89.9 | Confident | 85.6 | Confident | 26 Ų | 26 | 72.8 Ų | 72.8 | 22% | 0.215 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -65.8 | -39.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I11 F12 L18 A19 F74 F78 | I11-A15 WeakPolarHBondContact O-CB 3.26Å; I11-A15 PolarHBondContact O-N 3.39Å; F12-A15 PolarHBondContact O-N 3.29Å; A15-L18 PolarHBondContact O-N 3.47Å; A15-A19 WeakPolarHBondContact O-CB 3.44Å; A15-A19 PolarHBondContact O-N 2.9Å; A15-F74 HydrophobicContact CB-CD2 4.09Å; A15-F74 HydrophobicContact CB-CE2 3.86Å; A15-F78 HydrophobicContact CB-CE2 3.65Å; A15-F78 HydrophobicContact CB-CZ 3.72Å |
| 16 | C | 88.9 | Confident | 85.5 | Confident | 31 Ų | 31 | 73 Ų | 73 | 21% | 0.209 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.3 | -48.6 | 171.8 | -75.7 | 0 | 0 | 0 | 0 | 111.2 | F12 L13 L18 A19 I20 F74 | F12-C16 VanDerWaalsContact CE1-SG 3.59Å; F12-C16 WeakPolarHBondContact O-CB 3.31Å; F12-C16 PolarHBondContact O-N 2.88Å; F12-C16 PolarHBondContact O-SG 2.75Å; F12-C16 VanDerWaalsContact O-SG 3.34Å; L13-C16 PolarHBondContact O-N 3.36Å; C16-L18 VanDerWaalsContact C-N 3.32Å; C16-L18 PolarHBondContact O-N 3.37Å; C16-A19 PolarHBondContact O-N 2.97Å; C16-I20 WeakPolarHBondContact O-CB 3.41Å; C16-I20 WeakPolarHBondContact O-CG1 3.48Å; C16-I20 PolarHBondContact O-N 3.37Å; C16-F74 VanDerWaalsContact SG-CZ 3.5Å |
| 17 | S | 87.7 | Confident | 85.3 | Confident | 75 Ų | 75 | 71 Ų | 71 | 52% | 0.524 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.6 | -41.7 | 178.2 | -66.4 | 0 | 0 | 0 | 0 | 111.8 | L13 A14 F21 | L13-S17 WeakPolarHBondContact O-CB 3.46Å; L13-S17 PolarHBondContact O-N 2.8Å; L13-S17 PolarHBondContact O-OG 3.02Å; A14-S17 PolarHBondContact O-N 2.66Å; S17-F21 WeakPolarHBondContact O-CB 3.27Å; S17-F21 PolarHBondContact O-N 3.16Å |
| 18 | L | 86.7 | Confident | 84.7 | Confident | 112 Ų | 112 | 70.4 Ų | 70.4 | 59% | 0.586 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -65.4 | -44.6 | 175.7 | -179.5 | 62.5 | 0 | 0 | 0 | 111.6 | A14 A15 C16 F21 V22 | A14-L18 WeakPolarHBondContact O-CB 3.41Å; A14-L18 PolarHBondContact O-N 3.24Å; A15-L18 PolarHBondContact O-N 3.47Å; C16-L18 VanDerWaalsContact C-N 3.32Å; C16-L18 PolarHBondContact O-N 3.37Å; L18-F21 PolarHBondContact O-N 3.16Å; L18-V22 HydrophobicContact CD1-CG2 4.44Å; L18-V22 WeakPolarHBondContact O-CG2 3.48Å; L18-V22 PolarHBondContact O-N 3.35Å |
| 19 | A | 85.7 | Confident | 83.9 | Confident | 15 Ų | 15 | 69 Ų | 69 | 12% | 0.124 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -60.7 | -49 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | A15 C16 F21 V22 F23 I70 | A15-A19 WeakPolarHBondContact O-CB 3.44Å; A15-A19 PolarHBondContact O-N 2.9Å; C16-A19 PolarHBondContact O-N 2.97Å; A19-F21 VanDerWaalsContact C-N 3.34Å; A19-F21 PolarHBondContact O-N 2.65Å; A19-V22 PolarHBondContact O-N 3.47Å; A19-F23 HydrophobicContact CB-CD2 4.41Å; A19-F23 HydrophobicContact CB-CE2 4.32Å; A19-F23 WeakPolarHBondContact O-CD2 3.5Å; A19-F23 PolarHBondContact O-N 3.39Å; A19-I70 HydrophobicContact CB-CG2 4.07Å |
| 20 | I | 85.3 | Confident | 83.1 | Confident | 105 Ų | 105 | 71 Ų | 71 | 54% | 0.538 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -58.5 | -46.8 | 176.5 | -68 | 164.7 | 0 | 0 | 0 | 110.3 | C16 V22 F23 T24 | C16-I20 WeakPolarHBondContact O-CB 3.41Å; C16-I20 WeakPolarHBondContact O-CG1 3.48Å; C16-I20 PolarHBondContact O-N 3.37Å; I20-V22 VanDerWaalsContact C-N 3.32Å; I20-V22 PolarHBondContact O-N 3.41Å; I20-F23 CarbonylContact O-C 2.73Å; I20-F23 PolarHBondContact O-N 3.26Å; I20-F23 VanDerWaalsContact O-N 3.16Å; I20-T24 HydrophobicContact CG2-CG2 4.12Å; I20-T24 WeakPolarHBondContact O-CG2 3.37Å; I20-T24 PolarHBondContact O-N 2.81Å; I20-T24 PolarHBondContact O-OG1 3.28Å |
| 21 | F | 83.5 | Confident | 81.9 | Confident | 115 Ų | 115 | 72.4 Ų | 72.4 | 50% | 0.504 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -58.2 | -44.4 | 178.1 | 176.4 | -93.1 | 0 | 0 | 0 | 111.9 | S17 L18 A19 T24 H25 | S17-F21 WeakPolarHBondContact O-CB 3.27Å; S17-F21 PolarHBondContact O-N 3.16Å; L18-F21 PolarHBondContact O-N 3.16Å; A19-F21 VanDerWaalsContact C-N 3.34Å; A19-F21 PolarHBondContact O-N 2.65Å; F21-T24 WeakPolarHBondContact CA-OG1 3.44Å; F21-T24 PolarHBondContact O-N 3.23Å; F21-T24 PolarHBondContact O-OG1 3.25Å; F21-H25 AromaticContact CD2-CE1 3.57Å; F21-H25 AromaticContact CD2-ND1 3.83Å; F21-H25 AromaticContact CE2-CE1 3.1Å; F21-H25 WeakPolarHBondContact CE2-CE1 3.32Å; F21-H25 AromaticContact CE2-ND1 3.67Å; F21-H25 AromaticContact CE2-NE2 3.84Å; F21-H25 AromaticContact CZ-CE1 3.42Å; F21-H25 VanDerWaalsContact CZ-CE1 3.42Å; F21-H25 WeakPolarHBondContact CZ-CE1 3.32Å; F21-H25 AromaticContact CZ-ND1 3.75Å; F21-H25 AromaticContact CZ-NE2 3.85Å; F21-H25 PolarHBondContact O-N 3.38Å; F21-H25 PolarHBondContact O-ND1 3.08Å |
| 22 | V | 81.3 | Confident | 80.7 | Confident | 44 Ų | 44 | 77.6 Ų | 77.6 | 27% | 0.267 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.9 | -49.4 | 175.6 | 172.2 | 0 | 0 | 0 | 0 | 109.6 | L18 A19 I20 T24 H25 F26 I70 | L18-V22 HydrophobicContact CD1-CG2 4.44Å; L18-V22 WeakPolarHBondContact O-CG2 3.48Å; L18-V22 PolarHBondContact O-N 3.35Å; A19-V22 PolarHBondContact O-N 3.47Å; I20-V22 VanDerWaalsContact C-N 3.32Å; I20-V22 PolarHBondContact O-N 3.41Å; V22-T24 VanDerWaalsContact C-N 3.3Å; V22-T24 PolarHBondContact O-N 2.88Å; V22-H25 CarbonylContact O-C 3.6Å; V22-H25 PolarHBondContact O-N 3.45Å; V22-H25 VanDerWaalsContact O-N 3.11Å; V22-F26 HydrophobicContact CG1-CD2 4.25Å; V22-F26 HydrophobicContact CG1-CE2 3.72Å; V22-F26 VanDerWaalsContact O-CD2 3.23Å; V22-F26 WeakPolarHBondContact O-CD2 3.23Å; V22-F26 PolarHBondContact O-N 2.84Å; V22-I70 HydrophobicContact CB-CD1 3.97Å; V22-I70 HydrophobicContact CG1-CD1 3.35Å; V22-I70 HydrophobicContact CG2-CD1 4.15Å |
| 23 | F | 79.7 | Confident | 79.7 | Confident | 82 Ų | 82 | 75.4 Ų | 75.4 | 36% | 0.36 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.7 | -26.3 | 179.3 | -74 | -62 | 0 | 0 | 0 | 114.6 | A19 I20 F26 A67 I70 | A19-F23 HydrophobicContact CB-CD2 4.41Å; A19-F23 HydrophobicContact CB-CE2 4.32Å; A19-F23 WeakPolarHBondContact O-CD2 3.5Å; A19-F23 PolarHBondContact O-N 3.39Å; I20-F23 CarbonylContact O-C 2.73Å; I20-F23 PolarHBondContact O-N 3.26Å; I20-F23 VanDerWaalsContact O-N 3.16Å; F23-F26 HydrophobicContact CD1-CD2 4.38Å; F23-F26 HydrophobicContact CD1-CE2 4.28Å; F23-F26 WeakPolarHBondContact O-CB 3.33Å; F23-A67 HydrophobicContact CE1-CB 3.62Å; F23-A67 HydrophobicContact CZ-CB 4.29Å; F23-I70 HydrophobicContact CE2-CG2 4.36Å |
| 24 | T | 77.8 | Confident | 78.6 | Confident | 97 Ų | 97 | 77.1 Ų | 77.1 | 60% | 0.595 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -78.9 | -25.7 | 174.8 | 55.6 | 0 | 0 | 0 | 0 | 112.6 | I20 F21 V22 F26 | I20-T24 HydrophobicContact CG2-CG2 4.12Å; I20-T24 WeakPolarHBondContact O-CG2 3.37Å; I20-T24 PolarHBondContact O-N 2.81Å; I20-T24 PolarHBondContact O-OG1 3.28Å; F21-T24 WeakPolarHBondContact CA-OG1 3.44Å; F21-T24 PolarHBondContact O-N 3.23Å; F21-T24 PolarHBondContact O-OG1 3.25Å; V22-T24 VanDerWaalsContact C-N 3.3Å; V22-T24 PolarHBondContact O-N 2.88Å; T24-F26 VanDerWaalsContact C-N 3.29Å |
| 25 | H | 80.3 | Confident | 77.4 | Confident | 129 Ų | 129 | 83.7 Ų | 83.7 | 60% | 0.597 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.4 | 7.2 | 173.3 | -68.8 | 75.7 | 0 | 0 | 0 | 112.9 | F21 V22 | F21-H25 AromaticContact CD2-CE1 3.57Å; F21-H25 AromaticContact CD2-ND1 3.83Å; F21-H25 AromaticContact CE2-CE1 3.1Å; F21-H25 WeakPolarHBondContact CE2-CE1 3.32Å; F21-H25 AromaticContact CE2-ND1 3.67Å; F21-H25 AromaticContact CE2-NE2 3.84Å; F21-H25 AromaticContact CZ-CE1 3.42Å; F21-H25 VanDerWaalsContact CZ-CE1 3.42Å; F21-H25 WeakPolarHBondContact CZ-CE1 3.32Å; F21-H25 AromaticContact CZ-ND1 3.75Å; F21-H25 AromaticContact CZ-NE2 3.85Å; F21-H25 PolarHBondContact O-N 3.38Å; F21-H25 PolarHBondContact O-ND1 3.08Å; V22-H25 CarbonylContact O-C 3.6Å; V22-H25 PolarHBondContact O-N 3.45Å; V22-H25 VanDerWaalsContact O-N 3.11Å |
| 26 | F | 78.4 | Confident | 76.3 | Confident | 38 Ų | 38 | 84.2 Ų | 84.2 | 17% | 0.167 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -63.3 | 149.3 | 173.3 | -102 | -123.5 | 0 | 0 | 0 | 111.3 | V22 F23 T24 A63 A67 | V22-F26 HydrophobicContact CG1-CD2 4.25Å; V22-F26 HydrophobicContact CG1-CE2 3.72Å; V22-F26 VanDerWaalsContact O-CD2 3.23Å; V22-F26 WeakPolarHBondContact O-CD2 3.23Å; V22-F26 PolarHBondContact O-N 2.84Å; F23-F26 HydrophobicContact CD1-CD2 4.38Å; F23-F26 HydrophobicContact CD1-CE2 4.28Å; F23-F26 WeakPolarHBondContact O-CB 3.33Å; T24-F26 VanDerWaalsContact C-N 3.29Å; F26-A63 HydrophobicContact CD1-CB 3.9Å; F26-A63 HydrophobicContact CE1-CB 3.61Å; F26-A63 WeakPolarHBondContact CE1-O 3.15Å; F26-A63 HydrophobicContact CZ-CB 4.17Å; F26-A63 WeakPolarHBondContact CZ-O 3.36Å; F26-A67 HydrophobicContact CE1-CB 3.66Å; F26-A67 HydrophobicContact CZ-CB 3.48Å; F26-A67 VanDerWaalsContact CZ-CB 3.48Å |
| 27 | P | 77.3 | Confident | 75.5 | Confident | 40 Ų | 40 | 85.3 Ų | 85.3 | 26% | 0.26 | 45% | 0.446 | S | S | . | . | P | Polyproline II helix | trans | -53 | 144.3 | 172.6 | -14.9 | 25.1 | 0 | 0 | 0 | 110 | L29 Y56 H60 A63 | P27-L29 PolarHBondContact O-N 3.29Å; P27-Y56 WeakPolarHBondContact CB-OH 3.43Å; P27-Y56 PolarHBondContact O-OH 3.47Å; P27-H60 HydrophobicContact CG-CB 4.39Å; P27-A63 HydrophobicContact CG-CB 3.95Å |
| 28 | P | 71.3 | Confident | 75.1 | Confident | 113 Ų | 113 | 89.1 Ų | 89.1 | 73% | 0.734 | 45% | 0.453 | S | S | * | . | P | Polyproline II helix | trans | -58.3 | 118.9 | -170.5 | 22.4 | -32.3 | 0 | 0 | 0 | 110.8 | ||
| 29 | L | 69.4 | Low | 74.7 | Confident | 30 Ų | 30 | 87.1 Ų | 87.1 | 16% | 0.157 | 45% | 0.446 | C | S | . | . | P | Polyproline II helix | trans | -80.6 | 138.5 | 166.2 | -74 | 157.6 | 0 | 0 | 0 | 108.4 | P27 E33 K34 V37 Y56 | P27-L29 PolarHBondContact O-N 3.29Å; L29-E33 HydrophobicContact CB-CB 4.13Å; L29-E33 HydrophobicContact CD2-CB 3.81Å; L29-K34 HydrophobicContact CB-CD 4.38Å; L29-K34 HydrophobicContact CB-CG 3.44Å; L29-K34 VanDerWaalsContact CB-CG 3.44Å; L29-K34 HydrophobicContact CD1-CG 4.17Å; L29-K34 HydrophobicContact CG-CG 4.46Å; L29-K34 WeakPolarHBondContact O-CE 3.15Å; L29-V37 HydrophobicContact CD1-CG2 4.15Å; L29-V37 HydrophobicContact CD2-CG2 4.41Å; L29-Y56 HydrophobicContact CD2-CD1 4.27Å; L29-Y56 HydrophobicContact CD2-CD2 3.54Å; L29-Y56 HydrophobicContact CD2-CE1 4.15Å; L29-Y56 HydrophobicContact CD2-CE2 3.4Å; L29-Y56 HydrophobicContact CD2-CG 3.98Å; L29-Y56 HydrophobicContact CG-CE2 3.91Å |
| 30 | E | 69.6 | Low | 74.5 | Confident | 121 Ų | 121 | 86.5 Ų | 86.5 | 57% | 0.565 | 44% | 0.44 | S | S | * | . | P | Polyproline II helix | trans | -59.1 | 153.4 | 169.1 | -67.6 | 177.6 | 179.7 | 0 | 0 | 109.5 | E32 E33 K34 | E30-E32 PolarHBondContact O-N 3.06Å; E30-E32 VanDerWaalsContact O-N 3.13Å; E30-E33 HydrophobicContact CB-CG 4.04Å; E30-E33 PolarHBondContact N-OE2 3.37Å; E30-E33 WeakPolarHBondContact O-CB 3.46Å; E30-E33 PolarHBondContact O-N 2.86Å; E30-K34 PolarHBondContact O-N 3.29Å |
| 31 | A | 66 | Low | 74.2 | Confident | 70 Ų | 70 | 91.5 Ų | 91.5 | 58% | 0.579 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -59.4 | -30.7 | -172.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 32 | E | 63.2 | Low | 74.1 | Confident | 162 Ų | 162 | 88.1 Ų | 88.1 | 76% | 0.757 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -70.8 | -41.9 | 173.8 | -65.8 | -171.2 | 169.3 | 0 | 0 | 111.9 | E30 K34 R35 | E30-E32 PolarHBondContact O-N 3.06Å; E30-E32 VanDerWaalsContact O-N 3.13Å; E32-K34 PolarHBondContact O-N 2.92Å; E32-R35 PolarHBondContact O-N 3.46Å |
| 33 | E | 68.5 | Low | 73.9 | Confident | 22 Ų | 22 | 90.7 Ų | 90.7 | 10% | 0.103 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 178.1 | -57.7 | 178 | 138.8 | 0 | 0 | 110.7 | L29 E30 R35 A36 V37 I52 | L29-E33 HydrophobicContact CB-CB 4.13Å; L29-E33 HydrophobicContact CD2-CB 3.81Å; E30-E33 HydrophobicContact CB-CG 4.04Å; E30-E33 PolarHBondContact N-OE2 3.37Å; E30-E33 WeakPolarHBondContact O-CB 3.46Å; E30-E33 PolarHBondContact O-N 2.86Å; E33-R35 VanDerWaalsContact C-N 3.3Å; E33-R35 PolarHBondContact O-N 3.29Å; E33-A36 PolarHBondContact O-N 3.41Å; E33-A36 VanDerWaalsContact O-N 3.13Å; E33-V37 WeakPolarHBondContact O-CG2 3.38Å; E33-V37 PolarHBondContact O-N 2.89Å; E33-V37 VanDerWaalsContact O-N 3.14Å; E33-I52 HydrophobicContact CB-CG2 3.97Å; E33-I52 HydrophobicContact CG-CG2 3.99Å |
| 34 | K | 68.5 | Low | 73.9 | Confident | 132 Ų | 132 | 91.4 Ų | 91.4 | 57% | 0.574 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -57 | -38.6 | 178.4 | -74.3 | -170.7 | 179.8 | 179 | 0 | 113.6 | L29 E30 E32 A36 | L29-K34 HydrophobicContact CB-CD 4.38Å; L29-K34 HydrophobicContact CB-CG 3.44Å; L29-K34 VanDerWaalsContact CB-CG 3.44Å; L29-K34 HydrophobicContact CD1-CG 4.17Å; L29-K34 HydrophobicContact CG-CG 4.46Å; L29-K34 WeakPolarHBondContact O-CE 3.15Å; E30-K34 PolarHBondContact O-N 3.29Å; E32-K34 PolarHBondContact O-N 2.92Å; K34-A36 VanDerWaalsContact C-N 3.27Å; K34-A36 PolarHBondContact O-N 3.46Å |
| 35 | R | 65.7 | Low | 74.1 | Confident | 199 Ų | 199 | 90 Ų | 90 | 75% | 0.751 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -69.8 | -27.4 | -178.4 | -69.8 | -173.4 | -149.9 | -179.5 | 7 | 112.7 | E32 E33 K38 | E32-R35 PolarHBondContact O-N 3.46Å; E33-R35 VanDerWaalsContact C-N 3.3Å; E33-R35 PolarHBondContact O-N 3.29Å; R35-K38 WeakPolarHBondContact O-CE 3.46Å |
| 36 | A | 67 | Low | 74.2 | Confident | 36 Ų | 36 | 83.9 Ų | 83.9 | 30% | 0.298 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -92.1 | -18.6 | -177 | 0 | 0 | 0 | 0 | 0 | 113.6 | E33 K34 K38 I52 | E33-A36 PolarHBondContact O-N 3.41Å; E33-A36 VanDerWaalsContact O-N 3.13Å; K34-A36 VanDerWaalsContact C-N 3.27Å; K34-A36 PolarHBondContact O-N 3.46Å; A36-K38 VanDerWaalsContact C-N 3.3Å; A36-K38 PolarHBondContact O-N 3.13Å; A36-I52 HydrophobicContact CB-CD1 3.11Å |
| 37 | V | 72.5 | Confident | 74.4 | Confident | 55 Ų | 55 | 86.5 Ų | 86.5 | 33% | 0.333 | 43% | 0.428 | S | S | . | . | trans | -71.6 | 86.4 | 174.6 | 179 | 0 | 0 | 0 | 0 | 110 | L29 E33 L49 L53 | L29-V37 HydrophobicContact CD1-CG2 4.15Å; L29-V37 HydrophobicContact CD2-CG2 4.41Å; E33-V37 WeakPolarHBondContact O-CG2 3.38Å; E33-V37 PolarHBondContact O-N 2.89Å; E33-V37 VanDerWaalsContact O-N 3.14Å; V37-L49 HydrophobicContact CB-CD1 4.44Å; V37-L49 HydrophobicContact CG2-CD1 4.21Å; V37-L53 HydrophobicContact CG2-CD2 4.34Å | ||
| 38 | K | 78.8 | Confident | 74.8 | Confident | 155 Ų | 155 | 88.6 Ų | 88.6 | 67% | 0.674 | 44% | 0.437 | S | S | * | . | trans | -128 | 148.3 | 171.8 | -65.4 | 179.4 | -176.9 | 173.6 | 0 | 108.9 | R35 A36 P40 L49 | R35-K38 WeakPolarHBondContact O-CE 3.46Å; A36-K38 VanDerWaalsContact C-N 3.3Å; A36-K38 PolarHBondContact O-N 3.13Å; K38-P40 WeakPolarHBondContact O-CD 3.45Å; K38-L49 WeakPolarHBondContact O-CD2 3.19Å | ||
| 39 | V | 78.3 | Confident | 75.4 | Confident | 70 Ų | 70 | 83.7 Ų | 83.7 | 42% | 0.424 | 41% | 0.405 | S | S | . | . | trans | -59.3 | 122.6 | 173.7 | 178.6 | 0 | 0 | 0 | 0 | 108.5 | R41 L75 | V39-R41 PolarHBondContact O-N 3.42Å; V39-L75 HydrophobicContact CG1-CD1 4.13Å | ||
| 40 | P | 81.5 | Confident | 76.2 | Confident | 1 Ų | 1 | 82.3 Ų | 82.3 | 1% | 0.006 | 40% | 0.397 | C | S | . | . | trans | -69.2 | 133.3 | -173.2 | 26.9 | -33.5 | 0 | 0 | 0 | 110.7 | K38 D45 A46 L49 F85 L86 | K38-P40 WeakPolarHBondContact O-CD 3.45Å; P40-D45 HydrophobicContact CB-CB 3.78Å; P40-A46 HydrophobicContact CB-CB 3.93Å; P40-A46 HydrophobicContact CG-CB 4.43Å; P40-L49 HydrophobicContact CG-CD2 4.21Å; P40-F85 HydrophobicContact CB-CB 4.04Å; P40-F85 HydrophobicContact CG-CB 3.74Å; P40-F85 WeakPolarHBondContact O-CD2 3.37Å; P40-L86 HydrophobicContact CG-CD2 4.28Å | ||
| 41 | R | 80.2 | Confident | 77 | Confident | 211 Ų | 211 | 79.1 Ų | 79.1 | 80% | 0.796 | 38% | 0.384 | S | S | * | . | trans | -115.2 | -8.8 | 178.8 | -63.3 | -177.4 | 179.9 | 144.2 | -1.7 | 112.9 | V39 D45 F85 | V39-R41 PolarHBondContact O-N 3.42Å; R41-D45 PolarHBondContact N-OD2 3.29Å; R41-F85 VanDerWaalsContact C-CE2 3.45Å; R41-F85 WeakPolarHBondContact O-CE2 3.4Å; R41-F85 WeakPolarHBondContact O-CZ 3.41Å | ||
| 42 | S | 80.4 | Confident | 78 | Confident | 43 Ų | 43 | 78 Ų | 78 | 30% | 0.301 | 37% | 0.368 | S | S | . | . | S | Bend | trans | -136 | 165.6 | 175.6 | 67.5 | 0 | 0 | 0 | 0 | 110.4 | E44 D45 A46 | S42-E44 PolarHBondContact O-N 3.44Å; S42-D45 PolarHBondContact N-OD2 2.92Å; S42-D45 PolarHBondContact O-N 2.96Å; S42-D45 PolarHBondContact OG-N 3.29Å; S42-D45 PolarHBondContact OG-OD1 3.45Å; S42-D45 PolarHBondContact OG-OD2 2.98Å; S42-A46 PolarHBondContact O-N 2.96Å |
| 43 | L | 77 | Confident | 79.1 | Confident | 99 Ų | 99 | 71 Ų | 71 | 52% | 0.518 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.2 | -34 | 173.4 | -175.8 | 62.3 | 0 | 0 | 0 | 111.5 | A46 R47 I88 L202 | L43-A46 PolarHBondContact O-N 3.17Å; L43-R47 WeakPolarHBondContact O-CB 3.38Å; L43-R47 PolarHBondContact O-N 3.27Å; L43-I88 HydrophobicContact CD1-CD1 4.35Å; L43-I88 HydrophobicContact CD1-CG2 4.17Å; L43-L202 HydrophobicContact CD1-CD2 4.19Å |
| 44 | E | 80.8 | Confident | 80 | Confident | 96 Ų | 96 | 73.4 Ų | 73.4 | 45% | 0.449 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -69.1 | -42.1 | 177.1 | -168.5 | 59.2 | -153.9 | 0 | 0 | 111.4 | S42 A46 R47 L48 | S42-E44 PolarHBondContact O-N 3.44Å; E44-A46 VanDerWaalsContact C-N 3.29Å; E44-A46 PolarHBondContact O-N 3.36Å; E44-R47 WeakPolarHBondContact O-CB 3.22Å; E44-R47 PolarHBondContact O-N 2.91Å; E44-R47 VanDerWaalsContact O-N 3.14Å; E44-R47 IonicContact OE2-NH1 3.88Å; E44-L48 HydrophobicContact CG-CD1 4.32Å; E44-L48 WeakPolarHBondContact O-CG 3.5Å; E44-L48 PolarHBondContact O-N 3.3Å |
| 45 | D | 81.7 | Confident | 80.9 | Confident | 68 Ų | 68 | 73.3 Ų | 73.3 | 36% | 0.364 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.2 | -43.6 | 173 | -60.6 | -34.7 | 0 | 0 | 0 | 111 | P40 R41 S42 R47 L48 L49 | P40-D45 HydrophobicContact CB-CB 3.78Å; R41-D45 PolarHBondContact N-OD2 3.29Å; S42-D45 PolarHBondContact N-OD2 2.92Å; S42-D45 PolarHBondContact O-N 2.96Å; S42-D45 PolarHBondContact OG-N 3.29Å; S42-D45 PolarHBondContact OG-OD1 3.45Å; S42-D45 PolarHBondContact OG-OD2 2.98Å; D45-R47 VanDerWaalsContact C-N 3.3Å; D45-R47 PolarHBondContact O-N 3.43Å; D45-L48 PolarHBondContact O-N 2.88Å; D45-L49 WeakPolarHBondContact O-CB 3.45Å; D45-L49 PolarHBondContact O-N 3.42Å |
| 46 | A | 82.1 | Confident | 81.8 | Confident | 1 Ų | 1 | 64.4 Ų | 64.4 | 1% | 0.008 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.4 | -37.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P40 S42 L43 E44 G50 | P40-A46 HydrophobicContact CB-CB 3.93Å; P40-A46 HydrophobicContact CG-CB 4.43Å; S42-A46 PolarHBondContact O-N 2.96Å; L43-A46 PolarHBondContact O-N 3.17Å; E44-A46 VanDerWaalsContact C-N 3.29Å; E44-A46 PolarHBondContact O-N 3.36Å; A46-G50 WeakPolarHBondContact O-CA 3.39Å; A46-G50 PolarHBondContact O-N 2.85Å |
| 47 | R | 83.4 | Confident | 82.8 | Confident | 92 Ų | 92 | 64.8 Ų | 64.8 | 35% | 0.347 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -65.1 | -52.5 | 175.3 | -175 | -171.3 | 174.1 | -178 | -1.5 | 111.9 | L43 E44 D45 G50 L51 L202 | L43-R47 WeakPolarHBondContact O-CB 3.38Å; L43-R47 PolarHBondContact O-N 3.27Å; E44-R47 WeakPolarHBondContact O-CB 3.22Å; E44-R47 PolarHBondContact O-N 2.91Å; E44-R47 VanDerWaalsContact O-N 3.14Å; E44-R47 IonicContact OE2-NH1 3.88Å; D45-R47 VanDerWaalsContact C-N 3.3Å; D45-R47 PolarHBondContact O-N 3.43Å; R47-G50 PolarHBondContact O-N 2.89Å; R47-L51 PolarHBondContact O-N 3.46Å; R47-L202 HydrophobicContact CB-CD2 3.94Å; R47-L202 HydrophobicContact CG-CD1 4.17Å; R47-L202 HydrophobicContact CG-CD2 4.25Å; R47-L202 HydrophobicContact CG-CG 4.38Å |
| 48 | L | 84.7 | Confident | 83.5 | Confident | 85 Ų | 85 | 69.7 Ų | 69.7 | 45% | 0.445 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.1 | -45.6 | -178.2 | -69.8 | 174.1 | 0 | 0 | 0 | 111 | E44 D45 G50 L51 I52 | E44-L48 HydrophobicContact CG-CD1 4.32Å; E44-L48 WeakPolarHBondContact O-CG 3.5Å; E44-L48 PolarHBondContact O-N 3.3Å; D45-L48 PolarHBondContact O-N 2.88Å; L48-G50 VanDerWaalsContact C-N 3.31Å; L48-G50 PolarHBondContact O-N 3.32Å; L48-L51 PolarHBondContact O-N 3.07Å; L48-I52 PolarHBondContact O-N 3.25Å |
| 49 | L | 85.1 | Confident | 83.9 | Confident | 10 Ų | 10 | 70.7 Ų | 70.7 | 5% | 0.052 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.1 | -41.1 | 174.4 | -176.4 | 63.1 | 0 | 0 | 0 | 111.3 | V37 K38 P40 D45 L51 I52 L53 L89 | V37-L49 HydrophobicContact CB-CD1 4.44Å; V37-L49 HydrophobicContact CG2-CD1 4.21Å; K38-L49 WeakPolarHBondContact O-CD2 3.19Å; P40-L49 HydrophobicContact CG-CD2 4.21Å; D45-L49 WeakPolarHBondContact O-CB 3.45Å; D45-L49 PolarHBondContact O-N 3.42Å; L49-L51 VanDerWaalsContact C-N 3.35Å; L49-L51 PolarHBondContact O-N 3.26Å; L49-I52 PolarHBondContact O-N 2.76Å; L49-L53 HydrophobicContact CD1-CD1 3.8Å; L49-L53 HydrophobicContact CD1-CD2 4.4Å; L49-L53 HydrophobicContact CD1-CG 3.8Å; L49-L53 HydrophobicContact CD2-CD1 4.17Å; L49-L53 HydrophobicContact CG-CD1 3.65Å; L49-L53 HydrophobicContact CG-CG 4.02Å; L49-L53 VanDerWaalsContact O-CB 3.29Å; L49-L53 WeakPolarHBondContact O-CB 3.17Å; L49-L53 VanDerWaalsContact O-CG 3.3Å; L49-L53 WeakPolarHBondContact O-CG 3.41Å; L49-L53 PolarHBondContact O-N 3.07Å; L49-L89 HydrophobicContact CB-CD1 4.45Å; L49-L89 HydrophobicContact CD2-CD1 4.43Å; L49-L89 HydrophobicContact CD2-CD2 3.59Å; L49-L89 HydrophobicContact CG-CD1 4.31Å; L49-L89 HydrophobicContact CG-CD2 4.21Å |
| 50 | G | 86.2 | Confident | 84.4 | Confident | 0 Ų | 0 | 70.4 Ų | 70.4 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -56.9 | -45.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A46 R47 L48 I52 R54 Y92 | A46-G50 WeakPolarHBondContact O-CA 3.39Å; A46-G50 PolarHBondContact O-N 2.85Å; R47-G50 PolarHBondContact O-N 2.89Å; L48-G50 VanDerWaalsContact C-N 3.31Å; L48-G50 PolarHBondContact O-N 3.32Å; G50-I52 PolarHBondContact O-N 2.99Å; G50-R54 WeakPolarHBondContact O-CB 3.43Å; G50-R54 PolarHBondContact O-N 2.98Å; G50-Y92 WeakPolarHBondContact O-CE1 3.3Å |
| 51 | L | 86.3 | Confident | 84.8 | Confident | 55 Ų | 55 | 74.2 Ų | 74.2 | 29% | 0.288 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60 | -44.7 | 179.3 | -78.4 | 166 | 0 | 0 | 0 | 112.7 | R47 L48 L49 Y92 V206 | R47-L51 PolarHBondContact O-N 3.46Å; L48-L51 PolarHBondContact O-N 3.07Å; L49-L51 VanDerWaalsContact C-N 3.35Å; L49-L51 PolarHBondContact O-N 3.26Å; L51-Y92 WeakPolarHBondContact CD2-OH 3.46Å; L51-Y92 WeakPolarHBondContact CG-OH 3.45Å; L51-V206 HydrophobicContact CD1-CG1 4.38Å; L51-V206 HydrophobicContact CD2-CG1 3.55Å; L51-V206 HydrophobicContact CG-CG1 4.4Å |
| 52 | I | 86.1 | Confident | 85.3 | Confident | 45 Ų | 45 | 69.2 Ų | 69.2 | 23% | 0.231 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -71.1 | -50.9 | -178.6 | -66.3 | 170.6 | 0 | 0 | 0 | 110.1 | E33 A36 L48 L49 G50 R54 K55 Y56 | E33-I52 HydrophobicContact CB-CG2 3.97Å; E33-I52 HydrophobicContact CG-CG2 3.99Å; A36-I52 HydrophobicContact CB-CD1 3.11Å; L48-I52 PolarHBondContact O-N 3.25Å; L49-I52 PolarHBondContact O-N 2.76Å; G50-I52 PolarHBondContact O-N 2.99Å; I52-R54 PolarHBondContact O-N 3.43Å; I52-K55 PolarHBondContact O-N 2.85Å; I52-Y56 PolarHBondContact O-N 3.36Å |
| 53 | L | 86.7 | Confident | 85.6 | Confident | 17 Ų | 17 | 68 Ų | 68 | 9% | 0.089 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64 | -28.1 | 179.6 | -69.1 | -175.6 | 0 | 0 | 0 | 112.2 | V37 L49 Y56 K57 V64 L89 L93 | V37-L53 HydrophobicContact CG2-CD2 4.34Å; L49-L53 HydrophobicContact CD1-CD1 3.8Å; L49-L53 HydrophobicContact CD1-CD2 4.4Å; L49-L53 HydrophobicContact CD1-CG 3.8Å; L49-L53 HydrophobicContact CD2-CD1 4.17Å; L49-L53 HydrophobicContact CG-CD1 3.65Å; L49-L53 HydrophobicContact CG-CG 4.02Å; L49-L53 VanDerWaalsContact O-CB 3.29Å; L49-L53 WeakPolarHBondContact O-CB 3.17Å; L49-L53 VanDerWaalsContact O-CG 3.3Å; L49-L53 WeakPolarHBondContact O-CG 3.41Å; L49-L53 PolarHBondContact O-N 3.07Å; L53-Y56 PolarHBondContact O-N 3.2Å; L53-K57 WeakPolarHBondContact O-CA 3.33Å; L53-K57 WeakPolarHBondContact O-CB 3.45Å; L53-K57 PolarHBondContact O-N 2.98Å; L53-V64 HydrophobicContact CB-CG1 4.28Å; L53-V64 HydrophobicContact CD1-CG1 4.29Å; L53-V64 HydrophobicContact CD2-CG2 4.4Å; L53-L89 HydrophobicContact CD1-CD2 4.15Å; L53-L93 HydrophobicContact CB-CD1 3.92Å; L53-L93 HydrophobicContact CB-CD2 3.79Å; L53-L93 HydrophobicContact CD1-CD1 3.93Å |
| 54 | R | 86.9 | Confident | 86.2 | Confident | 71 Ų | 71 | 63.3 Ų | 63.3 | 27% | 0.268 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62 | -50.2 | 175.8 | -178.1 | 176.8 | 73.4 | 178.4 | 9.3 | 111.5 | G50 I52 Y56 K57 Y92 L93 T207 | G50-R54 WeakPolarHBondContact O-CB 3.43Å; G50-R54 PolarHBondContact O-N 2.98Å; I52-R54 PolarHBondContact O-N 3.43Å; R54-Y56 VanDerWaalsContact C-N 3.35Å; R54-K57 PolarHBondContact O-N 2.95Å; R54-Y92 HydrophobicContact CB-CE1 4.2Å; R54-L93 HydrophobicContact CB-CD2 4.11Å; R54-T207 PolarHBondContact NH1-OG1 2.88Å |
| 55 | K | 86.6 | Confident | 86.8 | Confident | 131 Ų | 131 | 60.6 Ų | 60.6 | 57% | 0.57 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -62.2 | -44.8 | 176.9 | -173.5 | -174.9 | 177.3 | -165.4 | 0 | 110.6 | I52 K57 E58 | I52-K55 PolarHBondContact O-N 2.85Å; K55-K57 PolarHBondContact O-N 3.34Å; K55-E58 WeakPolarHBondContact O-CB 3.49Å; K55-E58 PolarHBondContact O-N 3.17Å |
| 56 | Y | 85.3 | Confident | 87.3 | Confident | 12 Ų | 12 | 58.6 Ų | 58.6 | 5% | 0.047 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67 | -36.2 | 179.9 | -174.6 | -95.4 | 0 | 0 | 0 | 113 | P27 L29 I52 L53 R54 E58 K59 H60 V64 | P27-Y56 WeakPolarHBondContact CB-OH 3.43Å; P27-Y56 PolarHBondContact O-OH 3.47Å; L29-Y56 HydrophobicContact CD2-CD1 4.27Å; L29-Y56 HydrophobicContact CD2-CD2 3.54Å; L29-Y56 HydrophobicContact CD2-CE1 4.15Å; L29-Y56 HydrophobicContact CD2-CE2 3.4Å; L29-Y56 HydrophobicContact CD2-CG 3.98Å; L29-Y56 HydrophobicContact CG-CE2 3.91Å; I52-Y56 PolarHBondContact O-N 3.36Å; L53-Y56 PolarHBondContact O-N 3.2Å; R54-Y56 VanDerWaalsContact C-N 3.35Å; Y56-E58 PolarHBondContact O-N 3.23Å; Y56-K59 PolarHBondContact O-N 2.88Å; Y56-K59 VanDerWaalsContact O-N 3.16Å; Y56-H60 HydrophobicContact CD1-CB 4.02Å; Y56-H60 HydrophobicContact CE1-CB 3.54Å; Y56-H60 AromaticContact CE2-CD2 3.51Å; Y56-H60 AromaticContact CZ-CD2 3.52Å; Y56-H60 AromaticContact CZ-CG 3.9Å; Y56-H60 PolarHBondContact O-N 3.26Å; Y56-V64 HydrophobicContact CD1-CG2 3.54Å; Y56-V64 HydrophobicContact CE1-CG2 4.06Å |
| 57 | K | 88.8 | Confident | 87.6 | Confident | 44 Ų | 44 | 59.4 Ų | 59.4 | 19% | 0.191 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.3 | -28.2 | 178.1 | -170.2 | -159.3 | 72.8 | 168.2 | 0 | 112.5 | L53 R54 K55 K59 H60 Y61 V64 L93 F94 | L53-K57 WeakPolarHBondContact O-CA 3.33Å; L53-K57 WeakPolarHBondContact O-CB 3.45Å; L53-K57 PolarHBondContact O-N 2.98Å; R54-K57 PolarHBondContact O-N 2.95Å; K55-K57 PolarHBondContact O-N 3.34Å; K57-K59 PolarHBondContact O-N 3.42Å; K57-H60 PolarHBondContact O-N 3.38Å; K57-Y61 HydrophobicContact CD-CD2 3.71Å; K57-Y61 HydrophobicContact CD-CE2 3.99Å; K57-Y61 HydrophobicContact CG-CD2 3.65Å; K57-Y61 HydrophobicContact CG-CE2 4.39Å; K57-Y61 HydrophobicContact CG-CG 4.29Å; K57-Y61 WeakPolarHBondContact O-CA 3.07Å; K57-Y61 PolarHBondContact O-N 2.83Å; K57-Y61 VanDerWaalsContact O-N 3.08Å; K57-V64 HydrophobicContact CB-CB 4.41Å; K57-V64 HydrophobicContact CB-CG2 4.02Å; K57-V64 HydrophobicContact CG-CB 4.32Å; K57-V64 HydrophobicContact CG-CG2 4.42Å; K57-L93 PolarHBondContact NZ-O 3.31Å; K57-F94 HydrophobicContact CD-CD1 4.21Å; K57-F94 HydrophobicContact CD-CE1 3.94Å |
| 58 | E | 87.4 | Confident | 88.1 | Confident | 158 Ų | 158 | 55.3 Ų | 55.3 | 74% | 0.738 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -59.3 | -33.2 | 177.2 | -67.8 | 178.6 | -179.7 | 0 | 0 | 112.2 | K55 Y56 | K55-E58 WeakPolarHBondContact O-CB 3.49Å; K55-E58 PolarHBondContact O-N 3.17Å; Y56-E58 PolarHBondContact O-N 3.23Å |
| 59 | K | 87.4 | Confident | 88.6 | Confident | 176 Ų | 176 | 53.6 Ų | 53.6 | 77% | 0.765 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -98.4 | -29.8 | 175.9 | -64.8 | -179.8 | -179.5 | 177.8 | 0 | 113 | Y56 K57 | Y56-K59 PolarHBondContact O-N 2.88Å; Y56-K59 VanDerWaalsContact O-N 3.16Å; K57-K59 PolarHBondContact O-N 3.42Å |
| 60 | H | 88.3 | Confident | 89 | Confident | 63 Ų | 63 | 55.5 Ų | 55.5 | 29% | 0.292 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -132.6 | 50.7 | -167.8 | -59 | -58.6 | 0 | 0 | 0 | 113.3 | P27 Y56 K57 C62 A63 V64 | P27-H60 HydrophobicContact CG-CB 4.39Å; Y56-H60 HydrophobicContact CD1-CB 4.02Å; Y56-H60 HydrophobicContact CE1-CB 3.54Å; Y56-H60 AromaticContact CE2-CD2 3.51Å; Y56-H60 AromaticContact CZ-CD2 3.52Å; Y56-H60 AromaticContact CZ-CG 3.9Å; Y56-H60 PolarHBondContact O-N 3.26Å; K57-H60 PolarHBondContact O-N 3.38Å; H60-C62 PolarHBondContact O-N 3.46Å; H60-A63 HydrophobicContact CB-CB 4.05Å; H60-A63 WeakPolarHBondContact O-CB 3.36Å; H60-A63 PolarHBondContact O-N 2.88Å; H60-A63 VanDerWaalsContact O-N 3.17Å; H60-V64 PolarHBondContact O-N 3.36Å; H60-V64 VanDerWaalsContact O-N 3.11Å |
| 61 | Y | 89.4 | Confident | 89.3 | Confident | 82 Ų | 82 | 56.2 Ų | 56.2 | 32% | 0.322 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -51.3 | -52.6 | -177.9 | -176.6 | -86.1 | 0 | 0 | 0 | 113.8 | K57 A63 V64 L65 F94 | K57-Y61 HydrophobicContact CD-CD2 3.71Å; K57-Y61 HydrophobicContact CD-CE2 3.99Å; K57-Y61 HydrophobicContact CG-CD2 3.65Å; K57-Y61 HydrophobicContact CG-CE2 4.39Å; K57-Y61 HydrophobicContact CG-CG 4.29Å; K57-Y61 WeakPolarHBondContact O-CA 3.07Å; K57-Y61 PolarHBondContact O-N 2.83Å; K57-Y61 VanDerWaalsContact O-N 3.08Å; Y61-A63 VanDerWaalsContact C-N 3.27Å; Y61-A63 PolarHBondContact O-N 3.19Å; Y61-V64 PolarHBondContact O-N 3.34Å; Y61-L65 HydrophobicContact CE1-CD2 4.08Å; Y61-L65 WeakPolarHBondContact O-CB 3.35Å; Y61-L65 PolarHBondContact O-N 3.03Å; Y61-F94 HydrophobicContact CD2-CE1 4.27Å; Y61-F94 HydrophobicContact CE1-CE1 4.37Å; Y61-F94 AromaticContact CE2-CD1 3.57Å; Y61-F94 HydrophobicContact CE2-CD1 3.57Å; Y61-F94 AromaticContact CE2-CE1 3.67Å; Y61-F94 HydrophobicContact CE2-CE1 3.67Å; Y61-F94 AromaticContact CZ-CD1 3.62Å; Y61-F94 AromaticContact CZ-CE1 3.71Å; Y61-F94 WeakPolarHBondContact OH-CD1 3.41Å |
| 62 | C | 89.8 | Confident | 89.7 | Confident | 105 Ų | 105 | 54 Ų | 54 | 71% | 0.709 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -63.9 | -33.3 | -177.5 | -63.3 | 0 | 0 | 0 | 0 | 112.5 | H60 G66 | H60-C62 PolarHBondContact O-N 3.46Å; C62-G66 PolarHBondContact O-N 3.14Å |
| 63 | A | 88.1 | Confident | 90.2 | Very high | 17 Ų | 17 | 53 Ų | 53 | 14% | 0.14 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.1 | -52.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | F26 P27 H60 Y61 L65 G66 A67 | F26-A63 HydrophobicContact CD1-CB 3.9Å; F26-A63 HydrophobicContact CE1-CB 3.61Å; F26-A63 WeakPolarHBondContact CE1-O 3.15Å; F26-A63 HydrophobicContact CZ-CB 4.17Å; F26-A63 WeakPolarHBondContact CZ-O 3.36Å; P27-A63 HydrophobicContact CG-CB 3.95Å; H60-A63 HydrophobicContact CB-CB 4.05Å; H60-A63 WeakPolarHBondContact O-CB 3.36Å; H60-A63 PolarHBondContact O-N 2.88Å; H60-A63 VanDerWaalsContact O-N 3.17Å; Y61-A63 VanDerWaalsContact C-N 3.27Å; Y61-A63 PolarHBondContact O-N 3.19Å; A63-L65 VanDerWaalsContact C-N 3.29Å; A63-L65 PolarHBondContact O-N 3.34Å; A63-G66 PolarHBondContact O-N 3.44Å; A63-G66 VanDerWaalsContact O-N 3.12Å; A63-A67 PolarHBondContact O-N 2.91Å |
| 64 | V | 90.1 | Very high | 90.6 | Very high | 2 Ų | 2 | 54.1 Ų | 54.1 | 1% | 0.012 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.1 | -42.8 | 178.6 | 179.3 | 0 | 0 | 0 | 0 | 111.7 | L53 Y56 K57 H60 Y61 A67 I68 L93 F94 | L53-V64 HydrophobicContact CB-CG1 4.28Å; L53-V64 HydrophobicContact CD1-CG1 4.29Å; L53-V64 HydrophobicContact CD2-CG2 4.4Å; Y56-V64 HydrophobicContact CD1-CG2 3.54Å; Y56-V64 HydrophobicContact CE1-CG2 4.06Å; K57-V64 HydrophobicContact CB-CB 4.41Å; K57-V64 HydrophobicContact CB-CG2 4.02Å; K57-V64 HydrophobicContact CG-CB 4.32Å; K57-V64 HydrophobicContact CG-CG2 4.42Å; H60-V64 PolarHBondContact O-N 3.36Å; H60-V64 VanDerWaalsContact O-N 3.11Å; Y61-V64 PolarHBondContact O-N 3.34Å; V64-A67 PolarHBondContact O-N 2.89Å; V64-I68 HydrophobicContact CG1-CD1 4.17Å; V64-I68 PolarHBondContact O-N 3.47Å; V64-I68 VanDerWaalsContact O-N 3.13Å; V64-L93 HydrophobicContact CG1-CD1 3.91Å; V64-F94 HydrophobicContact CG1-CZ 4.1Å |
| 65 | L | 92.6 | Very high | 90.9 | Very high | 39 Ų | 39 | 51.4 Ų | 51.4 | 20% | 0.204 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62 | -48.1 | 175.8 | -179.7 | 60.7 | 0 | 0 | 0 | 111.6 | Y61 A63 A67 I68 V69 F94 V102 | Y61-L65 HydrophobicContact CE1-CD2 4.08Å; Y61-L65 WeakPolarHBondContact O-CB 3.35Å; Y61-L65 PolarHBondContact O-N 3.03Å; A63-L65 VanDerWaalsContact C-N 3.29Å; A63-L65 PolarHBondContact O-N 3.34Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-A67 PolarHBondContact O-N 3.3Å; L65-I68 PolarHBondContact O-N 3.19Å; L65-V69 HydrophobicContact CD1-CG2 4.29Å; L65-V69 HydrophobicContact CG-CG2 4.48Å; L65-V69 VanDerWaalsContact O-CG2 3.29Å; L65-V69 WeakPolarHBondContact O-CG2 3.49Å; L65-V69 PolarHBondContact O-N 2.94Å; L65-F94 HydrophobicContact CB-CE1 4.16Å; L65-F94 HydrophobicContact CB-CZ 3.95Å; L65-F94 HydrophobicContact CD1-CE1 4.3Å; L65-F94 HydrophobicContact CD1-CE2 4.16Å; L65-F94 HydrophobicContact CD1-CZ 3.93Å; L65-V102 HydrophobicContact CD1-CG1 4.09Å; L65-V102 HydrophobicContact CD1-CG2 3.72Å |
| 66 | G | 91.5 | Very high | 91.4 | Very high | 25 Ų | 25 | 45.5 Ų | 45.5 | 26% | 0.258 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.6 | -41.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | C62 A63 I68 V69 I70 | C62-G66 PolarHBondContact O-N 3.14Å; A63-G66 PolarHBondContact O-N 3.44Å; A63-G66 VanDerWaalsContact O-N 3.12Å; G66-I68 PolarHBondContact O-N 2.92Å; G66-V69 PolarHBondContact O-N 3.12Å; G66-I70 WeakPolarHBondContact O-CB 3.47Å; G66-I70 VanDerWaalsContact O-CG1 3.26Å; G66-I70 WeakPolarHBondContact O-CG1 3.36Å; G66-I70 PolarHBondContact O-N 3.45Å |
| 67 | A | 89.9 | Confident | 91.8 | Very high | 18 Ų | 18 | 45.4 Ų | 45.4 | 15% | 0.149 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.7 | -47.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | F23 F26 A63 V64 L65 I70 A71 | F23-A67 HydrophobicContact CE1-CB 3.62Å; F23-A67 HydrophobicContact CZ-CB 4.29Å; F26-A67 HydrophobicContact CE1-CB 3.66Å; F26-A67 HydrophobicContact CZ-CB 3.48Å; F26-A67 VanDerWaalsContact CZ-CB 3.48Å; A63-A67 PolarHBondContact O-N 2.91Å; V64-A67 PolarHBondContact O-N 2.89Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-A67 PolarHBondContact O-N 3.3Å; A67-I70 PolarHBondContact O-N 3.46Å; A67-A71 VanDerWaalsContact O-CB 3.27Å; A67-A71 WeakPolarHBondContact O-CB 3.48Å; A67-A71 PolarHBondContact O-N 3.22Å |
| 68 | I | 92.5 | Very high | 92.1 | Very high | 6 Ų | 6 | 45.4 Ų | 45.4 | 3% | 0.031 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.6 | -45.2 | 179.2 | -74.8 | 170.1 | 0 | 0 | 0 | 110.5 | V64 L65 G66 I70 A71 Y72 L89 L93 F94 | V64-I68 HydrophobicContact CG1-CD1 4.17Å; V64-I68 PolarHBondContact O-N 3.47Å; V64-I68 VanDerWaalsContact O-N 3.13Å; L65-I68 PolarHBondContact O-N 3.19Å; G66-I68 PolarHBondContact O-N 2.92Å; I68-I70 PolarHBondContact O-N 3.37Å; I68-A71 PolarHBondContact O-N 2.86Å; I68-Y72 WeakPolarHBondContact O-CB 3.27Å; I68-Y72 PolarHBondContact O-N 3.41Å; I68-L89 HydrophobicContact CD1-CD2 4.15Å; I68-L89 HydrophobicContact CD1-CG 4.33Å; I68-L89 HydrophobicContact CG1-CD2 4.36Å; I68-L93 HydrophobicContact CD1-CD1 3.56Å; I68-F94 HydrophobicContact CD1-CE2 3.61Å; I68-F94 HydrophobicContact CD1-CZ 4.14Å |
| 69 | V | 95.2 | Very high | 92.2 | Very high | 49 Ų | 49 | 39.5 Ų | 39.5 | 30% | 0.297 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -58.7 | -49.3 | 177.7 | 168.3 | 0 | 0 | 0 | 0 | 111 | L65 G66 Y72 V73 V102 | L65-V69 HydrophobicContact CD1-CG2 4.29Å; L65-V69 HydrophobicContact CG-CG2 4.48Å; L65-V69 VanDerWaalsContact O-CG2 3.29Å; L65-V69 WeakPolarHBondContact O-CG2 3.49Å; L65-V69 PolarHBondContact O-N 2.94Å; G66-V69 PolarHBondContact O-N 3.12Å; V69-Y72 PolarHBondContact O-N 3.14Å; V69-V73 HydrophobicContact CG1-CG2 4.46Å; V69-V73 WeakPolarHBondContact O-CB 3.32Å; V69-V73 VanDerWaalsContact O-CG2 3.3Å; V69-V73 WeakPolarHBondContact O-CG2 3.26Å; V69-V73 PolarHBondContact O-N 3.15Å; V69-V102 HydrophobicContact CG2-CG1 3.96Å |
| 70 | I | 93.3 | Very high | 92.3 | Very high | 50 Ų | 50 | 33.9 Ų | 33.9 | 26% | 0.256 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -63.5 | -49.8 | -178.8 | -70.2 | 167 | 0 | 0 | 0 | 110.5 | A19 V22 F23 G66 A67 I68 Y72 F74 | A19-I70 HydrophobicContact CB-CG2 4.07Å; V22-I70 HydrophobicContact CB-CD1 3.97Å; V22-I70 HydrophobicContact CG1-CD1 3.35Å; V22-I70 HydrophobicContact CG2-CD1 4.15Å; F23-I70 HydrophobicContact CE2-CG2 4.36Å; G66-I70 WeakPolarHBondContact O-CB 3.47Å; G66-I70 VanDerWaalsContact O-CG1 3.26Å; G66-I70 WeakPolarHBondContact O-CG1 3.36Å; G66-I70 PolarHBondContact O-N 3.45Å; A67-I70 PolarHBondContact O-N 3.46Å; I68-I70 PolarHBondContact O-N 3.37Å; I70-Y72 VanDerWaalsContact C-N 3.32Å; I70-Y72 PolarHBondContact O-N 2.86Å; I70-F74 WeakPolarHBondContact O-CB 3.43Å; I70-F74 PolarHBondContact O-N 3.4Å |
| 71 | A | 92.6 | Very high | 92.2 | Very high | 16 Ų | 16 | 36.6 Ų | 36.6 | 13% | 0.132 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.4 | -43.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | A67 I68 F74 L75 L86 | A67-A71 VanDerWaalsContact O-CB 3.27Å; A67-A71 WeakPolarHBondContact O-CB 3.48Å; A67-A71 PolarHBondContact O-N 3.22Å; I68-A71 PolarHBondContact O-N 2.86Å; A71-F74 PolarHBondContact O-N 2.88Å; A71-L75 VanDerWaalsContact O-CG 3.26Å; A71-L75 WeakPolarHBondContact O-CG 3.45Å; A71-L75 PolarHBondContact O-N 3.21Å; A71-L86 HydrophobicContact CB-CD1 3.94Å |
| 72 | Y | 95.3 | Very high | 92.1 | Very high | 8 Ų | 8 | 33.4 Ų | 33.4 | 3% | 0.031 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65.1 | -51.8 | -179.1 | -161 | -63.4 | 0 | 0 | 0 | 111.5 | I68 V69 I70 F74 L75 Q76 S83 L86 S87 V103 C106 | I68-Y72 WeakPolarHBondContact O-CB 3.27Å; I68-Y72 PolarHBondContact O-N 3.41Å; V69-Y72 PolarHBondContact O-N 3.14Å; I70-Y72 VanDerWaalsContact C-N 3.32Å; I70-Y72 PolarHBondContact O-N 2.86Å; Y72-F74 VanDerWaalsContact C-N 3.27Å; Y72-F74 PolarHBondContact O-N 3.45Å; Y72-L75 PolarHBondContact O-N 2.86Å; Y72-Q76 HydrophobicContact CD1-CG 3.57Å; Y72-Q76 HydrophobicContact CE1-CG 3.46Å; Y72-Q76 VanDerWaalsContact CE1-CG 3.46Å; Y72-Q76 WeakPolarHBondContact O-CB 3.2Å; Y72-Q76 VanDerWaalsContact O-CG 3.29Å; Y72-Q76 WeakPolarHBondContact O-CG 3.39Å; Y72-Q76 PolarHBondContact O-N 3.37Å; Y72-S83 WeakPolarHBondContact CE2-O 3.48Å; Y72-L86 VanDerWaalsContact CA-CD1 3.5Å; Y72-L86 HydrophobicContact CD2-CB 3.64Å; Y72-L86 HydrophobicContact CD2-CD1 4.11Å; Y72-L86 HydrophobicContact CE2-CB 4.17Å; Y72-L86 HydrophobicContact CG-CD1 4.27Å; Y72-S87 WeakPolarHBondContact CE2-OG 3.42Å; Y72-S87 PolarHBondContact OH-OG 2.83Å; Y72-V103 HydrophobicContact CE2-CG1 4.14Å; Y72-V103 HydrophobicContact CE2-CG2 4.35Å; Y72-C106 HydrophobicContact CD1-CB 3.48Å; Y72-C106 VanDerWaalsContact CD1-CB 3.48Å; Y72-C106 HydrophobicContact CE1-CB 4.1Å; Y72-C106 HydrophobicContact CG-CB 3.74Å |
| 73 | V | 96.2 | Very high | 92.2 | Very high | 24 Ų | 24 | 29.4 Ų | 29.4 | 15% | 0.145 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61 | -40.1 | 179 | 171.5 | 0 | 0 | 0 | 0 | 110.2 | V69 Q76 S77 C106 I109 | V69-V73 HydrophobicContact CG1-CG2 4.46Å; V69-V73 WeakPolarHBondContact O-CB 3.32Å; V69-V73 VanDerWaalsContact O-CG2 3.3Å; V69-V73 WeakPolarHBondContact O-CG2 3.26Å; V69-V73 PolarHBondContact O-N 3.15Å; V73-Q76 PolarHBondContact O-N 3.39Å; V73-S77 VanDerWaalsContact O-CB 3.25Å; V73-S77 WeakPolarHBondContact O-CB 3.48Å; V73-S77 PolarHBondContact O-N 3.41Å; V73-S77 PolarHBondContact O-OG 3.08Å; V73-C106 HydrophobicContact CG2-CB 3.99Å; V73-I109 HydrophobicContact CG1-CG2 4.11Å; V73-I109 HydrophobicContact CG2-CB 4.48Å; V73-I109 HydrophobicContact CG2-CG2 4.29Å |
| 74 | F | 95.1 | Very high | 92.3 | Very high | 40 Ų | 40 | 30.9 Ų | 30.9 | 18% | 0.175 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.6 | -53.2 | 176.3 | -178.3 | -88.5 | 0 | 0 | 0 | 111.8 | F12 A15 C16 I70 A71 Y72 Q76 S77 F78 I80 | F12-F74 HydrophobicContact CD2-CZ 4.09Å; F12-F74 HydrophobicContact CE2-CE1 4.07Å; F12-F74 HydrophobicContact CE2-CE2 4.28Å; F12-F74 AromaticContact CE2-CZ 3.43Å; F12-F74 HydrophobicContact CE2-CZ 3.43Å; F12-F74 VanDerWaalsContact CE2-CZ 3.43Å; F12-F74 AromaticContact CZ-CZ 3.92Å; F12-F74 HydrophobicContact CZ-CZ 3.92Å; A15-F74 HydrophobicContact CB-CD2 4.09Å; A15-F74 HydrophobicContact CB-CE2 3.86Å; C16-F74 VanDerWaalsContact SG-CZ 3.5Å; I70-F74 WeakPolarHBondContact O-CB 3.43Å; I70-F74 PolarHBondContact O-N 3.4Å; A71-F74 PolarHBondContact O-N 2.88Å; Y72-F74 VanDerWaalsContact C-N 3.27Å; Y72-F74 PolarHBondContact O-N 3.45Å; F74-Q76 VanDerWaalsContact C-N 3.29Å; F74-Q76 PolarHBondContact O-N 3.26Å; F74-S77 PolarHBondContact O-N 2.91Å; F74-F78 HydrophobicContact CD1-CD2 4.38Å; F74-F78 AromaticContact CD2-CD2 3.89Å; F74-F78 HydrophobicContact CD2-CD2 3.89Å; F74-F78 AromaticContact CD2-CE2 3.7Å; F74-F78 HydrophobicContact CD2-CE2 3.7Å; F74-F78 HydrophobicContact CE1-CD2 4.25Å; F74-F78 AromaticContact CE2-CD2 3.75Å; F74-F78 HydrophobicContact CE2-CD2 3.75Å; F74-F78 AromaticContact CE2-CE2 3.53Å; F74-F78 HydrophobicContact CE2-CE2 3.53Å; F74-F78 HydrophobicContact CG-CD2 4.2Å; F74-F78 HydrophobicContact CG-CE2 4.42Å; F74-F78 AromaticContact CZ-CD2 3.93Å; F74-F78 HydrophobicContact CZ-CD2 3.93Å; F74-F78 HydrophobicContact CZ-CE2 4.14Å; F74-F78 VanDerWaalsContact O-CD2 3.3Å; F74-F78 WeakPolarHBondContact O-CD2 3.49Å; F74-F78 PolarHBondContact O-N 3.44Å; F74-I80 HydrophobicContact CD1-CD1 4.39Å; F74-I80 HydrophobicContact CE1-CD1 3.8Å |
| 75 | L | 93.8 | Very high | 92.4 | Very high | 14 Ų | 14 | 33.1 Ų | 33.1 | 7% | 0.073 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.5 | -43.8 | 178.8 | -69 | 178.6 | 0 | 0 | 0 | 111.5 | V39 A71 Y72 A79 I80 L86 | V39-L75 HydrophobicContact CG1-CD1 4.13Å; A71-L75 VanDerWaalsContact O-CG 3.26Å; A71-L75 WeakPolarHBondContact O-CG 3.45Å; A71-L75 PolarHBondContact O-N 3.21Å; Y72-L75 PolarHBondContact O-N 2.86Å; L75-A79 PolarHBondContact O-N 2.9Å; L75-I80 HydrophobicContact CB-CB 4.48Å; L75-I80 HydrophobicContact CD2-CB 3.7Å; L75-I80 HydrophobicContact CD2-CD1 4.41Å; L75-I80 HydrophobicContact CD2-CG2 3.56Å; L75-I80 PolarHBondContact O-N 2.82Å; L75-L86 HydrophobicContact CD1-CD1 3.72Å; L75-L86 HydrophobicContact CD1-CG 4.45Å |
| 76 | Q | 95.9 | Very high | 92.5 | Very high | 8 Ų | 8 | 31.4 Ų | 31.4 | 4% | 0.037 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.5 | -42.7 | 178.5 | -73.8 | -70.3 | -11.9 | 0 | 0 | 113.2 | Y72 V73 F74 F78 A79 S83 G110 N163 | Y72-Q76 HydrophobicContact CD1-CG 3.57Å; Y72-Q76 HydrophobicContact CE1-CG 3.46Å; Y72-Q76 VanDerWaalsContact CE1-CG 3.46Å; Y72-Q76 WeakPolarHBondContact O-CB 3.2Å; Y72-Q76 VanDerWaalsContact O-CG 3.29Å; Y72-Q76 WeakPolarHBondContact O-CG 3.39Å; Y72-Q76 PolarHBondContact O-N 3.37Å; V73-Q76 PolarHBondContact O-N 3.39Å; F74-Q76 VanDerWaalsContact C-N 3.29Å; F74-Q76 PolarHBondContact O-N 3.26Å; Q76-F78 VanDerWaalsContact C-N 3.25Å; Q76-F78 PolarHBondContact O-N 3.03Å; Q76-A79 PolarHBondContact O-N 2.96Å; Q76-S83 PolarHBondContact NE2-OG 3.13Å; Q76-G110 CarbonylContact C-O 3.54Å; Q76-N163 PolarHBondContact NE2-ND2 3.37Å; Q76-N163 PolarHBondContact OE1-ND2 3.41Å |
| 77 | S | 95.4 | Very high | 92.7 | Very high | 9 Ų | 9 | 30.3 Ų | 30.3 | 6% | 0.063 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.9 | -36.9 | -178.8 | -59.2 | 0 | 0 | 0 | 0 | 111.8 | V73 F74 G110 N113 C114 | V73-S77 VanDerWaalsContact O-CB 3.25Å; V73-S77 WeakPolarHBondContact O-CB 3.48Å; V73-S77 PolarHBondContact O-N 3.41Å; V73-S77 PolarHBondContact O-OG 3.08Å; F74-S77 PolarHBondContact O-N 2.91Å; S77-G110 VanDerWaalsContact CA-O 3.29Å; S77-G110 WeakPolarHBondContact CA-O 3.17Å; S77-G110 PolarHBondContact N-O 3.5Å; S77-N113 VanDerWaalsContact OG-CB 3.27Å; S77-N113 WeakPolarHBondContact OG-CB 3.25Å; S77-N113 PolarHBondContact OG-ND2 2.93Å; S77-C114 WeakPolarHBondContact O-CA 3.2Å; S77-C114 WeakPolarHBondContact O-CB 3.2Å |
| 78 | F | 93.5 | Very high | 92.8 | Very high | 44 Ų | 44 | 30.2 Ų | 30.2 | 19% | 0.193 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | 16.7 | -176.7 | -62.1 | -69.2 | 0 | 0 | 0 | 113.8 | I11 F12 A15 F74 Q76 I80 L117 | I11-F78 HydrophobicContact CG2-CE1 4.34Å; I11-F78 HydrophobicContact CG2-CZ 4.2Å; F12-F78 HydrophobicContact CB-CD1 4.42Å; F12-F78 HydrophobicContact CB-CE1 3.9Å; F12-F78 HydrophobicContact CB-CZ 4.23Å; F12-F78 HydrophobicContact CD2-CB 4.33Å; F12-F78 AromaticContact CD2-CD1 3.61Å; F12-F78 HydrophobicContact CD2-CD1 3.61Å; F12-F78 AromaticContact CD2-CD2 3.82Å; F12-F78 HydrophobicContact CD2-CD2 3.82Å; F12-F78 AromaticContact CD2-CE1 3.76Å; F12-F78 HydrophobicContact CD2-CE1 3.76Å; F12-F78 AromaticContact CD2-CE2 3.97Å; F12-F78 HydrophobicContact CD2-CE2 3.97Å; F12-F78 AromaticContact CD2-CG 3.64Å; F12-F78 HydrophobicContact CD2-CG 3.64Å; F12-F78 AromaticContact CD2-CZ 3.94Å; F12-F78 HydrophobicContact CD2-CZ 3.94Å; F12-F78 HydrophobicContact CE2-CB 4.36Å; F12-F78 HydrophobicContact CE2-CD1 4.43Å; F12-F78 HydrophobicContact CE2-CD2 4.11Å; F12-F78 HydrophobicContact CE2-CG 4.05Å; F12-F78 HydrophobicContact CG-CE1 4.34Å; A15-F78 HydrophobicContact CB-CE2 3.65Å; A15-F78 HydrophobicContact CB-CZ 3.72Å; F74-F78 HydrophobicContact CD1-CD2 4.38Å; F74-F78 AromaticContact CD2-CD2 3.89Å; F74-F78 HydrophobicContact CD2-CD2 3.89Å; F74-F78 AromaticContact CD2-CE2 3.7Å; F74-F78 HydrophobicContact CD2-CE2 3.7Å; F74-F78 HydrophobicContact CE1-CD2 4.25Å; F74-F78 AromaticContact CE2-CD2 3.75Å; F74-F78 HydrophobicContact CE2-CD2 3.75Å; F74-F78 AromaticContact CE2-CE2 3.53Å; F74-F78 HydrophobicContact CE2-CE2 3.53Å; F74-F78 HydrophobicContact CG-CD2 4.2Å; F74-F78 HydrophobicContact CG-CE2 4.42Å; F74-F78 AromaticContact CZ-CD2 3.93Å; F74-F78 HydrophobicContact CZ-CD2 3.93Å; F74-F78 HydrophobicContact CZ-CE2 4.14Å; F74-F78 VanDerWaalsContact O-CD2 3.3Å; F74-F78 WeakPolarHBondContact O-CD2 3.49Å; F74-F78 PolarHBondContact O-N 3.44Å; Q76-F78 VanDerWaalsContact C-N 3.25Å; Q76-F78 PolarHBondContact O-N 3.03Å; F78-I80 HydrophobicContact CB-CD1 3.91Å; F78-I80 HydrophobicContact CB-CG1 3.87Å; F78-I80 WeakPolarHBondContact O-CG1 3.44Å; F78-I80 PolarHBondContact O-N 3.14Å; F78-I80 VanDerWaalsContact O-N 3.1Å; F78-L117 HydrophobicContact CD1-CD1 4.21Å; F78-L117 HydrophobicContact CE1-CD1 3.93Å |
| 79 | A | 90.5 | Very high | 92.9 | Very high | 34 Ų | 34 | 30 Ų | 30 | 28% | 0.281 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.9 | 27.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L75 Q76 W164 | L75-A79 PolarHBondContact O-N 2.9Å; Q76-A79 PolarHBondContact O-N 2.96Å; A79-W164 HydrophobicContact CB-CB 3.49Å; A79-W164 VanDerWaalsContact CB-CB 3.49Å; A79-W164 HydrophobicContact CB-CG 4.4Å |
| 80 | I | 90.1 | Very high | 92.9 | Very high | 58 Ų | 58 | 27.7 Ų | 27.7 | 30% | 0.297 | 16% | 0.162 | S | C | . | . | trans | -83.7 | 126.5 | -177.5 | -54.6 | 175.8 | 0 | 0 | 0 | 108.9 | F12 F74 L75 F78 | F12-I80 HydrophobicContact CE2-CD1 4.17Å; F74-I80 HydrophobicContact CD1-CD1 4.39Å; F74-I80 HydrophobicContact CE1-CD1 3.8Å; L75-I80 HydrophobicContact CB-CB 4.48Å; L75-I80 HydrophobicContact CD2-CB 3.7Å; L75-I80 HydrophobicContact CD2-CD1 4.41Å; L75-I80 HydrophobicContact CD2-CG2 3.56Å; L75-I80 PolarHBondContact O-N 2.82Å; F78-I80 HydrophobicContact CB-CD1 3.91Å; F78-I80 HydrophobicContact CB-CG1 3.87Å; F78-I80 WeakPolarHBondContact O-CG1 3.44Å; F78-I80 PolarHBondContact O-N 3.14Å; F78-I80 VanDerWaalsContact O-N 3.1Å | ||
| 81 | P | 86.2 | Confident | 93 | Very high | 121 Ų | 121 | 25.6 Ų | 25.6 | 79% | 0.786 | 15% | 0.152 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | 146.5 | 176.6 | 27.4 | -34.2 | 0 | 0 | 0 | 111.4 | ||
| 82 | G | 86.5 | Confident | 93.1 | Very high | 15 Ų | 15 | 25.1 Ų | 25.1 | 16% | 0.155 | 15% | 0.147 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 132.5 | -11.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | V84 F85 | G82-V84 PolarHBondContact O-N 3.27Å; G82-V84 VanDerWaalsContact O-N 3.13Å; G82-F85 PolarHBondContact O-N 3.49Å |
| 83 | S | 91.6 | Very high | 93 | Very high | 20 Ų | 20 | 25 Ų | 25 | 14% | 0.14 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.5 | -22.9 | 178.2 | 56.7 | 0 | 0 | 0 | 0 | 114.1 | Y72 Q76 F85 L86 S87 | Y72-S83 WeakPolarHBondContact CE2-O 3.48Å; Q76-S83 PolarHBondContact NE2-OG 3.13Å; S83-F85 VanDerWaalsContact C-N 3.33Å; S83-F85 PolarHBondContact O-N 2.99Å; S83-L86 WeakPolarHBondContact O-CB 3.19Å; S83-L86 PolarHBondContact O-N 2.98Å; S83-S87 PolarHBondContact O-N 3.13Å; S83-S87 PolarHBondContact O-OG 3.39Å |
| 84 | V | 91.2 | Very high | 93 | Very high | 49 Ų | 49 | 24.4 Ų | 24.4 | 30% | 0.297 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -60 | -41.2 | 171.9 | 67.2 | 0 | 0 | 0 | 0 | 112.1 | G82 L86 S87 I88 F195 | G82-V84 PolarHBondContact O-N 3.27Å; G82-V84 VanDerWaalsContact O-N 3.13Å; V84-L86 VanDerWaalsContact C-N 3.3Å; V84-L86 PolarHBondContact O-N 3.36Å; V84-S87 VanDerWaalsContact O-CB 3.32Å; V84-S87 WeakPolarHBondContact O-CB 3.29Å; V84-S87 PolarHBondContact O-N 2.95Å; V84-S87 VanDerWaalsContact O-N 3.11Å; V84-I88 PolarHBondContact O-N 3.48Å; V84-I88 VanDerWaalsContact O-N 3.08Å; V84-F195 HydrophobicContact CG2-CD1 3.5Å; V84-F195 HydrophobicContact CG2-CD2 4.04Å; V84-F195 HydrophobicContact CG2-CE1 3.36Å; V84-F195 HydrophobicContact CG2-CE2 3.91Å; V84-F195 HydrophobicContact CG2-CG 3.86Å; V84-F195 HydrophobicContact CG2-CZ 3.58Å |
| 85 | F | 92 | Very high | 92.9 | Very high | 48 Ų | 48 | 26.1 Ų | 26.1 | 21% | 0.211 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -69.8 | -31.5 | 178.2 | -62.7 | -66.6 | 0 | 0 | 0 | 111.7 | P40 R41 G82 S83 S87 I88 L89 | P40-F85 HydrophobicContact CB-CB 4.04Å; P40-F85 HydrophobicContact CG-CB 3.74Å; P40-F85 WeakPolarHBondContact O-CD2 3.37Å; R41-F85 VanDerWaalsContact C-CE2 3.45Å; R41-F85 WeakPolarHBondContact O-CE2 3.4Å; R41-F85 WeakPolarHBondContact O-CZ 3.41Å; G82-F85 PolarHBondContact O-N 3.49Å; S83-F85 VanDerWaalsContact C-N 3.33Å; S83-F85 PolarHBondContact O-N 2.99Å; F85-S87 VanDerWaalsContact C-N 3.32Å; F85-I88 HydrophobicContact CD1-CD1 4.4Å; F85-I88 PolarHBondContact O-N 2.93Å; F85-L89 VanDerWaalsContact O-CB 3.27Å; F85-L89 WeakPolarHBondContact O-CB 3.49Å; F85-L89 PolarHBondContact O-N 3.43Å |
| 86 | L | 93.9 | Very high | 93 | Very high | 4 Ų | 4 | 27.8 Ų | 27.8 | 2% | 0.021 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -67.2 | -34 | 170.9 | -63.8 | 179.2 | 0 | 0 | 0 | 111.9 | P40 A71 Y72 L75 S83 V84 L89 S90 | P40-L86 HydrophobicContact CG-CD2 4.28Å; A71-L86 HydrophobicContact CB-CD1 3.94Å; Y72-L86 VanDerWaalsContact CA-CD1 3.5Å; Y72-L86 HydrophobicContact CD2-CB 3.64Å; Y72-L86 HydrophobicContact CD2-CD1 4.11Å; Y72-L86 HydrophobicContact CE2-CB 4.17Å; Y72-L86 HydrophobicContact CG-CD1 4.27Å; L75-L86 HydrophobicContact CD1-CD1 3.72Å; L75-L86 HydrophobicContact CD1-CG 4.45Å; S83-L86 WeakPolarHBondContact O-CB 3.19Å; S83-L86 PolarHBondContact O-N 2.98Å; V84-L86 VanDerWaalsContact C-N 3.3Å; V84-L86 PolarHBondContact O-N 3.36Å; L86-L89 HydrophobicContact CD2-CD2 4.23Å; L86-L89 PolarHBondContact O-N 3.29Å; L86-S90 WeakPolarHBondContact O-CB 3.27Å; L86-S90 PolarHBondContact O-N 2.98Å; L86-S90 PolarHBondContact O-OG 3.13Å |
| 87 | S | 95.6 | Very high | 93 | Very high | 2 Ų | 2 | 36.8 Ų | 36.8 | 1% | 0.014 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.7 | -43.2 | 173.7 | -55.7 | 0 | 0 | 0 | 0 | 111.9 | Y72 S83 V84 F85 S90 G91 | Y72-S87 WeakPolarHBondContact CE2-OG 3.42Å; Y72-S87 PolarHBondContact OH-OG 2.83Å; S83-S87 PolarHBondContact O-N 3.13Å; S83-S87 PolarHBondContact O-OG 3.39Å; V84-S87 VanDerWaalsContact O-CB 3.32Å; V84-S87 WeakPolarHBondContact O-CB 3.29Å; V84-S87 PolarHBondContact O-N 2.95Å; V84-S87 VanDerWaalsContact O-N 3.11Å; F85-S87 VanDerWaalsContact C-N 3.32Å; S87-S90 PolarHBondContact O-N 3.2Å; S87-G91 PolarHBondContact O-N 3.45Å; S87-G91 VanDerWaalsContact O-N 3.15Å |
| 88 | I | 93.6 | Very high | 93.1 | Very high | 16 Ų | 16 | 38.8 Ų | 38.8 | 8% | 0.082 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.4 | -47 | 173.7 | -62.9 | 170.7 | 0 | 0 | 0 | 109.9 | L43 V84 F85 S90 G91 Y92 F195 G199 | L43-I88 HydrophobicContact CD1-CD1 4.35Å; L43-I88 HydrophobicContact CD1-CG2 4.17Å; V84-I88 PolarHBondContact O-N 3.48Å; V84-I88 VanDerWaalsContact O-N 3.08Å; F85-I88 HydrophobicContact CD1-CD1 4.4Å; F85-I88 PolarHBondContact O-N 2.93Å; I88-S90 VanDerWaalsContact C-N 3.32Å; I88-S90 PolarHBondContact O-N 3.26Å; I88-G91 PolarHBondContact O-N 3.29Å; I88-G91 VanDerWaalsContact O-N 3.14Å; I88-Y92 PolarHBondContact O-N 2.86Å; I88-F195 WeakPolarHBondContact CA-O 3.4Å; I88-F195 HydrophobicContact CG1-CB 4.06Å; I88-F195 HydrophobicContact CG1-CD1 4.41Å; I88-G199 WeakPolarHBondContact O-CA 3.49Å |
| 89 | L | 93.9 | Very high | 93.3 | Very high | 2 Ų | 2 | 36.7 Ų | 36.7 | 1% | 0.01 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.8 | -39.9 | 178.1 | -174.2 | 66.6 | 0 | 0 | 0 | 112 | L49 L53 I68 F85 L86 G91 Y92 L93 | L49-L89 HydrophobicContact CB-CD1 4.45Å; L49-L89 HydrophobicContact CD2-CD1 4.43Å; L49-L89 HydrophobicContact CD2-CD2 3.59Å; L49-L89 HydrophobicContact CG-CD1 4.31Å; L49-L89 HydrophobicContact CG-CD2 4.21Å; L53-L89 HydrophobicContact CD1-CD2 4.15Å; I68-L89 HydrophobicContact CD1-CD2 4.15Å; I68-L89 HydrophobicContact CD1-CG 4.33Å; I68-L89 HydrophobicContact CG1-CD2 4.36Å; F85-L89 VanDerWaalsContact O-CB 3.27Å; F85-L89 WeakPolarHBondContact O-CB 3.49Å; F85-L89 PolarHBondContact O-N 3.43Å; L86-L89 HydrophobicContact CD2-CD2 4.23Å; L86-L89 PolarHBondContact O-N 3.29Å; L89-G91 VanDerWaalsContact C-N 3.34Å; L89-G91 PolarHBondContact O-N 3.11Å; L89-Y92 WeakPolarHBondContact O-CB 3.49Å; L89-Y92 PolarHBondContact O-N 3.12Å; L89-L93 HydrophobicContact CD1-CD1 3.89Å; L89-L93 HydrophobicContact CD1-CG 4.27Å; L89-L93 HydrophobicContact CD2-CD1 4.39Å; L89-L93 HydrophobicContact CG-CD1 3.74Å; L89-L93 HydrophobicContact CG-CG 4.43Å; L89-L93 WeakPolarHBondContact O-CB 3.29Å; L89-L93 WeakPolarHBondContact O-CG 3.13Å; L89-L93 PolarHBondContact O-N 2.89Å |
| 90 | S | 96 | Very high | 93.6 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60 | -42.6 | 174.1 | -69.4 | 0 | 0 | 0 | 0 | 112 | L86 S87 I88 Y92 L93 F94 | L86-S90 WeakPolarHBondContact O-CB 3.27Å; L86-S90 PolarHBondContact O-N 2.98Å; L86-S90 PolarHBondContact O-OG 3.13Å; S87-S90 PolarHBondContact O-N 3.2Å; I88-S90 VanDerWaalsContact C-N 3.32Å; I88-S90 PolarHBondContact O-N 3.26Å; S90-Y92 VanDerWaalsContact C-N 3.32Å; S90-L93 PolarHBondContact O-N 2.7Å; S90-F94 WeakPolarHBondContact O-CD2 3.42Å; S90-F94 PolarHBondContact O-N 3.05Å |
| 91 | G | 95.1 | Very high | 94 | Very high | 5 Ų | 5 | 35.6 Ų | 35.6 | 5% | 0.052 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68 | -29.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | S87 I88 L89 I196 K200 | S87-G91 PolarHBondContact O-N 3.45Å; S87-G91 VanDerWaalsContact O-N 3.15Å; I88-G91 PolarHBondContact O-N 3.29Å; I88-G91 VanDerWaalsContact O-N 3.14Å; L89-G91 VanDerWaalsContact C-N 3.34Å; L89-G91 PolarHBondContact O-N 3.11Å; G91-I196 WeakPolarHBondContact CA-O 3.39Å; G91-K200 WeakPolarHBondContact O-CA 3.5Å; G91-K200 PolarHBondContact O-N 3.43Å |
| 92 | Y | 93.3 | Very high | 94.6 | Very high | 6 Ų | 6 | 30.9 Ų | 30.9 | 2% | 0.024 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -69.1 | -37.2 | 173.1 | -174 | -77.2 | 0 | 0 | 0 | 112 | G50 L51 R54 I88 L89 S90 G199 L202 N203 | G50-Y92 WeakPolarHBondContact O-CE1 3.3Å; L51-Y92 WeakPolarHBondContact CD2-OH 3.46Å; L51-Y92 WeakPolarHBondContact CG-OH 3.45Å; R54-Y92 HydrophobicContact CB-CE1 4.2Å; I88-Y92 PolarHBondContact O-N 2.86Å; L89-Y92 WeakPolarHBondContact O-CB 3.49Å; L89-Y92 PolarHBondContact O-N 3.12Å; S90-Y92 VanDerWaalsContact C-N 3.32Å; Y92-G199 WeakPolarHBondContact CA-O 3.38Å; Y92-L202 HydrophobicContact CD2-CB 4.22Å; Y92-L202 HydrophobicContact CD2-CD2 4.17Å; Y92-L202 HydrophobicContact CD2-CG 4.02Å; Y92-L202 HydrophobicContact CE2-CG 4.15Å; Y92-N203 HydrophobicContact CD1-CB 4.42Å; Y92-N203 HydrophobicContact CD2-CB 3.67Å; Y92-N203 HydrophobicContact CE1-CB 4.5Å; Y92-N203 WeakPolarHBondContact CE1-ND2 3.29Å; Y92-N203 VanDerWaalsContact CE2-CA 3.43Å; Y92-N203 HydrophobicContact CE2-CB 3.82Å; Y92-N203 HydrophobicContact CG-CB 3.98Å; Y92-N203 PolarHBondContact O-ND2 2.8Å |
| 93 | L | 93.3 | Very high | 95.1 | Very high | 6 Ų | 6 | 30.1 Ų | 30.1 | 3% | 0.031 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -97.2 | -33.4 | -169.3 | -68.2 | 172.7 | 0 | 0 | 0 | 114.4 | L53 R54 K57 V64 I68 L89 S90 | L53-L93 HydrophobicContact CB-CD1 3.92Å; L53-L93 HydrophobicContact CB-CD2 3.79Å; L53-L93 HydrophobicContact CD1-CD1 3.93Å; R54-L93 HydrophobicContact CB-CD2 4.11Å; K57-L93 PolarHBondContact NZ-O 3.31Å; V64-L93 HydrophobicContact CG1-CD1 3.91Å; I68-L93 HydrophobicContact CD1-CD1 3.56Å; L89-L93 HydrophobicContact CD1-CD1 3.89Å; L89-L93 HydrophobicContact CD1-CG 4.27Å; L89-L93 HydrophobicContact CD2-CD1 4.39Å; L89-L93 HydrophobicContact CG-CD1 3.74Å; L89-L93 HydrophobicContact CG-CG 4.43Å; L89-L93 WeakPolarHBondContact O-CB 3.29Å; L89-L93 WeakPolarHBondContact O-CG 3.13Å; L89-L93 PolarHBondContact O-N 2.89Å; S90-L93 PolarHBondContact O-N 2.7Å |
| 94 | F | 95.8 | Very high | 95.4 | Very high | 11 Ų | 11 | 29.4 Ų | 29.4 | 5% | 0.048 | 15% | 0.153 | C | C | . | . | S | Bend | trans | -117.7 | 158.9 | -169.1 | -57.3 | -70.4 | 0 | 0 | 0 | 112.7 | K57 Y61 V64 L65 I68 S90 A99 | K57-F94 HydrophobicContact CD-CD1 4.21Å; K57-F94 HydrophobicContact CD-CE1 3.94Å; Y61-F94 HydrophobicContact CD2-CE1 4.27Å; Y61-F94 HydrophobicContact CE1-CE1 4.37Å; Y61-F94 AromaticContact CE2-CD1 3.57Å; Y61-F94 HydrophobicContact CE2-CD1 3.57Å; Y61-F94 AromaticContact CE2-CE1 3.67Å; Y61-F94 HydrophobicContact CE2-CE1 3.67Å; Y61-F94 AromaticContact CZ-CD1 3.62Å; Y61-F94 AromaticContact CZ-CE1 3.71Å; Y61-F94 WeakPolarHBondContact OH-CD1 3.41Å; V64-F94 HydrophobicContact CG1-CZ 4.1Å; L65-F94 HydrophobicContact CB-CE1 4.16Å; L65-F94 HydrophobicContact CB-CZ 3.95Å; L65-F94 HydrophobicContact CD1-CE1 4.3Å; L65-F94 HydrophobicContact CD1-CE2 4.16Å; L65-F94 HydrophobicContact CD1-CZ 3.93Å; I68-F94 HydrophobicContact CD1-CE2 3.61Å; I68-F94 HydrophobicContact CD1-CZ 4.14Å; S90-F94 WeakPolarHBondContact O-CD2 3.42Å; S90-F94 PolarHBondContact O-N 3.05Å; F94-A99 HydrophobicContact CB-CB 4.26Å |
| 95 | P | 94.7 | Very high | 95.8 | Very high | 77 Ų | 77 | 30.8 Ų | 30.8 | 50% | 0.5 | 16% | 0.159 | S | C | . | . | trans | -55.5 | 147.9 | 167.7 | -22.2 | 33.8 | 0 | 0 | 0 | 111 | W97 T98 A99 | P95-W97 PolarHBondContact O-N 3.28Å; P95-T98 WeakPolarHBondContact O-CB 3.23Å; P95-T98 PolarHBondContact O-N 3.26Å; P95-T98 VanDerWaalsContact O-N 3.07Å; P95-A99 PolarHBondContact O-N 3.34Å | ||
| 96 | F | 94.6 | Very high | 96.1 | Very high | 49 Ų | 49 | 28.7 Ų | 28.7 | 22% | 0.215 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -51.1 | -52.1 | -171.6 | -179.8 | -98.4 | 0 | 0 | 0 | 113.9 | T98 A99 L100 L193 I196 | F96-T98 VanDerWaalsContact C-N 3.32Å; F96-T98 PolarHBondContact O-N 3Å; F96-A99 PolarHBondContact O-N 3Å; F96-L100 HydrophobicContact CE1-CD2 4.5Å; F96-L100 WeakPolarHBondContact O-CB 3.36Å; F96-L100 PolarHBondContact O-N 3.2Å; F96-L193 HydrophobicContact CE1-CD2 4.09Å; F96-L193 HydrophobicContact CE2-CD2 4.31Å; F96-L193 HydrophobicContact CZ-CD2 3.45Å; F96-L193 VanDerWaalsContact CZ-CD2 3.45Å; F96-I196 HydrophobicContact CD2-CG2 3.74Å; F96-I196 HydrophobicContact CE2-CG2 4.05Å |
| 97 | W | 96.7 | Very high | 96.2 | Very high | 197 Ų | 197 | 28.6 Ų | 28.6 | 75% | 0.746 | 15% | 0.15 | S | C | * | . | H | α-helix | trans | -66.1 | -35.3 | -178.2 | -62.4 | 115.1 | 0 | 0 | 0 | 112.7 | P95 L100 A101 | P95-W97 PolarHBondContact O-N 3.28Å; W97-L100 HydrophobicContact CE3-CD2 4.19Å; W97-L100 HydrophobicContact CZ3-CD2 4.17Å; W97-A101 WeakPolarHBondContact O-CB 3.3Å; W97-A101 PolarHBondContact O-N 2.7Å |
| 98 | T | 97 | Very high | 96.4 | Very high | 50 Ų | 50 | 28.5 Ų | 28.5 | 31% | 0.307 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -67.4 | -46.8 | 174.9 | -49.4 | 0 | 0 | 0 | 0 | 110.8 | P95 F96 L100 A101 V102 | P95-T98 WeakPolarHBondContact O-CB 3.23Å; P95-T98 PolarHBondContact O-N 3.26Å; P95-T98 VanDerWaalsContact O-N 3.07Å; F96-T98 VanDerWaalsContact C-N 3.32Å; F96-T98 PolarHBondContact O-N 3Å; T98-L100 VanDerWaalsContact C-N 3.32Å; T98-L100 PolarHBondContact O-N 2.75Å; T98-A101 PolarHBondContact O-N 3.03Å; T98-V102 HydrophobicContact CG2-CG2 4.39Å; T98-V102 WeakPolarHBondContact O-CB 3.37Å; T98-V102 WeakPolarHBondContact O-CG2 3.43Å; T98-V102 PolarHBondContact O-N 3.32Å |
| 99 | A | 97.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -58.6 | -45.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | F94 P95 F96 V102 V103 I196 | F94-A99 HydrophobicContact CB-CB 4.26Å; P95-A99 PolarHBondContact O-N 3.34Å; F96-A99 PolarHBondContact O-N 3Å; A99-V102 PolarHBondContact O-N 3.22Å; A99-V103 WeakPolarHBondContact O-CB 3.37Å; A99-V103 VanDerWaalsContact O-CG2 3.23Å; A99-V103 WeakPolarHBondContact O-CG2 2.97Å; A99-V103 PolarHBondContact O-N 3.12Å; A99-I196 HydrophobicContact CB-CD1 4.16Å; A99-I196 HydrophobicContact CB-CG1 4.26Å; A99-I196 HydrophobicContact CB-CG2 3.89Å |
| 100 | L | 97.9 | Very high | 96.8 | Very high | 23 Ų | 23 | 31.2 Ų | 31.2 | 12% | 0.12 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.8 | -50.2 | 179.6 | -175.3 | 64.5 | 0 | 0 | 0 | 111.7 | F96 W97 T98 V102 V103 C104 A189 L193 I196 | F96-L100 HydrophobicContact CE1-CD2 4.5Å; F96-L100 WeakPolarHBondContact O-CB 3.36Å; F96-L100 PolarHBondContact O-N 3.2Å; W97-L100 HydrophobicContact CE3-CD2 4.19Å; W97-L100 HydrophobicContact CZ3-CD2 4.17Å; T98-L100 VanDerWaalsContact C-N 3.32Å; T98-L100 PolarHBondContact O-N 2.75Å; L100-V102 VanDerWaalsContact C-N 3.33Å; L100-V102 PolarHBondContact O-N 3.4Å; L100-V103 PolarHBondContact O-N 3.38Å; L100-C104 WeakPolarHBondContact O-CB 3.45Å; L100-C104 PolarHBondContact O-N 3.05Å; L100-C104 PolarHBondContact O-SG 3.4Å; L100-A189 HydrophobicContact CD1-CB 4.35Å; L100-L193 HydrophobicContact CD1-CD2 3.81Å; L100-L193 HydrophobicContact CD1-CG 4.42Å; L100-L193 HydrophobicContact CD2-CD2 3.74Å; L100-L193 HydrophobicContact CG-CD2 4.4Å; L100-I196 VanDerWaalsContact CA-CD1 3.46Å; L100-I196 HydrophobicContact CB-CD1 4Å; L100-I196 HydrophobicContact CD1-CD1 3.95Å |
| 101 | A | 98 | Very high | 96.8 | Very high | 47 Ų | 47 | 31.2 Ų | 31.2 | 39% | 0.388 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -59.1 | -45.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | W97 T98 L105 | W97-A101 WeakPolarHBondContact O-CB 3.3Å; W97-A101 PolarHBondContact O-N 2.7Å; T98-A101 PolarHBondContact O-N 3.03Å; A101-L105 VanDerWaalsContact O-CB 3.3Å; A101-L105 WeakPolarHBondContact O-CB 3.28Å; A101-L105 VanDerWaalsContact O-CG 3.28Å; A101-L105 WeakPolarHBondContact O-CG 3.26Å; A101-L105 PolarHBondContact O-N 3.33Å |
| 102 | V | 97.6 | Very high | 96.9 | Very high | 21 Ų | 21 | 31.2 Ų | 31.2 | 13% | 0.127 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.8 | -49.6 | 178.9 | 169.9 | 0 | 0 | 0 | 0 | 111.1 | L65 V69 T98 A99 L100 C104 L105 C106 | L65-V102 HydrophobicContact CD1-CG1 4.09Å; L65-V102 HydrophobicContact CD1-CG2 3.72Å; V69-V102 HydrophobicContact CG2-CG1 3.96Å; T98-V102 HydrophobicContact CG2-CG2 4.39Å; T98-V102 WeakPolarHBondContact O-CB 3.37Å; T98-V102 WeakPolarHBondContact O-CG2 3.43Å; T98-V102 PolarHBondContact O-N 3.32Å; A99-V102 PolarHBondContact O-N 3.22Å; L100-V102 VanDerWaalsContact C-N 3.33Å; L100-V102 PolarHBondContact O-N 3.4Å; V102-C104 PolarHBondContact O-N 3.05Å; V102-L105 PolarHBondContact O-N 3.38Å; V102-C106 VanDerWaalsContact O-CB 3.26Å; V102-C106 WeakPolarHBondContact O-CB 3.29Å; V102-C106 PolarHBondContact O-N 3.09Å; V102-C106 PolarHBondContact O-SG 3.5Å |
| 103 | V | 98.1 | Very high | 97.1 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.4 | -46 | -178.8 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | Y72 A99 L100 S107 S192 I196 | Y72-V103 HydrophobicContact CE2-CG1 4.14Å; Y72-V103 HydrophobicContact CE2-CG2 4.35Å; A99-V103 WeakPolarHBondContact O-CB 3.37Å; A99-V103 VanDerWaalsContact O-CG2 3.23Å; A99-V103 WeakPolarHBondContact O-CG2 2.97Å; A99-V103 PolarHBondContact O-N 3.12Å; L100-V103 PolarHBondContact O-N 3.38Å; V103-S107 WeakPolarHBondContact O-CB 3.4Å; V103-S107 PolarHBondContact O-N 3.24Å; V103-S192 WeakPolarHBondContact CG1-OG 3.48Å; V103-I196 HydrophobicContact CB-CD1 4.38Å; V103-I196 HydrophobicContact CG2-CD1 4.26Å |
| 104 | C | 98.2 | Very high | 97.2 | Very high | 4 Ų | 4 | 34.2 Ų | 34.2 | 3% | 0.027 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.6 | -44.9 | 178.4 | -66 | 0 | 0 | 0 | 0 | 112.1 | L100 V102 S107 A108 F185 V188 | L100-C104 WeakPolarHBondContact O-CB 3.45Å; L100-C104 PolarHBondContact O-N 3.05Å; L100-C104 PolarHBondContact O-SG 3.4Å; V102-C104 PolarHBondContact O-N 3.05Å; C104-S107 PolarHBondContact O-N 2.97Å; C104-A108 WeakPolarHBondContact O-CB 3.02Å; C104-A108 PolarHBondContact O-N 2.93Å; C104-F185 HydrophobicContact CB-CD2 3.66Å; C104-F185 HydrophobicContact CB-CE2 3.54Å; C104-F185 HydrophobicContact CB-CG 4.5Å; C104-F185 HydrophobicContact CB-CZ 4.33Å; C104-V188 HydrophobicContact CB-CG2 4.3Å |
| 105 | L | 98.2 | Very high | 97.1 | Very high | 79 Ų | 79 | 35.1 Ų | 35.1 | 41% | 0.414 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -64.3 | -49.1 | 177.2 | -75.9 | 174.7 | 0 | 0 | 0 | 111.8 | A101 V102 S107 A108 I109 F185 | A101-L105 VanDerWaalsContact O-CB 3.3Å; A101-L105 WeakPolarHBondContact O-CB 3.28Å; A101-L105 VanDerWaalsContact O-CG 3.28Å; A101-L105 WeakPolarHBondContact O-CG 3.26Å; A101-L105 PolarHBondContact O-N 3.33Å; V102-L105 PolarHBondContact O-N 3.38Å; L105-S107 VanDerWaalsContact C-N 3.27Å; L105-S107 PolarHBondContact O-N 3.17Å; L105-A108 PolarHBondContact O-N 3.11Å; L105-I109 WeakPolarHBondContact O-CB 3.08Å; L105-I109 VanDerWaalsContact O-CG1 3.28Å; L105-I109 WeakPolarHBondContact O-CG1 3.47Å; L105-I109 PolarHBondContact O-N 3.02Å; L105-F185 HydrophobicContact CD2-CD2 3.99Å; L105-F185 HydrophobicContact CD2-CE2 3.66Å; L105-F185 HydrophobicContact CG-CD2 4.37Å; L105-F185 HydrophobicContact CG-CE2 3.79Å |
| 106 | C | 98.1 | Very high | 97.1 | Very high | 4 Ų | 4 | 34.2 Ų | 34.2 | 3% | 0.027 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | 178.5 | -70.8 | 0 | 0 | 0 | 0 | 111.9 | Y72 V73 V102 G110 | Y72-C106 HydrophobicContact CD1-CB 3.48Å; Y72-C106 VanDerWaalsContact CD1-CB 3.48Å; Y72-C106 HydrophobicContact CE1-CB 4.1Å; Y72-C106 HydrophobicContact CG-CB 3.74Å; V73-C106 HydrophobicContact CG2-CB 3.99Å; V102-C106 VanDerWaalsContact O-CB 3.26Å; V102-C106 WeakPolarHBondContact O-CB 3.29Å; V102-C106 PolarHBondContact O-N 3.09Å; V102-C106 PolarHBondContact O-SG 3.5Å; C106-G110 PolarHBondContact O-N 3.45Å |
| 107 | S | 97.6 | Very high | 96.9 | Very high | 1 Ų | 1 | 33.1 Ų | 33.1 | 1% | 0.007 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -66.9 | -44.6 | 175.6 | -162.8 | 0 | 0 | 0 | 0 | 111.9 | V103 C104 L105 A111 | V103-S107 WeakPolarHBondContact O-CB 3.4Å; V103-S107 PolarHBondContact O-N 3.24Å; C104-S107 PolarHBondContact O-N 2.97Å; L105-S107 VanDerWaalsContact C-N 3.27Å; L105-S107 PolarHBondContact O-N 3.17Å; S107-A111 WeakPolarHBondContact O-CB 3.29Å; S107-A111 PolarHBondContact O-N 3.37Å |
| 108 | A | 98.2 | Very high | 96.5 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.9 | -48 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | C104 L105 S112 F181 F185 | C104-A108 WeakPolarHBondContact O-CB 3.02Å; C104-A108 PolarHBondContact O-N 2.93Å; L105-A108 PolarHBondContact O-N 3.11Å; A108-S112 VanDerWaalsContact O-CB 3.26Å; A108-S112 WeakPolarHBondContact O-CB 3.35Å; A108-S112 PolarHBondContact O-N 3.03Å; A108-S112 PolarHBondContact O-OG 2.88Å; A108-F181 HydrophobicContact CB-CD2 3.92Å; A108-F181 HydrophobicContact CB-CE1 4.49Å; A108-F181 HydrophobicContact CB-CE2 3.67Å; A108-F181 HydrophobicContact CB-CG 4.45Å; A108-F181 HydrophobicContact CB-CZ 3.99Å; A108-F185 HydrophobicContact CB-CB 3.88Å; A108-F185 HydrophobicContact CB-CD2 4.45Å |
| 109 | I | 98.1 | Very high | 96.1 | Very high | 75 Ų | 75 | 23.8 Ų | 23.8 | 39% | 0.385 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -63 | -51.7 | 178.8 | -66.3 | 167 | 0 | 0 | 0 | 110.8 | V73 L105 A111 S112 N113 F181 | V73-I109 HydrophobicContact CG1-CG2 4.11Å; V73-I109 HydrophobicContact CG2-CB 4.48Å; V73-I109 HydrophobicContact CG2-CG2 4.29Å; L105-I109 WeakPolarHBondContact O-CB 3.08Å; L105-I109 VanDerWaalsContact O-CG1 3.28Å; L105-I109 WeakPolarHBondContact O-CG1 3.47Å; L105-I109 PolarHBondContact O-N 3.02Å; I109-A111 PolarHBondContact O-N 2.86Å; I109-S112 WeakPolarHBondContact O-CB 3.18Å; I109-S112 PolarHBondContact O-N 3.46Å; I109-N113 PolarHBondContact O-N 3.28Å; I109-F181 HydrophobicContact CG1-CE2 4.1Å |
| 110 | G | 97.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.2 | -40.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q76 S77 C106 S112 N113 C114 | Q76-G110 CarbonylContact C-O 3.54Å; S77-G110 VanDerWaalsContact CA-O 3.29Å; S77-G110 WeakPolarHBondContact CA-O 3.17Å; S77-G110 PolarHBondContact N-O 3.5Å; C106-G110 PolarHBondContact O-N 3.45Å; G110-S112 VanDerWaalsContact C-N 3.32Å; G110-S112 PolarHBondContact O-N 3.09Å; G110-N113 WeakPolarHBondContact O-CB 3.43Å; G110-N113 PolarHBondContact O-N 3.44Å; G110-C114 PolarHBondContact O-N 2.8Å |
| 111 | A | 97.2 | Very high | 94.5 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.5 | -39.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S107 I109 C114 Y115 N167 F180 T184 | S107-A111 WeakPolarHBondContact O-CB 3.29Å; S107-A111 PolarHBondContact O-N 3.37Å; I109-A111 PolarHBondContact O-N 2.86Å; A111-C114 WeakPolarHBondContact O-CB 3.42Å; A111-C114 PolarHBondContact O-N 3.42Å; A111-Y115 PolarHBondContact O-N 3.43Å; A111-N167 WeakPolarHBondContact CB-OD1 3.25Å; A111-F180 HydrophobicContact CB-CE1 3.92Å; A111-F180 HydrophobicContact CB-CZ 4Å; A111-F180 WeakPolarHBondContact O-CE1 3.4Å; A111-T184 HydrophobicContact CB-CG2 3.96Å |
| 112 | S | 97.8 | Very high | 93.2 | Very high | 5 Ų | 5 | 28.4 Ų | 28.4 | 4% | 0.035 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.1 | -37.2 | 175.4 | -81.6 | 0 | 0 | 0 | 0 | 112.6 | A108 I109 G110 Y115 V116 F181 | A108-S112 VanDerWaalsContact O-CB 3.26Å; A108-S112 WeakPolarHBondContact O-CB 3.35Å; A108-S112 PolarHBondContact O-N 3.03Å; A108-S112 PolarHBondContact O-OG 2.88Å; I109-S112 WeakPolarHBondContact O-CB 3.18Å; I109-S112 PolarHBondContact O-N 3.46Å; G110-S112 VanDerWaalsContact C-N 3.32Å; G110-S112 PolarHBondContact O-N 3.09Å; S112-Y115 WeakPolarHBondContact O-CB 3.44Å; S112-Y115 PolarHBondContact O-N 2.99Å; S112-V116 WeakPolarHBondContact O-CG2 3.23Å; S112-V116 PolarHBondContact O-N 3.3Å; S112-F181 WeakPolarHBondContact OG-CD2 3.16Å |
| 113 | N | 96.2 | Very high | 91.8 | Very high | 68 Ų | 68 | 30.6 Ų | 30.6 | 36% | 0.364 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.2 | -46 | 171.3 | -68.6 | -15.1 | 0 | 0 | 0 | 110.7 | S77 I109 G110 Y115 V116 L117 | S77-N113 VanDerWaalsContact OG-CB 3.27Å; S77-N113 WeakPolarHBondContact OG-CB 3.25Å; S77-N113 PolarHBondContact OG-ND2 2.93Å; I109-N113 PolarHBondContact O-N 3.28Å; G110-N113 WeakPolarHBondContact O-CB 3.43Å; G110-N113 PolarHBondContact O-N 3.44Å; N113-Y115 VanDerWaalsContact C-N 3.32Å; N113-Y115 PolarHBondContact O-N 3.23Å; N113-V116 PolarHBondContact O-N 2.87Å; N113-V116 VanDerWaalsContact O-N 3.17Å; N113-L117 VanDerWaalsContact O-CG 3.28Å; N113-L117 WeakPolarHBondContact O-CG 3.34Å; N113-L117 PolarHBondContact O-N 3.36Å |
| 114 | C | 94.9 | Very high | 90.2 | Very high | 8 Ų | 8 | 35 Ų | 35 | 5% | 0.054 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.9 | -41.7 | 175.9 | -172.2 | 0 | 0 | 0 | 0 | 111.8 | S77 G110 A111 V116 L117 S118 N167 | S77-C114 WeakPolarHBondContact O-CA 3.2Å; S77-C114 WeakPolarHBondContact O-CB 3.2Å; G110-C114 PolarHBondContact O-N 2.8Å; A111-C114 WeakPolarHBondContact O-CB 3.42Å; A111-C114 PolarHBondContact O-N 3.42Å; C114-V116 PolarHBondContact O-N 2.9Å; C114-L117 PolarHBondContact O-N 3.33Å; C114-S118 VanDerWaalsContact O-CB 3.24Å; C114-S118 WeakPolarHBondContact O-CB 3.12Å; C114-S118 PolarHBondContact O-N 2.85Å; C114-N167 HydrophobicContact CB-CB 3.84Å; C114-N167 VanDerWaalsContact SG-CB 3.54Å |
| 115 | Y | 94.4 | Very high | 88.7 | Confident | 29 Ų | 29 | 40 Ų | 40 | 11% | 0.114 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -56.6 | -49.2 | 172.7 | 175.8 | -72.9 | 0 | 0 | 0 | 111.1 | A111 S112 N113 S118 S119 A170 P171 V175 F177 F180 | A111-Y115 PolarHBondContact O-N 3.43Å; S112-Y115 WeakPolarHBondContact O-CB 3.44Å; S112-Y115 PolarHBondContact O-N 2.99Å; N113-Y115 VanDerWaalsContact C-N 3.32Å; N113-Y115 PolarHBondContact O-N 3.23Å; Y115-S118 PolarHBondContact O-N 3.48Å; Y115-S119 WeakPolarHBondContact O-CB 3.32Å; Y115-S119 PolarHBondContact O-N 3.46Å; Y115-A170 HydrophobicContact CD2-CB 3.79Å; Y115-A170 HydrophobicContact CE2-CB 3.91Å; Y115-P171 HydrophobicContact CD1-CB 4.31Å; Y115-P171 HydrophobicContact CD2-CB 4.11Å; Y115-P171 HydrophobicContact CD2-CG 4.18Å; Y115-P171 HydrophobicContact CE1-CB 3.94Å; Y115-P171 HydrophobicContact CE2-CB 3.74Å; Y115-P171 HydrophobicContact CE2-CG 4.26Å; Y115-P171 HydrophobicContact CG-CB 4.35Å; Y115-P171 HydrophobicContact CG-CG 4.37Å; Y115-V175 PolarHBondContact OH-O 3.01Å; Y115-F177 AromaticContact CD1-CD2 3.77Å; Y115-F177 HydrophobicContact CD1-CD2 3.77Å; Y115-F177 HydrophobicContact CD1-CE2 4.28Å; Y115-F177 AromaticContact CE1-CD2 3.96Å; Y115-F177 HydrophobicContact CE1-CD2 3.96Å; Y115-F177 HydrophobicContact CG-CD2 4.37Å; Y115-F180 HydrophobicContact CD2-CB 4.5Å; Y115-F180 AromaticContact CD2-CD1 3.97Å; Y115-F180 HydrophobicContact CD2-CD1 3.97Å; Y115-F180 HydrophobicContact CD2-CD2 4.15Å; Y115-F180 HydrophobicContact CD2-CE1 4.19Å; Y115-F180 HydrophobicContact CD2-CE2 4.33Å; Y115-F180 AromaticContact CD2-CG 3.94Å; Y115-F180 HydrophobicContact CD2-CG 3.94Å; Y115-F180 HydrophobicContact CD2-CZ 4.34Å; Y115-F180 HydrophobicContact CE2-CG 4.48Å; Y115-F180 HydrophobicContact CG-CD1 4.31Å; Y115-F180 HydrophobicContact CG-CE1 4.35Å |
| 116 | V | 94.1 | Very high | 87 | Confident | 59 Ų | 59 | 36.7 Ų | 36.7 | 36% | 0.358 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -65 | -46.6 | -178.6 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | S112 N113 C114 S118 S119 L120 F177 | S112-V116 WeakPolarHBondContact O-CG2 3.23Å; S112-V116 PolarHBondContact O-N 3.3Å; N113-V116 PolarHBondContact O-N 2.87Å; N113-V116 VanDerWaalsContact O-N 3.17Å; C114-V116 PolarHBondContact O-N 2.9Å; V116-S118 VanDerWaalsContact C-N 3.32Å; V116-S118 PolarHBondContact O-N 3.48Å; V116-S119 WeakPolarHBondContact CA-OG 3.25Å; V116-S119 PolarHBondContact O-N 2.91Å; V116-S119 PolarHBondContact O-OG 3.48Å; V116-L120 HydrophobicContact CG1-CD1 3.99Å; V116-L120 HydrophobicContact CG1-CG 4.43Å; V116-L120 WeakPolarHBondContact O-CG 3.24Å; V116-L120 PolarHBondContact O-N 3.39Å; V116-F177 HydrophobicContact CG2-CE2 4.06Å |
| 117 | L | 91.4 | Very high | 85.5 | Confident | 25 Ų | 25 | 39.4 Ų | 39.4 | 13% | 0.131 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.5 | -45.2 | 175.7 | -66.1 | 173.9 | 0 | 0 | 0 | 111.2 | L8 I11 F78 N113 C114 S119 L120 F121 | L8-L117 HydrophobicContact CD2-CB 4.18Å; L8-L117 HydrophobicContact CD2-CD2 4.05Å; I11-L117 HydrophobicContact CD1-CD2 3.65Å; I11-L117 HydrophobicContact CG2-CD2 4.17Å; F78-L117 HydrophobicContact CD1-CD1 4.21Å; F78-L117 HydrophobicContact CE1-CD1 3.93Å; N113-L117 VanDerWaalsContact O-CG 3.28Å; N113-L117 WeakPolarHBondContact O-CG 3.34Å; N113-L117 PolarHBondContact O-N 3.36Å; C114-L117 PolarHBondContact O-N 3.33Å; L117-S119 PolarHBondContact O-N 2.93Å; L117-L120 PolarHBondContact O-N 2.9Å; L117-F121 HydrophobicContact CD2-CE2 4.29Å; L117-F121 WeakPolarHBondContact O-CD2 3.26Å; L117-F121 PolarHBondContact O-N 2.88Å; L117-F121 VanDerWaalsContact O-N 3.11Å |
| 118 | S | 89 | Confident | 84 | Confident | 11 Ų | 11 | 49.8 Ų | 49.8 | 8% | 0.077 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.4 | -41.2 | 176.1 | -175.9 | 0 | 0 | 0 | 0 | 112.1 | C114 Y115 V116 L120 G122 K123 V168 F172 | C114-S118 VanDerWaalsContact O-CB 3.24Å; C114-S118 WeakPolarHBondContact O-CB 3.12Å; C114-S118 PolarHBondContact O-N 2.85Å; Y115-S118 PolarHBondContact O-N 3.48Å; V116-S118 VanDerWaalsContact C-N 3.32Å; V116-S118 PolarHBondContact O-N 3.48Å; S118-L120 VanDerWaalsContact C-N 3.35Å; S118-L120 PolarHBondContact O-N 3.16Å; S118-G122 VanDerWaalsContact O-CA 3.23Å; S118-G122 WeakPolarHBondContact O-CA 3.46Å; S118-G122 PolarHBondContact O-N 2.8Å; S118-K123 PolarHBondContact O-N 3.46Å; S118-V168 PolarHBondContact OG-O 3.21Å; S118-F172 VanDerWaalsContact OG-CE1 3.24Å; S118-F172 WeakPolarHBondContact OG-CE1 3.41Å; S118-F172 WeakPolarHBondContact OG-CZ 3.47Å |
| 119 | S | 87.6 | Confident | 82.7 | Confident | 41 Ų | 41 | 53.9 Ų | 53.9 | 29% | 0.287 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.5 | -37.6 | 176.7 | 73.3 | 0 | 0 | 0 | 0 | 113.4 | Y115 V116 L117 | Y115-S119 WeakPolarHBondContact O-CB 3.32Å; Y115-S119 PolarHBondContact O-N 3.46Å; V116-S119 WeakPolarHBondContact CA-OG 3.25Å; V116-S119 PolarHBondContact O-N 2.91Å; V116-S119 PolarHBondContact O-OG 3.48Å; L117-S119 PolarHBondContact O-N 2.93Å |
| 120 | L | 85.4 | Confident | 81.5 | Confident | 102 Ų | 102 | 54.4 Ų | 54.4 | 53% | 0.534 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -75.2 | -35.6 | -177.9 | -70.9 | 173.7 | 0 | 0 | 0 | 112.5 | V116 L117 S118 | V116-L120 HydrophobicContact CG1-CD1 3.99Å; V116-L120 HydrophobicContact CG1-CG 4.43Å; V116-L120 WeakPolarHBondContact O-CG 3.24Å; V116-L120 PolarHBondContact O-N 3.39Å; L117-L120 PolarHBondContact O-N 2.9Å; S118-L120 VanDerWaalsContact C-N 3.35Å; S118-L120 PolarHBondContact O-N 3.16Å |
| 121 | F | 77.5 | Confident | 80.4 | Confident | 48 Ų | 48 | 57.6 Ų | 57.6 | 21% | 0.211 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -118.8 | -22 | -168.9 | -56.6 | -67 | 0 | 0 | 0 | 114.8 | G4 F7 L8 I11 L117 | G4-F121 VanDerWaalsContact CA-CD1 3.44Å; F7-F121 HydrophobicContact CB-CE1 3.99Å; F7-F121 HydrophobicContact CB-CZ 4.25Å; F7-F121 AromaticContact CD1-CE1 3.72Å; F7-F121 HydrophobicContact CD1-CE1 3.72Å; F7-F121 HydrophobicContact CD1-CE2 4.04Å; F7-F121 AromaticContact CD1-CZ 3.15Å; F7-F121 HydrophobicContact CD1-CZ 3.15Å; F7-F121 AromaticContact CE1-CZ 3.69Å; F7-F121 HydrophobicContact CE1-CZ 3.69Å; F7-F121 HydrophobicContact CG-CE1 4.17Å; F7-F121 HydrophobicContact CG-CZ 4.04Å; L8-F121 HydrophobicContact CD1-CB 3.64Å; L8-F121 HydrophobicContact CD1-CD2 3.97Å; L8-F121 HydrophobicContact CD1-CG 3.82Å; L8-F121 HydrophobicContact CD2-CB 4.44Å; L8-F121 HydrophobicContact CD2-CD2 3.21Å; L8-F121 HydrophobicContact CD2-CE2 3.69Å; L8-F121 HydrophobicContact CD2-CG 3.95Å; L8-F121 HydrophobicContact CG-CB 4Å; L8-F121 HydrophobicContact CG-CD1 4.25Å; L8-F121 HydrophobicContact CG-CD2 3.37Å; L8-F121 HydrophobicContact CG-CE2 3.96Å; L8-F121 HydrophobicContact CG-CG 3.57Å; I11-F121 HydrophobicContact CD1-CE2 4.17Å; I11-F121 HydrophobicContact CD1-CZ 4.45Å; L117-F121 HydrophobicContact CD2-CE2 4.29Å; L117-F121 WeakPolarHBondContact O-CD2 3.26Å; L117-F121 PolarHBondContact O-N 2.88Å; L117-F121 VanDerWaalsContact O-N 3.11Å |
| 122 | G | 70 | Confident | 79.4 | Confident | 16 Ų | 16 | 65.6 Ų | 65.6 | 17% | 0.165 | 34% | 0.337 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.6 | -33.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | S118 S124 L125 I126 | S118-G122 VanDerWaalsContact O-CA 3.23Å; S118-G122 WeakPolarHBondContact O-CA 3.46Å; S118-G122 PolarHBondContact O-N 2.8Å; G122-S124 VanDerWaalsContact C-N 3.33Å; G122-S124 PolarHBondContact O-N 3.29Å; G122-L125 WeakPolarHBondContact O-CB 3.3Å; G122-L125 PolarHBondContact O-N 3.42Å; G122-I126 PolarHBondContact O-N 3.11Å |
| 123 | K | 67.2 | Low | 78.4 | Confident | 68 Ų | 68 | 71.3 Ų | 71.3 | 30% | 0.296 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.3 | -44.5 | -173.5 | -166.9 | 173 | -174.9 | 173.8 | 0 | 111.9 | S118 L125 I126 V127 F134 E174 | S118-K123 PolarHBondContact O-N 3.46Å; K123-L125 PolarHBondContact O-N 3.25Å; K123-I126 PolarHBondContact O-N 2.93Å; K123-V127 HydrophobicContact CG-CG2 4.16Å; K123-V127 WeakPolarHBondContact O-CB 3.47Å; K123-V127 VanDerWaalsContact O-CG2 3.31Å; K123-V127 WeakPolarHBondContact O-CG2 3.17Å; K123-V127 PolarHBondContact O-N 2.82Å; K123-F134 VanDerWaalsContact CE-CZ 3.44Å; K123-F134 HydrophobicContact CG-CE2 4.45Å; K123-E174 IonicContact NZ-OE1 2.65Å; K123-E174 PolarHBondContact NZ-OE1 2.91Å |
| 124 | S | 65.4 | Low | 77.4 | Confident | 93 Ų | 93 | 68.9 Ų | 68.9 | 65% | 0.65 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -63.6 | -27.3 | 179 | -49.8 | 0 | 0 | 0 | 0 | 113.9 | G122 R128 | G122-S124 VanDerWaalsContact C-N 3.33Å; G122-S124 PolarHBondContact O-N 3.29Å; S124-R128 WeakPolarHBondContact O-CB 3.2Å |
| 125 | L | 65.5 | Low | 76.6 | Confident | 108 Ų | 108 | 73.5 Ų | 73.5 | 57% | 0.565 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -76.8 | -44.6 | 179.3 | -173.6 | 63.6 | 0 | 0 | 0 | 110.8 | G122 K123 R128 L129 | G122-L125 WeakPolarHBondContact O-CB 3.3Å; G122-L125 PolarHBondContact O-N 3.42Å; K123-L125 PolarHBondContact O-N 3.25Å; L125-R128 PolarHBondContact O-N 3.22Å; L125-L129 HydrophobicContact CD1-CD1 4.11Å; L125-L129 HydrophobicContact CG-CD1 3.95Å; L125-L129 VanDerWaalsContact O-CG 3.27Å; L125-L129 WeakPolarHBondContact O-CG 3.33Å; L125-L129 PolarHBondContact O-N 3.42Å; L125-L129 VanDerWaalsContact O-N 3.14Å |
| 126 | I | 63.2 | Low | 76 | Confident | 10 Ų | 10 | 75.9 Ų | 75.9 | 5% | 0.051 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -73.8 | -43.2 | -178 | -74.6 | 173 | 0 | 0 | 0 | 112.2 | G122 K123 R128 L129 W130 F172 | G122-I126 PolarHBondContact O-N 3.11Å; K123-I126 PolarHBondContact O-N 2.93Å; I126-R128 PolarHBondContact O-N 2.9Å; I126-R128 VanDerWaalsContact O-N 3.16Å; I126-L129 PolarHBondContact O-N 2.65Å; I126-W130 PolarHBondContact O-N 3.47Å; I126-F172 HydrophobicContact CD1-CB 4.32Å; I126-F172 HydrophobicContact CD1-CD1 4.16Å; I126-F172 HydrophobicContact CD1-CD2 3.12Å; I126-F172 HydrophobicContact CD1-CE1 4.24Å; I126-F172 HydrophobicContact CD1-CE2 3.18Å; I126-F172 HydrophobicContact CD1-CG 3.63Å; I126-F172 HydrophobicContact CD1-CZ 3.77Å |
| 127 | V | 66 | Low | 75.4 | Confident | 60 Ų | 60 | 73.9 Ų | 73.9 | 36% | 0.364 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -57.2 | -32.8 | 175.7 | 172.9 | 0 | 0 | 0 | 0 | 110.7 | K123 P131 F134 | K123-V127 HydrophobicContact CG-CG2 4.16Å; K123-V127 WeakPolarHBondContact O-CB 3.47Å; K123-V127 VanDerWaalsContact O-CG2 3.31Å; K123-V127 WeakPolarHBondContact O-CG2 3.17Å; K123-V127 PolarHBondContact O-N 2.82Å; V127-P131 WeakPolarHBondContact O-CB 3.21Å; V127-F134 HydrophobicContact CG2-CD1 4.04Å; V127-F134 HydrophobicContact CG2-CD2 3.93Å; V127-F134 HydrophobicContact CG2-CE1 4.14Å; V127-F134 HydrophobicContact CG2-CE2 4Å; V127-F134 HydrophobicContact CG2-CG 3.97Å; V127-F134 HydrophobicContact CG2-CZ 4.14Å |
| 128 | R | 68.1 | Low | 74.8 | Confident | 219 Ų | 219 | 73.1 Ų | 73.1 | 83% | 0.826 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -76 | -31.8 | 176.5 | -172.1 | 176.8 | 179.1 | -177.5 | -0.1 | 113.7 | S124 L125 I126 | S124-R128 WeakPolarHBondContact O-CB 3.2Å; L125-R128 PolarHBondContact O-N 3.22Å; I126-R128 PolarHBondContact O-N 2.9Å; I126-R128 VanDerWaalsContact O-N 3.16Å |
| 129 | L | 70.8 | Confident | 74.5 | Confident | 86 Ų | 86 | 79.5 Ų | 79.5 | 45% | 0.45 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -89.4 | -35.2 | -175.9 | -70.3 | 171 | 0 | 0 | 0 | 112.9 | L125 I126 | L125-L129 HydrophobicContact CD1-CD1 4.11Å; L125-L129 HydrophobicContact CG-CD1 3.95Å; L125-L129 VanDerWaalsContact O-CG 3.27Å; L125-L129 WeakPolarHBondContact O-CG 3.33Å; L125-L129 PolarHBondContact O-N 3.42Å; L125-L129 VanDerWaalsContact O-N 3.14Å; I126-L129 PolarHBondContact O-N 2.65Å |
| 130 | W | 72.8 | Confident | 74.2 | Confident | 86 Ų | 86 | 79.3 Ų | 79.3 | 33% | 0.326 | 38% | 0.38 | S | S | . | . | trans | -145 | 64.5 | -174.9 | -59 | -74 | 0 | 0 | 0 | 112.8 | I126 E132 R133 F134 C268 | I126-W130 PolarHBondContact O-N 3.47Å; W130-E132 PolarHBondContact O-N 3.39Å; W130-R133 HydrophobicContact CB-CB 4.39Å; W130-R133 PolarHBondContact O-N 3.5Å; W130-F134 PolarHBondContact O-N 2.67Å; W130-F134 VanDerWaalsContact O-N 3.11Å; W130-C268 HydrophobicContact CE3-CB 4.49Å; W130-C268 HydrophobicContact CH2-CB 3.76Å; W130-C268 HydrophobicContact CZ2-CB 4.18Å; W130-C268 HydrophobicContact CZ3-CB 3.93Å | ||
| 131 | P | 73.7 | Confident | 73.9 | Confident | 68 Ų | 68 | 74.5 Ų | 74.5 | 44% | 0.442 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.9 | -47.5 | -175 | 22.9 | -32.6 | 0 | 0 | 0 | 113.3 | V127 R133 F134 D135 | V127-P131 WeakPolarHBondContact O-CB 3.21Å; P131-R133 VanDerWaalsContact C-N 3.31Å; P131-R133 PolarHBondContact O-N 3.01Å; P131-F134 WeakPolarHBondContact O-CB 3.36Å; P131-F134 PolarHBondContact O-N 2.96Å; P131-F134 VanDerWaalsContact O-N 3.12Å; P131-D135 PolarHBondContact O-N 3.19Å; P131-D135 VanDerWaalsContact O-N 3.12Å |
| 132 | E | 76.6 | Confident | 74.2 | Confident | 168 Ų | 168 | 75.4 Ų | 75.4 | 79% | 0.785 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -60.4 | -39.7 | -177.1 | -64.2 | 178.5 | 177.7 | 0 | 0 | 112.7 | W130 E136 | W130-E132 PolarHBondContact O-N 3.39Å; E132-E136 PolarHBondContact O-N 2.97Å |
| 133 | R | 76 | Confident | 74.8 | Confident | 124 Ų | 124 | 80.5 Ų | 80.5 | 47% | 0.468 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -71.7 | -37.2 | 177.4 | -67.9 | -163.5 | 177.5 | -172.3 | 1.3 | 112 | W130 P131 D135 E136 W137 S264 | W130-R133 HydrophobicContact CB-CB 4.39Å; W130-R133 PolarHBondContact O-N 3.5Å; P131-R133 VanDerWaalsContact C-N 3.31Å; P131-R133 PolarHBondContact O-N 3.01Å; R133-D135 VanDerWaalsContact C-N 3.32Å; R133-D135 PolarHBondContact O-N 3.38Å; R133-E136 PolarHBondContact O-N 3.41Å; R133-W137 HydrophobicContact CB-CD2 4.24Å; R133-W137 HydrophobicContact CB-CE3 4.41Å; R133-W137 HydrophobicContact CB-CH2 3.93Å; R133-W137 HydrophobicContact CB-CZ2 3.73Å; R133-W137 HydrophobicContact CB-CZ3 4.25Å; R133-W137 HydrophobicContact CG-CZ2 4.29Å; R133-W137 WeakPolarHBondContact O-CB 3.5Å; R133-W137 PolarHBondContact O-N 2.62Å; R133-S264 PolarHBondContact NH1-OG 3.35Å |
| 134 | F | 75.3 | Confident | 75.4 | Confident | 17 Ų | 17 | 78.3 Ų | 78.3 | 8% | 0.075 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -58.5 | -45.3 | 176.6 | 170.4 | -88.8 | 0 | 0 | 0 | 111.3 | K123 V127 W130 P131 W137 S138 F172 E174 | K123-F134 VanDerWaalsContact CE-CZ 3.44Å; K123-F134 HydrophobicContact CG-CE2 4.45Å; V127-F134 HydrophobicContact CG2-CD1 4.04Å; V127-F134 HydrophobicContact CG2-CD2 3.93Å; V127-F134 HydrophobicContact CG2-CE1 4.14Å; V127-F134 HydrophobicContact CG2-CE2 4Å; V127-F134 HydrophobicContact CG2-CG 3.97Å; V127-F134 HydrophobicContact CG2-CZ 4.14Å; W130-F134 PolarHBondContact O-N 2.67Å; W130-F134 VanDerWaalsContact O-N 3.11Å; P131-F134 WeakPolarHBondContact O-CB 3.36Å; P131-F134 PolarHBondContact O-N 2.96Å; P131-F134 VanDerWaalsContact O-N 3.12Å; F134-W137 PolarHBondContact O-N 3.5Å; F134-S138 WeakPolarHBondContact O-CB 3.49Å; F134-S138 PolarHBondContact O-N 2.91Å; F134-S138 PolarHBondContact O-OG 3.07Å; F134-F172 WeakPolarHBondContact CD2-O 3.15Å; F134-F172 WeakPolarHBondContact CE2-O 3.35Å; F134-E174 HydrophobicContact CZ-CG 4.42Å |
| 135 | D | 79 | Confident | 76.1 | Confident | 106 Ų | 106 | 76 Ų | 76 | 57% | 0.567 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -66 | -42.9 | 179.1 | -70.1 | -22.5 | 0 | 0 | 0 | 111.7 | P131 R133 W137 R139 | P131-D135 PolarHBondContact O-N 3.19Å; P131-D135 VanDerWaalsContact O-N 3.12Å; R133-D135 VanDerWaalsContact C-N 3.32Å; R133-D135 PolarHBondContact O-N 3.38Å; D135-W137 PolarHBondContact O-N 3.03Å; D135-R139 WeakPolarHBondContact O-CB 3.48Å; D135-R139 PolarHBondContact O-N 3.46Å |
| 136 | E | 80.6 | Confident | 76.8 | Confident | 79 Ų | 79 | 78.3 Ų | 78.3 | 37% | 0.369 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.6 | -46.9 | 176.3 | -170 | -166.9 | 159.6 | 0 | 0 | 111.6 | E132 R133 R139 K140 | E132-E136 PolarHBondContact O-N 2.97Å; R133-E136 PolarHBondContact O-N 3.41Å; E136-R139 PolarHBondContact O-N 3.46Å; E136-K140 HydrophobicContact CG-CD 4.39Å; E136-K140 WeakPolarHBondContact O-CG 3.47Å; E136-K140 PolarHBondContact O-N 2.99Å; E136-K140 VanDerWaalsContact O-N 3.09Å; E136-K140 WeakPolarHBondContact OE1-CE 3.4Å; E136-K140 IonicContact OE1-NZ 2.91Å; E136-K140 PolarHBondContact OE1-NZ 2.73Å |
| 137 | W | 81.6 | Confident | 77.9 | Confident | 16 Ų | 16 | 80.2 Ų | 80.2 | 6% | 0.061 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -66.4 | -44 | -178.2 | -62.4 | -15.6 | 0 | 0 | 0 | 112.4 | R133 F134 D135 R139 K140 V141 V173 I261 S264 I265 | R133-W137 HydrophobicContact CB-CD2 4.24Å; R133-W137 HydrophobicContact CB-CE3 4.41Å; R133-W137 HydrophobicContact CB-CH2 3.93Å; R133-W137 HydrophobicContact CB-CZ2 3.73Å; R133-W137 HydrophobicContact CB-CZ3 4.25Å; R133-W137 HydrophobicContact CG-CZ2 4.29Å; R133-W137 WeakPolarHBondContact O-CB 3.5Å; R133-W137 PolarHBondContact O-N 2.62Å; F134-W137 PolarHBondContact O-N 3.5Å; D135-W137 PolarHBondContact O-N 3.03Å; W137-R139 VanDerWaalsContact C-N 3.31Å; W137-R139 PolarHBondContact O-N 3.2Å; W137-K140 PolarHBondContact O-N 3.42Å; W137-V141 PolarHBondContact O-N 3.15Å; W137-V173 HydrophobicContact CB-CB 4.48Å; W137-V173 HydrophobicContact CB-CG1 3.95Å; W137-V173 HydrophobicContact CE3-CG1 4.36Å; W137-I261 HydrophobicContact CB-CD1 3.99Å; W137-I261 HydrophobicContact CB-CG1 4.14Å; W137-I261 HydrophobicContact CB-CG2 3.72Å; W137-I261 VanDerWaalsContact CD1-CG1 3.47Å; W137-I261 HydrophobicContact CD2-CG2 3.81Å; W137-I261 HydrophobicContact CE3-CG2 4.33Å; W137-I261 HydrophobicContact CG-CB 4.24Å; W137-I261 HydrophobicContact CG-CD1 4.17Å; W137-I261 HydrophobicContact CG-CG1 3.79Å; W137-I261 HydrophobicContact CG-CG2 3.56Å; W137-S264 WeakPolarHBondContact CZ2-OG 3.48Å; W137-I265 HydrophobicContact CE3-CD1 3.89Å; W137-I265 HydrophobicContact CE3-CG1 3.87Å; W137-I265 HydrophobicContact CH2-CG1 3.77Å; W137-I265 HydrophobicContact CZ3-CD1 3.89Å; W137-I265 HydrophobicContact CZ3-CG1 3.36Å |
| 138 | S | 80.4 | Confident | 78.9 | Confident | 10 Ų | 10 | 77.4 Ų | 77.4 | 7% | 0.07 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.1 | -39.3 | 178.4 | -55.3 | 0 | 0 | 0 | 0 | 110.7 | F134 V141 A142 | F134-S138 WeakPolarHBondContact O-CB 3.49Å; F134-S138 PolarHBondContact O-N 2.91Å; F134-S138 PolarHBondContact O-OG 3.07Å; S138-V141 PolarHBondContact O-N 3.45Å; S138-A142 WeakPolarHBondContact O-CB 3.39Å; S138-A142 PolarHBondContact O-N 3.48Å |
| 139 | R | 82.8 | Confident | 80 | Confident | 145 Ų | 145 | 68.9 Ų | 68.9 | 55% | 0.547 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.5 | -47.9 | 174.4 | -175.1 | 179.8 | 65.4 | -156.2 | -5.2 | 112.1 | D135 E136 W137 V141 A142 E143 | D135-R139 WeakPolarHBondContact O-CB 3.48Å; D135-R139 PolarHBondContact O-N 3.46Å; E136-R139 PolarHBondContact O-N 3.46Å; W137-R139 VanDerWaalsContact C-N 3.31Å; W137-R139 PolarHBondContact O-N 3.2Å; R139-V141 VanDerWaalsContact C-N 3.31Å; R139-V141 PolarHBondContact O-N 3.34Å; R139-A142 WeakPolarHBondContact O-CB 3.42Å; R139-A142 PolarHBondContact O-N 2.89Å; R139-A142 VanDerWaalsContact O-N 3.12Å; R139-E143 WeakPolarHBondContact CG-OE1 3.3Å; R139-E143 IonicContact NE-OE1 3.92Å; R139-E143 WeakPolarHBondContact O-CG 3.39Å; R139-E143 PolarHBondContact O-N 3.3Å |
| 140 | K | 79.6 | Confident | 80.9 | Confident | 37 Ų | 37 | 69.2 Ų | 69.2 | 16% | 0.161 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61.3 | -38.4 | 178.6 | -74.1 | 173.9 | 165.2 | -177 | 0 | 112.8 | E136 W137 N144 E257 I261 | E136-K140 HydrophobicContact CG-CD 4.39Å; E136-K140 WeakPolarHBondContact O-CG 3.47Å; E136-K140 PolarHBondContact O-N 2.99Å; E136-K140 VanDerWaalsContact O-N 3.09Å; E136-K140 WeakPolarHBondContact OE1-CE 3.4Å; E136-K140 IonicContact OE1-NZ 2.91Å; E136-K140 PolarHBondContact OE1-NZ 2.73Å; W137-K140 PolarHBondContact O-N 3.42Å; K140-N144 PolarHBondContact O-N 3.14Å; K140-N144 PolarHBondContact O-ND2 2.87Å; K140-E257 HydrophobicContact CD-CB 4.41Å; K140-E257 WeakPolarHBondContact CD-OE2 3.42Å; K140-E257 VanDerWaalsContact CE-CD 3.43Å; K140-E257 WeakPolarHBondContact CE-OE1 3.15Å; K140-E257 WeakPolarHBondContact CE-OE2 3.43Å; K140-E257 VanDerWaalsContact CG-OE2 3.31Å; K140-E257 WeakPolarHBondContact CG-OE2 3.46Å; K140-E257 IonicContact NZ-OE1 3.98Å; K140-E257 PolarHBondContact NZ-OE1 3.33Å; K140-E257 IonicContact NZ-OE2 2.84Å; K140-I261 HydrophobicContact CB-CD1 4.04Å; K140-I261 HydrophobicContact CD-CD1 4.16Å |
| 141 | V | 80.6 | Confident | 81.6 | Confident | 1 Ų | 1 | 65.2 Ų | 65.2 | 1% | 0.006 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -68.2 | -41.2 | 173.6 | 169.2 | 0 | 0 | 0 | 0 | 111.4 | W137 S138 R139 E143 N144 A145 M148 V173 V175 V258 | W137-V141 PolarHBondContact O-N 3.15Å; S138-V141 PolarHBondContact O-N 3.45Å; R139-V141 VanDerWaalsContact C-N 3.31Å; R139-V141 PolarHBondContact O-N 3.34Å; V141-E143 PolarHBondContact O-N 2.91Å; V141-N144 CarbonylContact O-C 3.57Å; V141-N144 PolarHBondContact O-N 3.09Å; V141-N144 VanDerWaalsContact O-N 3.16Å; V141-A145 PolarHBondContact O-N 3.01Å; V141-M148 HydrophobicContact CB-CE 4.17Å; V141-M148 HydrophobicContact CG1-CE 3.82Å; V141-M148 HydrophobicContact CG1-CG 4.38Å; V141-M148 HydrophobicContact CG1-SD 3.8Å; V141-M148 HydrophobicContact CG2-CE 4.29Å; V141-M148 WeakPolarHBondContact O-CE 3.43Å; V141-V173 WeakPolarHBondContact CB-O 3.4Å; V141-V173 WeakPolarHBondContact CG1-O 3.28Å; V141-V173 HydrophobicContact CG2-CB 3.96Å; V141-V173 HydrophobicContact CG2-CG2 4.06Å; V141-V173 WeakPolarHBondContact CG2-O 3.42Å; V141-V175 HydrophobicContact CG1-CG2 4.18Å; V141-V258 HydrophobicContact CG2-CG2 4.33Å |
| 142 | A | 83.4 | Confident | 82.3 | Confident | 67 Ų | 67 | 62.2 Ų | 62.2 | 55% | 0.554 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -62.9 | -41.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S138 R139 N144 A145 | S138-A142 WeakPolarHBondContact O-CB 3.39Å; S138-A142 PolarHBondContact O-N 3.48Å; R139-A142 WeakPolarHBondContact O-CB 3.42Å; R139-A142 PolarHBondContact O-N 2.89Å; R139-A142 VanDerWaalsContact O-N 3.12Å; A142-N144 PolarHBondContact O-N 3.29Å; A142-A145 WeakPolarHBondContact O-CB 3.16Å; A142-A145 PolarHBondContact O-N 3.19Å |
| 143 | E | 82.2 | Confident | 83 | Confident | 123 Ų | 123 | 55.2 Ų | 55.2 | 58% | 0.575 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -60.2 | -25.5 | 175.5 | -74 | 169 | -173.9 | 0 | 0 | 112.8 | R139 V141 | R139-E143 WeakPolarHBondContact CG-OE1 3.3Å; R139-E143 IonicContact NE-OE1 3.92Å; R139-E143 WeakPolarHBondContact O-CG 3.39Å; R139-E143 PolarHBondContact O-N 3.3Å; V141-E143 PolarHBondContact O-N 2.91Å |
| 144 | N | 80.1 | Confident | 83.6 | Confident | 22 Ų | 22 | 50.8 Ų | 50.8 | 12% | 0.118 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114 | 18.7 | -177.9 | -68.7 | -92 | 0 | 0 | 0 | 113.2 | K140 V141 A142 E146 H147 M148 Y151 | K140-N144 PolarHBondContact O-N 3.14Å; K140-N144 PolarHBondContact O-ND2 2.87Å; V141-N144 CarbonylContact O-C 3.57Å; V141-N144 PolarHBondContact O-N 3.09Å; V141-N144 VanDerWaalsContact O-N 3.16Å; A142-N144 PolarHBondContact O-N 3.29Å; N144-E146 PolarHBondContact O-N 3.01Å; N144-E146 VanDerWaalsContact O-N 3.1Å; N144-H147 PolarHBondContact O-N 3.13Å; N144-M148 HydrophobicContact CB-CE 3.55Å; N144-M148 WeakPolarHBondContact O-CE 3.27Å; N144-M148 PolarHBondContact O-N 3.43Å; N144-Y151 HydrophobicContact CB-CE2 3.58Å; N144-Y151 PolarHBondContact OD1-OH 2.92Å |
| 145 | A | 80.3 | Confident | 84.2 | Confident | 45 Ų | 45 | 50.3 Ų | 50.3 | 37% | 0.372 | 25% | 0.254 | S | S | . | . | G | 310 helix | trans | -56.3 | -33.4 | -170.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V141 A142 H147 M148 | V141-A145 PolarHBondContact O-N 3.01Å; A142-A145 WeakPolarHBondContact O-CB 3.16Å; A142-A145 PolarHBondContact O-N 3.19Å; A145-H147 VanDerWaalsContact C-N 3.27Å; A145-H147 PolarHBondContact O-N 3.48Å; A145-M148 WeakPolarHBondContact O-CB 3.42Å; A145-M148 PolarHBondContact O-N 3.11Å |
| 146 | E | 81.1 | Confident | 84.8 | Confident | 156 Ų | 156 | 46 Ų | 46 | 73% | 0.729 | 23% | 0.23 | S | C | * | . | G | 310 helix | trans | -65.7 | -25.3 | 179.2 | 61.8 | -179.1 | 172.6 | 0 | 0 | 114 | N144 | N144-E146 PolarHBondContact O-N 3.01Å; N144-E146 VanDerWaalsContact O-N 3.1Å |
| 147 | H | 85.7 | Confident | 85.1 | Confident | 50 Ų | 50 | 45.7 Ų | 45.7 | 23% | 0.231 | 23% | 0.23 | C | C | . | . | G | 310 helix | trans | -103.9 | 2.9 | -178.1 | -59.6 | -47.2 | 0 | 0 | 0 | 113.5 | N144 A145 V149 F150 Y151 S253 | N144-H147 PolarHBondContact O-N 3.13Å; A145-H147 VanDerWaalsContact C-N 3.27Å; A145-H147 PolarHBondContact O-N 3.48Å; H147-V149 VanDerWaalsContact C-N 3.26Å; H147-V149 PolarHBondContact O-N 3.42Å; H147-V149 VanDerWaalsContact O-N 3.15Å; H147-F150 WeakPolarHBondContact O-CB 3.23Å; H147-F150 PolarHBondContact O-N 3.36Å; H147-Y151 HydrophobicContact CB-CE1 3.93Å; H147-Y151 PolarHBondContact O-N 3.41Å; H147-Y151 VanDerWaalsContact O-N 3.11Å; H147-S253 VanDerWaalsContact CD2-CB 3.5Å; H147-S253 WeakPolarHBondContact CD2-CB 3.1Å; H147-S253 PolarHBondContact CD2-OG 3.24Å; H147-S253 VanDerWaalsContact CD2-OG 3.28Å; H147-S253 PolarHBondContact NE2-OG 3.28Å |
| 148 | M | 87.2 | Confident | 85 | Confident | 1 Ų | 1 | 45.2 Ų | 45.2 | 1% | 0.005 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.8 | -31.8 | -174 | -77 | -64.7 | 139.8 | 0 | 0 | 114.2 | V141 N144 A145 F150 Y151 V152 V175 A179 V258 | V141-M148 HydrophobicContact CB-CE 4.17Å; V141-M148 HydrophobicContact CG1-CE 3.82Å; V141-M148 HydrophobicContact CG1-CG 4.38Å; V141-M148 HydrophobicContact CG1-SD 3.8Å; V141-M148 HydrophobicContact CG2-CE 4.29Å; V141-M148 WeakPolarHBondContact O-CE 3.43Å; N144-M148 HydrophobicContact CB-CE 3.55Å; N144-M148 WeakPolarHBondContact O-CE 3.27Å; N144-M148 PolarHBondContact O-N 3.43Å; A145-M148 WeakPolarHBondContact O-CB 3.42Å; A145-M148 PolarHBondContact O-N 3.11Å; M148-F150 VanDerWaalsContact C-N 3.28Å; M148-F150 PolarHBondContact O-N 3.33Å; M148-Y151 HydrophobicContact CE-CD2 3.38Å; M148-Y151 HydrophobicContact CE-CE2 3.5Å; M148-Y151 VanDerWaalsContact CE-CE2 3.5Å; M148-Y151 PolarHBondContact O-N 3.15Å; M148-Y151 HydrophobicContact SD-CD2 3.81Å; M148-Y151 HydrophobicContact SD-CE2 4.49Å; M148-V152 VanDerWaalsContact O-CG2 3.3Å; M148-V152 WeakPolarHBondContact O-CG2 3.26Å; M148-V152 PolarHBondContact O-N 3.41Å; M148-V175 HydrophobicContact SD-CG2 4.2Å; M148-A179 HydrophobicContact CB-CB 3.68Å; M148-V258 HydrophobicContact CE-CG2 4.12Å |
| 149 | V | 90.6 | Very high | 84.7 | Confident | 39 Ų | 39 | 49.5 Ų | 49.5 | 24% | 0.236 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -57.7 | -47 | 174.1 | 176 | 0 | 0 | 0 | 0 | 109.7 | H147 V152 I153 A179 L182 | H147-V149 VanDerWaalsContact C-N 3.26Å; H147-V149 PolarHBondContact O-N 3.42Å; H147-V149 VanDerWaalsContact O-N 3.15Å; V149-V152 PolarHBondContact O-N 2.94Å; V149-I153 HydrophobicContact CG1-CD1 3.92Å; V149-I153 VanDerWaalsContact O-CG1 3.25Å; V149-I153 WeakPolarHBondContact O-CG1 3.42Å; V149-I153 PolarHBondContact O-N 3.13Å; V149-A179 HydrophobicContact CG2-CB 3.78Å; V149-L182 HydrophobicContact CG1-CB 4.47Å |
| 150 | F | 89 | Confident | 84.5 | Confident | 93 Ų | 93 | 46.2 Ų | 46.2 | 41% | 0.408 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -70.6 | -36 | -178.4 | -59.5 | -71 | 0 | 0 | 0 | 112.5 | H147 M148 I153 F154 L250 | H147-F150 WeakPolarHBondContact O-CB 3.23Å; H147-F150 PolarHBondContact O-N 3.36Å; M148-F150 VanDerWaalsContact C-N 3.28Å; M148-F150 PolarHBondContact O-N 3.33Å; F150-I153 PolarHBondContact O-N 2.93Å; F150-F154 WeakPolarHBondContact O-CB 3.33Å; F150-F154 PolarHBondContact O-N 2.68Å; F150-L250 HydrophobicContact CB-CD1 4.42Å; F150-L250 HydrophobicContact CB-CD2 3.36Å; F150-L250 HydrophobicContact CB-CG 4.43Å; F150-L250 HydrophobicContact CG-CD2 4.21Å |
| 151 | Y | 87.2 | Confident | 84.5 | Confident | 3 Ų | 3 | 45.2 Ų | 45.2 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64.7 | -43 | 173.9 | -63.8 | -8 | 0 | 0 | 0 | 111.6 | N144 H147 M148 I153 F154 L155 L250 S253 P255 V258 | N144-Y151 HydrophobicContact CB-CE2 3.58Å; N144-Y151 PolarHBondContact OD1-OH 2.92Å; H147-Y151 HydrophobicContact CB-CE1 3.93Å; H147-Y151 PolarHBondContact O-N 3.41Å; H147-Y151 VanDerWaalsContact O-N 3.11Å; M148-Y151 HydrophobicContact CE-CD2 3.38Å; M148-Y151 HydrophobicContact CE-CE2 3.5Å; M148-Y151 VanDerWaalsContact CE-CE2 3.5Å; M148-Y151 PolarHBondContact O-N 3.15Å; M148-Y151 HydrophobicContact SD-CD2 3.81Å; M148-Y151 HydrophobicContact SD-CE2 4.49Å; Y151-I153 VanDerWaalsContact C-N 3.34Å; Y151-F154 WeakPolarHBondContact O-CB 3.37Å; Y151-F154 PolarHBondContact O-N 3.48Å; Y151-L155 VanDerWaalsContact O-CG 3.29Å; Y151-L155 WeakPolarHBondContact O-CG 3.23Å; Y151-L155 PolarHBondContact O-N 3.31Å; Y151-L250 HydrophobicContact CD1-CD2 3.78Å; Y151-L250 HydrophobicContact CE1-CB 4.45Å; Y151-L250 HydrophobicContact CE1-CD2 3.7Å; Y151-S253 VanDerWaalsContact CE1-O 3.26Å; Y151-S253 WeakPolarHBondContact CE1-O 3.05Å; Y151-S253 VanDerWaalsContact OH-C 3.26Å; Y151-S253 WeakPolarHBondContact OH-CB 2.94Å; Y151-S253 PolarHBondContact OH-O 2.94Å; Y151-P255 HydrophobicContact CD1-CB 3.8Å; Y151-P255 HydrophobicContact CE1-CB 3.81Å; Y151-P255 HydrophobicContact CG-CB 4.5Å; Y151-V258 HydrophobicContact CD2-CB 4.31Å; Y151-V258 HydrophobicContact CD2-CG2 3.64Å; Y151-V258 HydrophobicContact CE2-CG2 3.97Å |
| 152 | V | 90.2 | Very high | 84.6 | Confident | 4 Ų | 4 | 48 Ų | 48 | 2% | 0.024 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.6 | -41.3 | 175.3 | 176.5 | 0 | 0 | 0 | 0 | 110.4 | M148 V149 F154 L155 R156 V175 | M148-V152 VanDerWaalsContact O-CG2 3.3Å; M148-V152 WeakPolarHBondContact O-CG2 3.26Å; M148-V152 PolarHBondContact O-N 3.41Å; V149-V152 PolarHBondContact O-N 2.94Å; V152-F154 VanDerWaalsContact C-N 3.32Å; V152-F154 PolarHBondContact O-N 3Å; V152-L155 PolarHBondContact O-N 2.72Å; V152-R156 HydrophobicContact CG1-CG 4.22Å; V152-R156 WeakPolarHBondContact O-CG 3.35Å; V152-R156 PolarHBondContact O-N 2.9Å; V152-V175 HydrophobicContact CG2-CG1 4.01Å |
| 153 | I | 91.4 | Very high | 84.8 | Confident | 22 Ų | 22 | 47.2 Ų | 47.2 | 11% | 0.113 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -55.9 | -50 | 173.8 | -72.7 | 168.4 | 0 | 0 | 0 | 110.5 | V149 F150 Y151 L155 R156 I157 G183 L186 | V149-I153 HydrophobicContact CG1-CD1 3.92Å; V149-I153 VanDerWaalsContact O-CG1 3.25Å; V149-I153 WeakPolarHBondContact O-CG1 3.42Å; V149-I153 PolarHBondContact O-N 3.13Å; F150-I153 PolarHBondContact O-N 2.93Å; Y151-I153 VanDerWaalsContact C-N 3.34Å; I153-L155 PolarHBondContact O-N 3.33Å; I153-R156 PolarHBondContact O-N 2.73Å; I153-I157 HydrophobicContact CG2-CD1 3.6Å; I153-I157 HydrophobicContact CG2-CG1 4.35Å; I153-I157 WeakPolarHBondContact O-CG1 3.36Å; I153-I157 PolarHBondContact O-N 3.04Å; I153-G183 WeakPolarHBondContact CG1-O 3.1Å; I153-L186 HydrophobicContact CD1-CB 3.9Å; I153-L186 HydrophobicContact CD1-CD1 4Å; I153-L186 HydrophobicContact CG1-CB 4.02Å |
| 154 | F | 87.8 | Confident | 85.1 | Confident | 30 Ų | 30 | 45.7 Ų | 45.7 | 13% | 0.132 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -55.1 | -55 | 177.6 | 177.5 | -98.9 | 0 | 0 | 0 | 110.4 | F150 Y151 V152 R156 I157 T158 I160 M241 L247 L250 V259 | F150-F154 WeakPolarHBondContact O-CB 3.33Å; F150-F154 PolarHBondContact O-N 2.68Å; Y151-F154 WeakPolarHBondContact O-CB 3.37Å; Y151-F154 PolarHBondContact O-N 3.48Å; V152-F154 VanDerWaalsContact C-N 3.32Å; V152-F154 PolarHBondContact O-N 3Å; F154-R156 PolarHBondContact O-N 3.35Å; F154-R156 VanDerWaalsContact O-N 3.09Å; F154-I157 PolarHBondContact O-N 2.82Å; F154-I157 VanDerWaalsContact O-N 3.14Å; F154-T158 HydrophobicContact CD1-CG2 4.32Å; F154-T158 HydrophobicContact CD2-CG2 3.88Å; F154-T158 HydrophobicContact CE1-CG2 4.04Å; F154-T158 HydrophobicContact CE2-CG2 3.55Å; F154-T158 HydrophobicContact CG-CG2 4.25Å; F154-T158 HydrophobicContact CZ-CG2 3.66Å; F154-T158 WeakPolarHBondContact O-CB 3.09Å; F154-T158 VanDerWaalsContact O-CG2 3.28Å; F154-T158 WeakPolarHBondContact O-CG2 3.43Å; F154-T158 PolarHBondContact O-N 2.93Å; F154-T158 PolarHBondContact O-OG1 2.88Å; F154-I160 HydrophobicContact CE1-CD1 4.4Å; F154-M241 HydrophobicContact CE2-SD 4.32Å; F154-M241 HydrophobicContact CZ-SD 4.31Å; F154-L247 HydrophobicContact CD2-CD1 4.45Å; F154-L247 HydrophobicContact CD2-CD2 4.41Å; F154-L247 HydrophobicContact CD2-CG 4.31Å; F154-L247 HydrophobicContact CE2-CD1 3.56Å; F154-L247 HydrophobicContact CE2-CD2 3.95Å; F154-L247 HydrophobicContact CE2-CG 3.84Å; F154-L247 HydrophobicContact CZ-CD1 4.11Å; F154-L247 HydrophobicContact CZ-CD2 4.24Å; F154-L250 HydrophobicContact CB-CD1 4.27Å; F154-V259 HydrophobicContact CD1-CG2 4.33Å; F154-V259 HydrophobicContact CE1-CG2 3.89Å |
| 155 | L | 87.5 | Confident | 85.4 | Confident | 8 Ų | 8 | 44.7 Ų | 44.7 | 4% | 0.042 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.7 | -30.5 | -179.9 | -70.5 | 175.3 | 0 | 0 | 0 | 113.9 | Y151 V152 I153 F161 I166 V258 V259 V262 | Y151-L155 VanDerWaalsContact O-CG 3.29Å; Y151-L155 WeakPolarHBondContact O-CG 3.23Å; Y151-L155 PolarHBondContact O-N 3.31Å; V152-L155 PolarHBondContact O-N 2.72Å; I153-L155 PolarHBondContact O-N 3.33Å; L155-F161 HydrophobicContact CD2-CD2 4.02Å; L155-F161 HydrophobicContact CD2-CE2 3.93Å; L155-I166 HydrophobicContact CB-CD1 4.14Å; L155-I166 HydrophobicContact CD1-CG2 4.49Å; L155-I166 WeakPolarHBondContact O-CD1 2.79Å; L155-V258 HydrophobicContact CD1-CG1 4.13Å; L155-V259 HydrophobicContact CD2-CG2 3.78Å; L155-V262 HydrophobicContact CD1-CG2 4.37Å |
| 156 | R | 90.8 | Very high | 85.8 | Confident | 16 Ų | 16 | 42.8 Ų | 42.8 | 6% | 0.06 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -84 | -31.8 | -179.5 | -66.2 | -70.6 | -170.9 | -160.3 | -5.2 | 113.5 | V152 I153 F154 N163 N167 T184 G187 V188 | V152-R156 HydrophobicContact CG1-CG 4.22Å; V152-R156 WeakPolarHBondContact O-CG 3.35Å; V152-R156 PolarHBondContact O-N 2.9Å; I153-R156 PolarHBondContact O-N 2.73Å; F154-R156 PolarHBondContact O-N 3.35Å; F154-R156 VanDerWaalsContact O-N 3.09Å; R156-N163 PolarHBondContact NH1-O 3.45Å; R156-N163 PolarHBondContact NH1-OD1 3.44Å; R156-N167 PolarHBondContact NH1-OD1 3.19Å; R156-N167 PolarHBondContact NH2-OD1 2.87Å; R156-T184 PolarHBondContact NE-OG1 3.03Å; R156-T184 VanDerWaalsContact NE-OG1 3.13Å; R156-T184 PolarHBondContact NH2-OG1 3.49Å; R156-G187 CarbonylContact C-O 3.56Å; R156-G187 VanDerWaalsContact CB-C 3.46Å; R156-V188 HydrophobicContact CB-CG1 4.2Å; R156-V188 HydrophobicContact CG-CG1 4.32Å |
| 157 | I | 87.8 | Confident | 86.3 | Confident | 72 Ų | 72 | 35.4 Ų | 35.4 | 37% | 0.369 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -74.1 | -41 | 174.8 | -66.9 | 173.5 | 0 | 0 | 0 | 109.5 | I153 F154 P159 G187 P190 | I153-I157 HydrophobicContact CG2-CD1 3.6Å; I153-I157 HydrophobicContact CG2-CG1 4.35Å; I153-I157 WeakPolarHBondContact O-CG1 3.36Å; I153-I157 PolarHBondContact O-N 3.04Å; F154-I157 PolarHBondContact O-N 2.82Å; F154-I157 VanDerWaalsContact O-N 3.14Å; I157-P159 WeakPolarHBondContact O-CD 3.35Å; I157-G187 WeakPolarHBondContact CG1-O 3.07Å; I157-G187 PolarHBondContact N-O 3.1Å; I157-P190 HydrophobicContact CD1-CG 3.93Å; I157-P190 HydrophobicContact CG1-CB 4.41Å; I157-P190 HydrophobicContact CG1-CG 3.94Å |
| 158 | T | 79.1 | Confident | 86.4 | Confident | 6 Ų | 6 | 34.3 Ų | 34.3 | 4% | 0.037 | 18% | 0.179 | C | C | . | . | S | Bend | trans | -81.9 | 119.1 | -178.2 | 65.9 | 0 | 0 | 0 | 0 | 110.2 | F154 I160 M241 | F154-T158 HydrophobicContact CD1-CG2 4.32Å; F154-T158 HydrophobicContact CD2-CG2 3.88Å; F154-T158 HydrophobicContact CE1-CG2 4.04Å; F154-T158 HydrophobicContact CE2-CG2 3.55Å; F154-T158 HydrophobicContact CG-CG2 4.25Å; F154-T158 HydrophobicContact CZ-CG2 3.66Å; F154-T158 WeakPolarHBondContact O-CB 3.09Å; F154-T158 VanDerWaalsContact O-CG2 3.28Å; F154-T158 WeakPolarHBondContact O-CG2 3.43Å; F154-T158 PolarHBondContact O-N 2.93Å; F154-T158 PolarHBondContact O-OG1 2.88Å; T158-I160 HydrophobicContact CG2-CD1 4.46Å; T158-I160 PolarHBondContact O-N 3.33Å; T158-M241 HydrophobicContact CG2-CG 4.43Å; T158-M241 HydrophobicContact CG2-SD 3.18Å; T158-M241 WeakPolarHBondContact CG2-SD 3.45Å |
| 159 | P | 75.4 | Confident | 86.3 | Confident | 99 Ų | 99 | 34.3 Ų | 34.3 | 64% | 0.643 | 18% | 0.179 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | 36.4 | 178.9 | 35.7 | -37.8 | 0 | 0 | 0 | 112.1 | I157 F161 M237 | I157-P159 WeakPolarHBondContact O-CD 3.35Å; P159-F161 VanDerWaalsContact C-N 3.32Å; P159-M237 HydrophobicContact CG-CE 3.37Å |
| 160 | I | 76.8 | Confident | 86.3 | Confident | 76 Ų | 76 | 32.7 Ų | 32.7 | 39% | 0.39 | 17% | 0.169 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -39.3 | 178.5 | -62.3 | 170.1 | 0 | 0 | 0 | 109.6 | F154 T158 | F154-I160 HydrophobicContact CE1-CD1 4.4Å; T158-I160 HydrophobicContact CG2-CD1 4.46Å; T158-I160 PolarHBondContact O-N 3.33Å |
| 161 | F | 80.6 | Confident | 86.3 | Confident | 16 Ų | 16 | 28.5 Ų | 28.5 | 7% | 0.07 | 15% | 0.152 | C | C | . | . | S | Bend | trans | -120.6 | 145 | -179.7 | -56.2 | -66.1 | 0 | 0 | 0 | 111.2 | L155 P159 I166 V259 V262 Q263 | L155-F161 HydrophobicContact CD2-CD2 4.02Å; L155-F161 HydrophobicContact CD2-CE2 3.93Å; P159-F161 VanDerWaalsContact C-N 3.32Å; F161-I166 HydrophobicContact CB-CD1 4.26Å; F161-I166 HydrophobicContact CB-CG1 3.92Å; F161-V259 HydrophobicContact CE2-CG1 3.92Å; F161-V259 HydrophobicContact CZ-CG1 3.93Å; F161-V259 WeakPolarHBondContact CZ-O 3.44Å; F161-V262 HydrophobicContact CD1-CG1 4.11Å; F161-V262 HydrophobicContact CD2-CB 4.37Å; F161-V262 HydrophobicContact CD2-CG1 3.67Å; F161-V262 HydrophobicContact CE1-CG1 4.24Å; F161-V262 HydrophobicContact CE2-CB 4.02Å; F161-V262 HydrophobicContact CE2-CG1 3.79Å; F161-V262 HydrophobicContact CG-CG1 3.84Å; F161-V262 HydrophobicContact CZ-CB 4.23Å; F161-V262 HydrophobicContact CZ-CG1 4.09Å; F161-Q263 HydrophobicContact CE1-CB 3.68Å; F161-Q263 HydrophobicContact CE1-CG 4Å; F161-Q263 HydrophobicContact CZ-CB 3.71Å; F161-Q263 HydrophobicContact CZ-CG 4.37Å |
| 162 | P | 83.4 | Confident | 86.1 | Confident | 61 Ų | 61 | 28.6 Ų | 28.6 | 40% | 0.396 | 15% | 0.152 | S | C | . | . | trans | -54.9 | 144.6 | 164.3 | -23.2 | 33.6 | 0 | 0 | 0 | 111.1 | W164 S165 | P162-W164 VanDerWaalsContact CB-CD1 3.48Å; P162-W164 HydrophobicContact CB-CG 4.28Å; P162-W164 VanDerWaalsContact CB-NE1 3.27Å; P162-W164 PolarHBondContact O-N 2.95Å; P162-S165 WeakPolarHBondContact O-CB 2.88Å; P162-S165 PolarHBondContact O-N 3.39Å | ||
| 163 | N | 87.4 | Confident | 85.8 | Confident | 50 Ų | 50 | 28.5 Ų | 28.5 | 27% | 0.267 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -58.3 | -34.7 | -177 | -177.8 | 74.3 | 0 | 0 | 0 | 113.2 | Q76 R156 N167 | Q76-N163 PolarHBondContact NE2-ND2 3.37Å; Q76-N163 PolarHBondContact OE1-ND2 3.41Å; R156-N163 PolarHBondContact NH1-O 3.45Å; R156-N163 PolarHBondContact NH1-OD1 3.44Å; N163-N167 PolarHBondContact O-N 2.89Å; N163-N167 PolarHBondContact O-ND2 2.83Å; N163-N167 PolarHBondContact O-OD1 2.92Å; N163-N167 VanDerWaalsContact O-OD1 3.08Å |
| 164 | W | 87 | Confident | 85.5 | Confident | 91 Ų | 91 | 31.9 Ų | 31.9 | 35% | 0.345 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -66 | -38.4 | 176.5 | 67.5 | -97.2 | 0 | 0 | 0 | 112.6 | A79 P162 I166 N167 V168 L269 | A79-W164 HydrophobicContact CB-CB 3.49Å; A79-W164 VanDerWaalsContact CB-CB 3.49Å; A79-W164 HydrophobicContact CB-CG 4.4Å; P162-W164 VanDerWaalsContact CB-CD1 3.48Å; P162-W164 HydrophobicContact CB-CG 4.28Å; P162-W164 VanDerWaalsContact CB-NE1 3.27Å; P162-W164 PolarHBondContact O-N 2.95Å; W164-I166 VanDerWaalsContact C-N 3.3Å; W164-I166 PolarHBondContact O-N 2.94Å; W164-N167 WeakPolarHBondContact O-CB 3.18Å; W164-N167 PolarHBondContact O-N 2.9Å; W164-N167 VanDerWaalsContact O-N 3.13Å; W164-V168 HydrophobicContact CE3-CG2 4.32Å; W164-V168 WeakPolarHBondContact O-CG2 3.16Å; W164-V168 PolarHBondContact O-N 2.62Å; W164-L269 HydrophobicContact CZ3-CD1 4.19Å |
| 165 | S | 86.2 | Confident | 85.6 | Confident | 1 Ų | 1 | 30.7 Ų | 30.7 | 1% | 0.007 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -60.7 | -42.9 | -177.4 | -54.8 | 0 | 0 | 0 | 0 | 110.8 | P162 V168 A169 N266 | P162-S165 WeakPolarHBondContact O-CB 2.88Å; P162-S165 PolarHBondContact O-N 3.39Å; S165-V168 PolarHBondContact O-N 2.99Å; S165-A169 WeakPolarHBondContact O-CB 3.28Å; S165-A169 PolarHBondContact O-N 2.91Å; S165-N266 VanDerWaalsContact CB-OD1 3.32Å; S165-N266 WeakPolarHBondContact CB-OD1 3Å; S165-N266 PolarHBondContact OG-OD1 3.41Å |
| 166 | I | 89.1 | Confident | 85.8 | Confident | 5 Ų | 5 | 32.8 Ų | 32.8 | 3% | 0.026 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.7 | -43.5 | 177.2 | -55.6 | 167 | 0 | 0 | 0 | 110.5 | L155 F161 W164 V168 A169 A170 F180 | L155-I166 HydrophobicContact CB-CD1 4.14Å; L155-I166 HydrophobicContact CD1-CG2 4.49Å; L155-I166 WeakPolarHBondContact O-CD1 2.79Å; F161-I166 HydrophobicContact CB-CD1 4.26Å; F161-I166 HydrophobicContact CB-CG1 3.92Å; W164-I166 VanDerWaalsContact C-N 3.3Å; W164-I166 PolarHBondContact O-N 2.94Å; I166-V168 VanDerWaalsContact C-N 3.35Å; I166-V168 PolarHBondContact O-N 3.45Å; I166-A169 PolarHBondContact O-N 2.88Å; I166-A170 VanDerWaalsContact O-CB 3.23Å; I166-A170 WeakPolarHBondContact O-CB 3.36Å; I166-A170 PolarHBondContact O-N 3.14Å; I166-F180 HydrophobicContact CG2-CE2 4.42Å |
| 167 | N | 91.8 | Very high | 86 | Confident | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.4 | -42.3 | -179 | -59.8 | -8.5 | 0 | 0 | 0 | 112.2 | A111 C114 R156 N163 W164 P171 F180 | A111-N167 WeakPolarHBondContact CB-OD1 3.25Å; C114-N167 HydrophobicContact CB-CB 3.84Å; C114-N167 VanDerWaalsContact SG-CB 3.54Å; R156-N167 PolarHBondContact NH1-OD1 3.19Å; R156-N167 PolarHBondContact NH2-OD1 2.87Å; N163-N167 PolarHBondContact O-N 2.89Å; N163-N167 PolarHBondContact O-ND2 2.83Å; N163-N167 PolarHBondContact O-OD1 2.92Å; N163-N167 VanDerWaalsContact O-OD1 3.08Å; W164-N167 WeakPolarHBondContact O-CB 3.18Å; W164-N167 PolarHBondContact O-N 2.9Å; W164-N167 VanDerWaalsContact O-N 3.13Å; N167-P171 VanDerWaalsContact O-CD 3.32Å; N167-P171 WeakPolarHBondContact O-CD 3.42Å; N167-F180 HydrophobicContact CB-CZ 4.32Å |
| 168 | V | 88 | Confident | 86.4 | Confident | 28 Ų | 28 | 42.9 Ų | 42.9 | 17% | 0.17 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -73.3 | -41.8 | -179.2 | 176.5 | 0 | 0 | 0 | 0 | 110 | S118 W164 S165 I166 P171 F172 L269 | S118-V168 PolarHBondContact OG-O 3.21Å; W164-V168 HydrophobicContact CE3-CG2 4.32Å; W164-V168 WeakPolarHBondContact O-CG2 3.16Å; W164-V168 PolarHBondContact O-N 2.62Å; S165-V168 PolarHBondContact O-N 2.99Å; I166-V168 VanDerWaalsContact C-N 3.35Å; I166-V168 PolarHBondContact O-N 3.45Å; V168-P171 VanDerWaalsContact O-CD 3.28Å; V168-P171 WeakPolarHBondContact O-CD 3.2Å; V168-P171 WeakPolarHBondContact O-CG 3.49Å; V168-F172 HydrophobicContact CG1-CE2 3.63Å; V168-F172 HydrophobicContact CG1-CZ 3.87Å; V168-F172 VanDerWaalsContact O-CD2 3.26Å; V168-F172 WeakPolarHBondContact O-CD2 3.44Å; V168-F172 WeakPolarHBondContact O-CE2 3.37Å; V168-F172 WeakPolarHBondContact O-CZ 3.18Å; V168-L269 HydrophobicContact CG1-CD1 4.07Å |
| 169 | A | 86.3 | Confident | 87.2 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.008 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -74.6 | -36.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | S165 I166 F172 V173 V262 I265 | S165-A169 WeakPolarHBondContact O-CB 3.28Å; S165-A169 PolarHBondContact O-N 2.91Å; I166-A169 PolarHBondContact O-N 2.88Å; A169-F172 WeakPolarHBondContact O-CB 3.13Å; A169-F172 PolarHBondContact O-N 2.83Å; A169-V173 PolarHBondContact O-N 3.24Å; A169-V262 HydrophobicContact CB-CG1 4.4Å; A169-V262 HydrophobicContact CB-CG2 4.45Å; A169-I265 HydrophobicContact CB-CB 4.27Å; A169-I265 HydrophobicContact CB-CD1 4.07Å; A169-I265 HydrophobicContact CB-CG2 3.82Å |
| 170 | A | 89.7 | Confident | 88.1 | Confident | 5 Ų | 5 | 38.3 Ų | 38.3 | 4% | 0.041 | 18% | 0.183 | C | C | . | . | G | 310 helix | trans | -49 | -46.2 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y115 I166 F172 V173 E174 V175 F180 | Y115-A170 HydrophobicContact CD2-CB 3.79Å; Y115-A170 HydrophobicContact CE2-CB 3.91Å; I166-A170 VanDerWaalsContact O-CB 3.23Å; I166-A170 WeakPolarHBondContact O-CB 3.36Å; I166-A170 PolarHBondContact O-N 3.14Å; A170-F172 VanDerWaalsContact C-N 3.29Å; A170-F172 PolarHBondContact O-N 3.25Å; A170-V173 WeakPolarHBondContact O-CG2 3.15Å; A170-V173 PolarHBondContact O-N 3.4Å; A170-E174 PolarHBondContact O-N 3.24Å; A170-V175 HydrophobicContact CB-CB 4.24Å; A170-V175 HydrophobicContact CB-CG2 4.41Å; A170-V175 PolarHBondContact O-N 3.34Å; A170-F180 HydrophobicContact CB-CD2 3.56Å; A170-F180 HydrophobicContact CB-CE2 3.55Å |
| 171 | P | 88.8 | Confident | 89.1 | Confident | 5 Ų | 5 | 37.6 Ų | 37.6 | 3% | 0.032 | 18% | 0.177 | C | C | . | . | G | 310 helix | trans | -70.8 | -21.4 | 177.5 | 26.6 | -35 | 0 | 0 | 0 | 114.1 | Y115 N167 V168 V173 E174 | Y115-P171 HydrophobicContact CD1-CB 4.31Å; Y115-P171 HydrophobicContact CD2-CB 4.11Å; Y115-P171 HydrophobicContact CD2-CG 4.18Å; Y115-P171 HydrophobicContact CE1-CB 3.94Å; Y115-P171 HydrophobicContact CE2-CB 3.74Å; Y115-P171 HydrophobicContact CE2-CG 4.26Å; Y115-P171 HydrophobicContact CG-CB 4.35Å; Y115-P171 HydrophobicContact CG-CG 4.37Å; N167-P171 VanDerWaalsContact O-CD 3.32Å; N167-P171 WeakPolarHBondContact O-CD 3.42Å; V168-P171 VanDerWaalsContact O-CD 3.28Å; V168-P171 WeakPolarHBondContact O-CD 3.2Å; V168-P171 WeakPolarHBondContact O-CG 3.49Å; P171-V173 VanDerWaalsContact C-N 3.26Å; P171-E174 PolarHBondContact O-N 3.45Å |
| 172 | F | 83 | Confident | 89.9 | Confident | 5 Ų | 5 | 41 Ų | 41 | 2% | 0.022 | 20% | 0.196 | C | C | . | . | G | 310 helix | trans | -77.8 | -16.6 | 179.4 | -52.7 | -32.9 | 0 | 0 | 0 | 113.2 | S118 I126 F134 V168 A169 A170 I265 | S118-F172 VanDerWaalsContact OG-CE1 3.24Å; S118-F172 WeakPolarHBondContact OG-CE1 3.41Å; S118-F172 WeakPolarHBondContact OG-CZ 3.47Å; I126-F172 HydrophobicContact CD1-CB 4.32Å; I126-F172 HydrophobicContact CD1-CD1 4.16Å; I126-F172 HydrophobicContact CD1-CD2 3.12Å; I126-F172 HydrophobicContact CD1-CE1 4.24Å; I126-F172 HydrophobicContact CD1-CE2 3.18Å; I126-F172 HydrophobicContact CD1-CG 3.63Å; I126-F172 HydrophobicContact CD1-CZ 3.77Å; F134-F172 WeakPolarHBondContact CD2-O 3.15Å; F134-F172 WeakPolarHBondContact CE2-O 3.35Å; V168-F172 HydrophobicContact CG1-CE2 3.63Å; V168-F172 HydrophobicContact CG1-CZ 3.87Å; V168-F172 VanDerWaalsContact O-CD2 3.26Å; V168-F172 WeakPolarHBondContact O-CD2 3.44Å; V168-F172 WeakPolarHBondContact O-CE2 3.37Å; V168-F172 WeakPolarHBondContact O-CZ 3.18Å; A169-F172 WeakPolarHBondContact O-CB 3.13Å; A169-F172 PolarHBondContact O-N 2.83Å; A170-F172 VanDerWaalsContact C-N 3.29Å; A170-F172 PolarHBondContact O-N 3.25Å; F172-I265 HydrophobicContact CB-CD1 4.31Å; F172-I265 HydrophobicContact CD2-CG2 4.14Å |
| 173 | V | 83 | Confident | 90.6 | Very high | 1 Ų | 1 | 38.1 Ų | 38.1 | 1% | 0.006 | 18% | 0.177 | C | C | . | . | G | 310 helix | trans | -114.7 | 15 | 176.8 | -56.2 | 0 | 0 | 0 | 0 | 109.6 | W137 V141 A169 A170 P171 V175 I261 I265 | W137-V173 HydrophobicContact CB-CB 4.48Å; W137-V173 HydrophobicContact CB-CG1 3.95Å; W137-V173 HydrophobicContact CE3-CG1 4.36Å; V141-V173 WeakPolarHBondContact CB-O 3.4Å; V141-V173 WeakPolarHBondContact CG1-O 3.28Å; V141-V173 HydrophobicContact CG2-CB 3.96Å; V141-V173 HydrophobicContact CG2-CG2 4.06Å; V141-V173 WeakPolarHBondContact CG2-O 3.42Å; A169-V173 PolarHBondContact O-N 3.24Å; A170-V173 WeakPolarHBondContact O-CG2 3.15Å; A170-V173 PolarHBondContact O-N 3.4Å; P171-V173 VanDerWaalsContact C-N 3.26Å; V173-V175 VanDerWaalsContact C-N 3.29Å; V173-V175 HydrophobicContact CG2-CG2 3.88Å; V173-V175 PolarHBondContact O-N 2.82Å; V173-I261 HydrophobicContact CB-CG2 4.16Å; V173-I261 HydrophobicContact CG1-CG2 3.27Å; V173-I265 HydrophobicContact CG1-CD1 3.39Å |
| 174 | E | 86.3 | Confident | 91 | Very high | 93 Ų | 93 | 35.7 Ų | 35.7 | 44% | 0.435 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.6 | 35.8 | 174.1 | -52.3 | -163.4 | 135.1 | 0 | 0 | 114.6 | K123 F134 A170 P171 P176 | K123-E174 IonicContact NZ-OE1 2.65Å; K123-E174 PolarHBondContact NZ-OE1 2.91Å; F134-E174 HydrophobicContact CZ-CG 4.42Å; A170-E174 PolarHBondContact O-N 3.24Å; P171-E174 PolarHBondContact O-N 3.45Å; E174-P176 WeakPolarHBondContact O-CD 3.26Å |
| 175 | V | 89.7 | Confident | 91.6 | Very high | 6 Ų | 6 | 34.5 Ų | 34.5 | 4% | 0.036 | 16% | 0.162 | C | C | . | . | trans | -58.2 | 125.6 | 171.7 | 171.6 | 0 | 0 | 0 | 0 | 109.1 | Y115 V141 M148 V152 A170 V173 F177 F180 | Y115-V175 PolarHBondContact OH-O 3.01Å; V141-V175 HydrophobicContact CG1-CG2 4.18Å; M148-V175 HydrophobicContact SD-CG2 4.2Å; V152-V175 HydrophobicContact CG2-CG1 4.01Å; A170-V175 HydrophobicContact CB-CB 4.24Å; A170-V175 HydrophobicContact CB-CG2 4.41Å; A170-V175 PolarHBondContact O-N 3.34Å; V173-V175 VanDerWaalsContact C-N 3.29Å; V173-V175 HydrophobicContact CG2-CG2 3.88Å; V173-V175 PolarHBondContact O-N 2.82Å; V175-F177 PolarHBondContact O-N 2.84Å; V175-F180 HydrophobicContact CG1-CB 4.03Å | ||
| 176 | P | 92.7 | Very high | 92.1 | Very high | 52 Ų | 52 | 38.7 Ų | 38.7 | 34% | 0.338 | 18% | 0.184 | S | C | . | . | trans | -56.4 | 129.1 | -179.7 | -25.9 | 33.8 | 0 | 0 | 0 | 111.7 | E174 R178 A179 F180 | E174-P176 WeakPolarHBondContact O-CD 3.26Å; P176-R178 VanDerWaalsContact C-N 3.26Å; P176-R178 PolarHBondContact O-N 3.5Å; P176-R178 VanDerWaalsContact O-N 3.14Å; P176-A179 HydrophobicContact CB-CB 4.15Å; P176-A179 WeakPolarHBondContact O-CA 3.3Å; P176-A179 WeakPolarHBondContact O-CB 3.39Å; P176-A179 PolarHBondContact O-N 3.49Å; P176-F180 PolarHBondContact O-N 3.49Å | ||
| 177 | F | 94.9 | Very high | 92.3 | Very high | 90 Ų | 90 | 38.5 Ų | 38.5 | 40% | 0.395 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -54.2 | -39.9 | -174.8 | 179.4 | -97.3 | 0 | 0 | 0 | 113.5 | Y115 V116 V175 F180 F181 | Y115-F177 AromaticContact CD1-CD2 3.77Å; Y115-F177 HydrophobicContact CD1-CD2 3.77Å; Y115-F177 HydrophobicContact CD1-CE2 4.28Å; Y115-F177 AromaticContact CE1-CD2 3.96Å; Y115-F177 HydrophobicContact CE1-CD2 3.96Å; Y115-F177 HydrophobicContact CG-CD2 4.37Å; V116-F177 HydrophobicContact CG2-CE2 4.06Å; V175-F177 PolarHBondContact O-N 2.84Å; F177-F180 PolarHBondContact O-N 3.33Å; F177-F181 PolarHBondContact O-N 2.6Å |
| 178 | R | 95.9 | Very high | 92.5 | Very high | 209 Ų | 209 | 38.9 Ų | 38.9 | 79% | 0.789 | 19% | 0.185 | S | C | * | . | H | α-helix | trans | -63.7 | -42.2 | 177.1 | -65.9 | -176.7 | -179.1 | -178.1 | 0.8 | 111.8 | P176 F180 F181 L182 | P176-R178 VanDerWaalsContact C-N 3.26Å; P176-R178 PolarHBondContact O-N 3.5Å; P176-R178 VanDerWaalsContact O-N 3.14Å; R178-F180 VanDerWaalsContact C-N 3.33Å; R178-F181 PolarHBondContact O-N 2.94Å; R178-L182 WeakPolarHBondContact O-CB 3.01Å; R178-L182 WeakPolarHBondContact O-CG 3.29Å; R178-L182 PolarHBondContact O-N 3.01Å |
| 179 | A | 94.6 | Very high | 92.9 | Very high | 9 Ų | 9 | 38.7 Ų | 38.7 | 7% | 0.074 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.6 | -40.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | M148 V149 P176 G183 | M148-A179 HydrophobicContact CB-CB 3.68Å; V149-A179 HydrophobicContact CG2-CB 3.78Å; P176-A179 HydrophobicContact CB-CB 4.15Å; P176-A179 WeakPolarHBondContact O-CA 3.3Å; P176-A179 WeakPolarHBondContact O-CB 3.39Å; P176-A179 PolarHBondContact O-N 3.49Å; A179-G183 WeakPolarHBondContact O-CA 3.4Å; A179-G183 PolarHBondContact O-N 2.69Å |
| 180 | F | 95.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.3 | -46.5 | 175 | -178.7 | -95.5 | 0 | 0 | 0 | 112.8 | A111 Y115 I166 N167 A170 V175 P176 F177 R178 T184 | A111-F180 HydrophobicContact CB-CE1 3.92Å; A111-F180 HydrophobicContact CB-CZ 4Å; A111-F180 WeakPolarHBondContact O-CE1 3.4Å; Y115-F180 HydrophobicContact CD2-CB 4.5Å; Y115-F180 AromaticContact CD2-CD1 3.97Å; Y115-F180 HydrophobicContact CD2-CD1 3.97Å; Y115-F180 HydrophobicContact CD2-CD2 4.15Å; Y115-F180 HydrophobicContact CD2-CE1 4.19Å; Y115-F180 HydrophobicContact CD2-CE2 4.33Å; Y115-F180 AromaticContact CD2-CG 3.94Å; Y115-F180 HydrophobicContact CD2-CG 3.94Å; Y115-F180 HydrophobicContact CD2-CZ 4.34Å; Y115-F180 HydrophobicContact CE2-CG 4.48Å; Y115-F180 HydrophobicContact CG-CD1 4.31Å; Y115-F180 HydrophobicContact CG-CE1 4.35Å; I166-F180 HydrophobicContact CG2-CE2 4.42Å; N167-F180 HydrophobicContact CB-CZ 4.32Å; A170-F180 HydrophobicContact CB-CD2 3.56Å; A170-F180 HydrophobicContact CB-CE2 3.55Å; V175-F180 HydrophobicContact CG1-CB 4.03Å; P176-F180 PolarHBondContact O-N 3.49Å; F177-F180 PolarHBondContact O-N 3.33Å; R178-F180 VanDerWaalsContact C-N 3.33Å; F180-T184 WeakPolarHBondContact O-CB 3.14Å; F180-T184 PolarHBondContact O-N 3.08Å; F180-T184 PolarHBondContact O-OG1 3.4Å |
| 181 | F | 98.1 | Very high | 93.2 | Very high | 61 Ų | 61 | 42.5 Ų | 42.5 | 27% | 0.268 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.3 | -53.1 | 179.3 | -179.6 | -88.6 | 0 | 0 | 0 | 111.7 | A108 I109 S112 F177 R178 T184 F185 | A108-F181 HydrophobicContact CB-CD2 3.92Å; A108-F181 HydrophobicContact CB-CE1 4.49Å; A108-F181 HydrophobicContact CB-CE2 3.67Å; A108-F181 HydrophobicContact CB-CG 4.45Å; A108-F181 HydrophobicContact CB-CZ 3.99Å; I109-F181 HydrophobicContact CG1-CE2 4.1Å; S112-F181 WeakPolarHBondContact OG-CD2 3.16Å; F177-F181 PolarHBondContact O-N 2.6Å; R178-F181 PolarHBondContact O-N 2.94Å; F181-T184 PolarHBondContact O-N 2.82Å; F181-F185 WeakPolarHBondContact O-CB 3.47Å; F181-F185 PolarHBondContact O-N 3.49Å |
| 182 | L | 97.7 | Very high | 93.5 | Very high | 88 Ų | 88 | 42.6 Ų | 42.6 | 46% | 0.461 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65.2 | -43.4 | -179.2 | -68 | 176.2 | 0 | 0 | 0 | 111.6 | V149 R178 T184 F185 L186 | V149-L182 HydrophobicContact CG1-CB 4.47Å; R178-L182 WeakPolarHBondContact O-CB 3.01Å; R178-L182 WeakPolarHBondContact O-CG 3.29Å; R178-L182 PolarHBondContact O-N 3.01Å; L182-T184 VanDerWaalsContact C-N 3.3Å; L182-T184 PolarHBondContact O-N 3.17Å; L182-F185 PolarHBondContact O-N 2.85Å; L182-L186 WeakPolarHBondContact O-CG 3.47Å; L182-L186 PolarHBondContact O-N 3.03Å |
| 183 | G | 96.2 | Very high | 94 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.6 | -34.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | I153 A179 G187 | I153-G183 WeakPolarHBondContact CG1-O 3.1Å; A179-G183 WeakPolarHBondContact O-CA 3.4Å; A179-G183 PolarHBondContact O-N 2.69Å; G183-G187 VanDerWaalsContact O-CA 3.3Å; G183-G187 WeakPolarHBondContact O-CA 3.26Å; G183-G187 PolarHBondContact O-N 3.1Å |
| 184 | T | 97.4 | Very high | 94.3 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -69.7 | -46.1 | 172.8 | -59.7 | 0 | 0 | 0 | 0 | 111.3 | A111 R156 F180 F181 L182 L186 G187 V188 | A111-T184 HydrophobicContact CB-CG2 3.96Å; R156-T184 PolarHBondContact NE-OG1 3.03Å; R156-T184 VanDerWaalsContact NE-OG1 3.13Å; R156-T184 PolarHBondContact NH2-OG1 3.49Å; F180-T184 WeakPolarHBondContact O-CB 3.14Å; F180-T184 PolarHBondContact O-N 3.08Å; F180-T184 PolarHBondContact O-OG1 3.4Å; F181-T184 PolarHBondContact O-N 2.82Å; L182-T184 VanDerWaalsContact C-N 3.3Å; L182-T184 PolarHBondContact O-N 3.17Å; T184-L186 VanDerWaalsContact C-N 3.32Å; T184-L186 PolarHBondContact O-N 3.18Å; T184-G187 PolarHBondContact O-N 2.84Å; T184-V188 HydrophobicContact CG2-CG1 4.02Å; T184-V188 WeakPolarHBondContact O-CG1 3.25Å; T184-V188 WeakPolarHBondContact O-CG2 3.46Å; T184-V188 PolarHBondContact O-N 3.25Å; T184-V188 VanDerWaalsContact O-N 3.09Å |
| 185 | F | 97.9 | Very high | 94.6 | Very high | 65 Ų | 65 | 49.6 Ų | 49.6 | 29% | 0.285 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -56.2 | -45.1 | 178.3 | 177.5 | -103.1 | 0 | 0 | 0 | 112.5 | C104 L105 A108 F181 L182 | C104-F185 HydrophobicContact CB-CD2 3.66Å; C104-F185 HydrophobicContact CB-CE2 3.54Å; C104-F185 HydrophobicContact CB-CG 4.5Å; C104-F185 HydrophobicContact CB-CZ 4.33Å; L105-F185 HydrophobicContact CD2-CD2 3.99Å; L105-F185 HydrophobicContact CD2-CE2 3.66Å; L105-F185 HydrophobicContact CG-CD2 4.37Å; L105-F185 HydrophobicContact CG-CE2 3.79Å; A108-F185 HydrophobicContact CB-CB 3.88Å; A108-F185 HydrophobicContact CB-CD2 4.45Å; F181-F185 WeakPolarHBondContact O-CB 3.47Å; F181-F185 PolarHBondContact O-N 3.49Å; L182-F185 PolarHBondContact O-N 2.85Å |
| 186 | L | 97 | Very high | 94.8 | Very high | 90 Ų | 90 | 49.3 Ų | 49.3 | 47% | 0.471 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -80.5 | -40.6 | -180 | -64.2 | 175.7 | 0 | 0 | 0 | 112.5 | I153 L182 T184 V188 A189 P190 | I153-L186 HydrophobicContact CD1-CB 3.9Å; I153-L186 HydrophobicContact CD1-CD1 4Å; I153-L186 HydrophobicContact CG1-CB 4.02Å; L182-L186 WeakPolarHBondContact O-CG 3.47Å; L182-L186 PolarHBondContact O-N 3.03Å; T184-L186 VanDerWaalsContact C-N 3.32Å; T184-L186 PolarHBondContact O-N 3.18Å; L186-V188 PolarHBondContact O-N 3.05Å; L186-A189 WeakPolarHBondContact O-CB 3.35Å; L186-A189 PolarHBondContact O-N 3.39Å; L186-P190 WeakPolarHBondContact O-CD 3.42Å |
| 187 | G | 94.5 | Very high | 94.7 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -73.4 | -26.9 | -173 | 0 | 0 | 0 | 0 | 0 | 114.5 | R156 I157 G183 T184 A189 | R156-G187 CarbonylContact C-O 3.56Å; R156-G187 VanDerWaalsContact CB-C 3.46Å; I157-G187 WeakPolarHBondContact CG1-O 3.07Å; I157-G187 PolarHBondContact N-O 3.1Å; G183-G187 VanDerWaalsContact O-CA 3.3Å; G183-G187 WeakPolarHBondContact O-CA 3.26Å; G183-G187 PolarHBondContact O-N 3.1Å; T184-G187 PolarHBondContact O-N 2.84Å; G187-A189 VanDerWaalsContact C-N 3.32Å |
| 188 | V | 95.8 | Very high | 94.4 | Very high | 9 Ų | 9 | 47.4 Ų | 47.4 | 6% | 0.055 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.4 | -16 | 174.2 | -58.3 | 0 | 0 | 0 | 0 | 112.7 | C104 R156 T184 L186 P191 S192 | C104-V188 HydrophobicContact CB-CG2 4.3Å; R156-V188 HydrophobicContact CB-CG1 4.2Å; R156-V188 HydrophobicContact CG-CG1 4.32Å; T184-V188 HydrophobicContact CG2-CG1 4.02Å; T184-V188 WeakPolarHBondContact O-CG1 3.25Å; T184-V188 WeakPolarHBondContact O-CG2 3.46Å; T184-V188 PolarHBondContact O-N 3.25Å; T184-V188 VanDerWaalsContact O-N 3.09Å; L186-V188 PolarHBondContact O-N 3.05Å; V188-P191 WeakPolarHBondContact O-CD 3.49Å; V188-P191 VanDerWaalsContact O-CG 3.26Å; V188-P191 WeakPolarHBondContact O-CG 3.21Å; V188-S192 VanDerWaalsContact O-CB 3.24Å; V188-S192 WeakPolarHBondContact O-CB 3.21Å; V188-S192 PolarHBondContact O-N 3.43Å; V188-S192 PolarHBondContact O-OG 3.47Å |
| 189 | A | 95.9 | Very high | 94.2 | Very high | 23 Ų | 23 | 37.5 Ų | 37.5 | 19% | 0.19 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.2 | -50.2 | -175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L100 L186 G187 S192 L193 | L100-A189 HydrophobicContact CD1-CB 4.35Å; L186-A189 WeakPolarHBondContact O-CB 3.35Å; L186-A189 PolarHBondContact O-N 3.39Å; G187-A189 VanDerWaalsContact C-N 3.32Å; A189-S192 CarbonylContact O-C 3.53Å; A189-S192 WeakPolarHBondContact O-CA 2.97Å; A189-S192 WeakPolarHBondContact O-CB 3.32Å; A189-S192 PolarHBondContact O-N 2.82Å; A189-S192 VanDerWaalsContact O-N 3.12Å; A189-L193 WeakPolarHBondContact O-CG 3.49Å; A189-L193 PolarHBondContact O-N 3.3Å |
| 190 | P | 92.5 | Very high | 94 | Very high | 52 Ų | 52 | 41 Ų | 41 | 34% | 0.338 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -56.7 | -51.7 | 179.7 | -25.2 | 36.1 | 0 | 0 | 0 | 115 | I157 L186 S192 L193 | I157-P190 HydrophobicContact CD1-CG 3.93Å; I157-P190 HydrophobicContact CG1-CB 4.41Å; I157-P190 HydrophobicContact CG1-CG 3.94Å; L186-P190 WeakPolarHBondContact O-CD 3.42Å; P190-S192 VanDerWaalsContact C-N 3.29Å; P190-S192 PolarHBondContact O-N 3.24Å; P190-L193 WeakPolarHBondContact O-CB 3.13Å; P190-L193 PolarHBondContact O-N 3.48Å |
| 191 | P | 90.2 | Very high | 93.7 | Very high | 35 Ų | 35 | 41.3 Ų | 41.3 | 23% | 0.227 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.8 | -35.1 | 174.9 | 22.5 | -30.6 | 0 | 0 | 0 | 112.2 | V188 L193 L194 F195 | V188-P191 WeakPolarHBondContact O-CD 3.49Å; V188-P191 VanDerWaalsContact O-CG 3.26Å; V188-P191 WeakPolarHBondContact O-CG 3.21Å; P191-L193 VanDerWaalsContact C-N 3.3Å; P191-L193 PolarHBondContact O-N 3.33Å; P191-L194 WeakPolarHBondContact O-CB 3.29Å; P191-L194 PolarHBondContact O-N 3.2Å; P191-F195 HydrophobicContact CB-CE2 4.25Å; P191-F195 WeakPolarHBondContact O-CD2 3.43Å; P191-F195 PolarHBondContact O-N 3.31Å |
| 192 | S | 94.1 | Very high | 93 | Very high | 6 Ų | 6 | 39.7 Ų | 39.7 | 4% | 0.042 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.8 | -31.9 | 175.2 | -67 | 0 | 0 | 0 | 0 | 113.4 | V103 V188 A189 P190 L194 F195 I196 | V103-S192 WeakPolarHBondContact CG1-OG 3.48Å; V188-S192 VanDerWaalsContact O-CB 3.24Å; V188-S192 WeakPolarHBondContact O-CB 3.21Å; V188-S192 PolarHBondContact O-N 3.43Å; V188-S192 PolarHBondContact O-OG 3.47Å; A189-S192 CarbonylContact O-C 3.53Å; A189-S192 WeakPolarHBondContact O-CA 2.97Å; A189-S192 WeakPolarHBondContact O-CB 3.32Å; A189-S192 PolarHBondContact O-N 2.82Å; A189-S192 VanDerWaalsContact O-N 3.12Å; P190-S192 VanDerWaalsContact C-N 3.29Å; P190-S192 PolarHBondContact O-N 3.24Å; S192-L194 VanDerWaalsContact C-N 3.27Å; S192-L194 PolarHBondContact O-N 3.24Å; S192-F195 PolarHBondContact O-N 3.32Å; S192-I196 VanDerWaalsContact O-CB 3.29Å; S192-I196 WeakPolarHBondContact O-CB 3Å; S192-I196 WeakPolarHBondContact O-CD1 3.26Å; S192-I196 WeakPolarHBondContact O-CG1 3.26Å; S192-I196 PolarHBondContact O-N 3.02Å |
| 193 | L | 93.8 | Very high | 92.6 | Very high | 70 Ų | 70 | 37.2 Ų | 37.2 | 37% | 0.366 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -56.9 | -42.8 | 174 | -62.2 | 170.3 | 0 | 0 | 0 | 111.1 | F96 L100 A189 P190 P191 Q197 | F96-L193 HydrophobicContact CE1-CD2 4.09Å; F96-L193 HydrophobicContact CE2-CD2 4.31Å; F96-L193 HydrophobicContact CZ-CD2 3.45Å; F96-L193 VanDerWaalsContact CZ-CD2 3.45Å; L100-L193 HydrophobicContact CD1-CD2 3.81Å; L100-L193 HydrophobicContact CD1-CG 4.42Å; L100-L193 HydrophobicContact CD2-CD2 3.74Å; L100-L193 HydrophobicContact CG-CD2 4.4Å; A189-L193 WeakPolarHBondContact O-CG 3.49Å; A189-L193 PolarHBondContact O-N 3.3Å; P190-L193 WeakPolarHBondContact O-CB 3.13Å; P190-L193 PolarHBondContact O-N 3.48Å; P191-L193 VanDerWaalsContact C-N 3.3Å; P191-L193 PolarHBondContact O-N 3.33Å; L193-Q197 WeakPolarHBondContact O-CB 3.04Å; L193-Q197 PolarHBondContact O-N 3.26Å |
| 194 | L | 90 | Very high | 92 | Very high | 98 Ų | 98 | 39.2 Ų | 39.2 | 51% | 0.513 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -65.1 | -46.9 | 179.6 | -62.8 | 176.4 | 0 | 0 | 0 | 111.2 | P191 S192 Q197 A198 L226 | P191-L194 WeakPolarHBondContact O-CB 3.29Å; P191-L194 PolarHBondContact O-N 3.2Å; S192-L194 VanDerWaalsContact C-N 3.27Å; S192-L194 PolarHBondContact O-N 3.24Å; L194-Q197 PolarHBondContact O-N 2.89Å; L194-A198 WeakPolarHBondContact O-CB 3.5Å; L194-A198 PolarHBondContact O-N 3.34Å; L194-L226 HydrophobicContact CD2-CD2 4.39Å |
| 195 | F | 91.6 | Very high | 91.3 | Very high | 79 Ų | 79 | 40.6 Ų | 40.6 | 35% | 0.346 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -67.4 | -41.4 | -179.8 | -61.2 | -54.9 | 0 | 0 | 0 | 112.5 | V84 I88 P191 S192 A198 G199 | V84-F195 HydrophobicContact CG2-CD1 3.5Å; V84-F195 HydrophobicContact CG2-CD2 4.04Å; V84-F195 HydrophobicContact CG2-CE1 3.36Å; V84-F195 HydrophobicContact CG2-CE2 3.91Å; V84-F195 HydrophobicContact CG2-CG 3.86Å; V84-F195 HydrophobicContact CG2-CZ 3.58Å; I88-F195 WeakPolarHBondContact CA-O 3.4Å; I88-F195 HydrophobicContact CG1-CB 4.06Å; I88-F195 HydrophobicContact CG1-CD1 4.41Å; P191-F195 HydrophobicContact CB-CE2 4.25Å; P191-F195 WeakPolarHBondContact O-CD2 3.43Å; P191-F195 PolarHBondContact O-N 3.31Å; S192-F195 PolarHBondContact O-N 3.32Å; F195-A198 WeakPolarHBondContact O-CB 3.45Å; F195-A198 PolarHBondContact O-N 3.04Å; F195-G199 PolarHBondContact O-N 3.19Å |
| 196 | I | 94.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.8 | -43.4 | 176.1 | -69.8 | 165.5 | 0 | 0 | 0 | 110.1 | G91 F96 A99 L100 V103 S192 A198 G199 K200 | G91-I196 WeakPolarHBondContact CA-O 3.39Å; F96-I196 HydrophobicContact CD2-CG2 3.74Å; F96-I196 HydrophobicContact CE2-CG2 4.05Å; A99-I196 HydrophobicContact CB-CD1 4.16Å; A99-I196 HydrophobicContact CB-CG1 4.26Å; A99-I196 HydrophobicContact CB-CG2 3.89Å; L100-I196 VanDerWaalsContact CA-CD1 3.46Å; L100-I196 HydrophobicContact CB-CD1 4Å; L100-I196 HydrophobicContact CD1-CD1 3.95Å; V103-I196 HydrophobicContact CB-CD1 4.38Å; V103-I196 HydrophobicContact CG2-CD1 4.26Å; S192-I196 VanDerWaalsContact O-CB 3.29Å; S192-I196 WeakPolarHBondContact O-CB 3Å; S192-I196 WeakPolarHBondContact O-CD1 3.26Å; S192-I196 WeakPolarHBondContact O-CG1 3.26Å; S192-I196 PolarHBondContact O-N 3.02Å; I196-A198 VanDerWaalsContact C-N 3.33Å; I196-A198 PolarHBondContact O-N 3.34Å; I196-G199 PolarHBondContact O-N 2.85Å; I196-K200 PolarHBondContact O-N 3.43Å |
| 197 | Q | 90.6 | Very high | 89.6 | Confident | 64 Ų | 64 | 38.5 Ų | 38.5 | 30% | 0.299 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -64.5 | -38.2 | 177 | -174.7 | 55.6 | 59.8 | 0 | 0 | 111.6 | L193 L194 G199 K200 S201 | L193-Q197 WeakPolarHBondContact O-CB 3.04Å; L193-Q197 PolarHBondContact O-N 3.26Å; L194-Q197 PolarHBondContact O-N 2.89Å; Q197-G199 VanDerWaalsContact C-N 3.32Å; Q197-G199 PolarHBondContact O-N 3.17Å; Q197-K200 PolarHBondContact O-N 3.42Å; Q197-S201 PolarHBondContact NE2-OG 3.03Å; Q197-S201 WeakPolarHBondContact O-CB 3.39Å; Q197-S201 PolarHBondContact O-N 2.95Å; Q197-S201 PolarHBondContact O-OG 3.34Å; Q197-S201 VanDerWaalsContact O-OG 3.06Å |
| 198 | A | 89 | Confident | 88.7 | Confident | 38 Ų | 38 | 40.4 Ų | 40.4 | 31% | 0.314 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -59.6 | -43.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L194 F195 I196 S201 L202 | L194-A198 WeakPolarHBondContact O-CB 3.5Å; L194-A198 PolarHBondContact O-N 3.34Å; F195-A198 WeakPolarHBondContact O-CB 3.45Å; F195-A198 PolarHBondContact O-N 3.04Å; I196-A198 VanDerWaalsContact C-N 3.33Å; I196-A198 PolarHBondContact O-N 3.34Å; A198-S201 PolarHBondContact O-N 2.86Å; A198-L202 WeakPolarHBondContact O-CB 3.41Å; A198-L202 PolarHBondContact O-N 2.87Å |
| 199 | G | 91.7 | Very high | 87.7 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.3 | -44.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | I88 Y92 F195 I196 Q197 L202 N203 | I88-G199 WeakPolarHBondContact O-CA 3.49Å; Y92-G199 WeakPolarHBondContact CA-O 3.38Å; F195-G199 PolarHBondContact O-N 3.19Å; I196-G199 PolarHBondContact O-N 2.85Å; Q197-G199 VanDerWaalsContact C-N 3.32Å; Q197-G199 PolarHBondContact O-N 3.17Å; G199-L202 WeakPolarHBondContact O-CB 3.39Å; G199-L202 PolarHBondContact O-N 3.48Å; G199-N203 PolarHBondContact O-N 3.37Å |
| 200 | K | 90.5 | Very high | 86.8 | Confident | 84 Ų | 84 | 51 Ų | 51 | 37% | 0.365 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65 | -46.4 | 177.6 | -174.4 | 176.2 | 178.9 | -177.9 | 0 | 111.6 | G91 I196 Q197 L202 N203 E204 | G91-K200 WeakPolarHBondContact O-CA 3.5Å; G91-K200 PolarHBondContact O-N 3.43Å; I196-K200 PolarHBondContact O-N 3.43Å; Q197-K200 PolarHBondContact O-N 3.42Å; K200-L202 VanDerWaalsContact C-N 3.26Å; K200-L202 PolarHBondContact O-N 3.22Å; K200-N203 WeakPolarHBondContact O-CB 3.47Å; K200-N203 PolarHBondContact O-N 2.89Å; K200-N203 VanDerWaalsContact O-N 3.13Å; K200-E204 WeakPolarHBondContact CE-OE1 3.3Å; K200-E204 WeakPolarHBondContact O-CG 3.5Å; K200-E204 PolarHBondContact O-N 3.1Å |
| 201 | S | 87.8 | Confident | 85.7 | Confident | 5 Ų | 5 | 53.1 Ų | 53.1 | 4% | 0.035 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -56.7 | -42 | 173.7 | -69.8 | 0 | 0 | 0 | 0 | 111.4 | Q197 A198 E204 L205 | Q197-S201 PolarHBondContact NE2-OG 3.03Å; Q197-S201 WeakPolarHBondContact O-CB 3.39Å; Q197-S201 PolarHBondContact O-N 2.95Å; Q197-S201 PolarHBondContact O-OG 3.34Å; Q197-S201 VanDerWaalsContact O-OG 3.06Å; A198-S201 PolarHBondContact O-N 2.86Å; S201-E204 PolarHBondContact O-N 3.37Å; S201-L205 WeakPolarHBondContact O-CB 3.42Å; S201-L205 VanDerWaalsContact O-CG 3.23Å; S201-L205 WeakPolarHBondContact O-CG 3.39Å; S201-L205 PolarHBondContact O-N 3.14Å |
| 202 | L | 85.1 | Confident | 84.9 | Confident | 27 Ų | 27 | 58 Ų | 58 | 14% | 0.141 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.9 | -41.4 | 175.6 | -177.4 | 63.1 | 0 | 0 | 0 | 112.3 | L43 R47 Y92 A198 G199 K200 L205 V206 | L43-L202 HydrophobicContact CD1-CD2 4.19Å; R47-L202 HydrophobicContact CB-CD2 3.94Å; R47-L202 HydrophobicContact CG-CD1 4.17Å; R47-L202 HydrophobicContact CG-CD2 4.25Å; R47-L202 HydrophobicContact CG-CG 4.38Å; Y92-L202 HydrophobicContact CD2-CB 4.22Å; Y92-L202 HydrophobicContact CD2-CD2 4.17Å; Y92-L202 HydrophobicContact CD2-CG 4.02Å; Y92-L202 HydrophobicContact CE2-CG 4.15Å; A198-L202 WeakPolarHBondContact O-CB 3.41Å; A198-L202 PolarHBondContact O-N 2.87Å; G199-L202 WeakPolarHBondContact O-CB 3.39Å; G199-L202 PolarHBondContact O-N 3.48Å; K200-L202 VanDerWaalsContact C-N 3.26Å; K200-L202 PolarHBondContact O-N 3.22Å; L202-L205 PolarHBondContact O-N 2.86Å; L202-V206 WeakPolarHBondContact O-CG2 3.33Å; L202-V206 PolarHBondContact O-N 2.95Å; L202-V206 VanDerWaalsContact O-N 3.16Å |
| 203 | N | 87.5 | Confident | 84.2 | Confident | 36 Ų | 36 | 58.7 Ų | 58.7 | 19% | 0.193 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 174.4 | -176.9 | -79.4 | 0 | 0 | 0 | 111.8 | Y92 G199 K200 L205 V206 T207 | Y92-N203 HydrophobicContact CD1-CB 4.42Å; Y92-N203 HydrophobicContact CD2-CB 3.67Å; Y92-N203 HydrophobicContact CE1-CB 4.5Å; Y92-N203 WeakPolarHBondContact CE1-ND2 3.29Å; Y92-N203 VanDerWaalsContact CE2-CA 3.43Å; Y92-N203 HydrophobicContact CE2-CB 3.82Å; Y92-N203 HydrophobicContact CG-CB 3.98Å; Y92-N203 PolarHBondContact O-ND2 2.8Å; G199-N203 PolarHBondContact O-N 3.37Å; K200-N203 WeakPolarHBondContact O-CB 3.47Å; K200-N203 PolarHBondContact O-N 2.89Å; K200-N203 VanDerWaalsContact O-N 3.13Å; N203-L205 VanDerWaalsContact C-N 3.34Å; N203-L205 PolarHBondContact O-N 3.34Å; N203-V206 PolarHBondContact O-N 3.42Å; N203-T207 WeakPolarHBondContact O-CB 3.28Å; N203-T207 PolarHBondContact O-N 2.78Å; N203-T207 PolarHBondContact O-OG1 3.46Å |
| 204 | E | 85 | Confident | 83.8 | Confident | 42 Ų | 42 | 60.8 Ų | 60.8 | 20% | 0.196 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 176.6 | -75.1 | -172.4 | -153.4 | 0 | 0 | 111.5 | K200 S201 V206 T207 M208 K215 I219 | K200-E204 WeakPolarHBondContact CE-OE1 3.3Å; K200-E204 WeakPolarHBondContact O-CG 3.5Å; K200-E204 PolarHBondContact O-N 3.1Å; S201-E204 PolarHBondContact O-N 3.37Å; E204-V206 VanDerWaalsContact C-N 3.3Å; E204-V206 PolarHBondContact O-N 3.34Å; E204-T207 PolarHBondContact O-N 2.91Å; E204-M208 HydrophobicContact CB-CE 3.96Å; E204-M208 WeakPolarHBondContact O-CG 3.36Å; E204-M208 PolarHBondContact O-N 2.89Å; E204-K215 WeakPolarHBondContact OE2-CE 3.38Å; E204-K215 IonicContact OE2-NZ 2.79Å; E204-K215 PolarHBondContact OE2-NZ 3.12Å; E204-I219 HydrophobicContact CB-CD1 4.08Å; E204-I219 WeakPolarHBondContact OE2-CD1 3.23Å |
| 205 | L | 81.3 | Confident | 83.4 | Confident | 30 Ų | 30 | 61.7 Ų | 61.7 | 16% | 0.157 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.1 | -30.7 | 177.1 | -75 | 172.6 | 0 | 0 | 0 | 113.4 | S201 L202 N203 R216 I219 L220 | S201-L205 WeakPolarHBondContact O-CB 3.42Å; S201-L205 VanDerWaalsContact O-CG 3.23Å; S201-L205 WeakPolarHBondContact O-CG 3.39Å; S201-L205 PolarHBondContact O-N 3.14Å; L202-L205 PolarHBondContact O-N 2.86Å; N203-L205 VanDerWaalsContact C-N 3.34Å; N203-L205 PolarHBondContact O-N 3.34Å; L205-R216 HydrophobicContact CD2-CB 3.96Å; L205-R216 HydrophobicContact CD2-CG 3.97Å; L205-R216 VanDerWaalsContact O-CZ 3.23Å; L205-R216 PolarHBondContact O-NE 3.06Å; L205-R216 PolarHBondContact O-NH2 3.42Å; L205-I219 HydrophobicContact CD1-CG2 4Å; L205-I219 HydrophobicContact CD2-CB 4.27Å; L205-I219 HydrophobicContact CD2-CG2 4.1Å; L205-I219 HydrophobicContact CG-CG2 3.9Å; L205-L220 HydrophobicContact CD1-CD2 3.64Å; L205-L220 HydrophobicContact CD1-CG 4.32Å; L205-L220 HydrophobicContact CD2-CD2 4.08Å; L205-L220 HydrophobicContact CD2-CG 3.91Å |
| 206 | V | 80.5 | Confident | 82.6 | Confident | 38 Ų | 38 | 59.4 Ų | 59.4 | 23% | 0.23 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -89.2 | -22.9 | 179.4 | -175.6 | 0 | 0 | 0 | 0 | 112.3 | L51 L202 N203 E204 | L51-V206 HydrophobicContact CD1-CG1 4.38Å; L51-V206 HydrophobicContact CD2-CG1 3.55Å; L51-V206 HydrophobicContact CG-CG1 4.4Å; L202-V206 WeakPolarHBondContact O-CG2 3.33Å; L202-V206 PolarHBondContact O-N 2.95Å; L202-V206 VanDerWaalsContact O-N 3.16Å; N203-V206 PolarHBondContact O-N 3.42Å; E204-V206 VanDerWaalsContact C-N 3.3Å; E204-V206 PolarHBondContact O-N 3.34Å |
| 207 | T | 79.6 | Confident | 82 | Confident | 72 Ų | 72 | 62.3 Ų | 62.3 | 44% | 0.442 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -87.7 | -23.8 | -177.1 | -50.8 | 0 | 0 | 0 | 0 | 113.8 | R54 N203 E204 | R54-T207 PolarHBondContact NH1-OG1 2.88Å; N203-T207 WeakPolarHBondContact O-CB 3.28Å; N203-T207 PolarHBondContact O-N 2.78Å; N203-T207 PolarHBondContact O-OG1 3.46Å; E204-T207 PolarHBondContact O-N 2.91Å |
| 208 | M | 74.7 | Confident | 81.7 | Confident | 40 Ų | 40 | 61.9 Ų | 61.9 | 20% | 0.197 | 35% | 0.349 | C | S | . | . | trans | -66.5 | 146.8 | 177.3 | -72.5 | 175.9 | -157 | 0 | 0 | 111 | E204 K215 R216 I219 | E204-M208 HydrophobicContact CB-CE 3.96Å; E204-M208 WeakPolarHBondContact O-CG 3.36Å; E204-M208 PolarHBondContact O-N 2.89Å; M208-K215 HydrophobicContact CE-CB 4.36Å; M208-K215 HydrophobicContact CE-CD 3.53Å; M208-K215 HydrophobicContact CE-CG 3.84Å; M208-K215 HydrophobicContact SD-CB 4.46Å; M208-R216 HydrophobicContact CB-CG 4.1Å; M208-R216 HydrophobicContact CG-CG 4.33Å; M208-R216 PolarHBondContact O-NH1 2.97Å; M208-R216 PolarHBondContact O-NH2 3.47Å; M208-R216 HydrophobicContact SD-CB 4.37Å; M208-R216 HydrophobicContact SD-CG 3.31Å; M208-R216 WeakPolarHBondContact SD-CG 3.32Å; M208-I219 HydrophobicContact CE-CD1 4.05Å | ||
| 209 | D | 75.9 | Confident | 81.4 | Confident | 159 Ų | 159 | 60.8 Ų | 60.8 | 85% | 0.85 | 34% | 0.338 | S | S | * | . | S | Bend | trans | -85.7 | -44.6 | 177.5 | -64.5 | -46.7 | 0 | 0 | 0 | 111.1 | P211 R216 | D209-P211 VanDerWaalsContact O-CD 3.29Å; D209-P211 WeakPolarHBondContact O-CD 3.37Å; D209-R216 PolarHBondContact O-NH1 3.13Å |
| 210 | N | 77.1 | Confident | 80.9 | Confident | 95 Ų | 95 | 65.4 Ų | 65.4 | 51% | 0.508 | 36% | 0.363 | S | S | . | . | trans | -81.6 | 113.2 | -174.4 | -177.2 | -10.2 | 0 | 0 | 0 | 112.5 | L212 A213 R216 | N210-L212 PolarHBondContact O-N 3.46Å; N210-L212 PolarHBondContact OD1-N 2.97Å; N210-A213 HydrophobicContact CB-CB 4.26Å; N210-A213 WeakPolarHBondContact O-CB 3.22Å; N210-A213 PolarHBondContact O-N 3.2Å; N210-R216 WeakPolarHBondContact O-CD 3.27Å; N210-R216 PolarHBondContact O-NH1 3.36Å | ||
| 211 | P | 68.5 | Low | 80.6 | Confident | 97 Ų | 97 | 66 Ų | 66 | 63% | 0.63 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -25.3 | -176.6 | 23.4 | -32.5 | 0 | 0 | 0 | 113.8 | D209 R216 | D209-P211 VanDerWaalsContact O-CD 3.29Å; D209-P211 WeakPolarHBondContact O-CD 3.37Å; P211-R216 VanDerWaalsContact CA-NH1 3.33Å; P211-R216 VanDerWaalsContact N-NH1 3.18Å |
| 212 | L | 73.3 | Confident | 80.4 | Confident | 138 Ų | 138 | 69.8 Ų | 69.8 | 72% | 0.723 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.4 | 17.5 | -179 | -64 | 174 | 0 | 0 | 0 | 113.1 | N210 | N210-L212 PolarHBondContact O-N 3.46Å; N210-L212 PolarHBondContact OD1-N 2.97Å |
| 213 | A | 80.6 | Confident | 80.1 | Confident | 20 Ų | 20 | 71.1 Ų | 71.1 | 17% | 0.165 | 40% | 0.397 | C | S | . | . | trans | -54.8 | 131.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | N210 K215 R216 V217 | N210-A213 HydrophobicContact CB-CB 4.26Å; N210-A213 WeakPolarHBondContact O-CB 3.22Å; N210-A213 PolarHBondContact O-N 3.2Å; A213-K215 PolarHBondContact O-N 2.89Å; A213-R216 HydrophobicContact CB-CG 4.38Å; A213-R216 WeakPolarHBondContact O-CB 3.48Å; A213-R216 PolarHBondContact O-N 3.42Å; A213-V217 PolarHBondContact O-N 3.16Å | ||
| 214 | P | 84.6 | Confident | 79.8 | Confident | 115 Ų | 115 | 71.7 Ų | 71.7 | 75% | 0.747 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -51.7 | -35.1 | -179.1 | -29.1 | 34.3 | 0 | 0 | 0 | 113 | V217 A218 | P214-V217 PolarHBondContact O-N 2.9Å; P214-A218 WeakPolarHBondContact O-CB 3.42Å; P214-A218 PolarHBondContact O-N 3.49Å |
| 215 | K | 81.2 | Confident | 79.7 | Confident | 117 Ų | 117 | 74.7 Ų | 74.7 | 51% | 0.509 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63 | -41.8 | 174.9 | -170.6 | 178.7 | 171.1 | -165.7 | 0 | 113.1 | E204 M208 A213 A218 I219 | E204-K215 WeakPolarHBondContact OE2-CE 3.38Å; E204-K215 IonicContact OE2-NZ 2.79Å; E204-K215 PolarHBondContact OE2-NZ 3.12Å; M208-K215 HydrophobicContact CE-CB 4.36Å; M208-K215 HydrophobicContact CE-CD 3.53Å; M208-K215 HydrophobicContact CE-CG 3.84Å; M208-K215 HydrophobicContact SD-CB 4.46Å; A213-K215 PolarHBondContact O-N 2.89Å; K215-A218 PolarHBondContact O-N 3.06Å; K215-I219 HydrophobicContact CG-CD1 4.09Å; K215-I219 VanDerWaalsContact O-CG1 3.26Å; K215-I219 WeakPolarHBondContact O-CG1 3.1Å; K215-I219 PolarHBondContact O-N 2.97Å |
| 216 | R | 75.9 | Confident | 79.6 | Confident | 30 Ų | 30 | 76.1 Ų | 76.1 | 11% | 0.113 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -62.6 | -48.6 | 175.5 | -78.7 | -164.5 | 155.8 | 136.5 | -15.4 | 110.8 | L205 M208 D209 N210 P211 A213 A218 I219 L220 | L205-R216 HydrophobicContact CD2-CB 3.96Å; L205-R216 HydrophobicContact CD2-CG 3.97Å; L205-R216 VanDerWaalsContact O-CZ 3.23Å; L205-R216 PolarHBondContact O-NE 3.06Å; L205-R216 PolarHBondContact O-NH2 3.42Å; M208-R216 HydrophobicContact CB-CG 4.1Å; M208-R216 HydrophobicContact CG-CG 4.33Å; M208-R216 PolarHBondContact O-NH1 2.97Å; M208-R216 PolarHBondContact O-NH2 3.47Å; M208-R216 HydrophobicContact SD-CB 4.37Å; M208-R216 HydrophobicContact SD-CG 3.31Å; M208-R216 WeakPolarHBondContact SD-CG 3.32Å; D209-R216 PolarHBondContact O-NH1 3.13Å; N210-R216 WeakPolarHBondContact O-CD 3.27Å; N210-R216 PolarHBondContact O-NH1 3.36Å; P211-R216 VanDerWaalsContact CA-NH1 3.33Å; P211-R216 VanDerWaalsContact N-NH1 3.18Å; A213-R216 HydrophobicContact CB-CG 4.38Å; A213-R216 WeakPolarHBondContact O-CB 3.48Å; A213-R216 PolarHBondContact O-N 3.42Å; R216-A218 VanDerWaalsContact C-N 3.3Å; R216-A218 PolarHBondContact O-N 3.33Å; R216-I219 PolarHBondContact O-N 2.67Å; R216-L220 WeakPolarHBondContact O-CG 3.31Å; R216-L220 PolarHBondContact O-N 3.37Å |
| 217 | V | 81.4 | Confident | 79.3 | Confident | 61 Ų | 61 | 77.7 Ų | 77.7 | 37% | 0.37 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.3 | -44.9 | 179.4 | 179 | 0 | 0 | 0 | 0 | 110.1 | A213 P214 I219 L220 I221 | A213-V217 PolarHBondContact O-N 3.16Å; P214-V217 PolarHBondContact O-N 2.9Å; V217-I219 PolarHBondContact O-N 3.4Å; V217-L220 PolarHBondContact O-N 3.39Å; V217-I221 HydrophobicContact CG1-CD1 3.86Å; V217-I221 HydrophobicContact CG1-CG1 4.49Å; V217-I221 VanDerWaalsContact O-CG1 3.27Å; V217-I221 WeakPolarHBondContact O-CG1 3.38Å; V217-I221 PolarHBondContact O-N 3.23Å |
| 218 | A | 85.7 | Confident | 79.2 | Confident | 55 Ų | 55 | 77.9 Ų | 77.9 | 46% | 0.455 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61.2 | -42.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | P214 K215 R216 I221 L222 | P214-A218 WeakPolarHBondContact O-CB 3.42Å; P214-A218 PolarHBondContact O-N 3.49Å; K215-A218 PolarHBondContact O-N 3.06Å; R216-A218 VanDerWaalsContact C-N 3.3Å; R216-A218 PolarHBondContact O-N 3.33Å; A218-I221 PolarHBondContact O-N 3.43Å; A218-L222 WeakPolarHBondContact O-CB 3.32Å; A218-L222 PolarHBondContact O-N 3.41Å |
| 219 | I | 81.4 | Confident | 79.1 | Confident | 15 Ų | 15 | 79.9 Ų | 79.9 | 8% | 0.077 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -63.8 | -43.4 | 175.9 | -70.6 | 166.9 | 0 | 0 | 0 | 111 | E204 L205 M208 K215 R216 V217 L222 V223 | E204-I219 HydrophobicContact CB-CD1 4.08Å; E204-I219 WeakPolarHBondContact OE2-CD1 3.23Å; L205-I219 HydrophobicContact CD1-CG2 4Å; L205-I219 HydrophobicContact CD2-CB 4.27Å; L205-I219 HydrophobicContact CD2-CG2 4.1Å; L205-I219 HydrophobicContact CG-CG2 3.9Å; M208-I219 HydrophobicContact CE-CD1 4.05Å; K215-I219 HydrophobicContact CG-CD1 4.09Å; K215-I219 VanDerWaalsContact O-CG1 3.26Å; K215-I219 WeakPolarHBondContact O-CG1 3.1Å; K215-I219 PolarHBondContact O-N 2.97Å; R216-I219 PolarHBondContact O-N 2.67Å; V217-I219 PolarHBondContact O-N 3.4Å; I219-L222 PolarHBondContact O-N 3Å; I219-V223 HydrophobicContact CG2-CG2 4.31Å; I219-V223 WeakPolarHBondContact O-CB 3.32Å; I219-V223 WeakPolarHBondContact O-CG2 3.15Å; I219-V223 PolarHBondContact O-N 3.17Å |
| 220 | L | 80.6 | Confident | 78.7 | Confident | 98 Ų | 98 | 76.2 Ų | 76.2 | 51% | 0.513 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63 | -43.8 | 177.8 | -71.9 | 172.8 | 0 | 0 | 0 | 111.5 | L205 R216 V217 V223 A224 | L205-L220 HydrophobicContact CD1-CD2 3.64Å; L205-L220 HydrophobicContact CD1-CG 4.32Å; L205-L220 HydrophobicContact CD2-CD2 4.08Å; L205-L220 HydrophobicContact CD2-CG 3.91Å; R216-L220 WeakPolarHBondContact O-CG 3.31Å; R216-L220 PolarHBondContact O-N 3.37Å; V217-L220 PolarHBondContact O-N 3.39Å; L220-V223 PolarHBondContact O-N 3.49Å; L220-A224 WeakPolarHBondContact O-CB 3.33Å; L220-A224 PolarHBondContact O-N 3.33Å |
| 221 | I | 85.2 | Confident | 78.6 | Confident | 96 Ų | 96 | 76.2 Ų | 76.2 | 49% | 0.492 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 173.7 | -68.6 | 167.3 | 0 | 0 | 0 | 109.9 | V217 A218 V223 A224 L225 | V217-I221 HydrophobicContact CG1-CD1 3.86Å; V217-I221 HydrophobicContact CG1-CG1 4.49Å; V217-I221 VanDerWaalsContact O-CG1 3.27Å; V217-I221 WeakPolarHBondContact O-CG1 3.38Å; V217-I221 PolarHBondContact O-N 3.23Å; A218-I221 PolarHBondContact O-N 3.43Å; I221-V223 PolarHBondContact O-N 2.82Å; I221-A224 PolarHBondContact O-N 2.83Å; I221-L225 HydrophobicContact CG2-CD1 3.84Å; I221-L225 HydrophobicContact CG2-CG 4.24Å; I221-L225 WeakPolarHBondContact O-CB 3.48Å; I221-L225 VanDerWaalsContact O-CG 3.26Å; I221-L225 WeakPolarHBondContact O-CG 3.13Å; I221-L225 PolarHBondContact O-N 3.43Å |
| 222 | L | 83.9 | Confident | 78.8 | Confident | 84 Ų | 84 | 79.9 Ų | 79.9 | 44% | 0.44 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.5 | -44.8 | 178.7 | 179.5 | 63.9 | 0 | 0 | 0 | 112 | A218 I219 A224 L225 L226 | A218-L222 WeakPolarHBondContact O-CB 3.32Å; A218-L222 PolarHBondContact O-N 3.41Å; I219-L222 PolarHBondContact O-N 3Å; L222-A224 VanDerWaalsContact C-N 3.34Å; L222-L225 PolarHBondContact O-N 3.26Å; L222-L226 HydrophobicContact CD1-CD1 4.27Å; L222-L226 HydrophobicContact CD1-CG 4.27Å; L222-L226 HydrophobicContact CG-CD1 4.05Å; L222-L226 HydrophobicContact CG-CG 4.44Å; L222-L226 WeakPolarHBondContact O-CB 3.38Å; L222-L226 VanDerWaalsContact O-CG 3.27Å; L222-L226 WeakPolarHBondContact O-CG 3.33Å; L222-L226 PolarHBondContact O-N 2.91Å |
| 223 | V | 78.9 | Confident | 78.4 | Confident | 56 Ų | 56 | 73.7 Ų | 73.7 | 34% | 0.339 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.1 | -40.5 | 176.8 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | I219 L220 I221 L226 S227 | I219-V223 HydrophobicContact CG2-CG2 4.31Å; I219-V223 WeakPolarHBondContact O-CB 3.32Å; I219-V223 WeakPolarHBondContact O-CG2 3.15Å; I219-V223 PolarHBondContact O-N 3.17Å; L220-V223 PolarHBondContact O-N 3.49Å; I221-V223 PolarHBondContact O-N 2.82Å; V223-L226 PolarHBondContact O-N 2.84Å; V223-S227 WeakPolarHBondContact O-CB 3.16Å; V223-S227 PolarHBondContact O-N 2.89Å; V223-S227 PolarHBondContact O-OG 3.3Å |
| 224 | A | 81.2 | Confident | 77.7 | Confident | 48 Ų | 48 | 80.5 Ų | 80.5 | 40% | 0.397 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -64.1 | -41.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L220 I221 L222 S227 L228 | L220-A224 WeakPolarHBondContact O-CB 3.33Å; L220-A224 PolarHBondContact O-N 3.33Å; I221-A224 PolarHBondContact O-N 2.83Å; L222-A224 VanDerWaalsContact C-N 3.34Å; A224-S227 PolarHBondContact O-N 2.86Å; A224-S227 PolarHBondContact O-OG 3.43Å; A224-L228 VanDerWaalsContact O-CG 3.29Å; A224-L228 WeakPolarHBondContact O-CG 3.38Å; A224-L228 PolarHBondContact O-N 3.47Å |
| 225 | L | 83.2 | Confident | 76.8 | Confident | 104 Ų | 104 | 79.7 Ų | 79.7 | 55% | 0.545 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.9 | -41.5 | 175.1 | -68.7 | 173.5 | 0 | 0 | 0 | 111.7 | I221 L222 S227 L228 L229 | I221-L225 HydrophobicContact CG2-CD1 3.84Å; I221-L225 HydrophobicContact CG2-CG 4.24Å; I221-L225 WeakPolarHBondContact O-CB 3.48Å; I221-L225 VanDerWaalsContact O-CG 3.26Å; I221-L225 WeakPolarHBondContact O-CG 3.13Å; I221-L225 PolarHBondContact O-N 3.43Å; L222-L225 PolarHBondContact O-N 3.26Å; L225-S227 VanDerWaalsContact C-N 3.33Å; L225-S227 PolarHBondContact O-N 3.31Å; L225-L228 PolarHBondContact O-N 2.88Å; L225-L229 PolarHBondContact O-N 2.91Å |
| 226 | L | 77.7 | Confident | 75.8 | Confident | 60 Ų | 60 | 82.9 Ų | 82.9 | 31% | 0.314 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.1 | -32.4 | 176.4 | -74.4 | 174.1 | 0 | 0 | 0 | 112.5 | L194 L222 V223 L228 L229 P230 | L194-L226 HydrophobicContact CD2-CD2 4.39Å; L222-L226 HydrophobicContact CD1-CD1 4.27Å; L222-L226 HydrophobicContact CD1-CG 4.27Å; L222-L226 HydrophobicContact CG-CD1 4.05Å; L222-L226 HydrophobicContact CG-CG 4.44Å; L222-L226 WeakPolarHBondContact O-CB 3.38Å; L222-L226 VanDerWaalsContact O-CG 3.27Å; L222-L226 WeakPolarHBondContact O-CG 3.33Å; L222-L226 PolarHBondContact O-N 2.91Å; V223-L226 PolarHBondContact O-N 2.84Å; L226-L228 VanDerWaalsContact C-N 3.32Å; L226-L229 HydrophobicContact CD2-CD1 3.97Å; L226-L229 WeakPolarHBondContact O-CB 3.24Å; L226-L229 PolarHBondContact O-N 3.33Å; L226-P230 WeakPolarHBondContact O-CD 3.48Å |
| 227 | S | 74.9 | Confident | 74.9 | Confident | 71 Ų | 71 | 84 Ų | 84 | 50% | 0.497 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -73.6 | -24.5 | 175.7 | 71 | 0 | 0 | 0 | 0 | 113 | V223 A224 L225 L229 P230 | V223-S227 WeakPolarHBondContact O-CB 3.16Å; V223-S227 PolarHBondContact O-N 2.89Å; V223-S227 PolarHBondContact O-OG 3.3Å; A224-S227 PolarHBondContact O-N 2.86Å; A224-S227 PolarHBondContact O-OG 3.43Å; L225-S227 VanDerWaalsContact C-N 3.33Å; L225-S227 PolarHBondContact O-N 3.31Å; S227-L229 VanDerWaalsContact C-N 3.33Å; S227-P230 WeakPolarHBondContact O-CD 3.28Å; S227-P230 WeakPolarHBondContact O-CG 3.43Å |
| 228 | L | 78.1 | Confident | 73.8 | Confident | 77 Ų | 77 | 87 Ų | 87 | 40% | 0.403 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -76.9 | -21.5 | 170.4 | -65 | 171.9 | 0 | 0 | 0 | 112.4 | A224 L225 L226 V231 Y232 | A224-L228 VanDerWaalsContact O-CG 3.29Å; A224-L228 WeakPolarHBondContact O-CG 3.38Å; A224-L228 PolarHBondContact O-N 3.47Å; L225-L228 PolarHBondContact O-N 2.88Å; L226-L228 VanDerWaalsContact C-N 3.32Å; L228-V231 WeakPolarHBondContact O-CB 3.32Å; L228-V231 PolarHBondContact O-N 3.13Å; L228-Y232 HydrophobicContact CB-CD2 3.97Å; L228-Y232 HydrophobicContact CB-CE2 4.05Å; L228-Y232 HydrophobicContact CD2-CE2 4.01Å; L228-Y232 HydrophobicContact CG-CE2 4.41Å; L228-Y232 WeakPolarHBondContact O-CD2 3.35Å; L228-Y232 PolarHBondContact O-N 2.85Å |
| 229 | L | 72.8 | Confident | 72.2 | Confident | 81 Ų | 81 | 91.5 Ų | 91.5 | 42% | 0.424 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.4 | -48.1 | -179.5 | -150.3 | 160.5 | 0 | 0 | 0 | 113.2 | L225 L226 S227 V231 G233 | L225-L229 PolarHBondContact O-N 2.91Å; L226-L229 HydrophobicContact CD2-CD1 3.97Å; L226-L229 WeakPolarHBondContact O-CB 3.24Å; L226-L229 PolarHBondContact O-N 3.33Å; S227-L229 VanDerWaalsContact C-N 3.33Å; L229-V231 PolarHBondContact O-N 3.43Å; L229-G233 WeakPolarHBondContact O-CA 3.45Å; L229-G233 PolarHBondContact O-N 2.95Å |
| 230 | P | 66.5 | Low | 70.8 | Confident | 82 Ų | 82 | 91.8 Ų | 91.8 | 53% | 0.532 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.4 | -21.6 | 174.7 | 23.9 | -33.1 | 0 | 0 | 0 | 114.1 | L226 S227 | L226-P230 WeakPolarHBondContact O-CD 3.48Å; S227-P230 WeakPolarHBondContact O-CD 3.28Å; S227-P230 WeakPolarHBondContact O-CG 3.43Å |
| 231 | V | 75 | Confident | 69.5 | Low | 96 Ų | 96 | 89.1 Ų | 89.1 | 58% | 0.582 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -77.3 | -53.5 | 179.2 | -179.2 | 0 | 0 | 0 | 0 | 110.8 | L228 L229 | L228-V231 WeakPolarHBondContact O-CB 3.32Å; L228-V231 PolarHBondContact O-N 3.13Å; L229-V231 PolarHBondContact O-N 3.43Å |
| 232 | Y | 73 | Confident | 68 | Low | 173 Ų | 173 | 88.3 Ų | 88.3 | 68% | 0.678 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -89.1 | -29 | -178.4 | -63.3 | -70.7 | 0 | 0 | 0 | 113.4 | L228 R234 | L228-Y232 HydrophobicContact CB-CD2 3.97Å; L228-Y232 HydrophobicContact CB-CE2 4.05Å; L228-Y232 HydrophobicContact CD2-CE2 4.01Å; L228-Y232 HydrophobicContact CG-CE2 4.41Å; L228-Y232 WeakPolarHBondContact O-CD2 3.35Å; L228-Y232 PolarHBondContact O-N 2.85Å; Y232-R234 PolarHBondContact O-N 2.93Å |
| 233 | G | 64.6 | Low | 66.3 | Low | 8 Ų | 8 | 91.1 Ų | 91.1 | 8% | 0.082 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -77.7 | -3.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L229 D235 W236 M237 | L229-G233 WeakPolarHBondContact O-CA 3.45Å; L229-G233 PolarHBondContact O-N 2.95Å; G233-D235 PolarHBondContact O-N 2.85Å; G233-W236 PolarHBondContact O-N 3.09Å; G233-M237 WeakPolarHBondContact O-CA 3.24Å; G233-M237 WeakPolarHBondContact O-CB 3.39Å; G233-M237 WeakPolarHBondContact O-CG 3.37Å; G233-M237 PolarHBondContact O-N 3.37Å |
| 234 | R | 65.9 | Low | 65 | Low | 164 Ų | 164 | 94.8 Ų | 94.8 | 62% | 0.619 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -54.4 | -55.6 | 172.5 | -177.7 | -172.3 | -64.9 | -131.7 | 1.3 | 110.6 | Y232 W236 M237 E238 | Y232-R234 PolarHBondContact O-N 2.93Å; R234-W236 PolarHBondContact O-N 2.94Å; R234-M237 PolarHBondContact O-N 3.45Å; R234-E238 WeakPolarHBondContact O-CG 3.35Å; R234-E238 PolarHBondContact O-N 3.35Å |
| 235 | D | 66 | Low | 63.3 | Low | 97 Ų | 97 | 101.3 Ų | 101.3 | 52% | 0.519 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.1 | -35.4 | -178.8 | -59 | -4.3 | 0 | 0 | 0 | 111.9 | G233 K239 | G233-D235 PolarHBondContact O-N 2.85Å; D235-K239 WeakPolarHBondContact O-CB 3.44Å; D235-K239 WeakPolarHBondContact O-CG 3.3Å; D235-K239 PolarHBondContact O-N 3.01Å |
| 236 | W | 59.5 | Low | 61.7 | Low | 184 Ų | 184 | 99.4 Ų | 99.4 | 70% | 0.697 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -75.1 | -32.3 | 177.8 | -173.5 | 83.8 | 0 | 0 | 0 | 112.6 | G233 R234 G240 | G233-W236 PolarHBondContact O-N 3.09Å; R234-W236 PolarHBondContact O-N 2.94Å; W236-G240 VanDerWaalsContact O-CA 3.23Å; W236-G240 WeakPolarHBondContact O-CA 3.01Å; W236-G240 PolarHBondContact O-N 3.42Å |
| 237 | M | 56.3 | Low | 60.2 | Low | 54 Ų | 54 | 97.9 Ų | 97.9 | 27% | 0.266 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.4 | -46.1 | 171.3 | -76.1 | 172.9 | 50.7 | 0 | 0 | 108.4 | P159 G233 R234 K239 M241 | P159-M237 HydrophobicContact CG-CE 3.37Å; G233-M237 WeakPolarHBondContact O-CA 3.24Å; G233-M237 WeakPolarHBondContact O-CB 3.39Å; G233-M237 WeakPolarHBondContact O-CG 3.37Å; G233-M237 PolarHBondContact O-N 3.37Å; R234-M237 PolarHBondContact O-N 3.45Å; M237-K239 PolarHBondContact O-N 3.2Å; M237-M241 WeakPolarHBondContact O-CB 3.4Å; M237-M241 WeakPolarHBondContact O-CE 3.33Å; M237-M241 WeakPolarHBondContact O-CG 3.44Å; M237-M241 PolarHBondContact O-N 3.43Å |
| 238 | E | 58.5 | Low | 59 | Low | 123 Ų | 123 | 97.5 Ų | 97.5 | 58% | 0.575 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -56.1 | -47.2 | 173.7 | -72.5 | 176.5 | -175.4 | 0 | 0 | 112.5 | R234 M241 | R234-E238 WeakPolarHBondContact O-CG 3.35Å; R234-E238 PolarHBondContact O-N 3.35Å; E238-M241 HydrophobicContact CG-CE 4.42Å |
| 239 | K | 53.2 | Low | 57.5 | Low | 151 Ų | 151 | 98.2 Ų | 98.2 | 66% | 0.657 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -77.3 | -40.2 | -179.8 | -72.9 | 176.9 | -173.7 | 175.1 | 0 | 114.5 | D235 M237 M241 A242 | D235-K239 WeakPolarHBondContact O-CB 3.44Å; D235-K239 WeakPolarHBondContact O-CG 3.3Å; D235-K239 PolarHBondContact O-N 3.01Å; M237-K239 PolarHBondContact O-N 3.2Å; K239-M241 VanDerWaalsContact C-N 3.33Å; K239-A242 WeakPolarHBondContact O-CB 3.18Å; K239-A242 PolarHBondContact O-N 3.09Å |
| 240 | G | 51.8 | Low | 56.1 | Low | 20 Ų | 20 | 94.5 Ų | 94.5 | 21% | 0.206 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -70.5 | -31.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | W236 A242 N243 F244 | W236-G240 VanDerWaalsContact O-CA 3.23Å; W236-G240 WeakPolarHBondContact O-CA 3.01Å; W236-G240 PolarHBondContact O-N 3.42Å; G240-A242 VanDerWaalsContact C-N 3.34Å; G240-N243 PolarHBondContact O-N 3.49Å; G240-F244 PolarHBondContact O-N 2.99Å |
| 241 | M | 53.3 | Low | 55 | Low | 42 Ų | 42 | 97.6 Ų | 97.6 | 21% | 0.207 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -57.5 | -46.7 | 167.5 | -76.6 | -178.1 | -55.6 | 0 | 0 | 110.6 | F154 T158 M237 E238 K239 N243 F244 L247 | F154-M241 HydrophobicContact CE2-SD 4.32Å; F154-M241 HydrophobicContact CZ-SD 4.31Å; T158-M241 HydrophobicContact CG2-CG 4.43Å; T158-M241 HydrophobicContact CG2-SD 3.18Å; T158-M241 WeakPolarHBondContact CG2-SD 3.45Å; M237-M241 WeakPolarHBondContact O-CB 3.4Å; M237-M241 WeakPolarHBondContact O-CE 3.33Å; M237-M241 WeakPolarHBondContact O-CG 3.44Å; M237-M241 PolarHBondContact O-N 3.43Å; E238-M241 HydrophobicContact CG-CE 4.42Å; K239-M241 VanDerWaalsContact C-N 3.33Å; M241-N243 PolarHBondContact O-N 3.33Å; M241-F244 PolarHBondContact O-N 2.79Å; M241-L247 VanDerWaalsContact C-CD1 3.42Å; M241-L247 HydrophobicContact CB-CD1 3.89Å; M241-L247 WeakPolarHBondContact O-CD1 3.38Å |
| 242 | A | 54 | Low | 54 | Low | 80 Ų | 80 | 100.4 Ų | 100.4 | 66% | 0.661 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -56.5 | -23.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | K239 G240 | K239-A242 WeakPolarHBondContact O-CB 3.18Å; K239-A242 PolarHBondContact O-N 3.09Å; G240-A242 VanDerWaalsContact C-N 3.34Å |
| 243 | N | 48 | Very low | 52.9 | Low | 143 Ų | 143 | 92.9 Ų | 92.9 | 77% | 0.765 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.1 | -8 | -179.9 | -73.8 | -21.1 | 0 | 0 | 0 | 114.6 | G240 M241 K245 | G240-N243 PolarHBondContact O-N 3.49Å; M241-N243 PolarHBondContact O-N 3.33Å; N243-K245 PolarHBondContact O-N 3.48Å |
| 244 | F | 51.6 | Low | 52.4 | Low | 132 Ų | 132 | 97.3 Ų | 97.3 | 58% | 0.579 | 48% | 0.484 | S | S | * | . | trans | -71.7 | 124.4 | -173.4 | -160.8 | -112.8 | 0 | 0 | 0 | 110.1 | G240 M241 L246 L247 A248 | G240-F244 PolarHBondContact O-N 2.99Å; M241-F244 PolarHBondContact O-N 2.79Å; F244-L246 HydrophobicContact CD1-CB 3.42Å; F244-L246 VanDerWaalsContact CD1-CB 3.42Å; F244-L246 HydrophobicContact CE1-CB 3.42Å; F244-L246 VanDerWaalsContact CE1-CB 3.42Å; F244-L246 HydrophobicContact CE1-CD2 4.21Å; F244-L246 HydrophobicContact CE1-CG 4.45Å; F244-L246 PolarHBondContact O-N 2.94Å; F244-L246 VanDerWaalsContact O-N 3.12Å; F244-L247 CarbonylContact O-C 3.57Å; F244-L247 VanDerWaalsContact O-CA 3.25Å; F244-L247 WeakPolarHBondContact O-CA 3.31Å; F244-L247 VanDerWaalsContact O-CB 3.23Å; F244-L247 WeakPolarHBondContact O-CB 3.4Å; F244-L247 PolarHBondContact O-N 2.95Å; F244-A248 PolarHBondContact O-N 3.42Å | ||
| 245 | K | 45.9 | Very low | 52 | Low | 185 Ų | 185 | 89.8 Ų | 89.8 | 80% | 0.804 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -56.1 | -28.2 | -179.2 | -87.2 | 179.5 | 173.9 | 179.6 | 0 | 114 | N243 L247 A248 V249 | N243-K245 PolarHBondContact O-N 3.48Å; K245-L247 VanDerWaalsContact C-N 3.28Å; K245-L247 PolarHBondContact O-N 2.77Å; K245-A248 WeakPolarHBondContact O-CB 3.42Å; K245-A248 PolarHBondContact O-N 2.76Å; K245-V249 PolarHBondContact O-N 3.44Å; K245-V249 VanDerWaalsContact O-N 3.09Å |
| 246 | L | 48.7 | Very low | 51.8 | Low | 64 Ų | 64 | 91 Ų | 91 | 34% | 0.335 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.3 | -35.8 | 171.2 | -165.1 | 75.6 | 0 | 0 | 0 | 110.5 | F244 A248 V249 L250 | F244-L246 HydrophobicContact CD1-CB 3.42Å; F244-L246 VanDerWaalsContact CD1-CB 3.42Å; F244-L246 HydrophobicContact CE1-CB 3.42Å; F244-L246 VanDerWaalsContact CE1-CB 3.42Å; F244-L246 HydrophobicContact CE1-CD2 4.21Å; F244-L246 HydrophobicContact CE1-CG 4.45Å; F244-L246 PolarHBondContact O-N 2.94Å; F244-L246 VanDerWaalsContact O-N 3.12Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.11Å; L246-V249 PolarHBondContact O-N 3.47Å; L246-L250 HydrophobicContact CD2-CD1 4.28Å; L246-L250 HydrophobicContact CG-CD1 4.1Å; L246-L250 HydrophobicContact CG-CG 4.37Å; L246-L250 WeakPolarHBondContact O-CB 3.47Å; L246-L250 WeakPolarHBondContact O-CG 3.34Å; L246-L250 PolarHBondContact O-N 3.43Å |
| 247 | L | 47.5 | Very low | 52.3 | Low | 28 Ų | 28 | 84.7 Ų | 84.7 | 15% | 0.147 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -69.5 | -19.5 | 168.4 | -95.1 | 169.9 | 0 | 0 | 0 | 112.8 | F154 M241 F244 K245 L250 K251 P255 | F154-L247 HydrophobicContact CD2-CD1 4.45Å; F154-L247 HydrophobicContact CD2-CD2 4.41Å; F154-L247 HydrophobicContact CD2-CG 4.31Å; F154-L247 HydrophobicContact CE2-CD1 3.56Å; F154-L247 HydrophobicContact CE2-CD2 3.95Å; F154-L247 HydrophobicContact CE2-CG 3.84Å; F154-L247 HydrophobicContact CZ-CD1 4.11Å; F154-L247 HydrophobicContact CZ-CD2 4.24Å; M241-L247 VanDerWaalsContact C-CD1 3.42Å; M241-L247 HydrophobicContact CB-CD1 3.89Å; M241-L247 WeakPolarHBondContact O-CD1 3.38Å; F244-L247 CarbonylContact O-C 3.57Å; F244-L247 VanDerWaalsContact O-CA 3.25Å; F244-L247 WeakPolarHBondContact O-CA 3.31Å; F244-L247 VanDerWaalsContact O-CB 3.23Å; F244-L247 WeakPolarHBondContact O-CB 3.4Å; F244-L247 PolarHBondContact O-N 2.95Å; K245-L247 VanDerWaalsContact C-N 3.28Å; K245-L247 PolarHBondContact O-N 2.77Å; L247-L250 HydrophobicContact CD2-CB 4.43Å; L247-L250 CarbonylContact O-C 3.53Å; L247-K251 VanDerWaalsContact O-CA 3.25Å; L247-K251 WeakPolarHBondContact O-CA 3.42Å; L247-K251 WeakPolarHBondContact O-CB 3.38Å; L247-K251 PolarHBondContact O-N 2.65Å; L247-P255 HydrophobicContact CD2-CG 3.96Å |
| 248 | A | 48.8 | Very low | 52.9 | Low | 63 Ų | 63 | 82.4 Ų | 82.4 | 52% | 0.521 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -72.4 | -42.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | F244 K245 L246 K251 D252 | F244-A248 PolarHBondContact O-N 3.42Å; K245-A248 WeakPolarHBondContact O-CB 3.42Å; K245-A248 PolarHBondContact O-N 2.76Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.11Å; A248-K251 PolarHBondContact O-N 3.42Å; A248-D252 PolarHBondContact O-N 3.32Å |
| 249 | V | 46.5 | Very low | 53.7 | Low | 93 Ų | 93 | 77.4 Ų | 77.4 | 56% | 0.564 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63 | -44.6 | 171.3 | 176.7 | 0 | 0 | 0 | 0 | 110.7 | K245 L246 S253 | K245-V249 PolarHBondContact O-N 3.44Å; K245-V249 VanDerWaalsContact O-N 3.09Å; L246-V249 PolarHBondContact O-N 3.47Å; V249-S253 PolarHBondContact O-N 3.47Å; V249-S253 PolarHBondContact O-OG 2.99Å |
| 250 | L | 43 | Very low | 54.9 | Low | 2 Ų | 2 | 72.8 Ų | 72.8 | 1% | 0.01 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -75.8 | -28.9 | 177.3 | -59.8 | 170.9 | 0 | 0 | 0 | 111.8 | F150 Y151 F154 L246 L247 D252 S253 Q254 P255 | F150-L250 HydrophobicContact CB-CD1 4.42Å; F150-L250 HydrophobicContact CB-CD2 3.36Å; F150-L250 HydrophobicContact CB-CG 4.43Å; F150-L250 HydrophobicContact CG-CD2 4.21Å; Y151-L250 HydrophobicContact CD1-CD2 3.78Å; Y151-L250 HydrophobicContact CE1-CB 4.45Å; Y151-L250 HydrophobicContact CE1-CD2 3.7Å; F154-L250 HydrophobicContact CB-CD1 4.27Å; L246-L250 HydrophobicContact CD2-CD1 4.28Å; L246-L250 HydrophobicContact CG-CD1 4.1Å; L246-L250 HydrophobicContact CG-CG 4.37Å; L246-L250 WeakPolarHBondContact O-CB 3.47Å; L246-L250 WeakPolarHBondContact O-CG 3.34Å; L246-L250 PolarHBondContact O-N 3.43Å; L247-L250 HydrophobicContact CD2-CB 4.43Å; L247-L250 CarbonylContact O-C 3.53Å; L250-D252 VanDerWaalsContact C-N 3.32Å; L250-S253 CarbonylContact O-C 3.39Å; L250-S253 WeakPolarHBondContact O-CA 3.33Å; L250-S253 WeakPolarHBondContact O-CB 3.39Å; L250-S253 PolarHBondContact O-N 3.48Å; L250-Q254 PolarHBondContact O-N 3.15Å; L250-P255 HydrophobicContact CB-CB 4.19Å; L250-P255 HydrophobicContact CB-CG 3.82Å; L250-P255 WeakPolarHBondContact O-CD 3.26Å; L250-P255 VanDerWaalsContact O-CG 3.26Å; L250-P255 WeakPolarHBondContact O-CG 3.24Å |
| 251 | K | 44.7 | Very low | 55.9 | Low | 148 Ų | 148 | 72 Ų | 72 | 64% | 0.643 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -70.8 | -31.9 | 179.3 | 177.4 | -179.1 | -176.6 | -174.8 | 0 | 111.3 | L247 A248 S253 Q254 | L247-K251 VanDerWaalsContact O-CA 3.25Å; L247-K251 WeakPolarHBondContact O-CA 3.42Å; L247-K251 WeakPolarHBondContact O-CB 3.38Å; L247-K251 PolarHBondContact O-N 2.65Å; A248-K251 PolarHBondContact O-N 3.42Å; K251-S253 PolarHBondContact O-N 3.09Å; K251-Q254 PolarHBondContact O-N 3.38Å |
| 252 | D | 53.8 | Low | 57.1 | Low | 154 Ų | 154 | 70.3 Ų | 70.3 | 82% | 0.824 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -60.7 | -36.7 | 165.6 | -128 | 24.9 | 0 | 0 | 0 | 110 | A248 L250 Q254 | A248-D252 PolarHBondContact O-N 3.32Å; L250-D252 VanDerWaalsContact C-N 3.32Å; D252-Q254 PolarHBondContact O-N 3.32Å |
| 253 | S | 49.9 | Very low | 58.3 | Low | 15 Ų | 15 | 70.6 Ų | 70.6 | 11% | 0.105 | 37% | 0.368 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | 59.1 | 171 | -34.5 | 0 | 0 | 0 | 0 | 112.9 | H147 Y151 V249 L250 K251 P255 | H147-S253 VanDerWaalsContact CD2-CB 3.5Å; H147-S253 WeakPolarHBondContact CD2-CB 3.1Å; H147-S253 PolarHBondContact CD2-OG 3.24Å; H147-S253 VanDerWaalsContact CD2-OG 3.28Å; H147-S253 PolarHBondContact NE2-OG 3.28Å; Y151-S253 VanDerWaalsContact CE1-O 3.26Å; Y151-S253 WeakPolarHBondContact CE1-O 3.05Å; Y151-S253 VanDerWaalsContact OH-C 3.26Å; Y151-S253 WeakPolarHBondContact OH-CB 2.94Å; Y151-S253 PolarHBondContact OH-O 2.94Å; V249-S253 PolarHBondContact O-N 3.47Å; V249-S253 PolarHBondContact O-OG 2.99Å; L250-S253 CarbonylContact O-C 3.39Å; L250-S253 WeakPolarHBondContact O-CA 3.33Å; L250-S253 WeakPolarHBondContact O-CB 3.39Å; L250-S253 PolarHBondContact O-N 3.48Å; K251-S253 PolarHBondContact O-N 3.09Å; S253-P255 WeakPolarHBondContact O-CD 3.36Å |
| 254 | Q | 53.5 | Low | 59.7 | Low | 101 Ų | 101 | 64.9 Ų | 64.9 | 47% | 0.472 | 34% | 0.34 | S | S | . | . | trans | 6.6 | 69.5 | 172.5 | -61.8 | -73.5 | -59.9 | 0 | 0 | 118.9 | L250 K251 D252 L256 E257 | L250-Q254 PolarHBondContact O-N 3.15Å; K251-Q254 PolarHBondContact O-N 3.38Å; D252-Q254 PolarHBondContact O-N 3.32Å; Q254-L256 VanDerWaalsContact C-N 3.33Å; Q254-L256 PolarHBondContact O-N 3.32Å; Q254-E257 HydrophobicContact CB-CG 4.42Å | ||
| 255 | P | 56.8 | Low | 60.8 | Low | 6 Ų | 6 | 58.7 Ų | 58.7 | 4% | 0.039 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -83.7 | -19.1 | -174.8 | 31.5 | -21.6 | 0 | 0 | 0 | 110.6 | Y151 L247 L250 S253 E257 V258 V259 | Y151-P255 HydrophobicContact CD1-CB 3.8Å; Y151-P255 HydrophobicContact CE1-CB 3.81Å; Y151-P255 HydrophobicContact CG-CB 4.5Å; L247-P255 HydrophobicContact CD2-CG 3.96Å; L250-P255 HydrophobicContact CB-CB 4.19Å; L250-P255 HydrophobicContact CB-CG 3.82Å; L250-P255 WeakPolarHBondContact O-CD 3.26Å; L250-P255 VanDerWaalsContact O-CG 3.26Å; L250-P255 WeakPolarHBondContact O-CG 3.24Å; S253-P255 WeakPolarHBondContact O-CD 3.36Å; P255-E257 PolarHBondContact O-N 3.04Å; P255-V258 PolarHBondContact O-N 3.09Å; P255-V259 WeakPolarHBondContact O-CG2 3.41Å; P255-V259 PolarHBondContact O-N 3.29Å; P255-V259 VanDerWaalsContact O-N 3.14Å |
| 256 | L | 63.7 | Low | 62.3 | Low | 124 Ų | 124 | 51.3 Ų | 51.3 | 65% | 0.649 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -60.4 | -31.4 | 175.6 | -72 | 170.3 | 0 | 0 | 0 | 111.4 | Q254 A260 | Q254-L256 VanDerWaalsContact C-N 3.33Å; Q254-L256 PolarHBondContact O-N 3.32Å; L256-A260 VanDerWaalsContact O-CB 3.31Å; L256-A260 WeakPolarHBondContact O-CB 3.33Å; L256-A260 PolarHBondContact O-N 3.08Å |
| 257 | E | 69.1 | Low | 63.7 | Low | 51 Ų | 51 | 54 Ų | 54 | 24% | 0.238 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.3 | -47.2 | 175.7 | -65.9 | -155.8 | 132.6 | 0 | 0 | 111 | K140 Q254 P255 V259 A260 I261 | K140-E257 HydrophobicContact CD-CB 4.41Å; K140-E257 WeakPolarHBondContact CD-OE2 3.42Å; K140-E257 VanDerWaalsContact CE-CD 3.43Å; K140-E257 WeakPolarHBondContact CE-OE1 3.15Å; K140-E257 WeakPolarHBondContact CE-OE2 3.43Å; K140-E257 VanDerWaalsContact CG-OE2 3.31Å; K140-E257 WeakPolarHBondContact CG-OE2 3.46Å; K140-E257 IonicContact NZ-OE1 3.98Å; K140-E257 PolarHBondContact NZ-OE1 3.33Å; K140-E257 IonicContact NZ-OE2 2.84Å; Q254-E257 HydrophobicContact CB-CG 4.42Å; P255-E257 PolarHBondContact O-N 3.04Å; E257-V259 VanDerWaalsContact C-N 3.31Å; E257-V259 PolarHBondContact O-N 3.32Å; E257-A260 PolarHBondContact O-N 3.36Å; E257-A260 VanDerWaalsContact O-N 3.1Å; E257-I261 WeakPolarHBondContact O-CB 3.02Å; E257-I261 WeakPolarHBondContact O-CG1 3.23Å; E257-I261 PolarHBondContact O-N 3.27Å |
| 258 | V | 68.7 | Low | 64.9 | Low | 5 Ų | 5 | 53.8 Ų | 53.8 | 3% | 0.03 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 178.7 | -179.7 | 0 | 0 | 0 | 0 | 111.6 | V141 M148 Y151 L155 P255 I261 V262 | V141-V258 HydrophobicContact CG2-CG2 4.33Å; M148-V258 HydrophobicContact CE-CG2 4.12Å; Y151-V258 HydrophobicContact CD2-CB 4.31Å; Y151-V258 HydrophobicContact CD2-CG2 3.64Å; Y151-V258 HydrophobicContact CE2-CG2 3.97Å; L155-V258 HydrophobicContact CD1-CG1 4.13Å; P255-V258 PolarHBondContact O-N 3.09Å; V258-I261 PolarHBondContact O-N 2.95Å; V258-V262 WeakPolarHBondContact O-CG2 3.39Å; V258-V262 PolarHBondContact O-N 3.49Å |
| 259 | V | 74.7 | Confident | 65.9 | Low | 19 Ų | 19 | 54 Ų | 54 | 12% | 0.115 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.1 | -48.7 | 172 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | F154 L155 F161 P255 E257 I261 V262 Q263 | F154-V259 HydrophobicContact CD1-CG2 4.33Å; F154-V259 HydrophobicContact CE1-CG2 3.89Å; L155-V259 HydrophobicContact CD2-CG2 3.78Å; F161-V259 HydrophobicContact CE2-CG1 3.92Å; F161-V259 HydrophobicContact CZ-CG1 3.93Å; F161-V259 WeakPolarHBondContact CZ-O 3.44Å; P255-V259 WeakPolarHBondContact O-CG2 3.41Å; P255-V259 PolarHBondContact O-N 3.29Å; P255-V259 VanDerWaalsContact O-N 3.14Å; E257-V259 VanDerWaalsContact C-N 3.31Å; E257-V259 PolarHBondContact O-N 3.32Å; V259-I261 VanDerWaalsContact C-N 3.31Å; V259-I261 PolarHBondContact O-N 3.44Å; V259-V262 PolarHBondContact O-N 3.38Å; V259-Q263 WeakPolarHBondContact O-CB 3.41Å; V259-Q263 PolarHBondContact O-N 3.47Å |
| 260 | A | 78.1 | Confident | 67 | Low | 53 Ų | 53 | 52.9 Ų | 52.9 | 44% | 0.438 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.5 | -37.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L256 E257 Q263 S264 | L256-A260 VanDerWaalsContact O-CB 3.31Å; L256-A260 WeakPolarHBondContact O-CB 3.33Å; L256-A260 PolarHBondContact O-N 3.08Å; E257-A260 PolarHBondContact O-N 3.36Å; E257-A260 VanDerWaalsContact O-N 3.1Å; A260-Q263 PolarHBondContact O-N 3.12Å; A260-S264 WeakPolarHBondContact O-CB 3.12Å; A260-S264 PolarHBondContact O-N 3.11Å |
| 261 | I | 74.4 | Confident | 67.7 | Low | 5 Ų | 5 | 58.2 Ų | 58.2 | 3% | 0.026 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.7 | -53.4 | 174.8 | -69.8 | 169.2 | 0 | 0 | 0 | 110.2 | W137 K140 V173 E257 V258 V259 Q263 S264 I265 | W137-I261 HydrophobicContact CB-CD1 3.99Å; W137-I261 HydrophobicContact CB-CG1 4.14Å; W137-I261 HydrophobicContact CB-CG2 3.72Å; W137-I261 VanDerWaalsContact CD1-CG1 3.47Å; W137-I261 HydrophobicContact CD2-CG2 3.81Å; W137-I261 HydrophobicContact CE3-CG2 4.33Å; W137-I261 HydrophobicContact CG-CB 4.24Å; W137-I261 HydrophobicContact CG-CD1 4.17Å; W137-I261 HydrophobicContact CG-CG1 3.79Å; W137-I261 HydrophobicContact CG-CG2 3.56Å; K140-I261 HydrophobicContact CB-CD1 4.04Å; K140-I261 HydrophobicContact CD-CD1 4.16Å; V173-I261 HydrophobicContact CB-CG2 4.16Å; V173-I261 HydrophobicContact CG1-CG2 3.27Å; E257-I261 WeakPolarHBondContact O-CB 3.02Å; E257-I261 WeakPolarHBondContact O-CG1 3.23Å; E257-I261 PolarHBondContact O-N 3.27Å; V258-I261 PolarHBondContact O-N 2.95Å; V259-I261 VanDerWaalsContact C-N 3.31Å; V259-I261 PolarHBondContact O-N 3.44Å; I261-Q263 VanDerWaalsContact C-N 3.25Å; I261-Q263 PolarHBondContact O-N 3.12Å; I261-S264 PolarHBondContact O-N 3.03Å; I261-S264 VanDerWaalsContact O-N 3.13Å; I261-I265 HydrophobicContact CG2-CD1 4.1Å; I261-I265 WeakPolarHBondContact O-CG1 3.33Å; I261-I265 PolarHBondContact O-N 3.25Å |
| 262 | V | 77.5 | Confident | 68 | Low | 5 Ų | 5 | 57.4 Ų | 57.4 | 3% | 0.03 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60.5 | -38.2 | 178 | 173.4 | 0 | 0 | 0 | 0 | 110.6 | L155 F161 A169 V258 V259 I265 N266 | L155-V262 HydrophobicContact CD1-CG2 4.37Å; F161-V262 HydrophobicContact CD1-CG1 4.11Å; F161-V262 HydrophobicContact CD2-CB 4.37Å; F161-V262 HydrophobicContact CD2-CG1 3.67Å; F161-V262 HydrophobicContact CE1-CG1 4.24Å; F161-V262 HydrophobicContact CE2-CB 4.02Å; F161-V262 HydrophobicContact CE2-CG1 3.79Å; F161-V262 HydrophobicContact CG-CG1 3.84Å; F161-V262 HydrophobicContact CZ-CB 4.23Å; F161-V262 HydrophobicContact CZ-CG1 4.09Å; A169-V262 HydrophobicContact CB-CG1 4.4Å; A169-V262 HydrophobicContact CB-CG2 4.45Å; V258-V262 WeakPolarHBondContact O-CG2 3.39Å; V258-V262 PolarHBondContact O-N 3.49Å; V259-V262 PolarHBondContact O-N 3.38Å; V262-I265 PolarHBondContact O-N 3.27Å; V262-N266 VanDerWaalsContact O-CB 3.3Å; V262-N266 WeakPolarHBondContact O-CB 3.49Å; V262-N266 PolarHBondContact O-N 3.25Å |
| 263 | Q | 80.3 | Confident | 67.3 | Low | 86 Ų | 86 | 56.9 Ų | 56.9 | 40% | 0.402 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.7 | -43 | 175.3 | -165.6 | 173.5 | 0.6 | 0 | 0 | 112.5 | F161 V259 A260 I261 I265 N266 K267 | F161-Q263 HydrophobicContact CE1-CB 3.68Å; F161-Q263 HydrophobicContact CE1-CG 4Å; F161-Q263 HydrophobicContact CZ-CB 3.71Å; F161-Q263 HydrophobicContact CZ-CG 4.37Å; V259-Q263 WeakPolarHBondContact O-CB 3.41Å; V259-Q263 PolarHBondContact O-N 3.47Å; A260-Q263 PolarHBondContact O-N 3.12Å; I261-Q263 VanDerWaalsContact C-N 3.25Å; I261-Q263 PolarHBondContact O-N 3.12Å; Q263-I265 VanDerWaalsContact C-N 3.34Å; Q263-N266 PolarHBondContact O-N 3.44Å; Q263-K267 WeakPolarHBondContact O-CG 3.41Å; Q263-K267 PolarHBondContact O-N 3.27Å |
| 264 | S | 77.1 | Confident | 66.9 | Low | 23 Ų | 23 | 61.6 Ų | 61.6 | 16% | 0.161 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 177.2 | -171.7 | 0 | 0 | 0 | 0 | 110.9 | R133 W137 A260 I261 K267 C268 | R133-S264 PolarHBondContact NH1-OG 3.35Å; W137-S264 WeakPolarHBondContact CZ2-OG 3.48Å; A260-S264 WeakPolarHBondContact O-CB 3.12Å; A260-S264 PolarHBondContact O-N 3.11Å; I261-S264 PolarHBondContact O-N 3.03Å; I261-S264 VanDerWaalsContact O-N 3.13Å; S264-K267 PolarHBondContact O-N 3.29Å; S264-C268 PolarHBondContact O-N 3.12Å; S264-C268 VanDerWaalsContact O-N 3.08Å; S264-C268 PolarHBondContact O-SG 3.22Å |
| 265 | I | 74.8 | Confident | 66 | Low | 3 Ų | 3 | 69.2 Ų | 69.2 | 2% | 0.015 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 175.1 | -67.4 | 169.3 | 0 | 0 | 0 | 110.4 | W137 A169 F172 V173 I261 V262 Q263 K267 C268 L269 | W137-I265 HydrophobicContact CE3-CD1 3.89Å; W137-I265 HydrophobicContact CE3-CG1 3.87Å; W137-I265 HydrophobicContact CH2-CG1 3.77Å; W137-I265 HydrophobicContact CZ3-CD1 3.89Å; W137-I265 HydrophobicContact CZ3-CG1 3.36Å; A169-I265 HydrophobicContact CB-CB 4.27Å; A169-I265 HydrophobicContact CB-CD1 4.07Å; A169-I265 HydrophobicContact CB-CG2 3.82Å; F172-I265 HydrophobicContact CB-CD1 4.31Å; F172-I265 HydrophobicContact CD2-CG2 4.14Å; V173-I265 HydrophobicContact CG1-CD1 3.39Å; I261-I265 HydrophobicContact CG2-CD1 4.1Å; I261-I265 WeakPolarHBondContact O-CG1 3.33Å; I261-I265 PolarHBondContact O-N 3.25Å; V262-I265 PolarHBondContact O-N 3.27Å; Q263-I265 VanDerWaalsContact C-N 3.34Å; I265-K267 VanDerWaalsContact C-N 3.31Å; I265-K267 PolarHBondContact O-N 2.89Å; I265-C268 WeakPolarHBondContact O-CB 3.31Å; I265-C268 PolarHBondContact O-N 3.03Å; I265-C268 VanDerWaalsContact O-N 3.09Å; I265-L269 HydrophobicContact CG2-CD1 3.94Å; I265-L269 HydrophobicContact CG2-CG 4.3Å; I265-L269 WeakPolarHBondContact O-CG 3.5Å; I265-L269 PolarHBondContact O-N 3.3Å |
| 266 | N | 76 | Confident | 66.4 | Low | 30 Ų | 30 | 72.4 Ų | 72.4 | 16% | 0.16 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -59.9 | -42 | 179.8 | -169.9 | 67.9 | 0 | 0 | 0 | 111.6 | S165 V262 Q263 C268 L269 T270 | S165-N266 VanDerWaalsContact CB-OD1 3.32Å; S165-N266 WeakPolarHBondContact CB-OD1 3Å; S165-N266 PolarHBondContact OG-OD1 3.41Å; V262-N266 VanDerWaalsContact O-CB 3.3Å; V262-N266 WeakPolarHBondContact O-CB 3.49Å; V262-N266 PolarHBondContact O-N 3.25Å; Q263-N266 PolarHBondContact O-N 3.44Å; N266-C268 PolarHBondContact O-N 3.15Å; N266-L269 PolarHBondContact O-N 3.38Å; N266-T270 WeakPolarHBondContact O-CG2 3.3Å; N266-T270 PolarHBondContact O-N 2.98Å; N266-T270 PolarHBondContact O-OG1 2.85Å |
| 267 | K | 78.6 | Confident | 66.6 | Low | 120 Ų | 120 | 69.6 Ų | 69.6 | 52% | 0.522 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.3 | -45.4 | 172.9 | -75.3 | 178.4 | 179.9 | -180 | 0 | 111.7 | Q263 S264 I265 L269 T270 V271 | Q263-K267 WeakPolarHBondContact O-CG 3.41Å; Q263-K267 PolarHBondContact O-N 3.27Å; S264-K267 PolarHBondContact O-N 3.29Å; I265-K267 VanDerWaalsContact C-N 3.31Å; I265-K267 PolarHBondContact O-N 2.89Å; K267-L269 VanDerWaalsContact C-N 3.27Å; K267-L269 PolarHBondContact O-N 3.3Å; K267-T270 PolarHBondContact O-N 3.47Å; K267-T270 PolarHBondContact O-OG1 3Å; K267-V271 WeakPolarHBondContact O-CB 3.47Å; K267-V271 WeakPolarHBondContact O-CG2 3.27Å; K267-V271 PolarHBondContact O-N 3.14Å |
| 268 | C | 73.8 | Confident | 66.4 | Low | 24 Ų | 24 | 70.7 Ų | 70.7 | 16% | 0.162 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.4 | -34.3 | 176.5 | -69.8 | 0 | 0 | 0 | 0 | 112.8 | W130 S264 I265 N266 | W130-C268 HydrophobicContact CE3-CB 4.49Å; W130-C268 HydrophobicContact CH2-CB 3.76Å; W130-C268 HydrophobicContact CZ2-CB 4.18Å; W130-C268 HydrophobicContact CZ3-CB 3.93Å; S264-C268 PolarHBondContact O-N 3.12Å; S264-C268 VanDerWaalsContact O-N 3.08Å; S264-C268 PolarHBondContact O-SG 3.22Å; I265-C268 WeakPolarHBondContact O-CB 3.31Å; I265-C268 PolarHBondContact O-N 3.03Å; I265-C268 VanDerWaalsContact O-N 3.09Å; N266-C268 PolarHBondContact O-N 3.15Å |
| 269 | L | 67.8 | Low | 66.3 | Low | 66 Ų | 66 | 74.5 Ų | 74.5 | 35% | 0.346 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -75.7 | -33.5 | 178.4 | -66.6 | 174 | 0 | 0 | 0 | 112.9 | W164 V168 I265 N266 K267 | W164-L269 HydrophobicContact CZ3-CD1 4.19Å; V168-L269 HydrophobicContact CG1-CD1 4.07Å; I265-L269 HydrophobicContact CG2-CD1 3.94Å; I265-L269 HydrophobicContact CG2-CG 4.3Å; I265-L269 WeakPolarHBondContact O-CG 3.5Å; I265-L269 PolarHBondContact O-N 3.3Å; N266-L269 PolarHBondContact O-N 3.38Å; K267-L269 VanDerWaalsContact C-N 3.27Å; K267-L269 PolarHBondContact O-N 3.3Å |
| 270 | T | 70 | Confident | 65.8 | Low | 70 Ų | 70 | 78 Ų | 78 | 43% | 0.429 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -86.2 | -27.5 | -178.2 | 55.8 | 0 | 0 | 0 | 0 | 114.2 | N266 K267 N272 N273 | N266-T270 WeakPolarHBondContact O-CG2 3.3Å; N266-T270 PolarHBondContact O-N 2.98Å; N266-T270 PolarHBondContact O-OG1 2.85Å; K267-T270 PolarHBondContact O-N 3.47Å; K267-T270 PolarHBondContact O-OG1 3Å; T270-N272 PolarHBondContact O-N 3.5Å; T270-N272 VanDerWaalsContact O-N 3.09Å; T270-N273 PolarHBondContact O-N 3.16Å |
| 271 | V | 58.1 | Low | 65 | Low | 114 Ų | 114 | 79.7 Ų | 79.7 | 69% | 0.691 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -7.5 | -176.7 | 169 | 0 | 0 | 0 | 0 | 113.4 | K267 N273 | K267-V271 WeakPolarHBondContact O-CB 3.47Å; K267-V271 WeakPolarHBondContact O-CG2 3.27Å; K267-V271 PolarHBondContact O-N 3.14Å; V271-N273 VanDerWaalsContact C-N 3.25Å; V271-N273 PolarHBondContact O-N 3.43Å |
| 272 | N | 50.7 | Low | 64.3 | Low | 132 Ų | 132 | 85 Ų | 85 | 71% | 0.706 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.9 | 17 | 171.6 | -79.8 | -42.8 | 0 | 0 | 0 | 115 | T270 P274 | T270-N272 PolarHBondContact O-N 3.5Å; T270-N272 VanDerWaalsContact O-N 3.09Å; N272-P274 VanDerWaalsContact O-CD 3.3Å; N272-P274 WeakPolarHBondContact O-CD 3.35Å |
| 273 | N | 40.2 | Very low | 63.3 | Low | 142 Ų | 142 | 91.2 Ų | 91.2 | 76% | 0.759 | 49% | 0.486 | S | S | * | . | trans | -104.8 | 94.5 | 166.7 | -138.1 | 26.5 | 0 | 0 | 0 | 108.2 | T270 V271 E275 | T270-N273 PolarHBondContact O-N 3.16Å; V271-N273 VanDerWaalsContact C-N 3.25Å; V271-N273 PolarHBondContact O-N 3.43Å; N273-E275 PolarHBondContact O-N 3.15Å | ||
| 274 | P | 41.8 | Very low | 61.8 | Low | 114 Ų | 114 | 91.6 Ų | 91.6 | 74% | 0.74 | 49% | 0.493 | S | S | * | . | trans | -65 | 118 | 166.2 | 27.5 | -29 | 0 | 0 | 0 | 107.3 | N272 | N272-P274 VanDerWaalsContact O-CD 3.3Å; N272-P274 WeakPolarHBondContact O-CD 3.35Å | ||
| 275 | E | 33.2 | Very low | 60.5 | Low | 261 Ų | 261 | 97.8 Ų | 97.8 | 100% | 1.22 | 52% | 0.523 | S | S | * | . | trans | -55.8 | 0 | 150.8 | -67.6 | -176.4 | 163.4 | 0 | 0 | 109.6 | N273 | N273-E275 PolarHBondContact O-N 3.15Š|
Retrieved 275 of 275 residues in 136.8 ms
(Link to these results)