| 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 | 62.9 | Low | 73.6 | Confident | 146 Ų | 146 | 95.5 Ų | 95.5 | 72% | 0.719 | 50% | 0.495 | S | S | * | . | 0 | -57.9 | 0 | -166.9 | 174.9 | 173.2 | 0 | 0 | 111.6 | L3 A4 F5 I155 F287 | M1-L3 PolarHBondContact O-N 3.47Å; M1-A4 PolarHBondContact O-N 2.93Å; M1-F5 PolarHBondContact O-N 3.32Å; M1-I155 HydrophobicContact CE-CD1 4.47Å; M1-F287 HydrophobicContact CE-CZ 4.12Å | |||
| 2 | L | 67.2 | Low | 74.3 | Confident | 89 Ų | 89 | 88.8 Ų | 88.8 | 47% | 0.466 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -57.5 | -43.2 | -179.5 | -68 | 171.3 | 0 | 0 | 0 | 113.9 | A4 F5 S6 | L2-A4 PolarHBondContact O-N 3.28Å; L2-F5 WeakPolarHBondContact O-CB 3.44Å; L2-F5 PolarHBondContact O-N 3.45Å; L2-S6 PolarHBondContact O-N 3.47Å; L2-S6 PolarHBondContact O-OG 2.94Å |
| 3 | L | 70.8 | Confident | 75 | Confident | 148 Ų | 148 | 84 Ų | 84 | 78% | 0.775 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.3 | -44.7 | 176.1 | -74.5 | 167.4 | 0 | 0 | 0 | 113 | M1 F5 S6 V7 | M1-L3 PolarHBondContact O-N 3.47Å; L3-F5 VanDerWaalsContact C-N 3.28Å; L3-F5 PolarHBondContact O-N 3Å; L3-S6 PolarHBondContact O-N 3.31Å; L3-V7 WeakPolarHBondContact O-CG2 3.3Å; L3-V7 PolarHBondContact O-N 2.79Å |
| 4 | A | 70.4 | Confident | 75.7 | Confident | 63 Ų | 63 | 84.9 Ų | 84.9 | 52% | 0.521 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -63.1 | -38.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | M1 L2 V7 V8 | M1-A4 PolarHBondContact O-N 2.93Å; L2-A4 PolarHBondContact O-N 3.28Å; A4-V7 PolarHBondContact O-N 3Å; A4-V8 VanDerWaalsContact O-CG2 3.26Å; A4-V8 WeakPolarHBondContact O-CG2 3.4Å; A4-V8 PolarHBondContact O-N 3.42Å |
| 5 | F | 73.6 | Confident | 76.6 | Confident | 33 Ų | 33 | 80.9 Ų | 80.9 | 15% | 0.145 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 175.1 | -168.5 | -113.5 | 0 | 0 | 0 | 111.7 | M1 L2 L3 V7 V8 I9 F147 L148 V151 L152 | M1-F5 PolarHBondContact O-N 3.32Å; L2-F5 WeakPolarHBondContact O-CB 3.44Å; L2-F5 PolarHBondContact O-N 3.45Å; L3-F5 VanDerWaalsContact C-N 3.28Å; L3-F5 PolarHBondContact O-N 3Å; F5-V7 VanDerWaalsContact C-N 3.33Å; F5-V7 PolarHBondContact O-N 3.48Å; F5-V8 PolarHBondContact O-N 2.89Å; F5-I9 HydrophobicContact CD1-CD1 3.66Å; F5-I9 HydrophobicContact CD1-CG1 4.46Å; F5-I9 HydrophobicContact CE1-CD1 3.68Å; F5-I9 HydrophobicContact CE1-CG1 4.42Å; F5-I9 HydrophobicContact CG-CD1 4.4Å; F5-I9 HydrophobicContact CZ-CD1 4.41Å; F5-I9 VanDerWaalsContact O-CG1 3.24Å; F5-I9 WeakPolarHBondContact O-CG1 3.38Å; F5-I9 PolarHBondContact O-N 2.95Å; F5-F147 AromaticContact CE2-CE1 3.94Å; F5-F147 HydrophobicContact CE2-CE1 3.94Å; F5-F147 HydrophobicContact CE2-CZ 4.17Å; F5-F147 HydrophobicContact CZ-CE1 4.09Å; F5-L148 HydrophobicContact CE1-CD2 3.65Å; F5-L148 HydrophobicContact CE2-CD2 4.3Å; F5-L148 HydrophobicContact CZ-CD2 3.37Å; F5-V151 HydrophobicContact CE1-CG1 4.31Å; F5-V151 HydrophobicContact CE2-CG1 4.08Å; F5-V151 HydrophobicContact CZ-CB 4.2Å; F5-V151 HydrophobicContact CZ-CG1 3.7Å; F5-L152 HydrophobicContact CE1-CD2 4.42Å |
| 6 | S | 73.6 | Confident | 77.4 | Confident | 72 Ų | 72 | 75.9 Ų | 75.9 | 50% | 0.503 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.2 | -40 | 174.8 | -58.8 | 0 | 0 | 0 | 0 | 112.9 | L2 L3 I9 Y10 | L2-S6 PolarHBondContact O-N 3.47Å; L2-S6 PolarHBondContact O-OG 2.94Å; L3-S6 PolarHBondContact O-N 3.31Å; S6-I9 PolarHBondContact O-N 3.45Å; S6-Y10 PolarHBondContact O-N 3.48Å; S6-Y10 VanDerWaalsContact O-N 3.11Å |
| 7 | V | 76.5 | Confident | 78.2 | Confident | 81 Ų | 81 | 72.6 Ų | 72.6 | 49% | 0.491 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.1 | -42.3 | 176 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | L3 A4 F5 I9 Y10 F11 | L3-V7 WeakPolarHBondContact O-CG2 3.3Å; L3-V7 PolarHBondContact O-N 2.79Å; A4-V7 PolarHBondContact O-N 3Å; F5-V7 VanDerWaalsContact C-N 3.33Å; F5-V7 PolarHBondContact O-N 3.48Å; V7-I9 VanDerWaalsContact C-N 3.31Å; V7-I9 PolarHBondContact O-N 2.91Å; V7-Y10 WeakPolarHBondContact O-CB 3.33Å; V7-Y10 PolarHBondContact O-N 2.87Å; V7-Y10 VanDerWaalsContact O-N 3.16Å; V7-F11 HydrophobicContact CG1-CD2 3.93Å; V7-F11 HydrophobicContact CG1-CE2 3.55Å; V7-F11 WeakPolarHBondContact O-CD2 3.48Å; V7-F11 PolarHBondContact O-N 3.39Å |
| 8 | V | 77.3 | Confident | 78.9 | Confident | 22 Ų | 22 | 72.5 Ų | 72.5 | 13% | 0.133 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.7 | -39.5 | 177.6 | 173 | 0 | 0 | 0 | 0 | 111.3 | A4 F5 Y10 F11 G12 A15 M16 I19 | A4-V8 VanDerWaalsContact O-CG2 3.26Å; A4-V8 WeakPolarHBondContact O-CG2 3.4Å; A4-V8 PolarHBondContact O-N 3.42Å; F5-V8 PolarHBondContact O-N 2.89Å; V8-Y10 VanDerWaalsContact C-N 3.26Å; V8-Y10 PolarHBondContact O-N 3.24Å; V8-F11 PolarHBondContact O-N 2.89Å; V8-G12 PolarHBondContact O-N 2.89Å; V8-A15 HydrophobicContact CG1-CB 4.25Å; V8-M16 HydrophobicContact CG1-CG 4.14Å; V8-I19 HydrophobicContact CG1-CB 4.44Å; V8-I19 HydrophobicContact CG1-CG2 3.93Å; V8-I19 HydrophobicContact CG2-CD1 3.7Å |
| 9 | I | 77.1 | Confident | 79.6 | Confident | 58 Ų | 58 | 71.5 Ų | 71.5 | 30% | 0.297 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.9 | -40.8 | 175 | -65.2 | 163.5 | 0 | 0 | 0 | 111 | F5 S6 V7 F11 G12 M16 L148 | F5-I9 HydrophobicContact CD1-CD1 3.66Å; F5-I9 HydrophobicContact CD1-CG1 4.46Å; F5-I9 HydrophobicContact CE1-CD1 3.68Å; F5-I9 HydrophobicContact CE1-CG1 4.42Å; F5-I9 HydrophobicContact CG-CD1 4.4Å; F5-I9 HydrophobicContact CZ-CD1 4.41Å; F5-I9 VanDerWaalsContact O-CG1 3.24Å; F5-I9 WeakPolarHBondContact O-CG1 3.38Å; F5-I9 PolarHBondContact O-N 2.95Å; S6-I9 PolarHBondContact O-N 3.45Å; V7-I9 VanDerWaalsContact C-N 3.31Å; V7-I9 PolarHBondContact O-N 2.91Å; I9-F11 VanDerWaalsContact C-N 3.34Å; I9-F11 PolarHBondContact O-N 2.93Å; I9-G12 PolarHBondContact O-N 3.37Å; I9-M16 HydrophobicContact CB-CE 4.03Å; I9-M16 HydrophobicContact CG1-CE 3.87Å; I9-M16 HydrophobicContact CG2-CE 3.99Å; I9-L148 HydrophobicContact CD1-CD1 3.99Å; I9-L148 HydrophobicContact CD1-CD2 3.61Å; I9-L148 HydrophobicContact CD1-CG 4.42Å; I9-L148 HydrophobicContact CG1-CD1 4.03Å; I9-L148 HydrophobicContact CG1-CD2 3.56Å; I9-L148 HydrophobicContact CG1-CG 4.45Å; I9-L148 HydrophobicContact CG2-CD1 3.98Å |
| 10 | Y | 77.5 | Confident | 80.2 | Confident | 195 Ų | 195 | 68.5 Ų | 68.5 | 77% | 0.765 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62.5 | -38.2 | -179.8 | 179.4 | -95.9 | 0 | 0 | 0 | 113 | S6 V7 V8 G12 | S6-Y10 PolarHBondContact O-N 3.48Å; S6-Y10 VanDerWaalsContact O-N 3.11Å; V7-Y10 WeakPolarHBondContact O-CB 3.33Å; V7-Y10 PolarHBondContact O-N 2.87Å; V7-Y10 VanDerWaalsContact O-N 3.16Å; V8-Y10 VanDerWaalsContact C-N 3.26Å; V8-Y10 PolarHBondContact O-N 3.24Å; Y10-G12 PolarHBondContact O-N 2.92Å |
| 11 | F | 82.3 | Confident | 80.9 | Confident | 143 Ų | 143 | 67.8 Ų | 67.8 | 63% | 0.627 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.5 | -2.8 | 175.2 | -71.6 | -69.6 | 0 | 0 | 0 | 114.1 | V7 V8 I9 A15 | V7-F11 HydrophobicContact CG1-CD2 3.93Å; V7-F11 HydrophobicContact CG1-CE2 3.55Å; V7-F11 WeakPolarHBondContact O-CD2 3.48Å; V7-F11 PolarHBondContact O-N 3.39Å; V8-F11 PolarHBondContact O-N 2.89Å; I9-F11 VanDerWaalsContact C-N 3.34Å; I9-F11 PolarHBondContact O-N 2.93Å; F11-A15 HydrophobicContact CB-CB 3.48Å; F11-A15 VanDerWaalsContact CB-CB 3.48Å |
| 12 | G | 82.2 | Confident | 82.4 | Confident | 15 Ų | 15 | 65.8 Ų | 65.8 | 16% | 0.155 | 36% | 0.36 | C | S | . | . | trans | 82.8 | -171.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | V8 I9 Y10 V14 A15 M16 | V8-G12 PolarHBondContact O-N 2.89Å; I9-G12 PolarHBondContact O-N 3.37Å; Y10-G12 PolarHBondContact O-N 2.92Å; G12-V14 PolarHBondContact O-N 2.88Å; G12-A15 WeakPolarHBondContact O-CB 3.25Å; G12-A15 PolarHBondContact O-N 3.25Å; G12-A15 VanDerWaalsContact O-N 3.14Å; G12-M16 PolarHBondContact O-N 2.97Å | ||
| 13 | P | 83.5 | Confident | 83.6 | Confident | 27 Ų | 27 | 63.1 Ų | 63.1 | 18% | 0.175 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.6 | -36.9 | -169.4 | -22.8 | 30 | 0 | 0 | 0 | 114.6 | A15 M16 I17 I140 T144 F209 | P13-A15 VanDerWaalsContact C-N 3.32Å; P13-A15 PolarHBondContact O-N 3.37Å; P13-M16 WeakPolarHBondContact O-CB 3.28Å; P13-M16 PolarHBondContact O-N 2.98Å; P13-M16 VanDerWaalsContact O-N 3.14Å; P13-I17 WeakPolarHBondContact O-CG1 3.38Å; P13-I17 PolarHBondContact O-N 3.38Å; P13-I140 HydrophobicContact CB-CG2 4.03Å; P13-T144 HydrophobicContact CG-CG2 4.03Å; P13-F209 HydrophobicContact CB-CE1 3.94Å; P13-F209 HydrophobicContact CB-CZ 3.57Å; P13-F209 HydrophobicContact CG-CD1 4.36Å; P13-F209 HydrophobicContact CG-CE1 3.38Å; P13-F209 HydrophobicContact CG-CE2 3.76Å; P13-F209 HydrophobicContact CG-CZ 3.03Å |
| 14 | V | 85.6 | Confident | 84.8 | Confident | 96 Ų | 96 | 56.3 Ų | 56.3 | 58% | 0.582 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -63.9 | -39.5 | 178.4 | 178.7 | 0 | 0 | 0 | 0 | 111 | G12 M16 I17 T18 | G12-V14 PolarHBondContact O-N 2.88Å; V14-M16 VanDerWaalsContact C-N 3.34Å; V14-I17 PolarHBondContact O-N 2.98Å; V14-T18 WeakPolarHBondContact O-CB 3.36Å; V14-T18 PolarHBondContact O-N 3.45Å; V14-T18 PolarHBondContact O-OG1 3.49Å |
| 15 | A | 88.4 | Confident | 86 | Confident | 25 Ų | 25 | 55.6 Ų | 55.6 | 21% | 0.207 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.4 | -37.9 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | V8 F11 G12 P13 T18 I19 | V8-A15 HydrophobicContact CG1-CB 4.25Å; F11-A15 HydrophobicContact CB-CB 3.48Å; F11-A15 VanDerWaalsContact CB-CB 3.48Å; G12-A15 WeakPolarHBondContact O-CB 3.25Å; G12-A15 PolarHBondContact O-N 3.25Å; G12-A15 VanDerWaalsContact O-N 3.14Å; P13-A15 VanDerWaalsContact C-N 3.32Å; P13-A15 PolarHBondContact O-N 3.37Å; A15-T18 PolarHBondContact O-N 2.96Å; A15-I19 PolarHBondContact O-N 3.12Å |
| 16 | M | 89.4 | Confident | 86.9 | Confident | 2 Ų | 2 | 58.3 Ų | 58.3 | 1% | 0.01 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.9 | -44.3 | 174.2 | -60.9 | 179.3 | -173.7 | 0 | 0 | 112.2 | V8 I9 G12 P13 V14 T18 I19 V20 I140 T144 F147 L148 | V8-M16 HydrophobicContact CG1-CG 4.14Å; I9-M16 HydrophobicContact CB-CE 4.03Å; I9-M16 HydrophobicContact CG1-CE 3.87Å; I9-M16 HydrophobicContact CG2-CE 3.99Å; G12-M16 PolarHBondContact O-N 2.97Å; P13-M16 WeakPolarHBondContact O-CB 3.28Å; P13-M16 PolarHBondContact O-N 2.98Å; P13-M16 VanDerWaalsContact O-N 3.14Å; V14-M16 VanDerWaalsContact C-N 3.34Å; M16-T18 VanDerWaalsContact C-N 3.31Å; M16-T18 PolarHBondContact O-N 3.4Å; M16-I19 WeakPolarHBondContact O-CG2 3.45Å; M16-I19 PolarHBondContact O-N 3.4Å; M16-V20 VanDerWaalsContact O-CG2 3.26Å; M16-V20 WeakPolarHBondContact O-CG2 3.43Å; M16-V20 PolarHBondContact O-N 3.39Å; M16-I140 HydrophobicContact CB-CD1 3.81Å; M16-I140 HydrophobicContact CB-CG1 4.47Å; M16-I140 HydrophobicContact CB-CG2 4.36Å; M16-I140 HydrophobicContact SD-CG2 4.37Å; M16-T144 HydrophobicContact CE-CG2 4.07Å; M16-T144 HydrophobicContact SD-CG2 4.16Å; M16-F147 HydrophobicContact CB-CE1 4.27Å; M16-F147 HydrophobicContact CG-CD1 4.43Å; M16-F147 HydrophobicContact CG-CE1 4.21Å; M16-F147 HydrophobicContact SD-CD1 3.69Å; M16-F147 HydrophobicContact SD-CE1 4.04Å; M16-L148 HydrophobicContact CE-CD1 4.16Å; M16-L148 HydrophobicContact CE-CD2 4.05Å; M16-L148 HydrophobicContact CE-CG 4.33Å |
| 17 | I | 90.6 | Very high | 87.9 | Confident | 19 Ų | 19 | 55.1 Ų | 55.1 | 10% | 0.097 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 176.8 | -67.2 | 164.2 | 0 | 0 | 0 | 110.3 | P13 V14 V20 L21 M67 I137 I140 F141 | P13-I17 WeakPolarHBondContact O-CG1 3.38Å; P13-I17 PolarHBondContact O-N 3.38Å; V14-I17 PolarHBondContact O-N 2.98Å; I17-V20 PolarHBondContact O-N 2.94Å; I17-L21 PolarHBondContact O-N 3.06Å; I17-M67 HydrophobicContact CD1-CE 4.36Å; I17-M67 HydrophobicContact CG2-CE 4.19Å; I17-I137 HydrophobicContact CD1-CG2 4.47Å; I17-I137 HydrophobicContact CG1-CG1 4.37Å; I17-I137 HydrophobicContact CG1-CG2 4.19Å; I17-I137 HydrophobicContact CG2-CD1 4.07Å; I17-I137 HydrophobicContact CG2-CG1 4.24Å; I17-I137 HydrophobicContact CG2-CG2 4.47Å; I17-I140 HydrophobicContact CG1-CD1 4.32Å; I17-I140 HydrophobicContact CG1-CG2 4.25Å; I17-F141 HydrophobicContact CD1-CD1 4.33Å; I17-F141 HydrophobicContact CD1-CE1 3.62Å; I17-F141 HydrophobicContact CD1-CE2 4.15Å; I17-F141 HydrophobicContact CD1-CZ 3.52Å |
| 18 | T | 91.4 | Very high | 88.8 | Confident | 71 Ų | 71 | 51.3 Ų | 51.3 | 44% | 0.436 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.2 | -45 | 178.6 | -56.8 | 0 | 0 | 0 | 0 | 111.4 | V14 A15 M16 V20 L21 L22 | V14-T18 WeakPolarHBondContact O-CB 3.36Å; V14-T18 PolarHBondContact O-N 3.45Å; V14-T18 PolarHBondContact O-OG1 3.49Å; A15-T18 PolarHBondContact O-N 2.96Å; M16-T18 VanDerWaalsContact C-N 3.31Å; M16-T18 PolarHBondContact O-N 3.4Å; T18-V20 PolarHBondContact O-N 3.5Å; T18-L21 PolarHBondContact O-N 3.09Å; T18-L22 HydrophobicContact CG2-CD1 4.34Å; T18-L22 WeakPolarHBondContact O-CG 3.46Å; T18-L22 PolarHBondContact O-N 3.22Å |
| 19 | I | 91.4 | Very high | 89.6 | Confident | 54 Ų | 54 | 54.2 Ų | 54.2 | 28% | 0.277 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -66.8 | -38 | 178.3 | -159.4 | 162.7 | 0 | 0 | 0 | 111.7 | V8 A15 M16 L21 L22 I23 | V8-I19 HydrophobicContact CG1-CB 4.44Å; V8-I19 HydrophobicContact CG1-CG2 3.93Å; V8-I19 HydrophobicContact CG2-CD1 3.7Å; A15-I19 PolarHBondContact O-N 3.12Å; M16-I19 WeakPolarHBondContact O-CG2 3.45Å; M16-I19 PolarHBondContact O-N 3.4Å; I19-L21 VanDerWaalsContact C-N 3.33Å; I19-L21 PolarHBondContact O-N 2.96Å; I19-L22 PolarHBondContact O-N 2.95Å; I19-I23 HydrophobicContact CG1-CD1 3.97Å; I19-I23 HydrophobicContact CG1-CG1 4.4Å; I19-I23 WeakPolarHBondContact O-CB 3.37Å; I19-I23 WeakPolarHBondContact O-CD1 3.28Å; I19-I23 VanDerWaalsContact O-CG1 3.24Å; I19-I23 WeakPolarHBondContact O-CG1 3.39Å; I19-I23 PolarHBondContact O-N 2.78Å |
| 20 | V | 93 | Very high | 90.4 | Very high | 11 Ų | 11 | 52 Ų | 52 | 7% | 0.067 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 176.1 | 169.7 | 0 | 0 | 0 | 0 | 110.6 | M16 I17 T18 I23 Q24 I136 I137 I140 F147 | M16-V20 VanDerWaalsContact O-CG2 3.26Å; M16-V20 WeakPolarHBondContact O-CG2 3.43Å; M16-V20 PolarHBondContact O-N 3.39Å; I17-V20 PolarHBondContact O-N 2.94Å; T18-V20 PolarHBondContact O-N 3.5Å; V20-I23 PolarHBondContact O-N 3.13Å; V20-Q24 VanDerWaalsContact O-CB 3.28Å; V20-Q24 WeakPolarHBondContact O-CB 3.24Å; V20-Q24 PolarHBondContact O-N 2.95Å; V20-I136 HydrophobicContact CG1-CB 4.46Å; V20-I136 HydrophobicContact CG1-CG2 4.13Å; V20-I136 HydrophobicContact CG2-CG2 3.83Å; V20-I137 HydrophobicContact CB-CG1 4.43Å; V20-I137 HydrophobicContact CG1-CD1 4.15Å; V20-I137 HydrophobicContact CG1-CG1 3.99Å; V20-I140 HydrophobicContact CG2-CD1 4.08Å; V20-F147 HydrophobicContact CG2-CE2 4.17Å; V20-F147 HydrophobicContact CG2-CZ 4.23Å |
| 21 | L | 94 | Very high | 91.2 | Very high | 54 Ų | 54 | 43.2 Ų | 43.2 | 28% | 0.283 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -62.6 | -45 | 174.6 | -178.5 | 70.6 | 0 | 0 | 0 | 112.2 | I17 T18 I19 I23 Q24 I25 Y63 | I17-L21 PolarHBondContact O-N 3.06Å; T18-L21 PolarHBondContact O-N 3.09Å; I19-L21 VanDerWaalsContact C-N 3.33Å; I19-L21 PolarHBondContact O-N 2.96Å; L21-I23 PolarHBondContact O-N 3.02Å; L21-Q24 VanDerWaalsContact CD1-OE1 3.32Å; L21-Q24 WeakPolarHBondContact O-CB 3.45Å; L21-Q24 PolarHBondContact O-N 3.31Å; L21-I25 HydrophobicContact CD1-CD1 4.28Å; L21-I25 HydrophobicContact CG-CD1 4.05Å; L21-I25 WeakPolarHBondContact O-CG1 3.44Å; L21-I25 PolarHBondContact O-N 3.37Å; L21-Y63 HydrophobicContact CB-CE1 4.08Å; L21-Y63 HydrophobicContact CD1-CD1 4.23Å; L21-Y63 HydrophobicContact CD1-CE1 3.49Å; L21-Y63 VanDerWaalsContact CD1-CE1 3.49Å; L21-Y63 HydrophobicContact CD1-CE2 4.15Å; L21-Y63 VanDerWaalsContact CD1-CZ 3.47Å; L21-Y63 HydrophobicContact CG-CE1 4.27Å |
| 22 | L | 93.8 | Very high | 91.7 | Very high | 104 Ų | 104 | 36.6 Ų | 36.6 | 55% | 0.545 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.8 | -41.8 | 178.1 | -69.9 | 175.5 | 0 | 0 | 0 | 112.1 | T18 I19 K26 | T18-L22 HydrophobicContact CG2-CD1 4.34Å; T18-L22 WeakPolarHBondContact O-CG 3.46Å; T18-L22 PolarHBondContact O-N 3.22Å; I19-L22 PolarHBondContact O-N 2.95Å; L22-K26 WeakPolarHBondContact O-CB 3.48Å; L22-K26 WeakPolarHBondContact O-CG 3.39Å; L22-K26 PolarHBondContact O-N 2.93Å; L22-K26 VanDerWaalsContact O-N 3.09Å |
| 23 | I | 93 | Very high | 92.1 | Very high | 32 Ų | 32 | 38.7 Ų | 38.7 | 16% | 0.164 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.6 | -47.1 | 174.8 | -69.3 | 161.3 | 0 | 0 | 0 | 109.9 | I19 V20 L21 I25 K26 C27 L283 F287 | I19-I23 HydrophobicContact CG1-CD1 3.97Å; I19-I23 HydrophobicContact CG1-CG1 4.4Å; I19-I23 WeakPolarHBondContact O-CB 3.37Å; I19-I23 WeakPolarHBondContact O-CD1 3.28Å; I19-I23 VanDerWaalsContact O-CG1 3.24Å; I19-I23 WeakPolarHBondContact O-CG1 3.39Å; I19-I23 PolarHBondContact O-N 2.78Å; V20-I23 PolarHBondContact O-N 3.13Å; L21-I23 PolarHBondContact O-N 3.02Å; I23-I25 PolarHBondContact O-N 3.24Å; I23-K26 PolarHBondContact O-N 3.34Å; I23-C27 WeakPolarHBondContact O-CB 3.46Å; I23-C27 PolarHBondContact O-N 3Å; I23-C27 PolarHBondContact O-SG 3.33Å; I23-C27 VanDerWaalsContact O-SG 3.33Å; I23-L283 HydrophobicContact CB-CD2 4.04Å; I23-L283 HydrophobicContact CG1-CD2 4.07Å; I23-L283 HydrophobicContact CG2-CD2 3.85Å; I23-L283 HydrophobicContact CG2-CG 4.22Å; I23-F287 HydrophobicContact CD1-CE1 3.82Å; I23-F287 HydrophobicContact CD1-CE2 4.01Å; I23-F287 HydrophobicContact CD1-CZ 3.48Å; I23-F287 VanDerWaalsContact CD1-CZ 3.48Å; I23-F287 HydrophobicContact CG1-CE2 4.23Å; I23-F287 HydrophobicContact CG1-CZ 4.2Å; I23-F287 HydrophobicContact CG2-CD1 4.36Å; I23-F287 HydrophobicContact CG2-CD2 3.83Å; I23-F287 HydrophobicContact CG2-CE2 4.06Å; I23-F287 HydrophobicContact CG2-CG 4.01Å; I23-F287 HydrophobicContact CG2-CZ 4.42Å |
| 24 | Q | 95.5 | Very high | 92.4 | Very high | 5 Ų | 5 | 38.2 Ų | 38.2 | 2% | 0.023 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -56.9 | -50.2 | 178.1 | 172.3 | -106.5 | -22.8 | 0 | 0 | 112.1 | V20 L21 K26 C27 F28 N59 I129 | V20-Q24 VanDerWaalsContact O-CB 3.28Å; V20-Q24 WeakPolarHBondContact O-CB 3.24Å; V20-Q24 PolarHBondContact O-N 2.95Å; L21-Q24 VanDerWaalsContact CD1-OE1 3.32Å; L21-Q24 WeakPolarHBondContact O-CB 3.45Å; L21-Q24 PolarHBondContact O-N 3.31Å; Q24-K26 VanDerWaalsContact C-N 3.29Å; Q24-K26 PolarHBondContact O-N 3.24Å; Q24-C27 PolarHBondContact O-N 2.89Å; Q24-F28 WeakPolarHBondContact O-CB 3.48Å; Q24-F28 PolarHBondContact O-N 3.19Å; Q24-N59 PolarHBondContact NE2-ND2 3.49Å; Q24-N59 PolarHBondContact NE2-OD1 3.16Å; Q24-N59 PolarHBondContact OE1-ND2 3.12Å; Q24-N59 PolarHBondContact OE1-OD1 3.14Å; Q24-I129 HydrophobicContact CB-CG2 4.22Å; Q24-I129 HydrophobicContact CG-CG2 3.66Å |
| 25 | I | 95.4 | Very high | 92.7 | Very high | 49 Ų | 49 | 33.6 Ų | 33.6 | 25% | 0.251 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -59.5 | -41.7 | 178.8 | -69.3 | 167.5 | 0 | 0 | 0 | 111 | L21 I23 Q29 W52 L55 | L21-I25 HydrophobicContact CD1-CD1 4.28Å; L21-I25 HydrophobicContact CG-CD1 4.05Å; L21-I25 WeakPolarHBondContact O-CG1 3.44Å; L21-I25 PolarHBondContact O-N 3.37Å; I23-I25 PolarHBondContact O-N 3.24Å; I25-Q29 WeakPolarHBondContact O-CB 3.43Å; I25-Q29 PolarHBondContact O-N 2.76Å; I25-W52 HydrophobicContact CG2-CH2 4.06Å; I25-W52 HydrophobicContact CG2-CZ3 3.94Å; I25-L55 HydrophobicContact CG1-CD2 4.48Å |
| 26 | K | 94.4 | Very high | 92.7 | Very high | 90 Ų | 90 | 33.9 Ų | 33.9 | 39% | 0.391 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -70.5 | -43.4 | 179.7 | -75 | -68.6 | 174.3 | -168 | 0 | 113 | L22 I23 Q24 F28 Q29 E30 L283 | L22-K26 WeakPolarHBondContact O-CB 3.48Å; L22-K26 WeakPolarHBondContact O-CG 3.39Å; L22-K26 PolarHBondContact O-N 2.93Å; L22-K26 VanDerWaalsContact O-N 3.09Å; I23-K26 PolarHBondContact O-N 3.34Å; Q24-K26 VanDerWaalsContact C-N 3.29Å; Q24-K26 PolarHBondContact O-N 3.24Å; K26-F28 VanDerWaalsContact C-N 3.32Å; K26-F28 PolarHBondContact O-N 3.37Å; K26-Q29 VanDerWaalsContact NZ-OE1 3.16Å; K26-Q29 WeakPolarHBondContact O-CB 3.23Å; K26-Q29 PolarHBondContact O-N 3.19Å; K26-E30 WeakPolarHBondContact O-CG 3.26Å; K26-E30 PolarHBondContact O-N 3.23Å; K26-L283 HydrophobicContact CB-CD2 3.54Å; K26-L283 HydrophobicContact CG-CD2 4.42Å |
| 27 | C | 94.4 | Very high | 92.6 | Very high | 5 Ų | 5 | 36.8 Ų | 36.8 | 3% | 0.034 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.2 | -41.9 | 174 | -69.4 | 0 | 0 | 0 | 0 | 111.5 | I23 Q24 E30 I31 I129 M284 | I23-C27 WeakPolarHBondContact O-CB 3.46Å; I23-C27 PolarHBondContact O-N 3Å; I23-C27 PolarHBondContact O-SG 3.33Å; I23-C27 VanDerWaalsContact O-SG 3.33Å; Q24-C27 PolarHBondContact O-N 2.89Å; C27-E30 PolarHBondContact O-N 3.32Å; C27-I31 WeakPolarHBondContact O-CG1 3.29Å; C27-I31 PolarHBondContact O-N 2.98Å; C27-I129 HydrophobicContact CB-CD1 4.46Å; C27-I129 HydrophobicContact CB-CG2 4.16Å; C27-M284 HydrophobicContact CB-CB 4.47Å; C27-M284 HydrophobicContact CB-SD 4.47Å |
| 28 | F | 95.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.1 | -47.5 | 174.2 | 179.5 | -95.7 | 0 | 0 | 0 | 111.4 | Q24 K26 E30 I31 I32 S51 L55 T125 L126 | Q24-F28 WeakPolarHBondContact O-CB 3.48Å; Q24-F28 PolarHBondContact O-N 3.19Å; K26-F28 VanDerWaalsContact C-N 3.32Å; K26-F28 PolarHBondContact O-N 3.37Å; F28-E30 VanDerWaalsContact C-N 3.31Å; F28-E30 PolarHBondContact O-N 2.91Å; F28-I31 PolarHBondContact O-N 2.6Å; F28-I32 HydrophobicContact CD1-CG1 3.92Å; F28-I32 HydrophobicContact CD2-CD1 4.5Å; F28-I32 HydrophobicContact CD2-CG1 3.9Å; F28-I32 HydrophobicContact CE1-CB 4.47Å; F28-I32 HydrophobicContact CE1-CG1 3.62Å; F28-I32 HydrophobicContact CE2-CD1 3.88Å; F28-I32 HydrophobicContact CE2-CG1 3.57Å; F28-I32 HydrophobicContact CG-CG1 4.08Å; F28-I32 HydrophobicContact CZ-CD1 3.96Å; F28-I32 HydrophobicContact CZ-CG1 3.45Å; F28-I32 VanDerWaalsContact CZ-CG1 3.45Å; F28-I32 VanDerWaalsContact O-CB 3.25Å; F28-I32 WeakPolarHBondContact O-CB 3.49Å; F28-I32 VanDerWaalsContact O-CG1 3.24Å; F28-I32 WeakPolarHBondContact O-CG1 3.45Å; F28-I32 PolarHBondContact O-N 2.97Å; F28-S51 WeakPolarHBondContact CZ-O 3.43Å; F28-L55 HydrophobicContact CB-CD1 4.03Å; F28-L55 HydrophobicContact CD1-CB 4.27Å; F28-L55 HydrophobicContact CD1-CD1 3.77Å; F28-L55 HydrophobicContact CD1-CD2 3.58Å; F28-L55 HydrophobicContact CD1-CG 4.07Å; F28-L55 HydrophobicContact CD2-CD1 3.7Å; F28-L55 HydrophobicContact CE1-CB 3.8Å; F28-L55 HydrophobicContact CE1-CD1 4.05Å; F28-L55 HydrophobicContact CE1-CD2 3.89Å; F28-L55 HydrophobicContact CE1-CG 4.13Å; F28-L55 HydrophobicContact CE2-CD1 4.02Å; F28-L55 HydrophobicContact CG-CD1 3.55Å; F28-L55 HydrophobicContact CG-CD2 4.16Å; F28-L55 HydrophobicContact CG-CG 4.36Å; F28-L55 HydrophobicContact CZ-CB 3.93Å; F28-L55 HydrophobicContact CZ-CD1 4.16Å; F28-L55 HydrophobicContact CZ-CG 4.49Å; F28-T125 HydrophobicContact CD2-CG2 3.68Å; F28-T125 HydrophobicContact CE2-CG2 4.14Å; F28-L126 HydrophobicContact CD2-CD2 4.02Å; F28-L126 HydrophobicContact CE2-CD2 3.47Å; F28-L126 VanDerWaalsContact CE2-CD2 3.47Å; F28-L126 HydrophobicContact CE2-CG 3.89Å; F28-L126 HydrophobicContact CZ-CD2 4.11Å |
| 29 | Q | 93.9 | Very high | 92.1 | Very high | 84 Ų | 84 | 38 Ų | 38 | 39% | 0.393 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -55.9 | -45.2 | 176.9 | -178.1 | -176.2 | -8.9 | 0 | 0 | 111.7 | I25 K26 S33 W52 | I25-Q29 WeakPolarHBondContact O-CB 3.43Å; I25-Q29 PolarHBondContact O-N 2.76Å; K26-Q29 VanDerWaalsContact NZ-OE1 3.16Å; K26-Q29 WeakPolarHBondContact O-CB 3.23Å; K26-Q29 PolarHBondContact O-N 3.19Å; Q29-S33 VanDerWaalsContact O-CB 3.25Å; Q29-S33 WeakPolarHBondContact O-CB 3.34Å; Q29-S33 PolarHBondContact O-N 3.01Å; Q29-S33 PolarHBondContact O-OG 3.12Å; Q29-W52 HydrophobicContact CB-CH2 4.22Å; Q29-W52 HydrophobicContact CB-CZ2 4.21Å; Q29-W52 HydrophobicContact CG-CZ2 4.16Å |
| 30 | E | 93.2 | Very high | 91.5 | Very high | 10 Ų | 10 | 44.5 Ų | 44.5 | 5% | 0.047 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61 | -54.1 | 178.4 | -73.4 | -179.3 | 167.5 | 0 | 0 | 111.8 | K26 C27 F28 I32 S33 I34 F273 V276 G282 L283 M284 | K26-E30 WeakPolarHBondContact O-CG 3.26Å; K26-E30 PolarHBondContact O-N 3.23Å; C27-E30 PolarHBondContact O-N 3.32Å; F28-E30 VanDerWaalsContact C-N 3.31Å; F28-E30 PolarHBondContact O-N 2.91Å; E30-I32 PolarHBondContact O-N 2.83Å; E30-S33 PolarHBondContact O-N 3.31Å; E30-S33 PolarHBondContact O-OG 3.24Å; E30-I34 PolarHBondContact O-N 3.04Å; E30-F273 HydrophobicContact CB-CB 4.33Å; E30-V276 WeakPolarHBondContact OE1-CG2 3.47Å; E30-G282 WeakPolarHBondContact OE1-CA 3.46Å; E30-L283 VanDerWaalsContact CD-N 3.29Å; E30-L283 PolarHBondContact OE1-N 2.67Å; E30-L283 PolarHBondContact OE2-N 2.65Å; E30-M284 PolarHBondContact OE2-N 3Å |
| 31 | I | 93.3 | Very high | 90.4 | Very high | 12 Ų | 12 | 44.6 Ų | 44.6 | 6% | 0.062 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64 | -41.6 | -177.4 | -63.5 | 168.7 | 0 | 0 | 0 | 111.8 | C27 F28 S33 I34 G35 W121 T125 I129 F273 M284 | C27-I31 WeakPolarHBondContact O-CG1 3.29Å; C27-I31 PolarHBondContact O-N 2.98Å; F28-I31 PolarHBondContact O-N 2.6Å; I31-S33 VanDerWaalsContact C-N 3.35Å; I31-I34 PolarHBondContact O-N 2.91Å; I31-G35 PolarHBondContact O-N 3.05Å; I31-W121 HydrophobicContact CG2-CZ2 4.26Å; I31-W121 PolarHBondContact O-NE1 2.91Å; I31-T125 HydrophobicContact CB-CG2 3.84Å; I31-T125 HydrophobicContact CD1-CG2 4.05Å; I31-T125 HydrophobicContact CG2-CG2 3.64Å; I31-T125 WeakPolarHBondContact CG2-OG1 3.41Å; I31-I129 HydrophobicContact CD1-CD1 3.84Å; I31-I129 HydrophobicContact CD1-CG1 3.88Å; I31-F273 HydrophobicContact CG1-CD1 3.96Å; I31-F273 HydrophobicContact CG1-CE1 4.13Å; I31-M284 HydrophobicContact CD1-CE 4.03Å; I31-M284 HydrophobicContact CD1-CG 4.14Å; I31-M284 HydrophobicContact CD1-SD 3.99Å; I31-M284 HydrophobicContact CG1-CG 4.34Å |
| 32 | I | 93.1 | Very high | 89.1 | Confident | 4 Ų | 4 | 49.9 Ų | 49.9 | 2% | 0.021 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -67.5 | -36.9 | 178.5 | -70.1 | -52.2 | 0 | 0 | 0 | 111.5 | F28 E30 I34 G35 Y36 T122 T125 | F28-I32 HydrophobicContact CD1-CG1 3.92Å; F28-I32 HydrophobicContact CD2-CD1 4.5Å; F28-I32 HydrophobicContact CD2-CG1 3.9Å; F28-I32 HydrophobicContact CE1-CB 4.47Å; F28-I32 HydrophobicContact CE1-CG1 3.62Å; F28-I32 HydrophobicContact CE2-CD1 3.88Å; F28-I32 HydrophobicContact CE2-CG1 3.57Å; F28-I32 HydrophobicContact CG-CG1 4.08Å; F28-I32 HydrophobicContact CZ-CD1 3.96Å; F28-I32 HydrophobicContact CZ-CG1 3.45Å; F28-I32 VanDerWaalsContact CZ-CG1 3.45Å; F28-I32 VanDerWaalsContact O-CB 3.25Å; F28-I32 WeakPolarHBondContact O-CB 3.49Å; F28-I32 VanDerWaalsContact O-CG1 3.24Å; F28-I32 WeakPolarHBondContact O-CG1 3.45Å; F28-I32 PolarHBondContact O-N 2.97Å; E30-I32 PolarHBondContact O-N 2.83Å; I32-I34 VanDerWaalsContact C-N 3.27Å; I32-I34 PolarHBondContact O-N 3Å; I32-G35 PolarHBondContact O-N 3.42Å; I32-G35 VanDerWaalsContact O-N 3.16Å; I32-Y36 HydrophobicContact CG2-CD2 3.77Å; I32-Y36 HydrophobicContact CG2-CE2 3.12Å; I32-Y36 VanDerWaalsContact O-CD2 3.22Å; I32-Y36 WeakPolarHBondContact O-CD2 3.36Å; I32-Y36 PolarHBondContact O-N 3.07Å; I32-Y36 VanDerWaalsContact O-N 3.07Å; I32-T122 HydrophobicContact CD1-CG2 3.75Å; I32-T125 HydrophobicContact CD1-CG2 4.28Å; I32-T125 HydrophobicContact CG1-CG2 4.46Å |
| 33 | S | 90.8 | Very high | 87.9 | Confident | 59 Ų | 59 | 53.2 Ų | 53.2 | 41% | 0.413 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.7 | -37.1 | 177.2 | 76.2 | 0 | 0 | 0 | 0 | 112.6 | Q29 E30 I31 Y36 A37 | Q29-S33 VanDerWaalsContact O-CB 3.25Å; Q29-S33 WeakPolarHBondContact O-CB 3.34Å; Q29-S33 PolarHBondContact O-N 3.01Å; Q29-S33 PolarHBondContact O-OG 3.12Å; E30-S33 PolarHBondContact O-N 3.31Å; E30-S33 PolarHBondContact O-OG 3.24Å; I31-S33 VanDerWaalsContact C-N 3.35Å; S33-Y36 PolarHBondContact O-N 3.45Å; S33-A37 PolarHBondContact O-N 3.33Å; S33-A37 VanDerWaalsContact O-N 3.11Å |
| 34 | I | 91.3 | Very high | 87.1 | Confident | 16 Ų | 16 | 53 Ų | 53 | 8% | 0.082 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.8 | -46 | 174.6 | -68.5 | 158.7 | 0 | 0 | 0 | 110.6 | E30 I31 I32 Y36 A37 I38 W121 I270 F273 | E30-I34 PolarHBondContact O-N 3.04Å; I31-I34 PolarHBondContact O-N 2.91Å; I32-I34 VanDerWaalsContact C-N 3.27Å; I32-I34 PolarHBondContact O-N 3Å; I34-Y36 VanDerWaalsContact C-N 3.32Å; I34-Y36 PolarHBondContact O-N 3.17Å; I34-A37 PolarHBondContact O-N 2.85Å; I34-A37 VanDerWaalsContact O-N 3.16Å; I34-I38 HydrophobicContact CG2-CD1 3.44Å; I34-I38 VanDerWaalsContact CG2-CD1 3.44Å; I34-I38 HydrophobicContact CG2-CG1 4.31Å; I34-I38 WeakPolarHBondContact O-CD1 3.27Å; I34-I38 WeakPolarHBondContact O-CG1 3.25Å; I34-I38 PolarHBondContact O-N 2.94Å; I34-W121 HydrophobicContact CB-CZ2 4.4Å; I34-W121 HydrophobicContact CG2-CH2 4.31Å; I34-W121 HydrophobicContact CG2-CZ2 4.06Å; I34-I270 HydrophobicContact CD1-CD1 3.49Å; I34-I270 VanDerWaalsContact CD1-CD1 3.49Å; I34-I270 HydrophobicContact CG1-CD1 4Å; I34-I270 HydrophobicContact CG2-CD1 4.05Å; I34-F273 HydrophobicContact CD1-CB 4.34Å; I34-F273 HydrophobicContact CD1-CD1 3.61Å; I34-F273 HydrophobicContact CD1-CE1 4.4Å; I34-F273 HydrophobicContact CD1-CG 4.35Å |
| 35 | G | 90.4 | Very high | 85.9 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -55.2 | -46.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | I31 I32 A37 I38 Y39 | I31-G35 PolarHBondContact O-N 3.05Å; I32-G35 PolarHBondContact O-N 3.42Å; I32-G35 VanDerWaalsContact O-N 3.16Å; G35-A37 PolarHBondContact O-N 2.91Å; G35-I38 PolarHBondContact O-N 3.48Å; G35-Y39 WeakPolarHBondContact O-CD2 3.34Å; G35-Y39 PolarHBondContact O-N 3.16Å; G35-Y39 VanDerWaalsContact O-N 3.11Å |
| 36 | Y | 88.3 | Confident | 85.1 | Confident | 30 Ų | 30 | 62.3 Ų | 62.3 | 12% | 0.118 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61 | -41.5 | 176.7 | -70.9 | -54.4 | 0 | 0 | 0 | 113.7 | I32 S33 I34 R40 L41 F47 R48 S51 L118 | I32-Y36 HydrophobicContact CG2-CD2 3.77Å; I32-Y36 HydrophobicContact CG2-CE2 3.12Å; I32-Y36 VanDerWaalsContact O-CD2 3.22Å; I32-Y36 WeakPolarHBondContact O-CD2 3.36Å; I32-Y36 PolarHBondContact O-N 3.07Å; I32-Y36 VanDerWaalsContact O-N 3.07Å; S33-Y36 PolarHBondContact O-N 3.45Å; I34-Y36 VanDerWaalsContact C-N 3.32Å; I34-Y36 PolarHBondContact O-N 3.17Å; Y36-R40 PolarHBondContact O-N 3.42Å; Y36-L41 PolarHBondContact O-N 3.43Å; Y36-F47 HydrophobicContact CE1-CB 4.08Å; Y36-F47 VanDerWaalsContact OH-C 3.31Å; Y36-F47 PolarHBondContact OH-O 2.87Å; Y36-R48 HydrophobicContact CD1-CG 4.34Å; Y36-R48 HydrophobicContact CD2-CG 4.22Å; Y36-R48 HydrophobicContact CE1-CG 3.91Å; Y36-R48 HydrophobicContact CE2-CB 4.44Å; Y36-R48 HydrophobicContact CE2-CG 3.76Å; Y36-R48 WeakPolarHBondContact OH-CA 3.39Å; Y36-R48 PolarHBondContact OH-N 3Å; Y36-S51 VanDerWaalsContact OH-CB 3.24Å; Y36-S51 WeakPolarHBondContact OH-CB 3.35Å; Y36-S51 PolarHBondContact OH-OG 3.37Å; Y36-L118 HydrophobicContact CD1-CD1 4.29Å; Y36-L118 HydrophobicContact CD1-CD2 3.9Å; Y36-L118 HydrophobicContact CE1-CD1 4.14Å; Y36-L118 HydrophobicContact CE1-CD2 3.41Å; Y36-L118 VanDerWaalsContact CE1-CD2 3.41Å; Y36-L118 HydrophobicContact CE1-CG 4.35Å |
| 37 | A | 87.5 | Confident | 84.4 | Confident | 63 Ų | 63 | 58.2 Ų | 58.2 | 52% | 0.521 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.3 | -44.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | S33 I34 G35 R40 | S33-A37 PolarHBondContact O-N 3.33Å; S33-A37 VanDerWaalsContact O-N 3.11Å; I34-A37 PolarHBondContact O-N 2.85Å; I34-A37 VanDerWaalsContact O-N 3.16Å; G35-A37 PolarHBondContact O-N 2.91Å; A37-R40 PolarHBondContact O-N 3.23Å |
| 38 | I | 87 | Confident | 84 | Confident | 63 Ų | 63 | 65.6 Ų | 65.6 | 32% | 0.323 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -66.2 | -48.8 | -178.1 | -67.1 | 158.2 | 0 | 0 | 0 | 111.6 | I34 G35 R40 W121 F268 | I34-I38 HydrophobicContact CG2-CD1 3.44Å; I34-I38 VanDerWaalsContact CG2-CD1 3.44Å; I34-I38 HydrophobicContact CG2-CG1 4.31Å; I34-I38 WeakPolarHBondContact O-CD1 3.27Å; I34-I38 WeakPolarHBondContact O-CG1 3.25Å; I34-I38 PolarHBondContact O-N 2.94Å; G35-I38 PolarHBondContact O-N 3.48Å; I38-R40 PolarHBondContact O-N 3.21Å; I38-W121 HydrophobicContact CD1-CH2 4.14Å; I38-F268 HydrophobicContact CD1-CB 3.91Å; I38-F268 HydrophobicContact CD1-CD1 3.29Å; I38-F268 HydrophobicContact CD1-CD2 4.47Å; I38-F268 HydrophobicContact CD1-CE1 3.93Å; I38-F268 HydrophobicContact CD1-CG 3.62Å; I38-F268 HydrophobicContact CG1-CD1 4.25Å |
| 39 | Y | 84.3 | Confident | 83.8 | Confident | 53 Ų | 53 | 68.4 Ų | 68.4 | 21% | 0.208 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -78.7 | -1.9 | -177.7 | -63.9 | -67.3 | 0 | 0 | 0 | 113.3 | G35 L41 R114 L118 W121 | G35-Y39 WeakPolarHBondContact O-CD2 3.34Å; G35-Y39 PolarHBondContact O-N 3.16Å; G35-Y39 VanDerWaalsContact O-N 3.11Å; Y39-L41 VanDerWaalsContact C-N 3.25Å; Y39-L41 PolarHBondContact O-N 3.14Å; Y39-R114 HydrophobicContact CD1-CB 4.47Å; Y39-R114 WeakPolarHBondContact O-CD 3.37Å; Y39-R114 PolarHBondContact O-NH1 3.35Å; Y39-L118 HydrophobicContact CD2-CB 4.44Å; Y39-L118 HydrophobicContact CD2-CD1 4.44Å; Y39-W121 HydrophobicContact CE2-CE3 4.44Å |
| 40 | R | 79.1 | Confident | 83.7 | Confident | 190 Ų | 190 | 64.6 Ų | 64.6 | 72% | 0.717 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.7 | 43.7 | 178.1 | -60.4 | -176.5 | -179.5 | -173.7 | -0.1 | 112.4 | Y36 A37 I38 H42 | Y36-R40 PolarHBondContact O-N 3.42Å; A37-R40 PolarHBondContact O-N 3.23Å; I38-R40 PolarHBondContact O-N 3.21Å; R40-H42 PolarHBondContact O-N 3.1Å |
| 41 | L | 70.6 | Confident | 83.8 | Confident | 13 Ų | 13 | 64.3 Ų | 64.3 | 7% | 0.068 | 31% | 0.307 | C | S | . | . | trans | -80 | 24.3 | -171.9 | -118.3 | 99 | 0 | 0 | 0 | 114.5 | Y36 Y39 K43 L44 F47 R114 L118 | Y36-L41 PolarHBondContact O-N 3.43Å; Y39-L41 VanDerWaalsContact C-N 3.25Å; Y39-L41 PolarHBondContact O-N 3.14Å; L41-K43 PolarHBondContact O-N 3.37Å; L41-L44 HydrophobicContact CD2-CB 3.75Å; L41-L44 HydrophobicContact CD2-CD1 3.73Å; L41-L44 HydrophobicContact CD2-CG 4.39Å; L41-L44 HydrophobicContact CG-CB 4.32Å; L41-L44 HydrophobicContact CG-CD1 4.02Å; L41-L44 PolarHBondContact O-N 2.97Å; L41-F47 HydrophobicContact CD2-CB 3.92Å; L41-F47 HydrophobicContact CD2-CD1 4.23Å; L41-F47 HydrophobicContact CD2-CD2 3.75Å; L41-F47 HydrophobicContact CD2-CE2 4.46Å; L41-F47 HydrophobicContact CD2-CG 3.64Å; L41-R114 HydrophobicContact CD1-CB 3.81Å; L41-L118 HydrophobicContact CD2-CD2 4.07Å | ||
| 42 | H | 67.3 | Low | 83.9 | Confident | 165 Ų | 165 | 68 Ų | 68 | 76% | 0.764 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | -24.5 | -175.5 | -63.9 | 94.8 | 0 | 0 | 0 | 114.3 | R40 | R40-H42 PolarHBondContact O-N 3.1Š|
| 43 | K | 67.8 | Low | 84.1 | Confident | 174 Ų | 174 | 70.1 Ų | 70.1 | 76% | 0.757 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -4.5 | -179.6 | -62.6 | -168.1 | 176.2 | -170.1 | 0 | 114.8 | L41 | L41-K43 PolarHBondContact O-N 3.37Š|
| 44 | L | 75.6 | Confident | 84.4 | Confident | 27 Ų | 27 | 67.3 Ų | 67.3 | 14% | 0.141 | 31% | 0.309 | C | S | . | . | trans | -127.1 | 77.6 | -172.6 | -73.2 | 164.5 | 0 | 0 | 0 | 110.4 | L41 W46 F47 V108 Y111 Q115 | L41-L44 HydrophobicContact CD2-CB 3.75Å; L41-L44 HydrophobicContact CD2-CD1 3.73Å; L41-L44 HydrophobicContact CD2-CG 4.39Å; L41-L44 HydrophobicContact CG-CB 4.32Å; L41-L44 HydrophobicContact CG-CD1 4.02Å; L41-L44 PolarHBondContact O-N 2.97Å; L44-W46 VanDerWaalsContact C-N 3.26Å; L44-W46 PolarHBondContact O-N 3.07Å; L44-F47 HydrophobicContact CB-CD2 3.96Å; L44-F47 PolarHBondContact O-N 2.92Å; L44-V108 HydrophobicContact CD2-CB 4.49Å; L44-V108 HydrophobicContact CD2-CG2 3.85Å; L44-Y111 HydrophobicContact CD1-CG 4.22Å; L44-Q115 HydrophobicContact CD1-CG 4.46Å | ||
| 45 | P | 71.4 | Confident | 84.7 | Confident | 86 Ų | 86 | 66.7 Ų | 66.7 | 56% | 0.558 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -30.8 | -172.5 | 25.1 | -34.4 | 0 | 0 | 0 | 113.3 | F47 R48 | P45-F47 PolarHBondContact O-N 3.41Å; P45-F47 VanDerWaalsContact O-N 3.16Å; P45-R48 PolarHBondContact O-N 3.42Å; P45-R48 VanDerWaalsContact O-N 3.15Å |
| 46 | W | 78.3 | Confident | 85 | Confident | 165 Ų | 165 | 72.3 Ų | 72.3 | 63% | 0.625 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -60.6 | -25.7 | -177.5 | -65.7 | 111.9 | 0 | 0 | 0 | 114.3 | L44 R48 S49 L50 W102 | L44-W46 VanDerWaalsContact C-N 3.26Å; L44-W46 PolarHBondContact O-N 3.07Å; W46-R48 VanDerWaalsContact C-N 3.28Å; W46-R48 PolarHBondContact O-N 3.28Å; W46-S49 PolarHBondContact O-N 3.45Å; W46-L50 WeakPolarHBondContact O-CB 3.49Å; W46-L50 PolarHBondContact O-N 3.44Å; W46-W102 AromaticContact CE3-CZ2 3.82Å; W46-W102 HydrophobicContact CE3-CZ2 3.82Å; W46-W102 HydrophobicContact CZ3-CZ2 4.15Å |
| 47 | F | 80.1 | Confident | 85.4 | Confident | 4 Ų | 4 | 71.1 Ų | 71.1 | 2% | 0.018 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.6 | -32.3 | 178.7 | -87.7 | -91.1 | 0 | 0 | 0 | 113.1 | Y36 L41 L44 P45 L50 S51 F103 S106 Q115 L118 | Y36-F47 HydrophobicContact CE1-CB 4.08Å; Y36-F47 VanDerWaalsContact OH-C 3.31Å; Y36-F47 PolarHBondContact OH-O 2.87Å; L41-F47 HydrophobicContact CD2-CB 3.92Å; L41-F47 HydrophobicContact CD2-CD1 4.23Å; L41-F47 HydrophobicContact CD2-CD2 3.75Å; L41-F47 HydrophobicContact CD2-CE2 4.46Å; L41-F47 HydrophobicContact CD2-CG 3.64Å; L44-F47 HydrophobicContact CB-CD2 3.96Å; L44-F47 PolarHBondContact O-N 2.92Å; P45-F47 PolarHBondContact O-N 3.41Å; P45-F47 VanDerWaalsContact O-N 3.16Å; F47-L50 HydrophobicContact CD1-CD2 4.46Å; F47-L50 HydrophobicContact CE1-CD2 4.35Å; F47-L50 PolarHBondContact O-N 3.35Å; F47-S51 PolarHBondContact O-N 3.04Å; F47-S51 VanDerWaalsContact O-N 3.08Å; F47-S51 PolarHBondContact O-OG 3.27Å; F47-S51 VanDerWaalsContact O-OG 3.09Å; F47-F103 AromaticContact CE1-CD2 3.89Å; F47-F103 HydrophobicContact CE1-CD2 3.89Å; F47-F103 AromaticContact CE1-CE2 3.73Å; F47-F103 HydrophobicContact CE1-CE2 3.73Å; F47-F103 HydrophobicContact CZ-CD2 4.09Å; F47-F103 AromaticContact CZ-CE2 3.97Å; F47-F103 HydrophobicContact CZ-CE2 3.97Å; F47-S106 WeakPolarHBondContact CZ-OG 3.5Å; F47-Q115 HydrophobicContact CE1-CB 3.97Å; F47-Q115 HydrophobicContact CE1-CG 4.11Å; F47-Q115 HydrophobicContact CE2-CG 3.87Å; F47-Q115 HydrophobicContact CZ-CB 3.68Å; F47-Q115 HydrophobicContact CZ-CG 3.46Å; F47-Q115 VanDerWaalsContact CZ-CG 3.46Å; F47-L118 HydrophobicContact CB-CD2 3.89Å; F47-L118 HydrophobicContact CD1-CD2 3.57Å; F47-L118 HydrophobicContact CD1-CG 4.48Å; F47-L118 HydrophobicContact CG-CD2 4.02Å |
| 48 | R | 85.6 | Confident | 85.8 | Confident | 160 Ų | 160 | 69 Ų | 69 | 60% | 0.604 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -60.7 | -52.7 | 174.4 | -66.6 | -175.8 | 69.5 | 175.7 | -0.6 | 110.3 | Y36 P45 W46 L50 S51 W52 | Y36-R48 HydrophobicContact CD1-CG 4.34Å; Y36-R48 HydrophobicContact CD2-CG 4.22Å; Y36-R48 HydrophobicContact CE1-CG 3.91Å; Y36-R48 HydrophobicContact CE2-CB 4.44Å; Y36-R48 HydrophobicContact CE2-CG 3.76Å; Y36-R48 WeakPolarHBondContact OH-CA 3.39Å; Y36-R48 PolarHBondContact OH-N 3Å; P45-R48 PolarHBondContact O-N 3.42Å; P45-R48 VanDerWaalsContact O-N 3.15Å; W46-R48 VanDerWaalsContact C-N 3.28Å; W46-R48 PolarHBondContact O-N 3.28Å; R48-L50 VanDerWaalsContact C-N 3.32Å; R48-L50 PolarHBondContact O-N 3.32Å; R48-S51 PolarHBondContact O-N 3Å; R48-W52 PolarHBondContact O-N 2.95Å |
| 49 | S | 90.6 | Very high | 86.2 | Confident | 58 Ų | 58 | 67 Ų | 67 | 41% | 0.406 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.4 | -41.9 | 178.6 | -51 | 0 | 0 | 0 | 0 | 112 | W46 S51 W52 Y53 | W46-S49 PolarHBondContact O-N 3.45Å; S49-S51 VanDerWaalsContact C-N 3.34Å; S49-S51 PolarHBondContact O-N 3.37Å; S49-W52 PolarHBondContact O-N 3.3Å; S49-Y53 WeakPolarHBondContact O-CB 3.21Å; S49-Y53 PolarHBondContact O-N 2.93Å |
| 50 | L | 93.2 | Very high | 86.8 | Confident | 5 Ų | 5 | 67.5 Ų | 67.5 | 3% | 0.026 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.7 | -39.6 | 179.1 | -175.6 | 68.5 | 0 | 0 | 0 | 112.7 | W46 F47 R48 Y53 F54 W102 F103 | W46-L50 WeakPolarHBondContact O-CB 3.49Å; W46-L50 PolarHBondContact O-N 3.44Å; F47-L50 HydrophobicContact CD1-CD2 4.46Å; F47-L50 HydrophobicContact CE1-CD2 4.35Å; F47-L50 PolarHBondContact O-N 3.35Å; R48-L50 VanDerWaalsContact C-N 3.32Å; R48-L50 PolarHBondContact O-N 3.32Å; L50-Y53 WeakPolarHBondContact O-CB 3.42Å; L50-Y53 PolarHBondContact O-N 2.51Å; L50-F54 HydrophobicContact CD1-CD2 4.26Å; L50-F54 HydrophobicContact CD1-CE2 3.73Å; L50-F54 HydrophobicContact CD1-CZ 4.47Å; L50-F54 HydrophobicContact CD2-CE2 4.3Å; L50-F54 HydrophobicContact CG-CD2 4.07Å; L50-F54 HydrophobicContact CG-CE2 3.77Å; L50-F54 VanDerWaalsContact O-CD2 3.22Å; L50-F54 WeakPolarHBondContact O-CD2 3.45Å; L50-F54 PolarHBondContact O-N 2.76Å; L50-W102 HydrophobicContact CD1-CB 4.19Å; L50-W102 HydrophobicContact CD1-CD2 3.94Å; L50-W102 HydrophobicContact CD1-CE3 3.94Å; L50-W102 HydrophobicContact CD1-CG 4.07Å; L50-F103 HydrophobicContact CD2-CB 3.78Å; L50-F103 HydrophobicContact CD2-CD2 3.79Å; L50-F103 HydrophobicContact CD2-CG 4.24Å |
| 51 | S | 94.3 | Very high | 87.5 | Confident | 3 Ų | 3 | 62.4 Ų | 62.4 | 2% | 0.021 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -68 | -40 | 177.6 | -58.9 | 0 | 0 | 0 | 0 | 112.4 | F28 Y36 F47 R48 S49 Y53 F54 L55 T122 | F28-S51 WeakPolarHBondContact CZ-O 3.43Å; Y36-S51 VanDerWaalsContact OH-CB 3.24Å; Y36-S51 WeakPolarHBondContact OH-CB 3.35Å; Y36-S51 PolarHBondContact OH-OG 3.37Å; F47-S51 PolarHBondContact O-N 3.04Å; F47-S51 VanDerWaalsContact O-N 3.08Å; F47-S51 PolarHBondContact O-OG 3.27Å; F47-S51 VanDerWaalsContact O-OG 3.09Å; R48-S51 PolarHBondContact O-N 3Å; S49-S51 VanDerWaalsContact C-N 3.34Å; S49-S51 PolarHBondContact O-N 3.37Å; S51-Y53 VanDerWaalsContact C-N 3.32Å; S51-F54 PolarHBondContact O-N 3.5Å; S51-L55 PolarHBondContact O-N 2.79Å; S51-T122 WeakPolarHBondContact OG-CG2 3.45Å |
| 52 | W | 95.1 | Very high | 88.6 | Confident | 89 Ų | 89 | 63.9 Ų | 63.9 | 34% | 0.337 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -66.2 | -35.1 | 173.1 | -76.9 | 105.8 | 0 | 0 | 0 | 112.1 | I25 Q29 R48 S49 L55 I56 | I25-W52 HydrophobicContact CG2-CH2 4.06Å; I25-W52 HydrophobicContact CG2-CZ3 3.94Å; Q29-W52 HydrophobicContact CB-CH2 4.22Å; Q29-W52 HydrophobicContact CB-CZ2 4.21Å; Q29-W52 HydrophobicContact CG-CZ2 4.16Å; R48-W52 PolarHBondContact O-N 2.95Å; S49-W52 PolarHBondContact O-N 3.3Å; W52-L55 HydrophobicContact CE3-CD2 3.53Å; W52-L55 HydrophobicContact CZ3-CD2 3.47Å; W52-L55 VanDerWaalsContact CZ3-CD2 3.47Å; W52-L55 WeakPolarHBondContact O-CB 3.38Å; W52-L55 PolarHBondContact O-N 3.11Å; W52-I56 WeakPolarHBondContact O-CG1 3.29Å; W52-I56 PolarHBondContact O-N 3.27Å |
| 53 | Y | 97 | Very high | 89.7 | Confident | 49 Ų | 49 | 57.2 Ų | 57.2 | 19% | 0.192 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.7 | -48.7 | 173.5 | 179 | -86.6 | 0 | 0 | 0 | 111.7 | S49 L50 S51 L55 I56 T57 L95 T98 G99 W102 | S49-Y53 WeakPolarHBondContact O-CB 3.21Å; S49-Y53 PolarHBondContact O-N 2.93Å; L50-Y53 WeakPolarHBondContact O-CB 3.42Å; L50-Y53 PolarHBondContact O-N 2.51Å; S51-Y53 VanDerWaalsContact C-N 3.32Å; Y53-L55 VanDerWaalsContact C-N 3.3Å; Y53-L55 PolarHBondContact O-N 3.38Å; Y53-I56 PolarHBondContact O-N 3.22Å; Y53-T57 WeakPolarHBondContact CE1-OG1 3.32Å; Y53-T57 WeakPolarHBondContact O-CB 3.44Å; Y53-T57 PolarHBondContact O-N 2.89Å; Y53-T57 PolarHBondContact O-OG1 2.91Å; Y53-L95 WeakPolarHBondContact CE1-O 3.28Å; Y53-L95 WeakPolarHBondContact OH-CA 3.46Å; Y53-L95 WeakPolarHBondContact OH-CD2 3.21Å; Y53-L95 PolarHBondContact OH-O 3.48Å; Y53-T98 PolarHBondContact OH-OG1 3.36Å; Y53-G99 VanDerWaalsContact CE1-CA 3.45Å; Y53-W102 HydrophobicContact CD2-CE3 4.47Å; Y53-W102 HydrophobicContact CD2-CZ3 4.05Å; Y53-W102 HydrophobicContact CG-CE3 4.35Å; Y53-W102 HydrophobicContact CG-CZ3 4.12Å |
| 54 | F | 97.3 | Very high | 90.7 | Very high | 1 Ų | 1 | 49.7 Ų | 49.7 | 0% | 0.004 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.8 | -31.5 | 176.4 | -76.1 | -65.1 | 0 | 0 | 0 | 112.8 | L50 S51 S58 Y96 G99 F119 L126 | L50-F54 HydrophobicContact CD1-CD2 4.26Å; L50-F54 HydrophobicContact CD1-CE2 3.73Å; L50-F54 HydrophobicContact CD1-CZ 4.47Å; L50-F54 HydrophobicContact CD2-CE2 4.3Å; L50-F54 HydrophobicContact CG-CD2 4.07Å; L50-F54 HydrophobicContact CG-CE2 3.77Å; L50-F54 VanDerWaalsContact O-CD2 3.22Å; L50-F54 WeakPolarHBondContact O-CD2 3.45Å; L50-F54 PolarHBondContact O-N 2.76Å; S51-F54 PolarHBondContact O-N 3.5Å; F54-S58 VanDerWaalsContact O-CB 3.26Å; F54-S58 WeakPolarHBondContact O-CB 3.37Å; F54-S58 PolarHBondContact O-N 3.46Å; F54-S58 PolarHBondContact O-OG 2.9Å; F54-Y96 HydrophobicContact CD1-CD2 4.1Å; F54-Y96 HydrophobicContact CD1-CE2 4.07Å; F54-Y96 AromaticContact CE1-CD2 3.9Å; F54-Y96 HydrophobicContact CE1-CD2 3.9Å; F54-Y96 AromaticContact CE1-CE2 3.76Å; F54-Y96 HydrophobicContact CE1-CE2 3.76Å; F54-G99 VanDerWaalsContact CZ-C 3.43Å; F54-F119 HydrophobicContact CE2-CD2 4.28Å; F54-F119 AromaticContact CE2-CE2 3.74Å; F54-F119 HydrophobicContact CE2-CE2 3.74Å; F54-F119 AromaticContact CZ-CE2 3.75Å; F54-F119 HydrophobicContact CZ-CE2 3.75Å; F54-F119 HydrophobicContact CZ-CZ 4.39Å; F54-L126 HydrophobicContact CB-CD1 3.66Å |
| 55 | L | 97.2 | Very high | 91.3 | Very high | 3 Ų | 3 | 50.1 Ų | 50.1 | 2% | 0.016 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61 | -51.5 | 171.9 | -175.2 | 70.9 | 0 | 0 | 0 | 111.6 | I25 F28 S51 W52 Y53 T57 S58 N59 L126 V130 | I25-L55 HydrophobicContact CG1-CD2 4.48Å; F28-L55 HydrophobicContact CB-CD1 4.03Å; F28-L55 HydrophobicContact CD1-CB 4.27Å; F28-L55 HydrophobicContact CD1-CD1 3.77Å; F28-L55 HydrophobicContact CD1-CD2 3.58Å; F28-L55 HydrophobicContact CD1-CG 4.07Å; F28-L55 HydrophobicContact CD2-CD1 3.7Å; F28-L55 HydrophobicContact CE1-CB 3.8Å; F28-L55 HydrophobicContact CE1-CD1 4.05Å; F28-L55 HydrophobicContact CE1-CD2 3.89Å; F28-L55 HydrophobicContact CE1-CG 4.13Å; F28-L55 HydrophobicContact CE2-CD1 4.02Å; F28-L55 HydrophobicContact CG-CD1 3.55Å; F28-L55 HydrophobicContact CG-CD2 4.16Å; F28-L55 HydrophobicContact CG-CG 4.36Å; F28-L55 HydrophobicContact CZ-CB 3.93Å; F28-L55 HydrophobicContact CZ-CD1 4.16Å; F28-L55 HydrophobicContact CZ-CG 4.49Å; S51-L55 PolarHBondContact O-N 2.79Å; W52-L55 HydrophobicContact CE3-CD2 3.53Å; W52-L55 HydrophobicContact CZ3-CD2 3.47Å; W52-L55 VanDerWaalsContact CZ3-CD2 3.47Å; W52-L55 WeakPolarHBondContact O-CB 3.38Å; W52-L55 PolarHBondContact O-N 3.11Å; Y53-L55 VanDerWaalsContact C-N 3.3Å; Y53-L55 PolarHBondContact O-N 3.38Å; L55-T57 VanDerWaalsContact C-N 3.34Å; L55-T57 PolarHBondContact O-N 3.46Å; L55-S58 PolarHBondContact O-N 3.15Å; L55-N59 WeakPolarHBondContact O-CB 3.46Å; L55-N59 PolarHBondContact O-N 2.9Å; L55-L126 HydrophobicContact CB-CD2 4.25Å; L55-L126 HydrophobicContact CD1-CD2 3.76Å; L55-V130 HydrophobicContact CD1-CG2 3.97Å |
| 56 | I | 96.8 | Very high | 92 | Very high | 117 Ų | 117 | 46 Ų | 46 | 60% | 0.6 | 21% | 0.208 | S | C | * | . | H | α-helix | trans | -61.8 | -45.4 | 180 | -67.4 | 166.4 | 0 | 0 | 0 | 110.1 | W52 Y53 S58 N59 Y60 | W52-I56 WeakPolarHBondContact O-CG1 3.29Å; W52-I56 PolarHBondContact O-N 3.27Å; Y53-I56 PolarHBondContact O-N 3.22Å; I56-S58 PolarHBondContact O-N 3.08Å; I56-N59 PolarHBondContact O-N 2.73Å; I56-Y60 WeakPolarHBondContact O-CB 3.45Å; I56-Y60 PolarHBondContact O-N 3.32Å |
| 57 | T | 96.8 | Very high | 92.2 | Very high | 6 Ų | 6 | 40.3 Ų | 40.3 | 4% | 0.037 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.3 | -44.6 | 178.6 | -58.2 | 0 | 0 | 0 | 0 | 111.9 | Y53 L55 Y60 F61 L95 | Y53-T57 WeakPolarHBondContact CE1-OG1 3.32Å; Y53-T57 WeakPolarHBondContact O-CB 3.44Å; Y53-T57 PolarHBondContact O-N 2.89Å; Y53-T57 PolarHBondContact O-OG1 2.91Å; L55-T57 VanDerWaalsContact C-N 3.34Å; L55-T57 PolarHBondContact O-N 3.46Å; T57-Y60 PolarHBondContact O-N 3.18Å; T57-F61 PolarHBondContact O-N 2.85Å; T57-L95 HydrophobicContact CG2-CB 3.64Å |
| 58 | S | 96.8 | Very high | 92.3 | Very high | 19 Ų | 19 | 41.8 Ų | 41.8 | 13% | 0.133 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.1 | -42.7 | 178 | -56.2 | 0 | 0 | 0 | 0 | 111.4 | F54 L55 I56 F61 F62 | F54-S58 VanDerWaalsContact O-CB 3.26Å; F54-S58 WeakPolarHBondContact O-CB 3.37Å; F54-S58 PolarHBondContact O-N 3.46Å; F54-S58 PolarHBondContact O-OG 2.9Å; L55-S58 PolarHBondContact O-N 3.15Å; I56-S58 PolarHBondContact O-N 3.08Å; S58-F61 PolarHBondContact O-N 2.85Å; S58-F62 VanDerWaalsContact O-CD2 3.25Å; S58-F62 WeakPolarHBondContact O-CD2 3.45Å; S58-F62 PolarHBondContact O-N 3.41Å |
| 59 | N | 96.1 | Very high | 91.8 | Very high | 20 Ų | 20 | 39.5 Ų | 39.5 | 11% | 0.107 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.1 | -43.2 | 175.6 | -85.1 | -15.2 | 0 | 0 | 0 | 111.1 | Q24 L55 I56 F61 Y63 V130 | Q24-N59 PolarHBondContact NE2-ND2 3.49Å; Q24-N59 PolarHBondContact NE2-OD1 3.16Å; Q24-N59 PolarHBondContact OE1-ND2 3.12Å; Q24-N59 PolarHBondContact OE1-OD1 3.14Å; L55-N59 WeakPolarHBondContact O-CB 3.46Å; L55-N59 PolarHBondContact O-N 2.9Å; I56-N59 PolarHBondContact O-N 2.73Å; N59-F61 PolarHBondContact O-N 2.94Å; N59-Y63 HydrophobicContact CB-CD2 4.17Å; N59-Y63 HydrophobicContact CB-CE2 4.45Å; N59-Y63 WeakPolarHBondContact O-CA 3.18Å; N59-Y63 WeakPolarHBondContact O-CB 2.92Å; N59-Y63 VanDerWaalsContact O-CD2 3.31Å; N59-Y63 WeakPolarHBondContact O-CD2 3.41Å; N59-Y63 PolarHBondContact O-N 3.44Å; N59-Y63 VanDerWaalsContact OD1-CE2 3.22Å; N59-Y63 WeakPolarHBondContact OD1-CE2 3.4Å; N59-V130 WeakPolarHBondContact OD1-CG1 3.32Å |
| 60 | Y | 94.9 | Very high | 91 | Very high | 63 Ų | 63 | 41.2 Ų | 41.2 | 25% | 0.247 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -55.2 | -54 | 173.6 | 177.5 | -104.3 | 0 | 0 | 0 | 110.4 | I56 T57 G64 H88 I91 S92 L95 | I56-Y60 WeakPolarHBondContact O-CB 3.45Å; I56-Y60 PolarHBondContact O-N 3.32Å; T57-Y60 PolarHBondContact O-N 3.18Å; Y60-G64 VanDerWaalsContact O-CA 3.28Å; Y60-G64 WeakPolarHBondContact O-CA 3.5Å; Y60-G64 PolarHBondContact O-N 3.16Å; Y60-H88 AromaticContact CD1-CE1 3.86Å; Y60-H88 AromaticContact CE1-CE1 3.67Å; Y60-H88 AromaticContact CE1-ND1 3.45Å; Y60-H88 WeakPolarHBondContact CE1-ND1 3.25Å; Y60-H88 AromaticContact CZ-CE1 3.93Å; Y60-H88 AromaticContact CZ-ND1 3.4Å; Y60-H88 PolarHBondContact O-CE1 2.76Å; Y60-I91 HydrophobicContact CE1-CB 4.09Å; Y60-I91 HydrophobicContact CE1-CG2 3.68Å; Y60-S92 WeakPolarHBondContact CD1-OG 3.4Å; Y60-S92 VanDerWaalsContact CE1-OG 3.26Å; Y60-S92 WeakPolarHBondContact CE1-OG 3.34Å; Y60-L95 HydrophobicContact CD1-CD1 3.93Å; Y60-L95 HydrophobicContact CE1-CD1 4.27Å; Y60-L95 HydrophobicContact CG-CD1 4.5Å |
| 61 | F | 95.3 | Very high | 90.3 | Very high | 83 Ų | 83 | 44.9 Ų | 44.9 | 36% | 0.364 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -55.7 | -58.3 | -179.9 | 178.3 | -106.7 | 0 | 0 | 0 | 113 | T57 S58 N59 E65 H88 | T57-F61 PolarHBondContact O-N 2.85Å; S58-F61 PolarHBondContact O-N 2.85Å; N59-F61 PolarHBondContact O-N 2.94Å; F61-E65 WeakPolarHBondContact O-CG 3.31Å; F61-E65 PolarHBondContact O-N 3.15Å; F61-E65 VanDerWaalsContact O-N 3.1Å; F61-H88 PolarHBondContact O-NE2 3.27Å |
| 62 | F | 93.6 | Very high | 89.3 | Confident | 45 Ų | 45 | 46.3 Ų | 46.3 | 20% | 0.197 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -72.1 | -45.4 | -173.2 | -75.1 | -67.9 | 0 | 0 | 0 | 113 | S58 A66 V130 F131 Y134 | S58-F62 VanDerWaalsContact O-CD2 3.25Å; S58-F62 WeakPolarHBondContact O-CD2 3.45Å; S58-F62 PolarHBondContact O-N 3.41Å; F62-A66 PolarHBondContact O-N 2.97Å; F62-A66 VanDerWaalsContact O-N 3.07Å; F62-V130 HydrophobicContact CB-CG1 4.41Å; F62-V130 HydrophobicContact CD2-CB 4.49Å; F62-V130 HydrophobicContact CD2-CG1 3.55Å; F62-V130 HydrophobicContact CE2-CG1 4.22Å; F62-V130 HydrophobicContact CG-CG1 4.31Å; F62-F131 AromaticContact CE1-CD2 3.77Å; F62-F131 HydrophobicContact CE1-CD2 3.77Å; F62-F131 HydrophobicContact CE1-CE2 4.42Å; F62-F131 HydrophobicContact CZ-CD2 4.09Å; F62-Y134 HydrophobicContact CB-CD2 3.89Å; F62-Y134 HydrophobicContact CB-CG 4.01Å; F62-Y134 AromaticContact CD1-CD1 3.97Å; F62-Y134 HydrophobicContact CD1-CD1 3.97Å; F62-Y134 HydrophobicContact CD1-CD2 4.25Å; F62-Y134 HydrophobicContact CD1-CE1 4.43Å; F62-Y134 AromaticContact CD1-CG 3.88Å; F62-Y134 HydrophobicContact CD1-CG 3.88Å; F62-Y134 HydrophobicContact CG-CG 4.3Å; F62-Y134 WeakPolarHBondContact O-CD2 3.19Å; F62-Y134 VanDerWaalsContact O-CE2 3.24Å; F62-Y134 WeakPolarHBondContact O-CE2 3.44Å |
| 63 | Y | 90.3 | Very high | 88.1 | Confident | 25 Ų | 25 | 48.4 Ų | 48.4 | 10% | 0.098 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -73 | -33.9 | -179.8 | -70.7 | -117.9 | 0 | 0 | 0 | 110.6 | L21 N59 A66 M67 S133 I137 | L21-Y63 HydrophobicContact CB-CE1 4.08Å; L21-Y63 HydrophobicContact CD1-CD1 4.23Å; L21-Y63 HydrophobicContact CD1-CE1 3.49Å; L21-Y63 VanDerWaalsContact CD1-CE1 3.49Å; L21-Y63 HydrophobicContact CD1-CE2 4.15Å; L21-Y63 VanDerWaalsContact CD1-CZ 3.47Å; L21-Y63 HydrophobicContact CG-CE1 4.27Å; N59-Y63 HydrophobicContact CB-CD2 4.17Å; N59-Y63 HydrophobicContact CB-CE2 4.45Å; N59-Y63 WeakPolarHBondContact O-CA 3.18Å; N59-Y63 WeakPolarHBondContact O-CB 2.92Å; N59-Y63 VanDerWaalsContact O-CD2 3.31Å; N59-Y63 WeakPolarHBondContact O-CD2 3.41Å; N59-Y63 PolarHBondContact O-N 3.44Å; N59-Y63 VanDerWaalsContact OD1-CE2 3.22Å; N59-Y63 WeakPolarHBondContact OD1-CE2 3.4Å; Y63-A66 PolarHBondContact O-N 3.48Å; Y63-M67 WeakPolarHBondContact O-CB 3.15Å; Y63-M67 WeakPolarHBondContact O-CG 3.45Å; Y63-M67 PolarHBondContact O-N 3.06Å; Y63-S133 WeakPolarHBondContact OH-CB 3.36Å; Y63-S133 PolarHBondContact OH-OG 3Å; Y63-I137 HydrophobicContact CD1-CD1 3.72Å; Y63-I137 HydrophobicContact CE1-CD1 3.03Å; Y63-I137 HydrophobicContact CE2-CD1 4.4Å; Y63-I137 VanDerWaalsContact CZ-CD1 3.42Å |
| 64 | G | 89 | Confident | 87.1 | Confident | 16 Ų | 16 | 53 Ų | 53 | 17% | 0.165 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58.5 | -52 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y60 A66 M67 I68 | Y60-G64 VanDerWaalsContact O-CA 3.28Å; Y60-G64 WeakPolarHBondContact O-CA 3.5Å; Y60-G64 PolarHBondContact O-N 3.16Å; G64-A66 VanDerWaalsContact C-N 3.28Å; G64-A66 PolarHBondContact O-N 3.39Å; G64-M67 PolarHBondContact O-N 3.34Å; G64-M67 VanDerWaalsContact O-N 3.15Å; G64-I68 WeakPolarHBondContact O-CB 3.33Å; G64-I68 WeakPolarHBondContact O-CD1 3.11Å; G64-I68 WeakPolarHBondContact O-CG1 3.39Å; G64-I68 PolarHBondContact O-N 3.24Å |
| 65 | E | 87.3 | Confident | 85.9 | Confident | 35 Ų | 35 | 54.4 Ų | 54.4 | 16% | 0.164 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58 | -41.5 | 175.8 | -72.6 | -75.6 | 144.2 | 0 | 0 | 111.4 | F61 H88 R89 | F61-E65 WeakPolarHBondContact O-CG 3.31Å; F61-E65 PolarHBondContact O-N 3.15Å; F61-E65 VanDerWaalsContact O-N 3.1Å; E65-H88 PolarHBondContact N-NE2 3.41Å; E65-H88 IonicContact OE1-CD2 2.67Å; E65-H88 PolarHBondContact OE1-CD2 2.91Å; E65-R89 WeakPolarHBondContact OE1-CG 3.49Å; E65-R89 IonicContact OE1-CZ 2.91Å; E65-R89 IonicContact OE1-NE 3.7Å; E65-R89 PolarHBondContact OE1-NE 3.41Å; E65-R89 IonicContact OE1-NH2 3.08Å; E65-R89 IonicContact OE2-CZ 2.76Å; E65-R89 IonicContact OE2-NE 3.63Å; E65-R89 IonicContact OE2-NH2 3.68Å; E65-R89 PolarHBondContact OE2-NH2 2.99Å |
| 66 | A | 85.9 | Confident | 84.6 | Confident | 0 Ų | 0 | 61.1 Ų | 61.1 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.1 | -46 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F62 Y63 G64 Y70 Y134 I137 F141 | F62-A66 PolarHBondContact O-N 2.97Å; F62-A66 VanDerWaalsContact O-N 3.07Å; Y63-A66 PolarHBondContact O-N 3.48Å; G64-A66 VanDerWaalsContact C-N 3.28Å; G64-A66 PolarHBondContact O-N 3.39Å; A66-Y70 VanDerWaalsContact O-CD2 3.23Å; A66-Y70 WeakPolarHBondContact O-CD2 3.3Å; A66-Y134 HydrophobicContact CB-CD2 4.05Å; A66-Y134 HydrophobicContact CB-CE2 3.83Å; A66-I137 HydrophobicContact CB-CG2 4.34Å; A66-F141 HydrophobicContact CB-CE2 4.3Å |
| 67 | M | 82.2 | Confident | 83.8 | Confident | 45 Ų | 45 | 66.3 Ų | 66.3 | 22% | 0.222 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -74.7 | -31.6 | -174.8 | -66.2 | -58.4 | 125 | 0 | 0 | 113.1 | I17 Y63 G64 D69 Y70 F71 I137 F141 | I17-M67 HydrophobicContact CD1-CE 4.36Å; I17-M67 HydrophobicContact CG2-CE 4.19Å; Y63-M67 WeakPolarHBondContact O-CB 3.15Å; Y63-M67 WeakPolarHBondContact O-CG 3.45Å; Y63-M67 PolarHBondContact O-N 3.06Å; G64-M67 PolarHBondContact O-N 3.34Å; G64-M67 VanDerWaalsContact O-N 3.15Å; M67-D69 VanDerWaalsContact C-N 3.29Å; M67-D69 PolarHBondContact O-N 2.83Å; M67-Y70 PolarHBondContact O-N 2.94Å; M67-F71 HydrophobicContact CB-CD2 4.29Å; M67-F71 WeakPolarHBondContact O-CB 3.47Å; M67-F71 PolarHBondContact O-N 2.91Å; M67-F71 HydrophobicContact SD-CD2 3.82Å; M67-F71 HydrophobicContact SD-CE2 3.63Å; M67-I137 HydrophobicContact CE-CG2 4.03Å; M67-F141 HydrophobicContact CE-CE2 3.5Å; M67-F141 VanDerWaalsContact CE-CE2 3.5Å; M67-F141 HydrophobicContact CE-CZ 3.35Å; M67-F141 HydrophobicContact SD-CE2 4.39Å; M67-F141 HydrophobicContact SD-CZ 3.77Å |
| 68 | I | 83.8 | Confident | 83.1 | Confident | 36 Ų | 36 | 69.7 Ų | 69.7 | 19% | 0.185 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.2 | -43.3 | -177.5 | -74.2 | 165.1 | 0 | 0 | 0 | 110.8 | G64 A72 V85 H88 | G64-I68 WeakPolarHBondContact O-CB 3.33Å; G64-I68 WeakPolarHBondContact O-CD1 3.11Å; G64-I68 WeakPolarHBondContact O-CG1 3.39Å; G64-I68 PolarHBondContact O-N 3.24Å; I68-A72 WeakPolarHBondContact O-CA 3.38Å; I68-A72 VanDerWaalsContact O-CB 3.27Å; I68-A72 WeakPolarHBondContact O-CB 3.07Å; I68-A72 PolarHBondContact O-N 3.09Å; I68-A72 VanDerWaalsContact O-N 3.08Å; I68-V85 HydrophobicContact CB-CG1 4.45Å; I68-V85 HydrophobicContact CD1-CG1 4.11Å; I68-V85 HydrophobicContact CG1-CB 4.37Å; I68-V85 HydrophobicContact CG1-CG1 3.85Å; I68-V85 HydrophobicContact CG1-CG2 4.02Å; I68-V85 HydrophobicContact CG2-CG1 3.81Å; I68-H88 HydrophobicContact CD1-CB 3.69Å |
| 69 | D | 73.5 | Confident | 82.6 | Confident | 111 Ų | 111 | 74.5 Ų | 74.5 | 59% | 0.594 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -66 | -39.4 | -179 | -73.7 | -16.2 | 0 | 0 | 0 | 112.5 | M67 | M67-D69 VanDerWaalsContact C-N 3.29Å; M67-D69 PolarHBondContact O-N 2.83Å |
| 70 | Y | 75.4 | Confident | 82.1 | Confident | 94 Ų | 94 | 80 Ų | 80 | 37% | 0.369 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -88.2 | -32.5 | -174.7 | -69.5 | -78.3 | 0 | 0 | 0 | 113.8 | A66 M67 F141 | A66-Y70 VanDerWaalsContact O-CD2 3.23Å; A66-Y70 WeakPolarHBondContact O-CD2 3.3Å; M67-Y70 PolarHBondContact O-N 2.94Å; Y70-F141 HydrophobicContact CD1-CB 4.17Å; Y70-F141 AromaticContact CD1-CD1 3.93Å; Y70-F141 HydrophobicContact CD1-CD1 3.93Å; Y70-F141 HydrophobicContact CD1-CE1 4.46Å; Y70-F141 HydrophobicContact CD1-CG 4.15Å; Y70-F141 HydrophobicContact CD2-CB 4.03Å; Y70-F141 AromaticContact CD2-CD1 3.81Å; Y70-F141 HydrophobicContact CD2-CD1 3.81Å; Y70-F141 AromaticContact CD2-CD2 3.47Å; Y70-F141 HydrophobicContact CD2-CD2 3.47Å; Y70-F141 VanDerWaalsContact CD2-CD2 3.47Å; Y70-F141 HydrophobicContact CD2-CE1 4Å; Y70-F141 AromaticContact CD2-CE2 3.66Å; Y70-F141 HydrophobicContact CD2-CE2 3.66Å; Y70-F141 AromaticContact CD2-CG 3.54Å; Y70-F141 HydrophobicContact CD2-CG 3.54Å; Y70-F141 AromaticContact CD2-CZ 3.91Å; Y70-F141 HydrophobicContact CD2-CZ 3.91Å; Y70-F141 HydrophobicContact CE1-CB 3.56Å; Y70-F141 HydrophobicContact CE1-CD1 4.2Å; Y70-F141 HydrophobicContact CE1-CG 4.01Å; Y70-F141 HydrophobicContact CE2-CB 3.42Å; Y70-F141 VanDerWaalsContact CE2-CB 3.42Å; Y70-F141 HydrophobicContact CE2-CD1 4.11Å; Y70-F141 AromaticContact CE2-CD2 3.38Å; Y70-F141 HydrophobicContact CE2-CD2 3.38Å; Y70-F141 HydrophobicContact CE2-CE2 4.03Å; Y70-F141 AromaticContact CE2-CG 3.42Å; Y70-F141 HydrophobicContact CE2-CG 3.42Å; Y70-F141 VanDerWaalsContact CE2-CG 3.42Å; Y70-F141 HydrophobicContact CG-CB 4.39Å; Y70-F141 AromaticContact CG-CD1 3.75Å; Y70-F141 HydrophobicContact CG-CD1 3.75Å; Y70-F141 HydrophobicContact CG-CD2 4.27Å; Y70-F141 AromaticContact CG-CE1 3.91Å; Y70-F141 HydrophobicContact CG-CE1 3.91Å; Y70-F141 HydrophobicContact CG-CE2 4.39Å; Y70-F141 AromaticContact CG-CG 3.94Å; Y70-F141 HydrophobicContact CG-CG 3.94Å; Y70-F141 HydrophobicContact CG-CZ 4.21Å; Y70-F141 AromaticContact CZ-CG 3.68Å; Y70-F141 VanDerWaalsContact OH-CB 3.25Å; Y70-F141 WeakPolarHBondContact OH-CB 3.44Å |
| 71 | F | 78.2 | Confident | 81.7 | Confident | 83 Ų | 83 | 79.6 Ų | 79.6 | 36% | 0.364 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -108.5 | 15.7 | -176.9 | -65 | -79.4 | 0 | 0 | 0 | 113 | M67 V73 F74 L75 F141 | M67-F71 HydrophobicContact CB-CD2 4.29Å; M67-F71 WeakPolarHBondContact O-CB 3.47Å; M67-F71 PolarHBondContact O-N 2.91Å; M67-F71 HydrophobicContact SD-CD2 3.82Å; M67-F71 HydrophobicContact SD-CE2 3.63Å; F71-V73 PolarHBondContact O-N 3.24Å; F71-V73 VanDerWaalsContact O-N 3.07Å; F71-F74 PolarHBondContact O-N 2.92Å; F71-L75 HydrophobicContact CB-CD1 3.93Å; F71-L75 HydrophobicContact CB-CG 4.1Å; F71-L75 WeakPolarHBondContact O-CG 3.3Å; F71-L75 PolarHBondContact O-N 3.38Å; F71-F141 HydrophobicContact CE2-CE1 4.25Å; F71-F141 HydrophobicContact CE2-CZ 4.25Å |
| 72 | A | 72.5 | Confident | 81.1 | Confident | 32 Ų | 32 | 80.8 Ų | 80.8 | 26% | 0.264 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -47.5 | -42 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | I68 K76 | I68-A72 WeakPolarHBondContact O-CA 3.38Å; I68-A72 VanDerWaalsContact O-CB 3.27Å; I68-A72 WeakPolarHBondContact O-CB 3.07Å; I68-A72 PolarHBondContact O-N 3.09Å; I68-A72 VanDerWaalsContact O-N 3.08Å; A72-K76 WeakPolarHBondContact O-CB 3.45Å; A72-K76 WeakPolarHBondContact O-CG 3.34Å; A72-K76 PolarHBondContact O-N 3.02Å; A72-K76 VanDerWaalsContact O-N 3.14Å |
| 73 | V | 70.8 | Confident | 80.9 | Confident | 134 Ų | 134 | 83.8 Ų | 83.8 | 81% | 0.812 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -66.7 | -43.6 | -179.4 | -178.6 | 0 | 0 | 0 | 0 | 111.5 | F71 | F71-V73 PolarHBondContact O-N 3.24Å; F71-V73 VanDerWaalsContact O-N 3.07Å |
| 74 | F | 76 | Confident | 80.9 | Confident | 144 Ų | 144 | 85 Ų | 85 | 63% | 0.632 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -70.9 | -43.5 | -180 | -176.2 | -96 | 0 | 0 | 0 | 111.4 | F71 K76 R77 | F71-F74 PolarHBondContact O-N 2.92Å; F74-K76 VanDerWaalsContact C-N 3.29Å; F74-K76 PolarHBondContact O-N 3.37Å; F74-R77 WeakPolarHBondContact O-CB 3.39Å; F74-R77 PolarHBondContact O-N 3.35Å |
| 75 | L | 72.2 | Confident | 80.8 | Confident | 31 Ų | 31 | 85.9 Ų | 85.9 | 16% | 0.162 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -69.4 | -25.3 | -176.8 | -66 | 168.4 | 0 | 0 | 0 | 113.1 | F71 R77 L81 V85 | F71-L75 HydrophobicContact CB-CD1 3.93Å; F71-L75 HydrophobicContact CB-CG 4.1Å; F71-L75 WeakPolarHBondContact O-CG 3.3Å; F71-L75 PolarHBondContact O-N 3.38Å; L75-R77 VanDerWaalsContact C-N 3.28Å; L75-R77 PolarHBondContact O-N 3.19Å; L75-L81 HydrophobicContact CD2-CB 4.43Å; L75-L81 HydrophobicContact CD2-CD1 4.18Å; L75-V85 HydrophobicContact CB-CG2 3.89Å; L75-V85 HydrophobicContact CD1-CG2 3.79Å; L75-V85 HydrophobicContact CG-CG2 4.28Å |
| 76 | K | 69.5 | Low | 80.8 | Confident | 145 Ų | 145 | 89.1 Ų | 89.1 | 63% | 0.63 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.5 | -12.7 | 176.8 | -80.7 | 179.1 | -178.6 | -174.7 | 0 | 114.3 | A72 F74 | A72-K76 WeakPolarHBondContact O-CB 3.45Å; A72-K76 WeakPolarHBondContact O-CG 3.34Å; A72-K76 PolarHBondContact O-N 3.02Å; A72-K76 VanDerWaalsContact O-N 3.14Å; F74-K76 VanDerWaalsContact C-N 3.29Å; F74-K76 PolarHBondContact O-N 3.37Å |
| 77 | R | 79 | Confident | 81.1 | Confident | 225 Ų | 225 | 93 Ų | 93 | 85% | 0.849 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.5 | -28.8 | -176.2 | -169.8 | 174.7 | -178.7 | 176.9 | 0.9 | 113.1 | F74 L75 | F74-R77 WeakPolarHBondContact O-CB 3.39Å; F74-R77 PolarHBondContact O-N 3.35Å; L75-R77 VanDerWaalsContact C-N 3.28Å; L75-R77 PolarHBondContact O-N 3.19Å |
| 78 | D | 83 | Confident | 81.6 | Confident | 77 Ų | 77 | 91.1 Ų | 91.1 | 41% | 0.412 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -106.6 | 131.4 | -178.3 | -177 | -84.5 | 0 | 0 | 0 | 110.5 | F80 L81 R82 | D78-F80 VanDerWaalsContact C-N 3.33Å; D78-F80 PolarHBondContact O-N 3.49Å; D78-F80 WeakPolarHBondContact OD1-CA 2.99Å; D78-F80 WeakPolarHBondContact OD1-CB 3.36Å; D78-F80 PolarHBondContact OD1-N 3.04Å; D78-L81 HydrophobicContact CB-CB 4.06Å; D78-L81 HydrophobicContact CB-CD1 3.95Å; D78-L81 HydrophobicContact CB-CG 3.99Å; D78-L81 PolarHBondContact O-N 3.15Å; D78-L81 PolarHBondContact OD1-N 3.33Å; D78-R82 VanDerWaalsContact O-CB 3.29Å; D78-R82 WeakPolarHBondContact O-CB 3.45Å; D78-R82 PolarHBondContact O-N 2.91Å |
| 79 | E | 85.8 | Confident | 82.1 | Confident | 121 Ų | 121 | 97.6 Ų | 97.6 | 57% | 0.565 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -61.3 | -39.2 | -176.9 | -77.7 | -68.5 | 149.5 | 0 | 0 | 112.7 | R82 F83 | E79-R82 VanDerWaalsContact CD-CZ 3.44Å; E79-R82 IonicContact OE1-CZ 3.73Å; E79-R82 IonicContact OE1-NH1 3.13Å; E79-R82 PolarHBondContact OE1-NH1 3.23Å; E79-R82 IonicContact OE1-NH2 2.6Å; E79-R82 PolarHBondContact OE1-NH2 3.43Å; E79-R82 IonicContact OE2-CZ 3.37Å; E79-R82 IonicContact OE2-NE 2.97Å; E79-R82 IonicContact OE2-NH1 2.92Å; E79-R82 IonicContact OE2-NH2 3.88Å; E79-R82 PolarHBondContact OE2-NH2 3.1Å; E79-F83 PolarHBondContact O-N 3.42Å; E79-F83 VanDerWaalsContact O-N 3.1Å |
| 80 | F | 86.6 | Confident | 83.2 | Confident | 135 Ų | 135 | 98.2 Ų | 98.2 | 59% | 0.592 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -72.7 | -43.8 | 179.9 | 175.7 | -101.2 | 0 | 0 | 0 | 111.3 | D78 R82 F83 L84 | D78-F80 VanDerWaalsContact C-N 3.33Å; D78-F80 PolarHBondContact O-N 3.49Å; D78-F80 WeakPolarHBondContact OD1-CA 2.99Å; D78-F80 WeakPolarHBondContact OD1-CB 3.36Å; D78-F80 PolarHBondContact OD1-N 3.04Å; F80-R82 VanDerWaalsContact C-N 3.3Å; F80-R82 PolarHBondContact O-N 2.9Å; F80-F83 WeakPolarHBondContact O-CB 3.4Å; F80-F83 PolarHBondContact O-N 2.87Å; F80-L84 HydrophobicContact CD1-CD1 4.21Å; F80-L84 HydrophobicContact CE1-CD1 3.61Å; F80-L84 HydrophobicContact CE1-CG 4.29Å; F80-L84 HydrophobicContact CZ-CD1 3.97Å; F80-L84 HydrophobicContact CZ-CG 4.33Å; F80-L84 PolarHBondContact O-N 2.96Å; F80-L84 VanDerWaalsContact O-N 3.16Å |
| 81 | L | 85.5 | Confident | 84.1 | Confident | 55 Ų | 55 | 95.6 Ų | 95.6 | 29% | 0.288 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.3 | -38.7 | 174.6 | -63.9 | -179.6 | 0 | 0 | 0 | 111.6 | L75 D78 F83 L84 V85 | L75-L81 HydrophobicContact CD2-CB 4.43Å; L75-L81 HydrophobicContact CD2-CD1 4.18Å; D78-L81 HydrophobicContact CB-CB 4.06Å; D78-L81 HydrophobicContact CB-CD1 3.95Å; D78-L81 HydrophobicContact CB-CG 3.99Å; D78-L81 PolarHBondContact O-N 3.15Å; D78-L81 PolarHBondContact OD1-N 3.33Å; L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.07Å; L81-L84 PolarHBondContact O-N 2.96Å; L81-V85 WeakPolarHBondContact O-CG2 3.4Å; L81-V85 PolarHBondContact O-N 3.32Å |
| 82 | R | 84 | Confident | 85 | Confident | 108 Ų | 108 | 91.9 Ų | 91.9 | 41% | 0.408 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -58.6 | -43.9 | 174.4 | -172.8 | 177 | 77.2 | -163.8 | 8 | 111.5 | D78 E79 F80 L84 V85 V86 | D78-R82 VanDerWaalsContact O-CB 3.29Å; D78-R82 WeakPolarHBondContact O-CB 3.45Å; D78-R82 PolarHBondContact O-N 2.91Å; E79-R82 VanDerWaalsContact CD-CZ 3.44Å; E79-R82 IonicContact OE1-CZ 3.73Å; E79-R82 IonicContact OE1-NH1 3.13Å; E79-R82 PolarHBondContact OE1-NH1 3.23Å; E79-R82 IonicContact OE1-NH2 2.6Å; E79-R82 PolarHBondContact OE1-NH2 3.43Å; E79-R82 IonicContact OE2-CZ 3.37Å; E79-R82 IonicContact OE2-NE 2.97Å; E79-R82 IonicContact OE2-NH1 2.92Å; E79-R82 IonicContact OE2-NH2 3.88Å; E79-R82 PolarHBondContact OE2-NH2 3.1Å; F80-R82 VanDerWaalsContact C-N 3.3Å; F80-R82 PolarHBondContact O-N 2.9Å; R82-L84 PolarHBondContact O-N 3.29Å; R82-V85 PolarHBondContact O-N 2.8Å; R82-V86 HydrophobicContact CG-CG2 4.17Å; R82-V86 WeakPolarHBondContact O-CB 3.4Å; R82-V86 VanDerWaalsContact O-CG2 3.26Å; R82-V86 WeakPolarHBondContact O-CG2 3.43Å; R82-V86 PolarHBondContact O-N 3.28Å |
| 83 | F | 88.5 | Confident | 86.2 | Confident | 108 Ų | 108 | 96 Ų | 96 | 47% | 0.474 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -58.2 | -47.5 | 175.5 | 172 | -96.2 | 0 | 0 | 0 | 111.9 | E79 F80 L81 V85 H87 I91 | E79-F83 PolarHBondContact O-N 3.42Å; E79-F83 VanDerWaalsContact O-N 3.1Å; F80-F83 WeakPolarHBondContact O-CB 3.4Å; F80-F83 PolarHBondContact O-N 2.87Å; L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.07Å; F83-V85 VanDerWaalsContact C-N 3.34Å; F83-V85 PolarHBondContact O-N 2.92Å; F83-H87 AromaticContact CD2-CE1 3.72Å; F83-H87 AromaticContact CD2-ND1 3.39Å; F83-H87 WeakPolarHBondContact CD2-ND1 3.24Å; F83-H87 AromaticContact CE2-CE1 3.81Å; F83-H87 AromaticContact CE2-ND1 3.5Å; F83-H87 WeakPolarHBondContact CE2-ND1 3.13Å; F83-H87 WeakPolarHBondContact O-CB 3.34Å; F83-H87 PolarHBondContact O-N 2.84Å; F83-H87 PolarHBondContact O-ND1 2.89Å; F83-H87 VanDerWaalsContact O-ND1 3.07Å; F83-I91 HydrophobicContact CE1-CD1 4.02Å |
| 84 | L | 90.1 | Very high | 87.4 | Confident | 49 Ų | 49 | 93.1 Ų | 93.1 | 26% | 0.257 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.3 | -38.8 | 178.8 | -68.3 | -179.8 | 0 | 0 | 0 | 112.6 | F80 L81 R82 H88 I91 | F80-L84 HydrophobicContact CD1-CD1 4.21Å; F80-L84 HydrophobicContact CE1-CD1 3.61Å; F80-L84 HydrophobicContact CE1-CG 4.29Å; F80-L84 HydrophobicContact CZ-CD1 3.97Å; F80-L84 HydrophobicContact CZ-CG 4.33Å; F80-L84 PolarHBondContact O-N 2.96Å; F80-L84 VanDerWaalsContact O-N 3.16Å; L81-L84 PolarHBondContact O-N 2.96Å; R82-L84 PolarHBondContact O-N 3.29Å; L84-H88 WeakPolarHBondContact O-CA 3.28Å; L84-H88 WeakPolarHBondContact O-CB 3.45Å; L84-H88 PolarHBondContact O-N 3.37Å; L84-I91 HydrophobicContact CD2-CD1 3.89Å |
| 85 | V | 87.7 | Confident | 88.5 | Confident | 36 Ų | 36 | 88.9 Ų | 88.9 | 22% | 0.218 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -71 | -48.4 | 178.7 | 167.7 | 0 | 0 | 0 | 0 | 111.8 | I68 L75 L81 R82 F83 H87 H88 | I68-V85 HydrophobicContact CB-CG1 4.45Å; I68-V85 HydrophobicContact CD1-CG1 4.11Å; I68-V85 HydrophobicContact CG1-CB 4.37Å; I68-V85 HydrophobicContact CG1-CG1 3.85Å; I68-V85 HydrophobicContact CG1-CG2 4.02Å; I68-V85 HydrophobicContact CG2-CG1 3.81Å; L75-V85 HydrophobicContact CB-CG2 3.89Å; L75-V85 HydrophobicContact CD1-CG2 3.79Å; L75-V85 HydrophobicContact CG-CG2 4.28Å; L81-V85 WeakPolarHBondContact O-CG2 3.4Å; L81-V85 PolarHBondContact O-N 3.32Å; R82-V85 PolarHBondContact O-N 2.8Å; F83-V85 VanDerWaalsContact C-N 3.34Å; F83-V85 PolarHBondContact O-N 2.92Å; V85-H87 VanDerWaalsContact C-N 3.32Å; V85-H87 PolarHBondContact O-N 3.18Å; V85-H88 VanDerWaalsContact O-CB 3.25Å; V85-H88 WeakPolarHBondContact O-CB 3.26Å; V85-H88 PolarHBondContact O-N 3.22Å |
| 86 | V | 87.8 | Confident | 89.7 | Confident | 102 Ų | 102 | 91.4 Ų | 91.4 | 62% | 0.618 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -63.6 | -40.1 | -177.9 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | R82 | R82-V86 HydrophobicContact CG-CG2 4.17Å; R82-V86 WeakPolarHBondContact O-CB 3.4Å; R82-V86 VanDerWaalsContact O-CG2 3.26Å; R82-V86 WeakPolarHBondContact O-CG2 3.43Å; R82-V86 PolarHBondContact O-N 3.28Å |
| 87 | H | 91.6 | Very high | 91 | Very high | 83 Ų | 83 | 87.7 Ų | 87.7 | 38% | 0.384 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 11.1 | -178.6 | -57.6 | 89.4 | 0 | 0 | 0 | 113.2 | F83 V85 R89 M90 I91 | F83-H87 AromaticContact CD2-CE1 3.72Å; F83-H87 AromaticContact CD2-ND1 3.39Å; F83-H87 WeakPolarHBondContact CD2-ND1 3.24Å; F83-H87 AromaticContact CE2-CE1 3.81Å; F83-H87 AromaticContact CE2-ND1 3.5Å; F83-H87 WeakPolarHBondContact CE2-ND1 3.13Å; F83-H87 WeakPolarHBondContact O-CB 3.34Å; F83-H87 PolarHBondContact O-N 2.84Å; F83-H87 PolarHBondContact O-ND1 2.89Å; F83-H87 VanDerWaalsContact O-ND1 3.07Å; V85-H87 VanDerWaalsContact C-N 3.32Å; V85-H87 PolarHBondContact O-N 3.18Å; H87-R89 VanDerWaalsContact C-N 3.31Å; H87-R89 PolarHBondContact O-N 3.47Å; H87-R89 VanDerWaalsContact O-N 3.17Å; H87-M90 PolarHBondContact O-N 3.5Å; H87-I91 HydrophobicContact CB-CD1 3.87Å; H87-I91 HydrophobicContact CB-CG1 4.06Å; H87-I91 WeakPolarHBondContact O-CG1 3.32Å; H87-I91 PolarHBondContact O-N 3.2Å |
| 88 | H | 93 | Very high | 91.9 | Very high | 5 Ų | 5 | 80.1 Ų | 80.1 | 2% | 0.023 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -47.5 | -49.7 | -172.7 | 176.8 | 56.9 | 0 | 0 | 0 | 113.6 | Y60 F61 E65 I68 L84 V85 I91 S92 | Y60-H88 AromaticContact CD1-CE1 3.86Å; Y60-H88 AromaticContact CE1-CE1 3.67Å; Y60-H88 AromaticContact CE1-ND1 3.45Å; Y60-H88 WeakPolarHBondContact CE1-ND1 3.25Å; Y60-H88 AromaticContact CZ-CE1 3.93Å; Y60-H88 AromaticContact CZ-ND1 3.4Å; Y60-H88 PolarHBondContact O-CE1 2.76Å; F61-H88 PolarHBondContact O-NE2 3.27Å; E65-H88 PolarHBondContact N-NE2 3.41Å; E65-H88 IonicContact OE1-CD2 2.67Å; E65-H88 PolarHBondContact OE1-CD2 2.91Å; I68-H88 HydrophobicContact CD1-CB 3.69Å; L84-H88 WeakPolarHBondContact O-CA 3.28Å; L84-H88 WeakPolarHBondContact O-CB 3.45Å; L84-H88 PolarHBondContact O-N 3.37Å; V85-H88 VanDerWaalsContact O-CB 3.25Å; V85-H88 WeakPolarHBondContact O-CB 3.26Å; V85-H88 PolarHBondContact O-N 3.22Å; H88-I91 PolarHBondContact O-N 3.48Å; H88-S92 PolarHBondContact CE1-OG 2.81Å; H88-S92 VanDerWaalsContact O-CB 3.3Å; H88-S92 WeakPolarHBondContact O-CB 3.32Å; H88-S92 PolarHBondContact O-N 2.81Å; H88-S92 PolarHBondContact O-OG 3.06Å |
| 89 | R | 93.8 | Very high | 92.6 | Very high | 171 Ų | 171 | 76.4 Ų | 76.4 | 65% | 0.645 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -64.9 | -42.5 | -179.7 | -66.5 | -179.2 | 179.4 | -179.8 | 0.1 | 112.4 | E65 H87 F93 | E65-R89 WeakPolarHBondContact OE1-CG 3.49Å; E65-R89 IonicContact OE1-CZ 2.91Å; E65-R89 IonicContact OE1-NE 3.7Å; E65-R89 PolarHBondContact OE1-NE 3.41Å; E65-R89 IonicContact OE1-NH2 3.08Å; E65-R89 IonicContact OE2-CZ 2.76Å; E65-R89 IonicContact OE2-NE 3.63Å; E65-R89 IonicContact OE2-NH2 3.68Å; E65-R89 PolarHBondContact OE2-NH2 2.99Å; H87-R89 VanDerWaalsContact C-N 3.31Å; H87-R89 PolarHBondContact O-N 3.47Å; H87-R89 VanDerWaalsContact O-N 3.17Å; R89-F93 WeakPolarHBondContact O-CB 3.36Å; R89-F93 PolarHBondContact O-N 3.42Å |
| 90 | M | 95.6 | Very high | 93.1 | Very high | 125 Ų | 125 | 74.9 Ų | 74.9 | 62% | 0.616 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -68.5 | -44.7 | 179 | -174.9 | 60.6 | 120.8 | 0 | 0 | 111.1 | H87 S92 F93 V94 | H87-M90 PolarHBondContact O-N 3.5Å; M90-S92 VanDerWaalsContact C-N 3.33Å; M90-S92 PolarHBondContact O-N 3.04Å; M90-F93 PolarHBondContact O-N 2.82Å; M90-V94 WeakPolarHBondContact O-CG2 3.22Å; M90-V94 PolarHBondContact O-N 3.06Å |
| 91 | I | 95.9 | Very high | 93.6 | Very high | 38 Ų | 38 | 73 Ų | 73 | 20% | 0.195 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.5 | -47 | 176 | -65.3 | 167.4 | 0 | 0 | 0 | 109.9 | Y60 F83 L84 H87 H88 F93 V94 L95 | Y60-I91 HydrophobicContact CE1-CB 4.09Å; Y60-I91 HydrophobicContact CE1-CG2 3.68Å; F83-I91 HydrophobicContact CE1-CD1 4.02Å; L84-I91 HydrophobicContact CD2-CD1 3.89Å; H87-I91 HydrophobicContact CB-CD1 3.87Å; H87-I91 HydrophobicContact CB-CG1 4.06Å; H87-I91 WeakPolarHBondContact O-CG1 3.32Å; H87-I91 PolarHBondContact O-N 3.2Å; H88-I91 PolarHBondContact O-N 3.48Å; I91-F93 VanDerWaalsContact C-N 3.31Å; I91-F93 PolarHBondContact O-N 2.77Å; I91-V94 PolarHBondContact O-N 2.99Å; I91-L95 HydrophobicContact CG2-CD1 3.98Å; I91-L95 HydrophobicContact CG2-CG 4.33Å; I91-L95 WeakPolarHBondContact O-CB 3.23Å; I91-L95 VanDerWaalsContact O-CG 3.31Å; I91-L95 WeakPolarHBondContact O-CG 3.25Å; I91-L95 PolarHBondContact O-N 2.82Å |
| 92 | S | 96.2 | Very high | 94 | Very high | 6 Ų | 6 | 74.5 Ų | 74.5 | 4% | 0.042 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -58.1 | -42.5 | 176.9 | -62.8 | 0 | 0 | 0 | 0 | 112.3 | Y60 H88 M90 L95 Y96 | Y60-S92 WeakPolarHBondContact CD1-OG 3.4Å; Y60-S92 VanDerWaalsContact CE1-OG 3.26Å; Y60-S92 WeakPolarHBondContact CE1-OG 3.34Å; H88-S92 PolarHBondContact CE1-OG 2.81Å; H88-S92 VanDerWaalsContact O-CB 3.3Å; H88-S92 WeakPolarHBondContact O-CB 3.32Å; H88-S92 PolarHBondContact O-N 2.81Å; H88-S92 PolarHBondContact O-OG 3.06Å; M90-S92 VanDerWaalsContact C-N 3.33Å; M90-S92 PolarHBondContact O-N 3.04Å; S92-L95 PolarHBondContact O-N 3.06Å; S92-Y96 PolarHBondContact O-N 2.81Å |
| 93 | F | 96.8 | Very high | 94.5 | Very high | 117 Ų | 117 | 69.5 Ų | 69.5 | 51% | 0.513 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.9 | -45.2 | 177.5 | -177.5 | -111.4 | 0 | 0 | 0 | 112.2 | R89 M90 I91 Y96 L97 | R89-F93 WeakPolarHBondContact O-CB 3.36Å; R89-F93 PolarHBondContact O-N 3.42Å; M90-F93 PolarHBondContact O-N 2.82Å; I91-F93 VanDerWaalsContact C-N 3.31Å; I91-F93 PolarHBondContact O-N 2.77Å; F93-Y96 PolarHBondContact O-N 2.73Å; F93-L97 HydrophobicContact CD1-CD1 3.94Å; F93-L97 HydrophobicContact CD1-CG 4.48Å; F93-L97 HydrophobicContact CE1-CD1 3.4Å; F93-L97 VanDerWaalsContact CE1-CD1 3.4Å; F93-L97 HydrophobicContact CE1-CG 4.14Å; F93-L97 HydrophobicContact CE2-CD1 4.42Å; F93-L97 HydrophobicContact CE2-CD2 4.5Å; F93-L97 HydrophobicContact CE2-CG 4.33Å; F93-L97 HydrophobicContact CZ-CD1 3.68Å; F93-L97 HydrophobicContact CZ-CD2 4.27Å; F93-L97 HydrophobicContact CZ-CG 4.05Å; F93-L97 WeakPolarHBondContact O-CG 3.43Å; F93-L97 PolarHBondContact O-N 3.34Å |
| 94 | V | 97.8 | Very high | 94.9 | Very high | 74 Ų | 74 | 67.6 Ų | 67.6 | 45% | 0.448 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.6 | -46.5 | 176.1 | 172 | 0 | 0 | 0 | 0 | 110.9 | M90 I91 Y96 L97 T98 | M90-V94 WeakPolarHBondContact O-CG2 3.22Å; M90-V94 PolarHBondContact O-N 3.06Å; I91-V94 PolarHBondContact O-N 2.99Å; V94-Y96 VanDerWaalsContact C-N 3.33Å; V94-Y96 PolarHBondContact O-N 3.3Å; V94-L97 PolarHBondContact O-N 3.16Å; V94-T98 HydrophobicContact CG1-CG2 4.33Å; V94-T98 WeakPolarHBondContact O-CG2 3.26Å; V94-T98 PolarHBondContact O-N 3.28Å; V94-T98 PolarHBondContact O-OG1 3.47Å |
| 95 | L | 97.6 | Very high | 95 | Very high | 56 Ų | 56 | 72 Ų | 72 | 29% | 0.293 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -56.2 | -48.9 | 175.6 | -71.1 | 172.2 | 0 | 0 | 0 | 110.8 | Y53 T57 Y60 I91 S92 L97 T98 G99 | Y53-L95 WeakPolarHBondContact CE1-O 3.28Å; Y53-L95 WeakPolarHBondContact OH-CA 3.46Å; Y53-L95 WeakPolarHBondContact OH-CD2 3.21Å; Y53-L95 PolarHBondContact OH-O 3.48Å; T57-L95 HydrophobicContact CG2-CB 3.64Å; Y60-L95 HydrophobicContact CD1-CD1 3.93Å; Y60-L95 HydrophobicContact CE1-CD1 4.27Å; Y60-L95 HydrophobicContact CG-CD1 4.5Å; I91-L95 HydrophobicContact CG2-CD1 3.98Å; I91-L95 HydrophobicContact CG2-CG 4.33Å; I91-L95 WeakPolarHBondContact O-CB 3.23Å; I91-L95 VanDerWaalsContact O-CG 3.31Å; I91-L95 WeakPolarHBondContact O-CG 3.25Å; I91-L95 PolarHBondContact O-N 2.82Å; S92-L95 PolarHBondContact O-N 3.06Å; L95-L97 PolarHBondContact O-N 3.02Å; L95-T98 PolarHBondContact O-N 3.02Å; L95-T98 PolarHBondContact O-OG1 3.42Å; L95-G99 PolarHBondContact O-N 3.2Å |
| 96 | Y | 97.5 | Very high | 95.2 | Very high | 83 Ų | 83 | 71.3 Ų | 71.3 | 33% | 0.325 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.8 | -47.2 | 177.2 | -177.1 | -95.7 | 0 | 0 | 0 | 112.4 | F54 S92 F93 V94 T98 G99 F100 H123 | F54-Y96 HydrophobicContact CD1-CD2 4.1Å; F54-Y96 HydrophobicContact CD1-CE2 4.07Å; F54-Y96 AromaticContact CE1-CD2 3.9Å; F54-Y96 HydrophobicContact CE1-CD2 3.9Å; F54-Y96 AromaticContact CE1-CE2 3.76Å; F54-Y96 HydrophobicContact CE1-CE2 3.76Å; S92-Y96 PolarHBondContact O-N 2.81Å; F93-Y96 PolarHBondContact O-N 2.73Å; V94-Y96 VanDerWaalsContact C-N 3.33Å; V94-Y96 PolarHBondContact O-N 3.3Å; Y96-T98 VanDerWaalsContact C-N 3.34Å; Y96-T98 PolarHBondContact O-N 2.84Å; Y96-G99 PolarHBondContact O-N 3.47Å; Y96-F100 PolarHBondContact O-N 3.08Å; Y96-H123 AromaticContact CE2-NE2 3.56Å; Y96-H123 AromaticContact CZ-NE2 3.77Å; Y96-H123 PolarHBondContact OH-NE2 2.93Å; Y96-H123 VanDerWaalsContact OH-NE2 3.1Å |
| 97 | L | 97.6 | Very high | 95.4 | Very high | 68 Ų | 68 | 68.8 Ų | 68.8 | 36% | 0.356 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.1 | -40.3 | 177.5 | -73.9 | -177.5 | 0 | 0 | 0 | 112.6 | F93 V94 L95 G99 F100 I101 | F93-L97 HydrophobicContact CD1-CD1 3.94Å; F93-L97 HydrophobicContact CD1-CG 4.48Å; F93-L97 HydrophobicContact CE1-CD1 3.4Å; F93-L97 VanDerWaalsContact CE1-CD1 3.4Å; F93-L97 HydrophobicContact CE1-CG 4.14Å; F93-L97 HydrophobicContact CE2-CD1 4.42Å; F93-L97 HydrophobicContact CE2-CD2 4.5Å; F93-L97 HydrophobicContact CE2-CG 4.33Å; F93-L97 HydrophobicContact CZ-CD1 3.68Å; F93-L97 HydrophobicContact CZ-CD2 4.27Å; F93-L97 HydrophobicContact CZ-CG 4.05Å; F93-L97 WeakPolarHBondContact O-CG 3.43Å; F93-L97 PolarHBondContact O-N 3.34Å; V94-L97 PolarHBondContact O-N 3.16Å; L95-L97 PolarHBondContact O-N 3.02Å; L97-G99 VanDerWaalsContact C-N 3.34Å; L97-G99 PolarHBondContact O-N 3.39Å; L97-F100 WeakPolarHBondContact O-CB 3.48Å; L97-F100 PolarHBondContact O-N 3.25Å; L97-I101 VanDerWaalsContact O-CG1 3.32Å; L97-I101 WeakPolarHBondContact O-CG1 3.46Å; L97-I101 PolarHBondContact O-N 2.8Å |
| 98 | T | 97.7 | Very high | 95.4 | Very high | 65 Ų | 65 | 67.8 Ų | 67.8 | 40% | 0.399 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.3 | -39.4 | 177.2 | 60.3 | 0 | 0 | 0 | 0 | 111.8 | Y53 V94 L95 Y96 I101 W102 | Y53-T98 PolarHBondContact OH-OG1 3.36Å; V94-T98 HydrophobicContact CG1-CG2 4.33Å; V94-T98 WeakPolarHBondContact O-CG2 3.26Å; V94-T98 PolarHBondContact O-N 3.28Å; V94-T98 PolarHBondContact O-OG1 3.47Å; L95-T98 PolarHBondContact O-N 3.02Å; L95-T98 PolarHBondContact O-OG1 3.42Å; Y96-T98 VanDerWaalsContact C-N 3.34Å; Y96-T98 PolarHBondContact O-N 2.84Å; T98-I101 PolarHBondContact O-N 3.36Å; T98-W102 VanDerWaalsContact O-CB 3.31Å; T98-W102 WeakPolarHBondContact O-CB 3.34Å; T98-W102 PolarHBondContact O-N 2.92Å |
| 99 | G | 96.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 75.6 Ų | 75.6 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y53 F54 L95 Y96 L97 W102 F103 | Y53-G99 VanDerWaalsContact CE1-CA 3.45Å; F54-G99 VanDerWaalsContact CZ-C 3.43Å; L95-G99 PolarHBondContact O-N 3.2Å; Y96-G99 PolarHBondContact O-N 3.47Å; L97-G99 VanDerWaalsContact C-N 3.34Å; L97-G99 PolarHBondContact O-N 3.39Å; G99-W102 PolarHBondContact O-N 3.37Å; G99-F103 PolarHBondContact O-N 3.27Å |
| 100 | F | 96.3 | Very high | 94.9 | Very high | 89 Ų | 89 | 78.7 Ų | 78.7 | 39% | 0.39 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -65 | -46.5 | 176.4 | -174.3 | -92.3 | 0 | 0 | 0 | 112.1 | Y96 L97 W102 F103 V104 F119 | Y96-F100 PolarHBondContact O-N 3.08Å; L97-F100 WeakPolarHBondContact O-CB 3.48Å; L97-F100 PolarHBondContact O-N 3.25Å; F100-W102 VanDerWaalsContact C-N 3.32Å; F100-W102 PolarHBondContact O-N 2.83Å; F100-F103 WeakPolarHBondContact O-CB 3.08Å; F100-F103 PolarHBondContact O-N 3.23Å; F100-V104 HydrophobicContact CD1-CG2 4.33Å; F100-V104 HydrophobicContact CE1-CG2 4Å; F100-V104 HydrophobicContact CZ-CG2 4.42Å; F100-V104 WeakPolarHBondContact O-CG2 3.42Å; F100-V104 PolarHBondContact O-N 2.92Å; F100-F119 AromaticContact CD2-CZ 3.94Å; F100-F119 HydrophobicContact CD2-CZ 3.94Å; F100-F119 HydrophobicContact CE2-CZ 4.23Å |
| 101 | I | 97.1 | Very high | 94.6 | Very high | 95 Ų | 95 | 76.2 Ų | 76.2 | 49% | 0.487 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.6 | -43.5 | 174.8 | -67 | 166.1 | 0 | 0 | 0 | 109.9 | L97 T98 F103 V104 L105 | L97-I101 VanDerWaalsContact O-CG1 3.32Å; L97-I101 WeakPolarHBondContact O-CG1 3.46Å; L97-I101 PolarHBondContact O-N 2.8Å; T98-I101 PolarHBondContact O-N 3.36Å; I101-F103 VanDerWaalsContact C-N 3.31Å; I101-F103 PolarHBondContact O-N 3.34Å; I101-V104 PolarHBondContact O-N 2.91Å; I101-V104 VanDerWaalsContact O-N 3.16Å; I101-L105 HydrophobicContact CG2-CD1 3.81Å; I101-L105 HydrophobicContact CG2-CG 4.17Å; I101-L105 WeakPolarHBondContact O-CG 3.48Å; I101-L105 PolarHBondContact O-N 3.31Å |
| 102 | W | 95.5 | Very high | 94.4 | Very high | 87 Ų | 87 | 79.6 Ų | 79.6 | 33% | 0.33 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.6 | -42.8 | 175.7 | -174.7 | 9.7 | 0 | 0 | 0 | 111.9 | W46 L50 Y53 T98 G99 F100 V104 L105 S106 | W46-W102 AromaticContact CE3-CZ2 3.82Å; W46-W102 HydrophobicContact CE3-CZ2 3.82Å; W46-W102 HydrophobicContact CZ3-CZ2 4.15Å; L50-W102 HydrophobicContact CD1-CB 4.19Å; L50-W102 HydrophobicContact CD1-CD2 3.94Å; L50-W102 HydrophobicContact CD1-CE3 3.94Å; L50-W102 HydrophobicContact CD1-CG 4.07Å; Y53-W102 HydrophobicContact CD2-CE3 4.47Å; Y53-W102 HydrophobicContact CD2-CZ3 4.05Å; Y53-W102 HydrophobicContact CG-CE3 4.35Å; Y53-W102 HydrophobicContact CG-CZ3 4.12Å; T98-W102 VanDerWaalsContact O-CB 3.31Å; T98-W102 WeakPolarHBondContact O-CB 3.34Å; T98-W102 PolarHBondContact O-N 2.92Å; G99-W102 PolarHBondContact O-N 3.37Å; F100-W102 VanDerWaalsContact C-N 3.32Å; F100-W102 PolarHBondContact O-N 2.83Å; W102-V104 PolarHBondContact O-N 2.91Å; W102-L105 PolarHBondContact O-N 3.36Å; W102-S106 WeakPolarHBondContact O-CB 3.36Å; W102-S106 PolarHBondContact O-N 2.91Å |
| 103 | F | 94.8 | Very high | 94.2 | Very high | 2 Ų | 2 | 86.7 Ų | 86.7 | 1% | 0.009 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -57.4 | -50 | 173.6 | 171.8 | -112.5 | 0 | 0 | 0 | 111.9 | F47 L50 G99 F100 I101 L105 S106 L107 Q115 F116 F119 | F47-F103 AromaticContact CE1-CD2 3.89Å; F47-F103 HydrophobicContact CE1-CD2 3.89Å; F47-F103 AromaticContact CE1-CE2 3.73Å; F47-F103 HydrophobicContact CE1-CE2 3.73Å; F47-F103 HydrophobicContact CZ-CD2 4.09Å; F47-F103 AromaticContact CZ-CE2 3.97Å; F47-F103 HydrophobicContact CZ-CE2 3.97Å; L50-F103 HydrophobicContact CD2-CB 3.78Å; L50-F103 HydrophobicContact CD2-CD2 3.79Å; L50-F103 HydrophobicContact CD2-CG 4.24Å; G99-F103 PolarHBondContact O-N 3.27Å; F100-F103 WeakPolarHBondContact O-CB 3.08Å; F100-F103 PolarHBondContact O-N 3.23Å; I101-F103 VanDerWaalsContact C-N 3.31Å; I101-F103 PolarHBondContact O-N 3.34Å; F103-L105 PolarHBondContact O-N 3.38Å; F103-S106 WeakPolarHBondContact O-CB 3.33Å; F103-S106 PolarHBondContact O-N 3.32Å; F103-S106 VanDerWaalsContact O-N 3.08Å; F103-S106 PolarHBondContact O-OG 3.43Å; F103-L107 HydrophobicContact CE1-CD2 4.41Å; F103-L107 HydrophobicContact CE2-CD2 4.18Å; F103-L107 HydrophobicContact CZ-CD2 3.93Å; F103-L107 PolarHBondContact O-N 3.36Å; F103-Q115 HydrophobicContact CE2-CB 4.22Å; F103-F116 AromaticContact CE1-CD1 3.99Å; F103-F116 HydrophobicContact CE1-CD1 3.99Å; F103-F116 AromaticContact CE1-CE1 3.7Å; F103-F116 HydrophobicContact CE1-CE1 3.7Å; F103-F116 HydrophobicContact CE1-CZ 4.25Å; F103-F116 AromaticContact CZ-CD1 3.87Å; F103-F116 HydrophobicContact CZ-CD1 3.87Å; F103-F116 AromaticContact CZ-CE1 3.98Å; F103-F116 HydrophobicContact CZ-CE1 3.98Å; F103-F116 HydrophobicContact CZ-CG 4.26Å; F103-F116 HydrophobicContact CZ-CZ 4.44Å; F103-F119 HydrophobicContact CB-CD2 4.11Å; F103-F119 HydrophobicContact CB-CE2 3.91Å; F103-F119 AromaticContact CD1-CD2 3.64Å; F103-F119 HydrophobicContact CD1-CD2 3.64Å; F103-F119 AromaticContact CD1-CE2 3.67Å; F103-F119 HydrophobicContact CD1-CE2 3.67Å; F103-F119 HydrophobicContact CD1-CG 4.12Å; F103-F119 HydrophobicContact CD1-CZ 4.21Å; F103-F119 HydrophobicContact CD2-CB 4.28Å; F103-F119 AromaticContact CD2-CD2 3.56Å; F103-F119 HydrophobicContact CD2-CD2 3.56Å; F103-F119 HydrophobicContact CD2-CE2 4.23Å; F103-F119 HydrophobicContact CD2-CG 4.2Å; F103-F119 HydrophobicContact CE1-CB 4.26Å; F103-F119 HydrophobicContact CE1-CD1 4.27Å; F103-F119 AromaticContact CE1-CD2 3.89Å; F103-F119 HydrophobicContact CE1-CD2 3.89Å; F103-F119 HydrophobicContact CE1-CE2 4.26Å; F103-F119 AromaticContact CE1-CG 3.89Å; F103-F119 HydrophobicContact CE1-CG 3.89Å; F103-F119 HydrophobicContact CE2-CB 3.68Å; F103-F119 AromaticContact CE2-CD2 3.82Å; F103-F119 HydrophobicContact CE2-CD2 3.82Å; F103-F119 AromaticContact CE2-CG 3.97Å; F103-F119 HydrophobicContact CE2-CG 3.97Å; F103-F119 AromaticContact CG-CD2 3.45Å; F103-F119 HydrophobicContact CG-CD2 3.45Å; F103-F119 VanDerWaalsContact CG-CD2 3.45Å; F103-F119 AromaticContact CG-CE2 3.65Å; F103-F119 HydrophobicContact CG-CE2 3.65Å; F103-F119 HydrophobicContact CG-CG 4.26Å; F103-F119 HydrophobicContact CZ-CB 3.67Å; F103-F119 HydrophobicContact CZ-CD1 4.49Å; F103-F119 AromaticContact CZ-CD2 3.98Å; F103-F119 HydrophobicContact CZ-CD2 3.98Å; F103-F119 AromaticContact CZ-CG 3.81Å; F103-F119 HydrophobicContact CZ-CG 3.81Å |
| 104 | V | 94.9 | Very high | 93.9 | Very high | 69 Ų | 69 | 86.4 Ų | 86.4 | 42% | 0.418 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61 | -44.5 | -179.8 | 175.4 | 0 | 0 | 0 | 0 | 111.3 | F100 I101 W102 S106 L107 | F100-V104 HydrophobicContact CD1-CG2 4.33Å; F100-V104 HydrophobicContact CE1-CG2 4Å; F100-V104 HydrophobicContact CZ-CG2 4.42Å; F100-V104 WeakPolarHBondContact O-CG2 3.42Å; F100-V104 PolarHBondContact O-N 2.92Å; I101-V104 PolarHBondContact O-N 2.91Å; I101-V104 VanDerWaalsContact O-N 3.16Å; W102-V104 PolarHBondContact O-N 2.91Å; V104-S106 PolarHBondContact O-N 3.1Å; V104-L107 HydrophobicContact CG1-CD1 4.45Å; V104-L107 WeakPolarHBondContact O-CB 3.45Å; V104-L107 VanDerWaalsContact O-CG 3.29Å; V104-L107 WeakPolarHBondContact O-CG 3.5Å; V104-L107 PolarHBondContact O-N 3.03Å |
| 105 | L | 93.6 | Very high | 93.6 | Very high | 142 Ų | 142 | 82.9 Ų | 82.9 | 74% | 0.743 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -67 | -22.8 | 177.1 | -66 | 176.9 | 0 | 0 | 0 | 112.9 | I101 W102 F103 L107 | I101-L105 HydrophobicContact CG2-CD1 3.81Å; I101-L105 HydrophobicContact CG2-CG 4.17Å; I101-L105 WeakPolarHBondContact O-CG 3.48Å; I101-L105 PolarHBondContact O-N 3.31Å; W102-L105 PolarHBondContact O-N 3.36Å; F103-L105 PolarHBondContact O-N 3.38Å; L105-L107 VanDerWaalsContact C-N 3.31Å |
| 106 | S | 91.6 | Very high | 93.4 | Very high | 21 Ų | 21 | 85.3 Ų | 85.3 | 15% | 0.147 | 39% | 0.392 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | -2.1 | 177.1 | 80.4 | 0 | 0 | 0 | 0 | 114.4 | F47 W102 F103 V104 V108 Q115 | F47-S106 WeakPolarHBondContact CZ-OG 3.5Å; W102-S106 WeakPolarHBondContact O-CB 3.36Å; W102-S106 PolarHBondContact O-N 2.91Å; F103-S106 WeakPolarHBondContact O-CB 3.33Å; F103-S106 PolarHBondContact O-N 3.32Å; F103-S106 VanDerWaalsContact O-N 3.08Å; F103-S106 PolarHBondContact O-OG 3.43Å; V104-S106 PolarHBondContact O-N 3.1Å; S106-V108 PolarHBondContact O-N 2.97Å; S106-Q115 PolarHBondContact O-NE2 2.97Å |
| 107 | L | 92.1 | Very high | 93.2 | Very high | 48 Ų | 48 | 83.5 Ų | 83.5 | 25% | 0.251 | 39% | 0.391 | S | S | . | . | trans | -67.1 | 125.8 | -175.9 | -71.1 | 175.2 | 0 | 0 | 0 | 111.6 | F103 V104 L105 Y112 Q115 F116 | F103-L107 HydrophobicContact CE1-CD2 4.41Å; F103-L107 HydrophobicContact CE2-CD2 4.18Å; F103-L107 HydrophobicContact CZ-CD2 3.93Å; F103-L107 PolarHBondContact O-N 3.36Å; V104-L107 HydrophobicContact CG1-CD1 4.45Å; V104-L107 WeakPolarHBondContact O-CB 3.45Å; V104-L107 VanDerWaalsContact O-CG 3.29Å; V104-L107 WeakPolarHBondContact O-CG 3.5Å; V104-L107 PolarHBondContact O-N 3.03Å; L105-L107 VanDerWaalsContact C-N 3.31Å; L107-Y112 HydrophobicContact CB-CD1 4.2Å; L107-Y112 HydrophobicContact CB-CE1 3.85Å; L107-Y112 HydrophobicContact CD2-CD1 4.23Å; L107-Q115 HydrophobicContact CD2-CB 4.13Å; L107-F116 HydrophobicContact CD1-CE2 4.44Å; L107-F116 HydrophobicContact CD1-CZ 4.3Å; L107-F116 HydrophobicContact CD2-CE2 4.15Å; L107-F116 HydrophobicContact CD2-CZ 4.47Å | ||
| 108 | V | 90.6 | Very high | 92.9 | Very high | 62 Ų | 62 | 80.3 Ų | 80.3 | 38% | 0.376 | 38% | 0.375 | S | S | . | . | trans | -116.3 | 126.3 | 179.8 | -177.3 | 0 | 0 | 0 | 0 | 109.6 | L44 S106 R110 Y111 Y112 Q115 | L44-V108 HydrophobicContact CD2-CB 4.49Å; L44-V108 HydrophobicContact CD2-CG2 3.85Å; S106-V108 PolarHBondContact O-N 2.97Å; V108-R110 PolarHBondContact O-N 3.25Å; V108-Y111 HydrophobicContact CB-CD2 4.44Å; V108-Y111 HydrophobicContact CG1-CD2 4.16Å; V108-Y111 PolarHBondContact O-N 2.95Å; V108-Y112 VanDerWaalsContact C-CE1 3.41Å; V108-Y112 WeakPolarHBondContact O-CD1 3.19Å; V108-Y112 WeakPolarHBondContact O-CE1 3.29Å; V108-Q115 PolarHBondContact O-OE1 2.98Å | ||
| 109 | K | 89.2 | Confident | 92.8 | Very high | 169 Ų | 169 | 78.7 Ų | 78.7 | 74% | 0.735 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.9 | 139.6 | 176.5 | -167 | 173.8 | -177.5 | 175.8 | 0 | 109.9 | ||
| 110 | R | 88.7 | Confident | 92.7 | Very high | 236 Ų | 236 | 81.1 Ų | 81.1 | 89% | 0.891 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.9 | -17.3 | -171 | -51.7 | 177.3 | 175.6 | 178.7 | -1.3 | 116.4 | V108 | V108-R110 PolarHBondContact O-N 3.25Š|
| 111 | Y | 89 | Confident | 92.6 | Very high | 74 Ų | 74 | 78 Ų | 78 | 29% | 0.29 | 37% | 0.368 | S | S | . | . | trans | -112.1 | 1.1 | -177.5 | -64.6 | -78.1 | 0 | 0 | 0 | 114.7 | L44 V108 M113 R114 Q115 | L44-Y111 HydrophobicContact CD1-CG 4.22Å; V108-Y111 HydrophobicContact CB-CD2 4.44Å; V108-Y111 HydrophobicContact CG1-CD2 4.16Å; V108-Y111 PolarHBondContact O-N 2.95Å; Y111-M113 PolarHBondContact O-N 3.18Å; Y111-R114 PolarHBondContact O-N 2.97Å; Y111-Q115 WeakPolarHBondContact O-CG 3.36Å; Y111-Q115 PolarHBondContact O-N 3.25Å | ||
| 112 | Y | 91.1 | Very high | 92.6 | Very high | 109 Ų | 109 | 73.7 Ų | 73.7 | 43% | 0.427 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -48.3 | -52.7 | -174.2 | -60.6 | -28.6 | 0 | 0 | 0 | 114 | L107 V108 R114 Q115 F116 | L107-Y112 HydrophobicContact CB-CD1 4.2Å; L107-Y112 HydrophobicContact CB-CE1 3.85Å; L107-Y112 HydrophobicContact CD2-CD1 4.23Å; V108-Y112 VanDerWaalsContact C-CE1 3.41Å; V108-Y112 WeakPolarHBondContact O-CD1 3.19Å; V108-Y112 WeakPolarHBondContact O-CE1 3.29Å; Y112-R114 VanDerWaalsContact C-N 3.27Å; Y112-R114 PolarHBondContact O-N 3.4Å; Y112-Q115 PolarHBondContact O-N 3.41Å; Y112-Q115 VanDerWaalsContact O-N 3.07Å; Y112-F116 VanDerWaalsContact O-CD2 3.27Å; Y112-F116 WeakPolarHBondContact O-CD2 3.28Å; Y112-F116 PolarHBondContact O-N 2.95Å |
| 113 | M | 91.2 | Very high | 92.6 | Very high | 155 Ų | 155 | 71.7 Ų | 71.7 | 76% | 0.764 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -55.7 | -43 | -179.8 | -69.1 | -63.8 | -86.3 | 0 | 0 | 111.9 | Y111 S117 | Y111-M113 PolarHBondContact O-N 3.18Å; M113-S117 VanDerWaalsContact O-CB 3.32Å; M113-S117 WeakPolarHBondContact O-CB 3.18Å; M113-S117 PolarHBondContact O-N 3.11Å; M113-S117 PolarHBondContact O-OG 3.5Å |
| 114 | R | 91.1 | Very high | 92.6 | Very high | 111 Ų | 111 | 75.6 Ų | 75.6 | 42% | 0.419 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.7 | -38.2 | 178.5 | -58.3 | -173.6 | -171.7 | -176.6 | 4.9 | 112.2 | Y39 L41 Y111 Y112 L118 | Y39-R114 HydrophobicContact CD1-CB 4.47Å; Y39-R114 WeakPolarHBondContact O-CD 3.37Å; Y39-R114 PolarHBondContact O-NH1 3.35Å; L41-R114 HydrophobicContact CD1-CB 3.81Å; Y111-R114 PolarHBondContact O-N 2.97Å; Y112-R114 VanDerWaalsContact C-N 3.27Å; Y112-R114 PolarHBondContact O-N 3.4Å; R114-L118 WeakPolarHBondContact O-CB 3.32Å; R114-L118 PolarHBondContact O-N 3.06Å |
| 115 | Q | 91.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 72.6 Ų | 72.6 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -65.1 | -46.8 | 177.3 | -67.1 | -179.6 | -77.7 | 0 | 0 | 111 | L44 F47 F103 S106 L107 V108 Y111 Y112 L118 F119 | L44-Q115 HydrophobicContact CD1-CG 4.46Å; F47-Q115 HydrophobicContact CE1-CB 3.97Å; F47-Q115 HydrophobicContact CE1-CG 4.11Å; F47-Q115 HydrophobicContact CE2-CG 3.87Å; F47-Q115 HydrophobicContact CZ-CB 3.68Å; F47-Q115 HydrophobicContact CZ-CG 3.46Å; F47-Q115 VanDerWaalsContact CZ-CG 3.46Å; F103-Q115 HydrophobicContact CE2-CB 4.22Å; S106-Q115 PolarHBondContact O-NE2 2.97Å; L107-Q115 HydrophobicContact CD2-CB 4.13Å; V108-Q115 PolarHBondContact O-OE1 2.98Å; Y111-Q115 WeakPolarHBondContact O-CG 3.36Å; Y111-Q115 PolarHBondContact O-N 3.25Å; Y112-Q115 PolarHBondContact O-N 3.41Å; Y112-Q115 VanDerWaalsContact O-N 3.07Å; Q115-L118 PolarHBondContact O-N 3.48Å; Q115-F119 WeakPolarHBondContact O-CB 3.4Å; Q115-F119 PolarHBondContact O-N 2.89Å |
| 116 | F | 93.6 | Very high | 92.8 | Very high | 107 Ų | 107 | 66.3 Ų | 66.3 | 47% | 0.469 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -66.2 | -40.9 | 175.4 | -81.2 | -73.1 | 0 | 0 | 0 | 112.5 | F103 L107 Y112 L118 F119 A120 | F103-F116 AromaticContact CE1-CD1 3.99Å; F103-F116 HydrophobicContact CE1-CD1 3.99Å; F103-F116 AromaticContact CE1-CE1 3.7Å; F103-F116 HydrophobicContact CE1-CE1 3.7Å; F103-F116 HydrophobicContact CE1-CZ 4.25Å; F103-F116 AromaticContact CZ-CD1 3.87Å; F103-F116 HydrophobicContact CZ-CD1 3.87Å; F103-F116 AromaticContact CZ-CE1 3.98Å; F103-F116 HydrophobicContact CZ-CE1 3.98Å; F103-F116 HydrophobicContact CZ-CG 4.26Å; F103-F116 HydrophobicContact CZ-CZ 4.44Å; L107-F116 HydrophobicContact CD1-CE2 4.44Å; L107-F116 HydrophobicContact CD1-CZ 4.3Å; L107-F116 HydrophobicContact CD2-CE2 4.15Å; L107-F116 HydrophobicContact CD2-CZ 4.47Å; Y112-F116 VanDerWaalsContact O-CD2 3.27Å; Y112-F116 WeakPolarHBondContact O-CD2 3.28Å; Y112-F116 PolarHBondContact O-N 2.95Å; F116-L118 VanDerWaalsContact C-N 3.33Å; F116-L118 PolarHBondContact O-N 3.16Å; F116-F119 PolarHBondContact O-N 3.04Å; F116-A120 WeakPolarHBondContact O-CB 3.47Å; F116-A120 PolarHBondContact O-N 3.45Å |
| 117 | S | 93.2 | Very high | 92.9 | Very high | 45 Ų | 45 | 70.5 Ų | 70.5 | 32% | 0.315 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 175.2 | -64.1 | 0 | 0 | 0 | 0 | 112.3 | M113 W121 | M113-S117 VanDerWaalsContact O-CB 3.32Å; M113-S117 WeakPolarHBondContact O-CB 3.18Å; M113-S117 PolarHBondContact O-N 3.11Å; M113-S117 PolarHBondContact O-OG 3.5Å; S117-W121 VanDerWaalsContact O-CB 3.31Å; S117-W121 WeakPolarHBondContact O-CB 3.48Å; S117-W121 PolarHBondContact O-N 3.31Å |
| 118 | L | 92.3 | Very high | 93 | Very high | 1 Ų | 1 | 71.6 Ų | 71.6 | 1% | 0.005 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -70.9 | -37.9 | 175.1 | -177.2 | 67.7 | 0 | 0 | 0 | 111.8 | Y36 Y39 L41 F47 R114 Q115 F116 A120 W121 T122 | Y36-L118 HydrophobicContact CD1-CD1 4.29Å; Y36-L118 HydrophobicContact CD1-CD2 3.9Å; Y36-L118 HydrophobicContact CE1-CD1 4.14Å; Y36-L118 HydrophobicContact CE1-CD2 3.41Å; Y36-L118 VanDerWaalsContact CE1-CD2 3.41Å; Y36-L118 HydrophobicContact CE1-CG 4.35Å; Y39-L118 HydrophobicContact CD2-CB 4.44Å; Y39-L118 HydrophobicContact CD2-CD1 4.44Å; L41-L118 HydrophobicContact CD2-CD2 4.07Å; F47-L118 HydrophobicContact CB-CD2 3.89Å; F47-L118 HydrophobicContact CD1-CD2 3.57Å; F47-L118 HydrophobicContact CD1-CG 4.48Å; F47-L118 HydrophobicContact CG-CD2 4.02Å; R114-L118 WeakPolarHBondContact O-CB 3.32Å; R114-L118 PolarHBondContact O-N 3.06Å; Q115-L118 PolarHBondContact O-N 3.48Å; F116-L118 VanDerWaalsContact C-N 3.33Å; F116-L118 PolarHBondContact O-N 3.16Å; L118-A120 VanDerWaalsContact C-N 3.35Å; L118-W121 WeakPolarHBondContact O-CB 3.28Å; L118-W121 PolarHBondContact O-N 3.39Å; L118-T122 VanDerWaalsContact O-CG2 3.27Å; L118-T122 WeakPolarHBondContact O-CG2 3.39Å; L118-T122 PolarHBondContact O-N 3.23Å; L118-T122 PolarHBondContact O-OG1 3.47Å |
| 119 | F | 94.2 | Very high | 93.2 | Very high | 30 Ų | 30 | 69 Ų | 69 | 13% | 0.132 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 173.8 | -176.4 | -93.3 | 0 | 0 | 0 | 111.8 | F54 F100 F103 Q115 F116 T122 H123 | F54-F119 HydrophobicContact CE2-CD2 4.28Å; F54-F119 AromaticContact CE2-CE2 3.74Å; F54-F119 HydrophobicContact CE2-CE2 3.74Å; F54-F119 AromaticContact CZ-CE2 3.75Å; F54-F119 HydrophobicContact CZ-CE2 3.75Å; F54-F119 HydrophobicContact CZ-CZ 4.39Å; F100-F119 AromaticContact CD2-CZ 3.94Å; F100-F119 HydrophobicContact CD2-CZ 3.94Å; F100-F119 HydrophobicContact CE2-CZ 4.23Å; F103-F119 HydrophobicContact CB-CD2 4.11Å; F103-F119 HydrophobicContact CB-CE2 3.91Å; F103-F119 AromaticContact CD1-CD2 3.64Å; F103-F119 HydrophobicContact CD1-CD2 3.64Å; F103-F119 AromaticContact CD1-CE2 3.67Å; F103-F119 HydrophobicContact CD1-CE2 3.67Å; F103-F119 HydrophobicContact CD1-CG 4.12Å; F103-F119 HydrophobicContact CD1-CZ 4.21Å; F103-F119 HydrophobicContact CD2-CB 4.28Å; F103-F119 AromaticContact CD2-CD2 3.56Å; F103-F119 HydrophobicContact CD2-CD2 3.56Å; F103-F119 HydrophobicContact CD2-CE2 4.23Å; F103-F119 HydrophobicContact CD2-CG 4.2Å; F103-F119 HydrophobicContact CE1-CB 4.26Å; F103-F119 HydrophobicContact CE1-CD1 4.27Å; F103-F119 AromaticContact CE1-CD2 3.89Å; F103-F119 HydrophobicContact CE1-CD2 3.89Å; F103-F119 HydrophobicContact CE1-CE2 4.26Å; F103-F119 AromaticContact CE1-CG 3.89Å; F103-F119 HydrophobicContact CE1-CG 3.89Å; F103-F119 HydrophobicContact CE2-CB 3.68Å; F103-F119 AromaticContact CE2-CD2 3.82Å; F103-F119 HydrophobicContact CE2-CD2 3.82Å; F103-F119 AromaticContact CE2-CG 3.97Å; F103-F119 HydrophobicContact CE2-CG 3.97Å; F103-F119 AromaticContact CG-CD2 3.45Å; F103-F119 HydrophobicContact CG-CD2 3.45Å; F103-F119 VanDerWaalsContact CG-CD2 3.45Å; F103-F119 AromaticContact CG-CE2 3.65Å; F103-F119 HydrophobicContact CG-CE2 3.65Å; F103-F119 HydrophobicContact CG-CG 4.26Å; F103-F119 HydrophobicContact CZ-CB 3.67Å; F103-F119 HydrophobicContact CZ-CD1 4.49Å; F103-F119 AromaticContact CZ-CD2 3.98Å; F103-F119 HydrophobicContact CZ-CD2 3.98Å; F103-F119 AromaticContact CZ-CG 3.81Å; F103-F119 HydrophobicContact CZ-CG 3.81Å; Q115-F119 WeakPolarHBondContact O-CB 3.4Å; Q115-F119 PolarHBondContact O-N 2.89Å; F116-F119 PolarHBondContact O-N 3.04Å; F119-T122 PolarHBondContact O-N 2.7Å; F119-T122 PolarHBondContact O-OG1 3.31Å; F119-H123 AromaticContact CD1-ND1 3.89Å; F119-H123 AromaticContact CD2-CE1 3.82Å; F119-H123 AromaticContact CE1-CE1 3.5Å; F119-H123 AromaticContact CE1-ND1 3.72Å; F119-H123 AromaticContact CE2-CE1 3.29Å; F119-H123 WeakPolarHBondContact CE2-CE1 3.39Å; F119-H123 AromaticContact CZ-CE1 3.1Å; F119-H123 WeakPolarHBondContact CZ-CE1 3.36Å; F119-H123 AromaticContact CZ-ND1 3.79Å; F119-H123 AromaticContact CZ-NE2 3.64Å; F119-H123 PolarHBondContact O-N 3.04Å; F119-H123 PolarHBondContact O-ND1 3.3Å |
| 120 | A | 95.6 | Very high | 93.5 | Very high | 51 Ų | 51 | 60.9 Ų | 60.9 | 42% | 0.421 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | F116 L118 T122 H123 V124 | F116-A120 WeakPolarHBondContact O-CB 3.47Å; F116-A120 PolarHBondContact O-N 3.45Å; L118-A120 VanDerWaalsContact C-N 3.35Å; A120-T122 VanDerWaalsContact C-N 3.33Å; A120-T122 PolarHBondContact O-N 3.4Å; A120-H123 PolarHBondContact O-N 2.89Å; A120-V124 WeakPolarHBondContact O-CB 3.47Å; A120-V124 VanDerWaalsContact O-CG2 3.31Å; A120-V124 WeakPolarHBondContact O-CG2 3.1Å; A120-V124 PolarHBondContact O-N 3.23Å |
| 121 | W | 94.2 | Very high | 93.8 | Very high | 25 Ų | 25 | 53.1 Ų | 53.1 | 10% | 0.095 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -57.3 | -44.5 | 176.3 | -174 | -81.3 | 0 | 0 | 0 | 112.5 | I31 I34 I38 Y39 S117 L118 T125 F264 F268 | I31-W121 HydrophobicContact CG2-CZ2 4.26Å; I31-W121 PolarHBondContact O-NE1 2.91Å; I34-W121 HydrophobicContact CB-CZ2 4.4Å; I34-W121 HydrophobicContact CG2-CH2 4.31Å; I34-W121 HydrophobicContact CG2-CZ2 4.06Å; I38-W121 HydrophobicContact CD1-CH2 4.14Å; Y39-W121 HydrophobicContact CE2-CE3 4.44Å; S117-W121 VanDerWaalsContact O-CB 3.31Å; S117-W121 WeakPolarHBondContact O-CB 3.48Å; S117-W121 PolarHBondContact O-N 3.31Å; L118-W121 WeakPolarHBondContact O-CB 3.28Å; L118-W121 PolarHBondContact O-N 3.39Å; W121-T125 VanDerWaalsContact O-CB 3.31Å; W121-T125 WeakPolarHBondContact O-CB 3.4Å; W121-T125 PolarHBondContact O-N 2.83Å; W121-T125 PolarHBondContact O-OG1 2.87Å; W121-F264 HydrophobicContact CH2-CE1 4.08Å; W121-F264 AromaticContact CH2-CE2 3.79Å; W121-F264 HydrophobicContact CH2-CE2 3.79Å; W121-F264 AromaticContact CH2-CZ 3.2Å; W121-F264 HydrophobicContact CH2-CZ 3.2Å; W121-F264 HydrophobicContact CZ2-CE1 4.24Å; W121-F264 HydrophobicContact CZ2-CE2 4.26Å; W121-F264 AromaticContact CZ2-CZ 3.41Å; W121-F264 HydrophobicContact CZ2-CZ 3.41Å; W121-F264 VanDerWaalsContact CZ2-CZ 3.41Å; W121-F264 HydrophobicContact CZ3-CE2 4.2Å; W121-F264 HydrophobicContact CZ3-CZ 4.06Å; W121-F268 AromaticContact CH2-CD2 4Å; W121-F268 HydrophobicContact CH2-CD2 4Å; W121-F268 HydrophobicContact CH2-CE1 4.21Å; W121-F268 AromaticContact CH2-CE2 3.58Å; W121-F268 HydrophobicContact CH2-CE2 3.58Å; W121-F268 AromaticContact CH2-CZ 3.71Å; W121-F268 HydrophobicContact CH2-CZ 3.71Å; W121-F268 HydrophobicContact CZ3-CD2 4.5Å; W121-F268 AromaticContact CZ3-CE1 3.96Å; W121-F268 HydrophobicContact CZ3-CE1 3.96Å; W121-F268 AromaticContact CZ3-CE2 3.69Å; W121-F268 HydrophobicContact CZ3-CE2 3.69Å; W121-F268 AromaticContact CZ3-CZ 3.39Å; W121-F268 HydrophobicContact CZ3-CZ 3.39Å |
| 122 | T | 95.5 | Very high | 94 | Very high | 3 Ų | 3 | 50.6 Ų | 50.6 | 2% | 0.018 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64 | -47.2 | 178.7 | 58.2 | 0 | 0 | 0 | 0 | 110.8 | I32 S51 L118 F119 A120 V124 T125 L126 | I32-T122 HydrophobicContact CD1-CG2 3.75Å; S51-T122 WeakPolarHBondContact OG-CG2 3.45Å; L118-T122 VanDerWaalsContact O-CG2 3.27Å; L118-T122 WeakPolarHBondContact O-CG2 3.39Å; L118-T122 PolarHBondContact O-N 3.23Å; L118-T122 PolarHBondContact O-OG1 3.47Å; F119-T122 PolarHBondContact O-N 2.7Å; F119-T122 PolarHBondContact O-OG1 3.31Å; A120-T122 VanDerWaalsContact C-N 3.33Å; A120-T122 PolarHBondContact O-N 3.4Å; T122-V124 PolarHBondContact O-N 3.41Å; T122-T125 PolarHBondContact O-N 2.9Å; T122-L126 WeakPolarHBondContact O-CG 3.43Å; T122-L126 PolarHBondContact O-N 3.4Å |
| 123 | H | 96.5 | Very high | 94.1 | Very high | 46 Ų | 46 | 45.7 Ų | 45.7 | 21% | 0.213 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.9 | -41.6 | -179.8 | -74.2 | 71.8 | 0 | 0 | 0 | 112.8 | Y96 F119 A120 T125 L126 L127 | Y96-H123 AromaticContact CE2-NE2 3.56Å; Y96-H123 AromaticContact CZ-NE2 3.77Å; Y96-H123 PolarHBondContact OH-NE2 2.93Å; Y96-H123 VanDerWaalsContact OH-NE2 3.1Å; F119-H123 AromaticContact CD1-ND1 3.89Å; F119-H123 AromaticContact CD2-CE1 3.82Å; F119-H123 AromaticContact CE1-CE1 3.5Å; F119-H123 AromaticContact CE1-ND1 3.72Å; F119-H123 AromaticContact CE2-CE1 3.29Å; F119-H123 WeakPolarHBondContact CE2-CE1 3.39Å; F119-H123 AromaticContact CZ-CE1 3.1Å; F119-H123 WeakPolarHBondContact CZ-CE1 3.36Å; F119-H123 AromaticContact CZ-ND1 3.79Å; F119-H123 AromaticContact CZ-NE2 3.64Å; F119-H123 PolarHBondContact O-N 3.04Å; F119-H123 PolarHBondContact O-ND1 3.3Å; A120-H123 PolarHBondContact O-N 2.89Å; H123-T125 VanDerWaalsContact C-N 3.34Å; H123-T125 PolarHBondContact O-N 3.49Å; H123-L126 PolarHBondContact O-N 2.87Å; H123-L127 WeakPolarHBondContact O-CB 3.43Å; H123-L127 PolarHBondContact O-N 3.41Å |
| 124 | V | 95.6 | Very high | 94.3 | Very high | 83 Ų | 83 | 40.5 Ų | 40.5 | 50% | 0.503 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.2 | -40.5 | 174 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | A120 T122 L127 L128 | A120-V124 WeakPolarHBondContact O-CB 3.47Å; A120-V124 VanDerWaalsContact O-CG2 3.31Å; A120-V124 WeakPolarHBondContact O-CG2 3.1Å; A120-V124 PolarHBondContact O-N 3.23Å; T122-V124 PolarHBondContact O-N 3.41Å; V124-L127 PolarHBondContact O-N 3.49Å; V124-L128 HydrophobicContact CG1-CD1 3.96Å; V124-L128 HydrophobicContact CG1-CG 4.38Å; V124-L128 WeakPolarHBondContact O-CB 3.33Å; V124-L128 WeakPolarHBondContact O-CG 3.31Å; V124-L128 PolarHBondContact O-N 3.29Å |
| 125 | T | 95.1 | Very high | 94.4 | Very high | 6 Ų | 6 | 35.9 Ų | 35.9 | 4% | 0.037 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.7 | -41.3 | 176.4 | -54.8 | 0 | 0 | 0 | 0 | 111.5 | F28 I31 I32 W121 T122 H123 L128 I129 | F28-T125 HydrophobicContact CD2-CG2 3.68Å; F28-T125 HydrophobicContact CE2-CG2 4.14Å; I31-T125 HydrophobicContact CB-CG2 3.84Å; I31-T125 HydrophobicContact CD1-CG2 4.05Å; I31-T125 HydrophobicContact CG2-CG2 3.64Å; I31-T125 WeakPolarHBondContact CG2-OG1 3.41Å; I32-T125 HydrophobicContact CD1-CG2 4.28Å; I32-T125 HydrophobicContact CG1-CG2 4.46Å; W121-T125 VanDerWaalsContact O-CB 3.31Å; W121-T125 WeakPolarHBondContact O-CB 3.4Å; W121-T125 PolarHBondContact O-N 2.83Å; W121-T125 PolarHBondContact O-OG1 2.87Å; T122-T125 PolarHBondContact O-N 2.9Å; H123-T125 VanDerWaalsContact C-N 3.34Å; H123-T125 PolarHBondContact O-N 3.49Å; T125-L128 PolarHBondContact O-N 3.14Å; T125-I129 HydrophobicContact CG2-CG1 4.12Å; T125-I129 WeakPolarHBondContact O-CB 3.26Å; T125-I129 WeakPolarHBondContact O-CG1 3.25Å; T125-I129 PolarHBondContact O-N 3.34Å |
| 126 | L | 96.5 | Very high | 94.5 | Very high | 10 Ų | 10 | 37.1 Ų | 37.1 | 5% | 0.052 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.7 | -45.2 | 176 | -67.4 | 165.9 | 0 | 0 | 0 | 110.8 | F28 F54 L55 T122 H123 L128 I129 V130 F131 | F28-L126 HydrophobicContact CD2-CD2 4.02Å; F28-L126 HydrophobicContact CE2-CD2 3.47Å; F28-L126 VanDerWaalsContact CE2-CD2 3.47Å; F28-L126 HydrophobicContact CE2-CG 3.89Å; F28-L126 HydrophobicContact CZ-CD2 4.11Å; F54-L126 HydrophobicContact CB-CD1 3.66Å; L55-L126 HydrophobicContact CB-CD2 4.25Å; L55-L126 HydrophobicContact CD1-CD2 3.76Å; T122-L126 WeakPolarHBondContact O-CG 3.43Å; T122-L126 PolarHBondContact O-N 3.4Å; H123-L126 PolarHBondContact O-N 2.87Å; L126-L128 VanDerWaalsContact C-N 3.31Å; L126-L128 PolarHBondContact O-N 3.45Å; L126-I129 PolarHBondContact O-N 3.48Å; L126-V130 HydrophobicContact CB-CG2 4.25Å; L126-V130 HydrophobicContact CD2-CG2 3.59Å; L126-V130 WeakPolarHBondContact O-CA 3.22Å; L126-V130 WeakPolarHBondContact O-CB 3.31Å; L126-V130 PolarHBondContact O-N 3.37Å; L126-F131 PolarHBondContact O-N 3.03Å |
| 127 | L | 94.7 | Very high | 94.4 | Very high | 109 Ų | 109 | 32 Ų | 32 | 57% | 0.571 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -60.6 | -39.1 | 174.9 | -178.9 | 65.3 | 0 | 0 | 0 | 112.2 | H123 V124 F131 | H123-L127 WeakPolarHBondContact O-CB 3.43Å; H123-L127 PolarHBondContact O-N 3.41Å; V124-L127 PolarHBondContact O-N 3.49Å; L127-F131 HydrophobicContact CD1-CB 4.49Å; L127-F131 WeakPolarHBondContact O-CB 3.33Å |
| 128 | L | 93.1 | Very high | 94.3 | Very high | 72 Ų | 72 | 30.2 Ų | 30.2 | 38% | 0.377 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -80 | -30.7 | -178.7 | -70.9 | 176.8 | 0 | 0 | 0 | 113.8 | V124 T125 L126 Q132 | V124-L128 HydrophobicContact CG1-CD1 3.96Å; V124-L128 HydrophobicContact CG1-CG 4.38Å; V124-L128 WeakPolarHBondContact O-CB 3.33Å; V124-L128 WeakPolarHBondContact O-CG 3.31Å; V124-L128 PolarHBondContact O-N 3.29Å; T125-L128 PolarHBondContact O-N 3.14Å; L126-L128 VanDerWaalsContact C-N 3.31Å; L126-L128 PolarHBondContact O-N 3.45Å; L128-Q132 WeakPolarHBondContact O-CB 3.41Å; L128-Q132 WeakPolarHBondContact O-CG 3.16Å |
| 129 | I | 94.6 | Very high | 94.2 | Very high | 6 Ų | 6 | 30.3 Ų | 30.3 | 3% | 0.031 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -105.8 | -49.1 | -173.4 | -55.7 | -54.7 | 0 | 0 | 0 | 111.9 | Q24 C27 I31 T125 L126 S133 M284 L291 | Q24-I129 HydrophobicContact CB-CG2 4.22Å; Q24-I129 HydrophobicContact CG-CG2 3.66Å; C27-I129 HydrophobicContact CB-CD1 4.46Å; C27-I129 HydrophobicContact CB-CG2 4.16Å; I31-I129 HydrophobicContact CD1-CD1 3.84Å; I31-I129 HydrophobicContact CD1-CG1 3.88Å; T125-I129 HydrophobicContact CG2-CG1 4.12Å; T125-I129 WeakPolarHBondContact O-CB 3.26Å; T125-I129 WeakPolarHBondContact O-CG1 3.25Å; T125-I129 PolarHBondContact O-N 3.34Å; L126-I129 PolarHBondContact O-N 3.48Å; I129-S133 PolarHBondContact O-N 2.89Å; I129-S133 PolarHBondContact O-OG 3.43Å; I129-M284 HydrophobicContact CD1-CE 4.13Å; I129-M284 HydrophobicContact CD1-SD 3.86Å; I129-L291 HydrophobicContact CD1-CD1 4.02Å; I129-L291 HydrophobicContact CD1-CD2 4.23Å |
| 130 | V | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -71.8 | -45.4 | -176.3 | -176.1 | 0 | 0 | 0 | 0 | 111 | L55 N59 F62 L126 Q132 S133 Y134 | L55-V130 HydrophobicContact CD1-CG2 3.97Å; N59-V130 WeakPolarHBondContact OD1-CG1 3.32Å; F62-V130 HydrophobicContact CB-CG1 4.41Å; F62-V130 HydrophobicContact CD2-CB 4.49Å; F62-V130 HydrophobicContact CD2-CG1 3.55Å; F62-V130 HydrophobicContact CE2-CG1 4.22Å; F62-V130 HydrophobicContact CG-CG1 4.31Å; L126-V130 HydrophobicContact CB-CG2 4.25Å; L126-V130 HydrophobicContact CD2-CG2 3.59Å; L126-V130 WeakPolarHBondContact O-CA 3.22Å; L126-V130 WeakPolarHBondContact O-CB 3.31Å; L126-V130 PolarHBondContact O-N 3.37Å; V130-Q132 VanDerWaalsContact C-N 3.25Å; V130-Q132 PolarHBondContact O-N 3.23Å; V130-S133 PolarHBondContact O-N 2.88Å; V130-S133 PolarHBondContact O-OG 3.45Å; V130-Y134 WeakPolarHBondContact O-CB 3.25Å; V130-Y134 PolarHBondContact O-N 2.94Å |
| 131 | F | 94.2 | Very high | 93.4 | Very high | 72 Ų | 72 | 27.7 Ų | 27.7 | 32% | 0.316 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -61.6 | -40.4 | 177.6 | -177.4 | -119.7 | 0 | 0 | 0 | 110.6 | F62 L126 L127 Y134 L135 | F62-F131 AromaticContact CE1-CD2 3.77Å; F62-F131 HydrophobicContact CE1-CD2 3.77Å; F62-F131 HydrophobicContact CE1-CE2 4.42Å; F62-F131 HydrophobicContact CZ-CD2 4.09Å; L126-F131 PolarHBondContact O-N 3.03Å; L127-F131 HydrophobicContact CD1-CB 4.49Å; L127-F131 WeakPolarHBondContact O-CB 3.33Å; F131-Y134 HydrophobicContact CD2-CD1 4.33Å; F131-Y134 HydrophobicContact CE2-CD1 4.4Å; F131-Y134 WeakPolarHBondContact O-CB 3.49Å; F131-Y134 PolarHBondContact O-N 3.4Å; F131-L135 HydrophobicContact CD1-CD1 4.13Å; F131-L135 HydrophobicContact CE1-CD1 3.7Å; F131-L135 HydrophobicContact CE1-CG 4.35Å; F131-L135 HydrophobicContact CE2-CD2 4.13Å; F131-L135 HydrophobicContact CE2-CG 4.43Å; F131-L135 HydrophobicContact CZ-CD1 3.95Å; F131-L135 HydrophobicContact CZ-CD2 4.03Å; F131-L135 HydrophobicContact CZ-CG 4.25Å; F131-L135 WeakPolarHBondContact O-CG 3.31Å; F131-L135 PolarHBondContact O-N 3.29Å |
| 132 | Q | 93.6 | Very high | 92.9 | Very high | 22 Ų | 22 | 28.4 Ų | 28.4 | 10% | 0.103 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -66.1 | -42.5 | 177.8 | -65.9 | -58.9 | -23.9 | 0 | 0 | 112.7 | L128 V130 Y134 L135 I136 L291 T295 | L128-Q132 WeakPolarHBondContact O-CB 3.41Å; L128-Q132 WeakPolarHBondContact O-CG 3.16Å; V130-Q132 VanDerWaalsContact C-N 3.25Å; V130-Q132 PolarHBondContact O-N 3.23Å; Q132-Y134 VanDerWaalsContact C-N 3.28Å; Q132-Y134 PolarHBondContact O-N 3.5Å; Q132-L135 PolarHBondContact O-N 3.26Å; Q132-I136 VanDerWaalsContact O-CG1 3.32Å; Q132-I136 WeakPolarHBondContact O-CG1 3.44Å; Q132-I136 PolarHBondContact O-N 3.48Å; Q132-L291 HydrophobicContact CB-CD2 3.66Å; Q132-L291 HydrophobicContact CG-CB 4.26Å; Q132-L291 HydrophobicContact CG-CD2 3.94Å; Q132-L291 PolarHBondContact OE1-O 2.95Å; Q132-T295 PolarHBondContact NE2-OG1 2.91Å; Q132-T295 PolarHBondContact OE1-OG1 2.84Å |
| 133 | S | 94.3 | Very high | 92.1 | Very high | 5 Ų | 5 | 29 Ų | 29 | 4% | 0.035 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.8 | -37.4 | 175.5 | 72.1 | 0 | 0 | 0 | 0 | 111.8 | Y63 I129 V130 I136 I137 | Y63-S133 WeakPolarHBondContact OH-CB 3.36Å; Y63-S133 PolarHBondContact OH-OG 3Å; I129-S133 PolarHBondContact O-N 2.89Å; I129-S133 PolarHBondContact O-OG 3.43Å; V130-S133 PolarHBondContact O-N 2.88Å; V130-S133 PolarHBondContact O-OG 3.45Å; S133-I136 PolarHBondContact O-N 3.44Å; S133-I137 WeakPolarHBondContact O-CD1 3.27Å; S133-I137 VanDerWaalsContact O-CG1 3.28Å; S133-I137 WeakPolarHBondContact O-CG1 3.37Å; S133-I137 PolarHBondContact O-N 3.42Å |
| 134 | Y | 94.2 | Very high | 91.4 | Very high | 47 Ų | 47 | 28.6 Ų | 28.6 | 18% | 0.184 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.2 | -48.3 | 172.2 | 167.2 | -103.8 | 0 | 0 | 0 | 112.5 | F62 A66 V130 F131 Q132 I136 I137 Q138 | F62-Y134 HydrophobicContact CB-CD2 3.89Å; F62-Y134 HydrophobicContact CB-CG 4.01Å; F62-Y134 AromaticContact CD1-CD1 3.97Å; F62-Y134 HydrophobicContact CD1-CD1 3.97Å; F62-Y134 HydrophobicContact CD1-CD2 4.25Å; F62-Y134 HydrophobicContact CD1-CE1 4.43Å; F62-Y134 AromaticContact CD1-CG 3.88Å; F62-Y134 HydrophobicContact CD1-CG 3.88Å; F62-Y134 HydrophobicContact CG-CG 4.3Å; F62-Y134 WeakPolarHBondContact O-CD2 3.19Å; F62-Y134 VanDerWaalsContact O-CE2 3.24Å; F62-Y134 WeakPolarHBondContact O-CE2 3.44Å; A66-Y134 HydrophobicContact CB-CD2 4.05Å; A66-Y134 HydrophobicContact CB-CE2 3.83Å; V130-Y134 WeakPolarHBondContact O-CB 3.25Å; V130-Y134 PolarHBondContact O-N 2.94Å; F131-Y134 HydrophobicContact CD2-CD1 4.33Å; F131-Y134 HydrophobicContact CE2-CD1 4.4Å; F131-Y134 WeakPolarHBondContact O-CB 3.49Å; F131-Y134 PolarHBondContact O-N 3.4Å; Q132-Y134 VanDerWaalsContact C-N 3.28Å; Q132-Y134 PolarHBondContact O-N 3.5Å; Y134-I136 VanDerWaalsContact C-N 3.33Å; Y134-I136 PolarHBondContact O-N 3.16Å; Y134-I137 PolarHBondContact O-N 3.06Å; Y134-Q138 HydrophobicContact CD2-CG 4.37Å; Y134-Q138 HydrophobicContact CE1-CG 4.25Å; Y134-Q138 HydrophobicContact CE2-CG 3.98Å; Y134-Q138 VanDerWaalsContact O-CG 3.32Å; Y134-Q138 WeakPolarHBondContact O-CG 3.29Å; Y134-Q138 PolarHBondContact O-N 3.27Å |
| 135 | L | 94.3 | Very high | 90.8 | Very high | 14 Ų | 14 | 25.8 Ų | 25.8 | 7% | 0.073 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.5 | -38.9 | 177.7 | -59.9 | 179.2 | 0 | 0 | 0 | 112 | F131 Q132 Q138 N139 T295 R298 | F131-L135 HydrophobicContact CD1-CD1 4.13Å; F131-L135 HydrophobicContact CE1-CD1 3.7Å; F131-L135 HydrophobicContact CE1-CG 4.35Å; F131-L135 HydrophobicContact CE2-CD2 4.13Å; F131-L135 HydrophobicContact CE2-CG 4.43Å; F131-L135 HydrophobicContact CZ-CD1 3.95Å; F131-L135 HydrophobicContact CZ-CD2 4.03Å; F131-L135 HydrophobicContact CZ-CG 4.25Å; F131-L135 WeakPolarHBondContact O-CG 3.31Å; F131-L135 PolarHBondContact O-N 3.29Å; Q132-L135 PolarHBondContact O-N 3.26Å; L135-Q138 WeakPolarHBondContact O-CB 3.2Å; L135-Q138 PolarHBondContact O-N 3.14Å; L135-N139 PolarHBondContact O-N 2.8Å; L135-N139 PolarHBondContact O-ND2 3.3Å; L135-N139 PolarHBondContact O-OD1 3.19Å; L135-T295 HydrophobicContact CD1-CG2 4.1Å; L135-T295 WeakPolarHBondContact CD1-OG1 3.47Å; L135-R298 HydrophobicContact CB-CB 4.27Å; L135-R298 HydrophobicContact CD2-CB 4.47Å; L135-R298 HydrophobicContact CD2-CG 3.94Å |
| 136 | I | 93.4 | Very high | 90.4 | Very high | 25 Ų | 25 | 27 Ų | 27 | 13% | 0.128 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -63.3 | -42.1 | 175.9 | -69.9 | 168.6 | 0 | 0 | 0 | 111 | V20 Q132 S133 Y134 N139 I140 F147 | V20-I136 HydrophobicContact CG1-CB 4.46Å; V20-I136 HydrophobicContact CG1-CG2 4.13Å; V20-I136 HydrophobicContact CG2-CG2 3.83Å; Q132-I136 VanDerWaalsContact O-CG1 3.32Å; Q132-I136 WeakPolarHBondContact O-CG1 3.44Å; Q132-I136 PolarHBondContact O-N 3.48Å; S133-I136 PolarHBondContact O-N 3.44Å; Y134-I136 VanDerWaalsContact C-N 3.33Å; Y134-I136 PolarHBondContact O-N 3.16Å; I136-N139 WeakPolarHBondContact O-CB 3.34Å; I136-N139 PolarHBondContact O-N 2.92Å; I136-I140 HydrophobicContact CG2-CD1 4.34Å; I136-I140 WeakPolarHBondContact O-CG1 3.17Å; I136-I140 PolarHBondContact O-N 3.36Å; I136-F147 HydrophobicContact CG2-CD2 3.66Å; I136-F147 HydrophobicContact CG2-CE2 3.58Å |
| 137 | I | 91.8 | Very high | 90 | Very high | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.005 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -64.8 | -41.9 | 177 | -73.1 | 165.1 | 0 | 0 | 0 | 111.3 | I17 V20 Y63 A66 M67 S133 Y134 N139 I140 F141 | I17-I137 HydrophobicContact CD1-CG2 4.47Å; I17-I137 HydrophobicContact CG1-CG1 4.37Å; I17-I137 HydrophobicContact CG1-CG2 4.19Å; I17-I137 HydrophobicContact CG2-CD1 4.07Å; I17-I137 HydrophobicContact CG2-CG1 4.24Å; I17-I137 HydrophobicContact CG2-CG2 4.47Å; V20-I137 HydrophobicContact CB-CG1 4.43Å; V20-I137 HydrophobicContact CG1-CD1 4.15Å; V20-I137 HydrophobicContact CG1-CG1 3.99Å; Y63-I137 HydrophobicContact CD1-CD1 3.72Å; Y63-I137 HydrophobicContact CE1-CD1 3.03Å; Y63-I137 HydrophobicContact CE2-CD1 4.4Å; Y63-I137 VanDerWaalsContact CZ-CD1 3.42Å; A66-I137 HydrophobicContact CB-CG2 4.34Å; M67-I137 HydrophobicContact CE-CG2 4.03Å; S133-I137 WeakPolarHBondContact O-CD1 3.27Å; S133-I137 VanDerWaalsContact O-CG1 3.28Å; S133-I137 WeakPolarHBondContact O-CG1 3.37Å; S133-I137 PolarHBondContact O-N 3.42Å; Y134-I137 PolarHBondContact O-N 3.06Å; I137-N139 VanDerWaalsContact C-N 3.28Å; I137-N139 PolarHBondContact O-N 3.03Å; I137-I140 WeakPolarHBondContact O-CB 2.9Å; I137-I140 PolarHBondContact O-N 2.99Å; I137-I140 VanDerWaalsContact O-N 3.11Å; I137-F141 HydrophobicContact CG2-CD2 3.77Å; I137-F141 HydrophobicContact CG2-CE2 3.43Å; I137-F141 VanDerWaalsContact CG2-CE2 3.43Å; I137-F141 HydrophobicContact CG2-CZ 4.35Å; I137-F141 VanDerWaalsContact O-CD2 3.25Å; I137-F141 WeakPolarHBondContact O-CD2 3.27Å; I137-F141 PolarHBondContact O-N 3.01Å |
| 138 | Q | 90 | Very high | 89.7 | Confident | 6 Ų | 6 | 22.7 Ų | 22.7 | 3% | 0.028 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -56.2 | -45.1 | 171.6 | -70.6 | -76.5 | -35.6 | 0 | 0 | 110.5 | Y134 L135 I140 F141 E142 | Y134-Q138 HydrophobicContact CD2-CG 4.37Å; Y134-Q138 HydrophobicContact CE1-CG 4.25Å; Y134-Q138 HydrophobicContact CE2-CG 3.98Å; Y134-Q138 VanDerWaalsContact O-CG 3.32Å; Y134-Q138 WeakPolarHBondContact O-CG 3.29Å; Y134-Q138 PolarHBondContact O-N 3.27Å; L135-Q138 WeakPolarHBondContact O-CB 3.2Å; L135-Q138 PolarHBondContact O-N 3.14Å; Q138-I140 VanDerWaalsContact C-N 3.33Å; Q138-I140 PolarHBondContact O-N 2.8Å; Q138-F141 PolarHBondContact O-N 2.61Å; Q138-E142 VanDerWaalsContact O-CG 3.28Å; Q138-E142 WeakPolarHBondContact O-CG 3.47Å; Q138-E142 PolarHBondContact O-N 3.45Å |
| 139 | N | 90.6 | Very high | 89.4 | Confident | 4 Ų | 4 | 19.4 Ų | 19.4 | 2% | 0.021 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -62.2 | -37.3 | 176 | -59.8 | -25.5 | 0 | 0 | 0 | 113 | L135 I136 I137 F141 E142 G143 G294 V297 R298 | L135-N139 PolarHBondContact O-N 2.8Å; L135-N139 PolarHBondContact O-ND2 3.3Å; L135-N139 PolarHBondContact O-OD1 3.19Å; I136-N139 WeakPolarHBondContact O-CB 3.34Å; I136-N139 PolarHBondContact O-N 2.92Å; I137-N139 VanDerWaalsContact C-N 3.28Å; I137-N139 PolarHBondContact O-N 3.03Å; N139-F141 VanDerWaalsContact C-N 3.32Å; N139-F141 PolarHBondContact O-N 3.46Å; N139-E142 PolarHBondContact O-N 3.35Å; N139-G143 PolarHBondContact O-N 3.4Å; N139-G143 VanDerWaalsContact O-O 3.13Å; N139-G294 PolarHBondContact ND2-O 3.35Å; N139-V297 HydrophobicContact CB-CG1 4.2Å; N139-R298 WeakPolarHBondContact OD1-CA 3.2Å; N139-R298 VanDerWaalsContact OD1-CB 3.28Å; N139-R298 WeakPolarHBondContact OD1-CB 3.07Å; N139-R298 PolarHBondContact OD1-N 3.05Å |
| 140 | I | 89.2 | Confident | 89.3 | Confident | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -61.1 | -44.4 | 175.5 | -69.1 | 164.9 | 0 | 0 | 0 | 110.4 | P13 M16 I17 V20 I136 I137 Q138 E142 G143 F147 | P13-I140 HydrophobicContact CB-CG2 4.03Å; M16-I140 HydrophobicContact CB-CD1 3.81Å; M16-I140 HydrophobicContact CB-CG1 4.47Å; M16-I140 HydrophobicContact CB-CG2 4.36Å; M16-I140 HydrophobicContact SD-CG2 4.37Å; I17-I140 HydrophobicContact CG1-CD1 4.32Å; I17-I140 HydrophobicContact CG1-CG2 4.25Å; V20-I140 HydrophobicContact CG2-CD1 4.08Å; I136-I140 HydrophobicContact CG2-CD1 4.34Å; I136-I140 WeakPolarHBondContact O-CG1 3.17Å; I136-I140 PolarHBondContact O-N 3.36Å; I137-I140 WeakPolarHBondContact O-CB 2.9Å; I137-I140 PolarHBondContact O-N 2.99Å; I137-I140 VanDerWaalsContact O-N 3.11Å; Q138-I140 VanDerWaalsContact C-N 3.33Å; Q138-I140 PolarHBondContact O-N 2.8Å; I140-E142 VanDerWaalsContact C-N 3.31Å; I140-E142 PolarHBondContact O-N 2.82Å; I140-G143 CarbonylContact O-C 3.47Å; I140-G143 PolarHBondContact O-N 2.9Å; I140-G143 VanDerWaalsContact O-N 3.15Å; I140-F147 HydrophobicContact CD1-CD1 4.31Å; I140-F147 HydrophobicContact CD1-CD2 4.1Å; I140-F147 HydrophobicContact CD1-CE2 4.3Å; I140-F147 HydrophobicContact CD1-CG 4.1Å; I140-F147 HydrophobicContact CD1-CZ 4.49Å; I140-F147 HydrophobicContact CG1-CB 3.57Å; I140-F147 HydrophobicContact CG1-CD1 3.96Å; I140-F147 HydrophobicContact CG1-CD2 3.83Å; I140-F147 HydrophobicContact CG1-CG 3.51Å |
| 141 | F | 85 | Confident | 89.1 | Confident | 25 Ų | 25 | 20.2 Ų | 20.2 | 11% | 0.11 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -69.6 | -28.3 | 179.6 | -72.3 | -57.5 | 0 | 0 | 0 | 113.9 | I17 A66 M67 Y70 F71 I137 Q138 N139 G143 | I17-F141 HydrophobicContact CD1-CD1 4.33Å; I17-F141 HydrophobicContact CD1-CE1 3.62Å; I17-F141 HydrophobicContact CD1-CE2 4.15Å; I17-F141 HydrophobicContact CD1-CZ 3.52Å; A66-F141 HydrophobicContact CB-CE2 4.3Å; M67-F141 HydrophobicContact CE-CE2 3.5Å; M67-F141 VanDerWaalsContact CE-CE2 3.5Å; M67-F141 HydrophobicContact CE-CZ 3.35Å; M67-F141 HydrophobicContact SD-CE2 4.39Å; M67-F141 HydrophobicContact SD-CZ 3.77Å; Y70-F141 HydrophobicContact CD1-CB 4.17Å; Y70-F141 AromaticContact CD1-CD1 3.93Å; Y70-F141 HydrophobicContact CD1-CD1 3.93Å; Y70-F141 HydrophobicContact CD1-CE1 4.46Å; Y70-F141 HydrophobicContact CD1-CG 4.15Å; Y70-F141 HydrophobicContact CD2-CB 4.03Å; Y70-F141 AromaticContact CD2-CD1 3.81Å; Y70-F141 HydrophobicContact CD2-CD1 3.81Å; Y70-F141 AromaticContact CD2-CD2 3.47Å; Y70-F141 HydrophobicContact CD2-CD2 3.47Å; Y70-F141 VanDerWaalsContact CD2-CD2 3.47Å; Y70-F141 HydrophobicContact CD2-CE1 4Å; Y70-F141 AromaticContact CD2-CE2 3.66Å; Y70-F141 HydrophobicContact CD2-CE2 3.66Å; Y70-F141 AromaticContact CD2-CG 3.54Å; Y70-F141 HydrophobicContact CD2-CG 3.54Å; Y70-F141 AromaticContact CD2-CZ 3.91Å; Y70-F141 HydrophobicContact CD2-CZ 3.91Å; Y70-F141 HydrophobicContact CE1-CB 3.56Å; Y70-F141 HydrophobicContact CE1-CD1 4.2Å; Y70-F141 HydrophobicContact CE1-CG 4.01Å; Y70-F141 HydrophobicContact CE2-CB 3.42Å; Y70-F141 VanDerWaalsContact CE2-CB 3.42Å; Y70-F141 HydrophobicContact CE2-CD1 4.11Å; Y70-F141 AromaticContact CE2-CD2 3.38Å; Y70-F141 HydrophobicContact CE2-CD2 3.38Å; Y70-F141 HydrophobicContact CE2-CE2 4.03Å; Y70-F141 AromaticContact CE2-CG 3.42Å; Y70-F141 HydrophobicContact CE2-CG 3.42Å; Y70-F141 VanDerWaalsContact CE2-CG 3.42Å; Y70-F141 HydrophobicContact CG-CB 4.39Å; Y70-F141 AromaticContact CG-CD1 3.75Å; Y70-F141 HydrophobicContact CG-CD1 3.75Å; Y70-F141 HydrophobicContact CG-CD2 4.27Å; Y70-F141 AromaticContact CG-CE1 3.91Å; Y70-F141 HydrophobicContact CG-CE1 3.91Å; Y70-F141 HydrophobicContact CG-CE2 4.39Å; Y70-F141 AromaticContact CG-CG 3.94Å; Y70-F141 HydrophobicContact CG-CG 3.94Å; Y70-F141 HydrophobicContact CG-CZ 4.21Å; Y70-F141 AromaticContact CZ-CG 3.68Å; Y70-F141 VanDerWaalsContact OH-CB 3.25Å; Y70-F141 WeakPolarHBondContact OH-CB 3.44Å; F71-F141 HydrophobicContact CE2-CE1 4.25Å; F71-F141 HydrophobicContact CE2-CZ 4.25Å; I137-F141 HydrophobicContact CG2-CD2 3.77Å; I137-F141 HydrophobicContact CG2-CE2 3.43Å; I137-F141 VanDerWaalsContact CG2-CE2 3.43Å; I137-F141 HydrophobicContact CG2-CZ 4.35Å; I137-F141 VanDerWaalsContact O-CD2 3.25Å; I137-F141 WeakPolarHBondContact O-CD2 3.27Å; I137-F141 PolarHBondContact O-N 3.01Å; Q138-F141 PolarHBondContact O-N 2.61Å; N139-F141 VanDerWaalsContact C-N 3.32Å; N139-F141 PolarHBondContact O-N 3.46Å; F141-G143 PolarHBondContact O-N 3.3Å |
| 142 | E | 82.1 | Confident | 88.8 | Confident | 41 Ų | 41 | 19.1 Ų | 19.1 | 19% | 0.192 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -68.3 | -19.5 | 172 | -67 | -66.7 | -166.1 | 0 | 0 | 113.3 | Q138 N139 I140 R298 I301 K309 | Q138-E142 VanDerWaalsContact O-CG 3.28Å; Q138-E142 WeakPolarHBondContact O-CG 3.47Å; Q138-E142 PolarHBondContact O-N 3.45Å; N139-E142 PolarHBondContact O-N 3.35Å; I140-E142 VanDerWaalsContact C-N 3.31Å; I140-E142 PolarHBondContact O-N 2.82Å; E142-R298 IonicContact OE1-NH1 2.83Å; E142-R298 PolarHBondContact OE1-NH1 3.43Å; E142-I301 HydrophobicContact CB-CD1 4.27Å; E142-I301 HydrophobicContact CG-CG2 4.27Å; E142-K309 IonicContact OE1-NZ 3.59Å; E142-K309 PolarHBondContact OE1-NZ 2.93Å; E142-K309 WeakPolarHBondContact OE2-CE 3.25Å; E142-K309 IonicContact OE2-NZ 3.69Å; E142-K309 PolarHBondContact OE2-NZ 2.67Å |
| 143 | G | 79.8 | Confident | 88.8 | Confident | 16 Ų | 16 | 18.1 Ų | 18.1 | 17% | 0.165 | 9% | 0.093 | C | C | . | . | trans | 147.9 | 135.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | N139 I140 F141 I145 W146 | N139-G143 PolarHBondContact O-N 3.4Å; N139-G143 VanDerWaalsContact O-O 3.13Å; I140-G143 CarbonylContact O-C 3.47Å; I140-G143 PolarHBondContact O-N 2.9Å; I140-G143 VanDerWaalsContact O-N 3.15Å; F141-G143 PolarHBondContact O-N 3.3Å; G143-I145 PolarHBondContact O-N 2.85Å; G143-W146 WeakPolarHBondContact O-CB 3.33Å; G143-W146 PolarHBondContact O-N 3.18Å | ||
| 144 | T | 82 | Confident | 88.8 | Confident | 36 Ų | 36 | 18 Ų | 18 | 22% | 0.221 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -55 | -31.4 | -179.4 | 54.1 | 0 | 0 | 0 | 0 | 112.3 | P13 M16 W146 F147 L148 F209 | P13-T144 HydrophobicContact CG-CG2 4.03Å; M16-T144 HydrophobicContact CE-CG2 4.07Å; M16-T144 HydrophobicContact SD-CG2 4.16Å; T144-W146 VanDerWaalsContact C-N 3.29Å; T144-W146 PolarHBondContact O-N 3.5Å; T144-F147 PolarHBondContact O-N 3.5Å; T144-F147 VanDerWaalsContact O-N 3.08Å; T144-L148 WeakPolarHBondContact O-CB 3.22Å; T144-L148 VanDerWaalsContact O-CG 3.27Å; T144-L148 WeakPolarHBondContact O-CG 3.41Å; T144-L148 PolarHBondContact O-N 2.93Å; T144-F209 HydrophobicContact CG2-CE2 4.35Å |
| 145 | I | 82.3 | Confident | 88.6 | Confident | 25 Ų | 25 | 17.1 Ų | 17.1 | 13% | 0.128 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -59.4 | -37.4 | 176.3 | -166.7 | 63.8 | 0 | 0 | 0 | 113 | G143 F147 L148 L149 F203 F223 F239 | G143-I145 PolarHBondContact O-N 2.85Å; I145-F147 PolarHBondContact O-N 2.79Å; I145-L148 PolarHBondContact O-N 3.45Å; I145-L149 HydrophobicContact CD1-CB 4.25Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 PolarHBondContact O-N 3.34Å; I145-F203 HydrophobicContact CD1-CB 4.11Å; I145-F203 HydrophobicContact CD1-CD1 3.5Å; I145-F203 HydrophobicContact CD1-CD2 4.36Å; I145-F203 HydrophobicContact CD1-CE1 3.92Å; I145-F203 HydrophobicContact CD1-CG 3.73Å; I145-F203 HydrophobicContact CD1-CZ 4.49Å; I145-F223 HydrophobicContact CG1-CZ 4.37Å; I145-F239 HydrophobicContact CD1-CE2 4.3Å; I145-F239 HydrophobicContact CD1-CZ 4.04Å; I145-F239 HydrophobicContact CG1-CE2 3.66Å; I145-F239 HydrophobicContact CG1-CZ 3.93Å |
| 146 | W | 86.6 | Confident | 88.5 | Confident | 32 Ų | 32 | 17.8 Ų | 17.8 | 12% | 0.121 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -71.8 | -14.1 | 179 | -66.1 | 116.8 | 0 | 0 | 0 | 112.8 | G143 T144 P150 H242 L246 V297 F300 I301 I304 | G143-W146 WeakPolarHBondContact O-CB 3.33Å; G143-W146 PolarHBondContact O-N 3.18Å; T144-W146 VanDerWaalsContact C-N 3.29Å; T144-W146 PolarHBondContact O-N 3.5Å; W146-P150 WeakPolarHBondContact O-CD 3.25Å; W146-P150 VanDerWaalsContact O-CG 3.29Å; W146-P150 WeakPolarHBondContact O-CG 3.32Å; W146-H242 HydrophobicContact CH2-CB 4.17Å; W146-H242 HydrophobicContact CZ3-CB 4.45Å; W146-L246 HydrophobicContact CE3-CD1 4.38Å; W146-L246 HydrophobicContact CZ3-CD1 4.17Å; W146-V297 HydrophobicContact CB-CG1 4.28Å; W146-V297 HydrophobicContact CE3-CG1 4.35Å; W146-V297 WeakPolarHBondContact O-CG1 3.43Å; W146-F300 HydrophobicContact CH2-CE1 4.44Å; W146-F300 HydrophobicContact CZ3-CD1 4.06Å; W146-F300 HydrophobicContact CZ3-CE1 4.11Å; W146-I301 HydrophobicContact CB-CD1 3.63Å; W146-I301 HydrophobicContact CD2-CD1 3.49Å; W146-I301 VanDerWaalsContact CD2-CD1 3.49Å; W146-I301 HydrophobicContact CD2-CG1 3.65Å; W146-I301 HydrophobicContact CE3-CD1 3.79Å; W146-I301 HydrophobicContact CE3-CG1 3.68Å; W146-I301 HydrophobicContact CG-CD1 3.41Å; W146-I301 VanDerWaalsContact CG-CD1 3.41Å; W146-I301 HydrophobicContact CG-CG1 4.12Å; W146-I301 HydrophobicContact CH2-CG1 4.3Å; W146-I301 HydrophobicContact CZ2-CG1 4.28Å; W146-I301 HydrophobicContact CZ3-CG1 4.01Å; W146-I304 HydrophobicContact CH2-CD1 4.25Å |
| 147 | F | 89.3 | Confident | 88.5 | Confident | 19 Ų | 19 | 16.8 Ų | 16.8 | 8% | 0.083 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -95.2 | -49.2 | 169.4 | 171.5 | -113.3 | 0 | 0 | 0 | 111.6 | F5 M16 V20 I136 I140 T144 I145 V151 | F5-F147 AromaticContact CE2-CE1 3.94Å; F5-F147 HydrophobicContact CE2-CE1 3.94Å; F5-F147 HydrophobicContact CE2-CZ 4.17Å; F5-F147 HydrophobicContact CZ-CE1 4.09Å; M16-F147 HydrophobicContact CB-CE1 4.27Å; M16-F147 HydrophobicContact CG-CD1 4.43Å; M16-F147 HydrophobicContact CG-CE1 4.21Å; M16-F147 HydrophobicContact SD-CD1 3.69Å; M16-F147 HydrophobicContact SD-CE1 4.04Å; V20-F147 HydrophobicContact CG2-CE2 4.17Å; V20-F147 HydrophobicContact CG2-CZ 4.23Å; I136-F147 HydrophobicContact CG2-CD2 3.66Å; I136-F147 HydrophobicContact CG2-CE2 3.58Å; I140-F147 HydrophobicContact CD1-CD1 4.31Å; I140-F147 HydrophobicContact CD1-CD2 4.1Å; I140-F147 HydrophobicContact CD1-CE2 4.3Å; I140-F147 HydrophobicContact CD1-CG 4.1Å; I140-F147 HydrophobicContact CD1-CZ 4.49Å; I140-F147 HydrophobicContact CG1-CB 3.57Å; I140-F147 HydrophobicContact CG1-CD1 3.96Å; I140-F147 HydrophobicContact CG1-CD2 3.83Å; I140-F147 HydrophobicContact CG1-CG 3.51Å; T144-F147 PolarHBondContact O-N 3.5Å; T144-F147 VanDerWaalsContact O-N 3.08Å; I145-F147 PolarHBondContact O-N 2.79Å; F147-V151 HydrophobicContact CD2-CG2 4.13Å; F147-V151 HydrophobicContact CE2-CG2 3.84Å; F147-V151 HydrophobicContact CZ-CG2 4.24Å; F147-V151 VanDerWaalsContact O-CG2 3.25Å; F147-V151 WeakPolarHBondContact O-CG2 3.21Å; F147-V151 PolarHBondContact O-N 3.2Å |
| 148 | L | 87.3 | Confident | 88.4 | Confident | 9 Ų | 9 | 19.6 Ų | 19.6 | 5% | 0.047 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -69.4 | -45.9 | -170.7 | -64.2 | -179.3 | 0 | 0 | 0 | 113.2 | F5 I9 M16 T144 I145 V151 L152 | F5-L148 HydrophobicContact CE1-CD2 3.65Å; F5-L148 HydrophobicContact CE2-CD2 4.3Å; F5-L148 HydrophobicContact CZ-CD2 3.37Å; I9-L148 HydrophobicContact CD1-CD1 3.99Å; I9-L148 HydrophobicContact CD1-CD2 3.61Å; I9-L148 HydrophobicContact CD1-CG 4.42Å; I9-L148 HydrophobicContact CG1-CD1 4.03Å; I9-L148 HydrophobicContact CG1-CD2 3.56Å; I9-L148 HydrophobicContact CG1-CG 4.45Å; I9-L148 HydrophobicContact CG2-CD1 3.98Å; M16-L148 HydrophobicContact CE-CD1 4.16Å; M16-L148 HydrophobicContact CE-CD2 4.05Å; M16-L148 HydrophobicContact CE-CG 4.33Å; T144-L148 WeakPolarHBondContact O-CB 3.22Å; T144-L148 VanDerWaalsContact O-CG 3.27Å; T144-L148 WeakPolarHBondContact O-CG 3.41Å; T144-L148 PolarHBondContact O-N 2.93Å; I145-L148 PolarHBondContact O-N 3.45Å; L148-V151 PolarHBondContact O-N 2.85Å; L148-L152 WeakPolarHBondContact O-CB 3.44Å; L148-L152 WeakPolarHBondContact O-CG 3.42Å; L148-L152 PolarHBondContact O-N 2.91Å |
| 149 | L | 88.1 | Confident | 88.4 | Confident | 3 Ų | 3 | 24.5 Ų | 24.5 | 2% | 0.016 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.9 | -52.3 | -177.7 | 171.3 | 63.7 | 0 | 0 | 0 | 111.3 | I145 V151 L152 L153 V199 F239 A243 L246 | I145-L149 HydrophobicContact CD1-CB 4.25Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 PolarHBondContact O-N 3.34Å; L149-V151 VanDerWaalsContact C-N 3.34Å; L149-V151 PolarHBondContact O-N 3.41Å; L149-L152 PolarHBondContact O-N 3.37Å; L149-L153 HydrophobicContact CD1-CD1 3.86Å; L149-L153 HydrophobicContact CD1-CD2 4.25Å; L149-L153 HydrophobicContact CD1-CG 3.87Å; L149-L153 HydrophobicContact CG-CD1 3.9Å; L149-L153 HydrophobicContact CG-CG 4.36Å; L149-L153 VanDerWaalsContact O-CG 3.29Å; L149-L153 WeakPolarHBondContact O-CG 3.5Å; L149-L153 PolarHBondContact O-N 3.46Å; L149-V199 HydrophobicContact CD1-CB 4.3Å; L149-V199 HydrophobicContact CD1-CG1 3.77Å; L149-V199 HydrophobicContact CD1-CG2 4.09Å; L149-F239 HydrophobicContact CD2-CE2 4.21Å; L149-F239 HydrophobicContact CD2-CZ 3.82Å; L149-A243 HydrophobicContact CD2-CB 3.95Å; L149-L246 HydrophobicContact CD2-CD1 3.92Å; L149-L246 HydrophobicContact CG-CD1 4.41Å |
| 150 | P | 92 | Very high | 88.5 | Confident | 5 Ų | 5 | 25.3 Ų | 25.3 | 3% | 0.032 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -53 | -45.7 | 174.6 | -35 | 42.6 | 0 | 0 | 0 | 115 | W146 L152 L153 I154 L246 M293 V297 | W146-P150 WeakPolarHBondContact O-CD 3.25Å; W146-P150 VanDerWaalsContact O-CG 3.29Å; W146-P150 WeakPolarHBondContact O-CG 3.32Å; P150-L152 PolarHBondContact O-N 2.85Å; P150-L153 PolarHBondContact O-N 2.87Å; P150-I154 WeakPolarHBondContact O-CG1 3.36Å; P150-I154 PolarHBondContact O-N 2.97Å; P150-I154 VanDerWaalsContact O-N 3.12Å; P150-L246 HydrophobicContact CG-CD1 4.19Å; P150-L246 HydrophobicContact CG-CD2 4.44Å; P150-M293 HydrophobicContact CB-CE 3.47Å; P150-M293 VanDerWaalsContact CB-CE 3.47Å; P150-M293 HydrophobicContact CB-CG 3.69Å; P150-M293 HydrophobicContact CB-SD 4.41Å; P150-M293 HydrophobicContact CG-CE 3.98Å; P150-V297 HydrophobicContact CB-CG2 3.72Å; P150-V297 HydrophobicContact CG-CB 4.47Å; P150-V297 HydrophobicContact CG-CG1 4.35Å; P150-V297 HydrophobicContact CG-CG2 3.33Å |
| 151 | V | 90.7 | Very high | 88.7 | Confident | 17 Ų | 17 | 26.4 Ų | 26.4 | 10% | 0.103 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.3 | -45.2 | 179.5 | 169.4 | 0 | 0 | 0 | 0 | 110.8 | F5 F147 L148 L149 I154 I155 Q290 | F5-V151 HydrophobicContact CE1-CG1 4.31Å; F5-V151 HydrophobicContact CE2-CG1 4.08Å; F5-V151 HydrophobicContact CZ-CB 4.2Å; F5-V151 HydrophobicContact CZ-CG1 3.7Å; F147-V151 HydrophobicContact CD2-CG2 4.13Å; F147-V151 HydrophobicContact CE2-CG2 3.84Å; F147-V151 HydrophobicContact CZ-CG2 4.24Å; F147-V151 VanDerWaalsContact O-CG2 3.25Å; F147-V151 WeakPolarHBondContact O-CG2 3.21Å; F147-V151 PolarHBondContact O-N 3.2Å; L148-V151 PolarHBondContact O-N 2.85Å; L149-V151 VanDerWaalsContact C-N 3.34Å; L149-V151 PolarHBondContact O-N 3.41Å; V151-I154 PolarHBondContact O-N 2.88Å; V151-I155 HydrophobicContact CG1-CD1 3.74Å; V151-I155 VanDerWaalsContact O-CG1 3.3Å; V151-I155 WeakPolarHBondContact O-CG1 3.27Å; V151-I155 PolarHBondContact O-N 3.28Å; V151-Q290 PolarHBondContact O-NE2 3.25Å |
| 152 | L | 89.1 | Confident | 89 | Confident | 50 Ų | 50 | 32.8 Ų | 32.8 | 26% | 0.262 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.2 | -39.8 | 178.3 | -71.8 | 171.5 | 0 | 0 | 0 | 112.4 | F5 L148 L149 P150 I155 C156 | F5-L152 HydrophobicContact CE1-CD2 4.42Å; L148-L152 WeakPolarHBondContact O-CB 3.44Å; L148-L152 WeakPolarHBondContact O-CG 3.42Å; L148-L152 PolarHBondContact O-N 2.91Å; L149-L152 PolarHBondContact O-N 3.37Å; P150-L152 PolarHBondContact O-N 2.85Å; L152-I155 PolarHBondContact O-N 3.08Å; L152-C156 VanDerWaalsContact O-CB 3.26Å; L152-C156 WeakPolarHBondContact O-CB 3.29Å; L152-C156 PolarHBondContact O-N 2.88Å |
| 153 | L | 92.9 | Very high | 89.5 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63 | -44.6 | 177.9 | -69.5 | 169.9 | 0 | 0 | 0 | 111.4 | L149 P150 C156 N157 T192 L195 L246 A247 A250 | L149-L153 HydrophobicContact CD1-CD1 3.86Å; L149-L153 HydrophobicContact CD1-CD2 4.25Å; L149-L153 HydrophobicContact CD1-CG 3.87Å; L149-L153 HydrophobicContact CG-CD1 3.9Å; L149-L153 HydrophobicContact CG-CG 4.36Å; L149-L153 VanDerWaalsContact O-CG 3.29Å; L149-L153 WeakPolarHBondContact O-CG 3.5Å; L149-L153 PolarHBondContact O-N 3.46Å; P150-L153 PolarHBondContact O-N 2.87Å; L153-C156 PolarHBondContact O-N 3.49Å; L153-N157 VanDerWaalsContact O-CB 3.27Å; L153-N157 WeakPolarHBondContact O-CB 3.22Å; L153-N157 PolarHBondContact O-N 3.06Å; L153-T192 HydrophobicContact CB-CG2 3.99Å; L153-T192 HydrophobicContact CD2-CG2 3.77Å; L153-T192 HydrophobicContact CG-CG2 4.43Å; L153-L195 HydrophobicContact CD2-CD2 4.38Å; L153-L246 HydrophobicContact CD1-CB 3.87Å; L153-A247 HydrophobicContact CD1-CB 4.25Å; L153-A247 HydrophobicContact CD2-CB 4.16Å; L153-A250 HydrophobicContact CB-CB 3.88Å |
| 154 | I | 93.3 | Very high | 90.2 | Very high | 3 Ų | 3 | 37.6 Ų | 37.6 | 2% | 0.015 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.3 | -45.4 | 176.5 | -66.4 | -71.3 | 0 | 0 | 0 | 111.3 | P150 V151 C156 N157 D158 A250 C289 Q290 M293 | P150-I154 WeakPolarHBondContact O-CG1 3.36Å; P150-I154 PolarHBondContact O-N 2.97Å; P150-I154 VanDerWaalsContact O-N 3.12Å; V151-I154 PolarHBondContact O-N 2.88Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 PolarHBondContact O-N 3.24Å; I154-N157 PolarHBondContact O-N 3.05Å; I154-D158 PolarHBondContact O-N 2.91Å; I154-A250 HydrophobicContact CD1-CB 3.74Å; I154-A250 HydrophobicContact CG1-CB 4.2Å; I154-C289 HydrophobicContact CG2-CB 3.73Å; I154-Q290 VanDerWaalsContact CB-NE2 3.32Å; I154-Q290 HydrophobicContact CG2-CG 4.38Å; I154-Q290 VanDerWaalsContact CG2-NE2 3.27Å; I154-M293 HydrophobicContact CD1-CB 4.2Å; I154-M293 HydrophobicContact CD1-CG 4.28Å; I154-M293 HydrophobicContact CD1-SD 4.31Å; I154-M293 HydrophobicContact CG1-CB 4Å; I154-M293 HydrophobicContact CG1-CG 3.85Å; I154-M293 HydrophobicContact CG1-SD 4.35Å |
| 155 | I | 90.7 | Very high | 90.8 | Very high | 29 Ų | 29 | 36.7 Ų | 36.7 | 15% | 0.149 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.3 | -44.8 | 178.4 | -68.5 | 168.5 | 0 | 0 | 0 | 110.5 | M1 V151 L152 D158 M159 | M1-I155 HydrophobicContact CE-CD1 4.47Å; V151-I155 HydrophobicContact CG1-CD1 3.74Å; V151-I155 VanDerWaalsContact O-CG1 3.3Å; V151-I155 WeakPolarHBondContact O-CG1 3.27Å; V151-I155 PolarHBondContact O-N 3.28Å; L152-I155 PolarHBondContact O-N 3.08Å; I155-D158 PolarHBondContact O-N 3.46Å; I155-M159 HydrophobicContact CG2-CG 4.46Å; I155-M159 HydrophobicContact CG2-SD 3.99Å; I155-M159 WeakPolarHBondContact O-CB 3.28Å; I155-M159 VanDerWaalsContact O-CG 3.31Å; I155-M159 WeakPolarHBondContact O-CG 3.26Å; I155-M159 PolarHBondContact O-N 3.31Å |
| 156 | C | 91.6 | Very high | 91.2 | Very high | 28 Ų | 28 | 42.2 Ų | 42.2 | 19% | 0.189 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.4 | -45.6 | 177.1 | -177.3 | 0 | 0 | 0 | 0 | 111.1 | L152 L153 I154 D158 M159 T160 L195 | L152-C156 VanDerWaalsContact O-CB 3.26Å; L152-C156 WeakPolarHBondContact O-CB 3.29Å; L152-C156 PolarHBondContact O-N 2.88Å; L153-C156 PolarHBondContact O-N 3.49Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 PolarHBondContact O-N 3.24Å; C156-D158 PolarHBondContact O-N 3.02Å; C156-M159 PolarHBondContact O-N 3.38Å; C156-T160 WeakPolarHBondContact O-CB 3.33Å; C156-T160 WeakPolarHBondContact O-CG2 3.29Å; C156-T160 PolarHBondContact O-N 3.49Å; C156-T160 PolarHBondContact O-OG1 3.08Å; C156-L195 HydrophobicContact CB-CD2 3.45Å; C156-L195 VanDerWaalsContact CB-CD2 3.45Å; C156-L195 VanDerWaalsContact SG-CD2 3.57Å |
| 157 | N | 94.1 | Very high | 91.5 | Very high | 3 Ų | 3 | 47.5 Ų | 47.5 | 2% | 0.016 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.9 | -49.3 | 177.7 | -175.2 | 73.1 | 0 | 0 | 0 | 111.5 | L153 I154 M159 T160 A161 G188 T192 S251 P255 | L153-N157 VanDerWaalsContact O-CB 3.27Å; L153-N157 WeakPolarHBondContact O-CB 3.22Å; L153-N157 PolarHBondContact O-N 3.06Å; I154-N157 PolarHBondContact O-N 3.05Å; N157-M159 PolarHBondContact O-N 3.45Å; N157-T160 PolarHBondContact O-N 3.38Å; N157-T160 PolarHBondContact O-OG1 2.96Å; N157-A161 WeakPolarHBondContact O-CB 3.19Å; N157-A161 PolarHBondContact O-N 2.67Å; N157-G188 VanDerWaalsContact OD1-C 3.26Å; N157-G188 PolarHBondContact OD1-O 2.64Å; N157-T192 WeakPolarHBondContact CA-OG1 3.46Å; N157-T192 HydrophobicContact CB-CG2 4.44Å; N157-T192 VanDerWaalsContact CB-OG1 3.27Å; N157-T192 WeakPolarHBondContact CB-OG1 3.42Å; N157-T192 PolarHBondContact OD1-OG1 3.24Å; N157-S251 WeakPolarHBondContact OD1-CA 3.19Å; N157-S251 WeakPolarHBondContact OD1-CB 3.35Å; N157-P255 WeakPolarHBondContact ND2-CG 3.32Å |
| 158 | D | 89.9 | Confident | 91.8 | Very high | 60 Ų | 60 | 52.8 Ų | 52.8 | 32% | 0.321 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -65.1 | -41.5 | -179.7 | -79.5 | -15.9 | 0 | 0 | 0 | 112.3 | I154 I155 C156 Y162 | I154-D158 PolarHBondContact O-N 2.91Å; I155-D158 PolarHBondContact O-N 3.46Å; C156-D158 PolarHBondContact O-N 3.02Å; D158-Y162 WeakPolarHBondContact O-CB 3.49Å; D158-Y162 PolarHBondContact O-N 3.49Å |
| 159 | M | 90.7 | Very high | 91.8 | Very high | 109 Ų | 109 | 53.6 Ų | 53.6 | 54% | 0.537 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.9 | -48.5 | 177.1 | -75.2 | -177.1 | 63.6 | 0 | 0 | 112 | I155 C156 N157 Y162 L163 | I155-M159 HydrophobicContact CG2-CG 4.46Å; I155-M159 HydrophobicContact CG2-SD 3.99Å; I155-M159 WeakPolarHBondContact O-CB 3.28Å; I155-M159 VanDerWaalsContact O-CG 3.31Å; I155-M159 WeakPolarHBondContact O-CG 3.26Å; I155-M159 PolarHBondContact O-N 3.31Å; C156-M159 PolarHBondContact O-N 3.38Å; N157-M159 PolarHBondContact O-N 3.45Å; M159-Y162 WeakPolarHBondContact O-CB 3.39Å; M159-Y162 PolarHBondContact O-N 3.08Å; M159-L163 WeakPolarHBondContact O-CG 3.36Å; M159-L163 PolarHBondContact O-N 3.4Å |
| 160 | T | 92.9 | Very high | 91.9 | Very high | 22 Ų | 22 | 64 Ų | 64 | 14% | 0.135 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -71.4 | -38.8 | -177.8 | 53 | 0 | 0 | 0 | 0 | 111 | C156 N157 Y162 L163 F164 G188 | C156-T160 WeakPolarHBondContact O-CB 3.33Å; C156-T160 WeakPolarHBondContact O-CG2 3.29Å; C156-T160 PolarHBondContact O-N 3.49Å; C156-T160 PolarHBondContact O-OG1 3.08Å; N157-T160 PolarHBondContact O-N 3.38Å; N157-T160 PolarHBondContact O-OG1 2.96Å; T160-Y162 VanDerWaalsContact C-N 3.27Å; T160-Y162 PolarHBondContact O-N 3.29Å; T160-L163 PolarHBondContact O-N 3.05Å; T160-L163 VanDerWaalsContact O-N 3.12Å; T160-F164 VanDerWaalsContact O-CD2 3.24Å; T160-F164 WeakPolarHBondContact O-CD2 3.36Å; T160-F164 PolarHBondContact O-N 3.3Å; T160-G188 WeakPolarHBondContact OG1-CA 3.47Å |
| 161 | A | 93.4 | Very high | 92 | Very high | 22 Ų | 22 | 66.9 Ų | 66.9 | 18% | 0.182 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -60.9 | -37.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | N157 G165 G184 | N157-A161 WeakPolarHBondContact O-CB 3.19Å; N157-A161 PolarHBondContact O-N 2.67Å; A161-G165 PolarHBondContact O-N 3.43Å; A161-G184 WeakPolarHBondContact CA-O 3.38Å; A161-G184 WeakPolarHBondContact CB-O 3.43Å; A161-G184 VanDerWaalsContact O-CA 3.29Å; A161-G184 WeakPolarHBondContact O-CA 3.47Å |
| 162 | Y | 90.3 | Very high | 91.9 | Very high | 159 Ų | 159 | 70 Ų | 70 | 62% | 0.624 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -64.3 | -46.5 | 171.6 | 175.5 | -96 | 0 | 0 | 0 | 112 | D158 M159 T160 G165 F166 | D158-Y162 WeakPolarHBondContact O-CB 3.49Å; D158-Y162 PolarHBondContact O-N 3.49Å; M159-Y162 WeakPolarHBondContact O-CB 3.39Å; M159-Y162 PolarHBondContact O-N 3.08Å; T160-Y162 VanDerWaalsContact C-N 3.27Å; T160-Y162 PolarHBondContact O-N 3.29Å; Y162-G165 PolarHBondContact O-N 2.97Å; Y162-F166 VanDerWaalsContact O-CB 3.29Å; Y162-F166 WeakPolarHBondContact O-CB 3.48Å; Y162-F166 PolarHBondContact O-N 3.25Å |
| 163 | L | 93.5 | Very high | 91.9 | Very high | 81 Ų | 81 | 69.1 Ų | 69.1 | 42% | 0.424 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.8 | -51.5 | 179.9 | -70.1 | 170.9 | 0 | 0 | 0 | 111.9 | M159 T160 G165 F166 F167 | M159-L163 WeakPolarHBondContact O-CG 3.36Å; M159-L163 PolarHBondContact O-N 3.4Å; T160-L163 PolarHBondContact O-N 3.05Å; T160-L163 VanDerWaalsContact O-N 3.12Å; L163-G165 VanDerWaalsContact C-N 3.32Å; L163-G165 PolarHBondContact O-N 3.43Å; L163-F166 PolarHBondContact O-N 3.05Å; L163-F167 HydrophobicContact CD2-CE2 4.42Å; L163-F167 WeakPolarHBondContact O-CD2 3.33Å; L163-F167 PolarHBondContact O-N 2.85Å |
| 164 | F | 94.5 | Very high | 91.6 | Very high | 77 Ų | 77 | 72.2 Ų | 72.2 | 34% | 0.338 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.1 | -38.1 | 177.7 | -78.6 | -77.7 | 0 | 0 | 0 | 111.9 | T160 F166 F168 S191 | T160-F164 VanDerWaalsContact O-CD2 3.24Å; T160-F164 WeakPolarHBondContact O-CD2 3.36Å; T160-F164 PolarHBondContact O-N 3.3Å; F164-F166 VanDerWaalsContact C-N 3.33Å; F164-F166 PolarHBondContact O-N 3.42Å; F164-F168 AromaticContact CD1-CD2 3.86Å; F164-F168 HydrophobicContact CD1-CD2 3.86Å; F164-F168 HydrophobicContact CD1-CE2 4.03Å; F164-F168 HydrophobicContact CE1-CE2 4.33Å; F164-F168 WeakPolarHBondContact O-CA 3.44Å; F164-F168 WeakPolarHBondContact O-CB 3.44Å; F164-F168 PolarHBondContact O-N 2.99Å; F164-S191 WeakPolarHBondContact CE2-OG 3.41Å |
| 165 | G | 92.7 | Very high | 91.2 | Very high | 17 Ų | 17 | 82.2 Ų | 82.2 | 18% | 0.175 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -65.1 | -34.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | A161 Y162 L163 G169 | A161-G165 PolarHBondContact O-N 3.43Å; Y162-G165 PolarHBondContact O-N 2.97Å; L163-G165 VanDerWaalsContact C-N 3.32Å; L163-G165 PolarHBondContact O-N 3.43Å; G165-G169 WeakPolarHBondContact O-CA 3.39Å; G165-G169 PolarHBondContact O-N 3.27Å |
| 166 | F | 91.7 | Very high | 90.8 | Very high | 141 Ų | 141 | 84.1 Ų | 84.1 | 62% | 0.618 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -71.3 | -44.6 | 177.2 | -179.4 | -96.9 | 0 | 0 | 0 | 112.5 | Y162 L163 F164 | Y162-F166 VanDerWaalsContact O-CB 3.29Å; Y162-F166 WeakPolarHBondContact O-CB 3.48Å; Y162-F166 PolarHBondContact O-N 3.25Å; L163-F166 PolarHBondContact O-N 3.05Å; F164-F166 VanDerWaalsContact C-N 3.33Å; F164-F166 PolarHBondContact O-N 3.42Å |
| 167 | F | 93.9 | Very high | 90.2 | Very high | 144 Ų | 144 | 83.7 Ų | 83.7 | 63% | 0.632 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -81.8 | -36.6 | -176.8 | -72.6 | -67.3 | 0 | 0 | 0 | 113.9 | L163 | L163-F167 HydrophobicContact CD2-CE2 4.42Å; L163-F167 WeakPolarHBondContact O-CD2 3.33Å; L163-F167 PolarHBondContact O-N 2.85Å |
| 168 | F | 93.8 | Very high | 89.5 | Confident | 129 Ų | 129 | 88.1 Ų | 88.1 | 57% | 0.566 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -120.9 | -4.4 | -171.1 | -57.1 | -79.9 | 0 | 0 | 0 | 113.8 | F164 R170 E183 | F164-F168 AromaticContact CD1-CD2 3.86Å; F164-F168 HydrophobicContact CD1-CD2 3.86Å; F164-F168 HydrophobicContact CD1-CE2 4.03Å; F164-F168 HydrophobicContact CE1-CE2 4.33Å; F164-F168 WeakPolarHBondContact O-CA 3.44Å; F164-F168 WeakPolarHBondContact O-CB 3.44Å; F164-F168 PolarHBondContact O-N 2.99Å; F168-R170 PolarHBondContact O-N 3.27Å; F168-E183 HydrophobicContact CB-CB 4.35Å |
| 169 | G | 88.7 | Confident | 89.1 | Confident | 27 Ų | 27 | 94.6 Ų | 94.6 | 28% | 0.278 | 46% | 0.461 | S | S | . | . | trans | -68 | 122.7 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | G165 T181 E183 | G165-G169 WeakPolarHBondContact O-CA 3.39Å; G165-G169 PolarHBondContact O-N 3.27Å; G169-T181 WeakPolarHBondContact CA-OG1 3.37Å; G169-E183 WeakPolarHBondContact CA-OE2 3.36Å | ||
| 170 | R | 90.4 | Very high | 88.9 | Confident | 221 Ų | 221 | 92.5 Ų | 92.5 | 83% | 0.834 | 45% | 0.449 | S | S | * | . | trans | -130.8 | -33.3 | 174.8 | -63.2 | -178.3 | -176.3 | 175.9 | 1.4 | 111.8 | F168 E183 | F168-R170 PolarHBondContact O-N 3.27Å; R170-E183 PolarHBondContact N-OE1 3.4Å; R170-E183 PolarHBondContact N-OE2 2.91Å; R170-E183 VanDerWaalsContact N-OE2 3.14Å | ||
| 171 | T | 92.2 | Very high | 88.9 | Confident | 65 Ų | 65 | 92.4 Ų | 92.4 | 40% | 0.399 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -106.2 | 115 | -172.9 | 55.1 | 0 | 0 | 0 | 0 | 111.7 | L173 T181 W182 E183 | T171-L173 PolarHBondContact O-N 2.94Å; T171-T181 CarbonylContact O-C 3.29Å; T171-T181 WeakPolarHBondContact O-CA 3.35Å; T171-T181 WeakPolarHBondContact O-CB 3.44Å; T171-W182 PolarHBondContact O-N 3.47Å; T171-E183 WeakPolarHBondContact CB-OE1 3.37Å; T171-E183 PolarHBondContact N-OE1 2.98Å; T171-E183 PolarHBondContact N-OE2 2.9Å; T171-E183 VanDerWaalsContact OG1-CD 3.22Å; T171-E183 PolarHBondContact OG1-OE1 3.33Å; T171-E183 PolarHBondContact OG1-OE2 2.97Å |
| 172 | P | 90.1 | Very high | 89 | Confident | 82 Ų | 82 | 97.8 Ų | 97.8 | 53% | 0.532 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.7 | 135.9 | 179.6 | 27.8 | -33.9 | 0 | 0 | 0 | 110.7 | ||
| 173 | L | 88.8 | Confident | 89.2 | Confident | 32 Ų | 32 | 92.7 Ų | 92.7 | 17% | 0.168 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.1 | -45.9 | -176.8 | -179.3 | 61.6 | 0 | 0 | 0 | 112.1 | T171 K180 W182 F185 F259 | T171-L173 PolarHBondContact O-N 2.94Å; L173-K180 WeakPolarHBondContact CB-O 3.44Å; L173-K180 PolarHBondContact N-O 2.97Å; L173-W182 HydrophobicContact CD1-CD2 3.34Å; L173-W182 HydrophobicContact CD1-CE3 3.63Å; L173-W182 HydrophobicContact CD1-CG 3.86Å; L173-W182 HydrophobicContact CD1-CH2 3.87Å; L173-W182 HydrophobicContact CD1-CZ2 3.6Å; L173-W182 HydrophobicContact CD1-CZ3 3.88Å; L173-F185 HydrophobicContact CD2-CB 4.02Å; L173-F185 HydrophobicContact CD2-CD2 3.92Å; L173-F185 HydrophobicContact CD2-CG 4.08Å; L173-F259 HydrophobicContact CD2-CE1 4.17Å; L173-F259 HydrophobicContact CD2-CE2 4.26Å; L173-F259 HydrophobicContact CD2-CZ 3.46Å; L173-F259 VanDerWaalsContact CD2-CZ 3.46Å; L173-F259 HydrophobicContact CG-CZ 4.4Å |
| 174 | I | 86.3 | Confident | 89.2 | Confident | 66 Ų | 66 | 88.9 Ų | 88.9 | 34% | 0.338 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.8 | 139.4 | -178.8 | -165.9 | 170.5 | 0 | 0 | 0 | 110.7 | L176 S177 F259 | I174-L176 HydrophobicContact CD1-CB 4.32Å; I174-L176 HydrophobicContact CG1-CB 4.19Å; I174-L176 HydrophobicContact CG2-CB 4.33Å; I174-L176 PolarHBondContact O-N 2.98Å; I174-L176 VanDerWaalsContact O-N 3.11Å; I174-S177 CarbonylContact O-C 3.33Å; I174-S177 PolarHBondContact O-N 3.41Å; I174-F259 HydrophobicContact CG2-CD1 4.05Å; I174-F259 HydrophobicContact CG2-CE1 4.07Å |
| 175 | K | 84.2 | Confident | 89.2 | Confident | 212 Ų | 212 | 86.7 Ų | 86.7 | 92% | 0.922 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -28.8 | 179.3 | -67.2 | -174.8 | 179.8 | 180 | 0 | 113.1 | S177 | K175-S177 VanDerWaalsContact C-N 3.27Å; K175-S177 PolarHBondContact O-N 3.35Å |
| 176 | L | 82.8 | Confident | 89.3 | Confident | 69 Ų | 69 | 89.7 Ų | 89.7 | 36% | 0.361 | 43% | 0.432 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | -25.7 | -179.8 | -168.7 | 63.4 | 0 | 0 | 0 | 113.4 | I174 R266 | I174-L176 HydrophobicContact CD1-CB 4.32Å; I174-L176 HydrophobicContact CG1-CB 4.19Å; I174-L176 HydrophobicContact CG2-CB 4.33Å; I174-L176 PolarHBondContact O-N 2.98Å; I174-L176 VanDerWaalsContact O-N 3.11Å; L176-R266 HydrophobicContact CD1-CB 4.36Å; L176-R266 HydrophobicContact CD1-CG 4.2Å |
| 177 | S | 80.3 | Confident | 89.4 | Confident | 19 Ų | 19 | 83.4 Ų | 83.4 | 13% | 0.133 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.7 | 79.1 | -178.1 | -165.7 | 0 | 0 | 0 | 0 | 109.9 | I174 K175 K179 K180 | I174-S177 CarbonylContact O-C 3.33Å; I174-S177 PolarHBondContact O-N 3.41Å; K175-S177 VanDerWaalsContact C-N 3.27Å; K175-S177 PolarHBondContact O-N 3.35Å; S177-K179 PolarHBondContact O-N 2.79Å; S177-K180 PolarHBondContact O-N 3.18Å |
| 178 | P | 77.8 | Confident | 89.4 | Confident | 97 Ų | 97 | 76.5 Ų | 76.5 | 63% | 0.63 | 38% | 0.376 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -64.7 | -16.3 | -170.2 | 25.4 | -35.3 | 0 | 0 | 0 | 113.8 | ||
| 179 | K | 82.4 | Confident | 89.4 | Confident | 196 Ų | 196 | 71.1 Ų | 71.1 | 85% | 0.852 | 36% | 0.355 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.5 | -14.7 | 178.2 | -65 | -171 | 175.9 | -169.7 | 0 | 113.8 | S177 | S177-K179 PolarHBondContact O-N 2.79Å |
| 180 | K | 86.7 | Confident | 89.7 | Confident | 65 Ų | 65 | 74.5 Ų | 74.5 | 28% | 0.283 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 127.4 | 178.4 | -72.2 | -174.5 | 169.7 | -165.3 | 0 | 108.6 | L173 S177 F259 | L173-K180 WeakPolarHBondContact CB-O 3.44Å; L173-K180 PolarHBondContact N-O 2.97Å; S177-K180 PolarHBondContact O-N 3.18Å; K180-F259 HydrophobicContact CB-CE1 4.43Å; K180-F259 HydrophobicContact CD-CD1 4.01Å; K180-F259 HydrophobicContact CD-CE1 3.28Å; K180-F259 HydrophobicContact CD-CZ 4.14Å; K180-F259 HydrophobicContact CG-CE1 4.46Å |
| 181 | T | 93.4 | Very high | 89.9 | Confident | 20 Ų | 20 | 65.1 Ų | 65.1 | 12% | 0.123 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 157.2 | -176.1 | 76.1 | 0 | 0 | 0 | 0 | 112.1 | G169 T171 E183 G184 F185 | G169-T181 WeakPolarHBondContact CA-OG1 3.37Å; T171-T181 CarbonylContact O-C 3.29Å; T171-T181 WeakPolarHBondContact O-CA 3.35Å; T171-T181 WeakPolarHBondContact O-CB 3.44Å; T181-E183 VanDerWaalsContact C-N 3.3Å; T181-E183 WeakPolarHBondContact CB-OE2 3.33Å; T181-E183 PolarHBondContact O-N 3.25Å; T181-E183 PolarHBondContact OG1-OE2 2.97Å; T181-E183 VanDerWaalsContact OG1-OE2 3.05Å; T181-G184 PolarHBondContact O-N 3.14Å; T181-G184 PolarHBondContact OG1-N 3.04Å; T181-G184 VanDerWaalsContact OG1-N 3.15Å; T181-F185 PolarHBondContact O-N 3.27Å |
| 182 | W | 93.8 | Very high | 90 | Very high | 134 Ų | 134 | 62 Ų | 62 | 51% | 0.508 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.8 | -38.4 | 175.7 | -82.8 | 100.6 | 0 | 0 | 0 | 111.8 | T171 L173 G184 F185 V186 | T171-W182 PolarHBondContact O-N 3.47Å; L173-W182 HydrophobicContact CD1-CD2 3.34Å; L173-W182 HydrophobicContact CD1-CE3 3.63Å; L173-W182 HydrophobicContact CD1-CG 3.86Å; L173-W182 HydrophobicContact CD1-CH2 3.87Å; L173-W182 HydrophobicContact CD1-CZ2 3.6Å; L173-W182 HydrophobicContact CD1-CZ3 3.88Å; W182-G184 VanDerWaalsContact C-N 3.32Å; W182-G184 PolarHBondContact O-N 3.44Å; W182-F185 HydrophobicContact CE3-CD1 4.49Å; W182-F185 HydrophobicContact CZ3-CD1 4.49Å; W182-F185 PolarHBondContact O-N 3.45Å; W182-V186 WeakPolarHBondContact O-CG2 3.3Å; W182-V186 PolarHBondContact O-N 3.32Å |
| 183 | E | 94.6 | Very high | 90.1 | Very high | 52 Ų | 52 | 60 Ų | 60 | 24% | 0.243 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 179 | -51.8 | 84.2 | 176.4 | 0 | 0 | 111 | F168 G169 R170 T171 T181 G187 | F168-E183 HydrophobicContact CB-CB 4.35Å; G169-E183 WeakPolarHBondContact CA-OE2 3.36Å; R170-E183 PolarHBondContact N-OE1 3.4Å; R170-E183 PolarHBondContact N-OE2 2.91Å; R170-E183 VanDerWaalsContact N-OE2 3.14Å; T171-E183 WeakPolarHBondContact CB-OE1 3.37Å; T171-E183 PolarHBondContact N-OE1 2.98Å; T171-E183 PolarHBondContact N-OE2 2.9Å; T171-E183 VanDerWaalsContact OG1-CD 3.22Å; T171-E183 PolarHBondContact OG1-OE1 3.33Å; T171-E183 PolarHBondContact OG1-OE2 2.97Å; T181-E183 VanDerWaalsContact C-N 3.3Å; T181-E183 WeakPolarHBondContact CB-OE2 3.33Å; T181-E183 PolarHBondContact O-N 3.25Å; T181-E183 PolarHBondContact OG1-OE2 2.97Å; T181-E183 VanDerWaalsContact OG1-OE2 3.05Å; E183-G187 PolarHBondContact O-N 3.2Å |
| 184 | G | 94.1 | Very high | 90.2 | Very high | 2 Ų | 2 | 64.6 Ų | 64.6 | 2% | 0.021 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.8 | -46.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A161 T181 W182 V186 G187 G188 | A161-G184 WeakPolarHBondContact CA-O 3.38Å; A161-G184 WeakPolarHBondContact CB-O 3.43Å; A161-G184 VanDerWaalsContact O-CA 3.29Å; A161-G184 WeakPolarHBondContact O-CA 3.47Å; T181-G184 PolarHBondContact O-N 3.14Å; T181-G184 PolarHBondContact OG1-N 3.04Å; T181-G184 VanDerWaalsContact OG1-N 3.15Å; W182-G184 VanDerWaalsContact C-N 3.32Å; W182-G184 PolarHBondContact O-N 3.44Å; G184-V186 PolarHBondContact O-N 2.85Å; G184-G187 PolarHBondContact O-N 2.73Å; G184-G188 PolarHBondContact O-N 2.98Å |
| 185 | F | 93.8 | Very high | 90.4 | Very high | 30 Ų | 30 | 63.8 Ų | 63.8 | 13% | 0.132 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 179 | -175.2 | -99.4 | 0 | 0 | 0 | 112.5 | L173 T181 W182 G188 A189 S251 L252 P255 | L173-F185 HydrophobicContact CD2-CB 4.02Å; L173-F185 HydrophobicContact CD2-CD2 3.92Å; L173-F185 HydrophobicContact CD2-CG 4.08Å; T181-F185 PolarHBondContact O-N 3.27Å; W182-F185 HydrophobicContact CE3-CD1 4.49Å; W182-F185 HydrophobicContact CZ3-CD1 4.49Å; W182-F185 PolarHBondContact O-N 3.45Å; F185-G188 PolarHBondContact O-N 3.46Å; F185-A189 PolarHBondContact O-N 3.33Å; F185-S251 WeakPolarHBondContact CE2-O 3.3Å; F185-L252 HydrophobicContact CE1-CD2 4.09Å; F185-L252 HydrophobicContact CZ-CD2 4.22Å; F185-P255 HydrophobicContact CD2-CG 4.39Å; F185-P255 HydrophobicContact CE2-CB 4.17Å; F185-P255 HydrophobicContact CE2-CG 3.93Å |
| 186 | V | 94.9 | Very high | 90.5 | Very high | 81 Ų | 81 | 53.8 Ų | 53.8 | 49% | 0.491 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -66.6 | -44.6 | 177.1 | 174.9 | 0 | 0 | 0 | 0 | 111.4 | W182 G184 G188 A189 V190 | W182-V186 WeakPolarHBondContact O-CG2 3.3Å; W182-V186 PolarHBondContact O-N 3.32Å; G184-V186 PolarHBondContact O-N 2.85Å; V186-G188 VanDerWaalsContact C-N 3.31Å; V186-G188 PolarHBondContact O-N 3.45Å; V186-A189 PolarHBondContact O-N 3.29Å; V186-A189 VanDerWaalsContact O-N 3.17Å; V186-V190 WeakPolarHBondContact O-CG2 3.45Å; V186-V190 PolarHBondContact O-N 3.27Å |
| 187 | G | 94.4 | Very high | 90.6 | Very high | 8 Ų | 8 | 54.6 Ų | 54.6 | 8% | 0.082 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.1 | -37.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | E183 G184 S191 | E183-G187 PolarHBondContact O-N 3.2Å; G184-G187 PolarHBondContact O-N 2.73Å; G187-S191 WeakPolarHBondContact O-CB 3.29Å; G187-S191 PolarHBondContact O-N 3.38Å; G187-S191 VanDerWaalsContact O-N 3.1Å; G187-S191 PolarHBondContact O-OG 3.49Å |
| 188 | G | 94.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.3 | -46.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | N157 T160 G184 F185 V186 S191 T192 | N157-G188 VanDerWaalsContact OD1-C 3.26Å; N157-G188 PolarHBondContact OD1-O 2.64Å; T160-G188 WeakPolarHBondContact OG1-CA 3.47Å; G184-G188 PolarHBondContact O-N 2.98Å; F185-G188 PolarHBondContact O-N 3.46Å; V186-G188 VanDerWaalsContact C-N 3.31Å; V186-G188 PolarHBondContact O-N 3.45Å; G188-S191 PolarHBondContact O-N 3.39Å; G188-T192 WeakPolarHBondContact O-CB 3.33Å; G188-T192 PolarHBondContact O-N 3.02Å; G188-T192 PolarHBondContact O-OG1 3.22Å |
| 189 | A | 94.6 | Very high | 90.6 | Very high | 16 Ų | 16 | 53.3 Ų | 53.3 | 13% | 0.132 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62 | -49 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | F185 V186 S191 T192 V193 S251 | F185-A189 PolarHBondContact O-N 3.33Å; V186-A189 PolarHBondContact O-N 3.29Å; V186-A189 VanDerWaalsContact O-N 3.17Å; A189-S191 VanDerWaalsContact C-N 3.33Å; A189-S191 PolarHBondContact O-N 3.45Å; A189-T192 PolarHBondContact O-N 3.12Å; A189-V193 WeakPolarHBondContact O-CG2 3.21Å; A189-V193 PolarHBondContact O-N 3.34Å; A189-S251 VanDerWaalsContact CA-CB 3.47Å |
| 190 | V | 95 | Very high | 89.8 | Confident | 97 Ų | 97 | 47.9 Ų | 47.9 | 59% | 0.588 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -60.2 | -44.7 | 178.6 | 174.2 | 0 | 0 | 0 | 0 | 111 | V186 T192 V193 F194 | V186-V190 WeakPolarHBondContact O-CG2 3.45Å; V186-V190 PolarHBondContact O-N 3.27Å; V190-T192 VanDerWaalsContact C-N 3.35Å; V190-T192 PolarHBondContact O-N 2.89Å; V190-V193 PolarHBondContact O-N 3.45Å; V190-F194 WeakPolarHBondContact O-CB 3.2Å; V190-F194 PolarHBondContact O-N 3.13Å |
| 191 | S | 94 | Very high | 88.6 | Confident | 25 Ų | 25 | 51.6 Ų | 51.6 | 18% | 0.175 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.8 | -39 | 179.7 | -57.1 | 0 | 0 | 0 | 0 | 112.4 | F164 G187 G188 A189 F194 L195 | F164-S191 WeakPolarHBondContact CE2-OG 3.41Å; G187-S191 WeakPolarHBondContact O-CB 3.29Å; G187-S191 PolarHBondContact O-N 3.38Å; G187-S191 VanDerWaalsContact O-N 3.1Å; G187-S191 PolarHBondContact O-OG 3.49Å; G188-S191 PolarHBondContact O-N 3.39Å; A189-S191 VanDerWaalsContact C-N 3.33Å; A189-S191 PolarHBondContact O-N 3.45Å; S191-F194 PolarHBondContact O-N 3.18Å; S191-L195 WeakPolarHBondContact O-CB 3.28Å; S191-L195 PolarHBondContact O-N 2.96Å |
| 192 | T | 93.4 | Very high | 87.1 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -68.3 | -41.7 | -179.6 | -56.2 | 0 | 0 | 0 | 0 | 111.5 | L153 N157 G188 A189 V190 L195 S196 A247 A250 | L153-T192 HydrophobicContact CB-CG2 3.99Å; L153-T192 HydrophobicContact CD2-CG2 3.77Å; L153-T192 HydrophobicContact CG-CG2 4.43Å; N157-T192 WeakPolarHBondContact CA-OG1 3.46Å; N157-T192 HydrophobicContact CB-CG2 4.44Å; N157-T192 VanDerWaalsContact CB-OG1 3.27Å; N157-T192 WeakPolarHBondContact CB-OG1 3.42Å; N157-T192 PolarHBondContact OD1-OG1 3.24Å; G188-T192 WeakPolarHBondContact O-CB 3.33Å; G188-T192 PolarHBondContact O-N 3.02Å; G188-T192 PolarHBondContact O-OG1 3.22Å; A189-T192 PolarHBondContact O-N 3.12Å; V190-T192 VanDerWaalsContact C-N 3.35Å; V190-T192 PolarHBondContact O-N 2.89Å; T192-L195 PolarHBondContact O-N 3.49Å; T192-S196 PolarHBondContact O-N 3.46Å; T192-A247 HydrophobicContact CG2-CB 4.1Å; T192-A250 HydrophobicContact CG2-CB 4.42Å |
| 193 | V | 92.7 | Very high | 85.5 | Confident | 38 Ų | 38 | 56 Ų | 56 | 23% | 0.23 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 173.8 | 173 | 0 | 0 | 0 | 0 | 110.5 | A189 V190 L195 S196 I197 A247 L248 | A189-V193 WeakPolarHBondContact O-CG2 3.21Å; A189-V193 PolarHBondContact O-N 3.34Å; V190-V193 PolarHBondContact O-N 3.45Å; V193-L195 PolarHBondContact O-N 3.13Å; V193-S196 WeakPolarHBondContact O-CB 3.3Å; V193-S196 PolarHBondContact O-N 3.38Å; V193-S196 PolarHBondContact O-OG 3.34Å; V193-I197 PolarHBondContact O-N 2.93Å; V193-A247 HydrophobicContact CG2-CB 4.47Å; V193-L248 HydrophobicContact CG2-CD2 4.13Å |
| 194 | F | 91.5 | Very high | 83.5 | Confident | 130 Ų | 130 | 56.2 Ų | 56.2 | 57% | 0.57 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -60.4 | -44.3 | 176.8 | -175.9 | -106.4 | 0 | 0 | 0 | 112.3 | V190 S191 S196 I197 L198 | V190-F194 WeakPolarHBondContact O-CB 3.2Å; V190-F194 PolarHBondContact O-N 3.13Å; S191-F194 PolarHBondContact O-N 3.18Å; F194-S196 VanDerWaalsContact C-N 3.3Å; F194-S196 PolarHBondContact O-N 3.43Å; F194-I197 PolarHBondContact O-N 3.49Å; F194-L198 HydrophobicContact CD1-CD1 3.8Å; F194-L198 HydrophobicContact CD1-CG 4.34Å; F194-L198 HydrophobicContact CE1-CD1 3.4Å; F194-L198 HydrophobicContact CE1-CG 4.03Å; F194-L198 HydrophobicContact CZ-CD1 4.03Å; F194-L198 HydrophobicContact CZ-CD2 4.33Å; F194-L198 HydrophobicContact CZ-CG 4.26Å; F194-L198 PolarHBondContact O-N 3.12Å; F194-L198 VanDerWaalsContact O-N 3.13Å |
| 195 | L | 89 | Confident | 81.2 | Confident | 48 Ų | 48 | 60.5 Ų | 60.5 | 25% | 0.251 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59.2 | -40.9 | 175 | 179.9 | 63.5 | 0 | 0 | 0 | 111.9 | L153 C156 S191 T192 V193 I197 L198 V199 | L153-L195 HydrophobicContact CD2-CD2 4.38Å; C156-L195 HydrophobicContact CB-CD2 3.45Å; C156-L195 VanDerWaalsContact CB-CD2 3.45Å; C156-L195 VanDerWaalsContact SG-CD2 3.57Å; S191-L195 WeakPolarHBondContact O-CB 3.28Å; S191-L195 PolarHBondContact O-N 2.96Å; T192-L195 PolarHBondContact O-N 3.49Å; V193-L195 PolarHBondContact O-N 3.13Å; L195-I197 PolarHBondContact O-N 3.22Å; L195-L198 PolarHBondContact O-N 2.97Å; L195-L198 VanDerWaalsContact O-N 3.12Å; L195-V199 HydrophobicContact CD1-CG2 4.21Å; L195-V199 HydrophobicContact CG-CG2 4.24Å; L195-V199 VanDerWaalsContact O-CG2 3.28Å; L195-V199 WeakPolarHBondContact O-CG2 3.39Å; L195-V199 PolarHBondContact O-N 3.05Å |
| 196 | S | 87.3 | Confident | 78.9 | Confident | 2 Ų | 2 | 65.6 Ų | 65.6 | 1% | 0.014 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.2 | -33.8 | -180 | 81.4 | 0 | 0 | 0 | 0 | 113.1 | T192 V193 F194 | T192-S196 PolarHBondContact O-N 3.46Å; V193-S196 WeakPolarHBondContact O-CB 3.3Å; V193-S196 PolarHBondContact O-N 3.38Å; V193-S196 PolarHBondContact O-OG 3.34Å; F194-S196 VanDerWaalsContact C-N 3.3Å; F194-S196 PolarHBondContact O-N 3.43Å |
| 197 | I | 84.4 | Confident | 76.5 | Confident | 86 Ų | 86 | 68.7 Ų | 68.7 | 44% | 0.441 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -74.9 | -40.7 | 176 | -61.4 | 169.7 | 0 | 0 | 0 | 110.3 | V193 F194 L195 V199 K200 | V193-I197 PolarHBondContact O-N 2.93Å; F194-I197 PolarHBondContact O-N 3.49Å; L195-I197 PolarHBondContact O-N 3.22Å; I197-V199 PolarHBondContact O-N 3.34Å; I197-K200 WeakPolarHBondContact O-CB 3.32Å; I197-K200 PolarHBondContact O-N 3.24Å |
| 198 | L | 82.8 | Confident | 73.7 | Confident | 77 Ų | 77 | 72 Ų | 72 | 40% | 0.403 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.8 | -37.6 | 178.5 | -72.6 | -179.4 | 0 | 0 | 0 | 113.3 | F194 L195 K200 L201 | F194-L198 HydrophobicContact CD1-CD1 3.8Å; F194-L198 HydrophobicContact CD1-CG 4.34Å; F194-L198 HydrophobicContact CE1-CD1 3.4Å; F194-L198 HydrophobicContact CE1-CG 4.03Å; F194-L198 HydrophobicContact CZ-CD1 4.03Å; F194-L198 HydrophobicContact CZ-CD2 4.33Å; F194-L198 HydrophobicContact CZ-CG 4.26Å; F194-L198 PolarHBondContact O-N 3.12Å; F194-L198 VanDerWaalsContact O-N 3.13Å; L195-L198 PolarHBondContact O-N 2.97Å; L195-L198 VanDerWaalsContact O-N 3.12Å; L198-K200 PolarHBondContact O-N 2.98Å; L198-K200 VanDerWaalsContact O-N 3.16Å; L198-L201 WeakPolarHBondContact O-CB 3.35Å; L198-L201 PolarHBondContact O-N 3.24Å |
| 199 | V | 76 | Confident | 71.2 | Confident | 12 Ų | 12 | 77.8 Ų | 77.8 | 7% | 0.073 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -56 | -32.2 | 178.9 | 163.2 | 0 | 0 | 0 | 0 | 111.6 | L149 L195 I197 L201 R202 F203 F239 | L149-V199 HydrophobicContact CD1-CB 4.3Å; L149-V199 HydrophobicContact CD1-CG1 3.77Å; L149-V199 HydrophobicContact CD1-CG2 4.09Å; L195-V199 HydrophobicContact CD1-CG2 4.21Å; L195-V199 HydrophobicContact CG-CG2 4.24Å; L195-V199 VanDerWaalsContact O-CG2 3.28Å; L195-V199 WeakPolarHBondContact O-CG2 3.39Å; L195-V199 PolarHBondContact O-N 3.05Å; I197-V199 PolarHBondContact O-N 3.34Å; V199-L201 PolarHBondContact O-N 3.07Å; V199-L201 VanDerWaalsContact O-N 3.14Å; V199-R202 PolarHBondContact O-N 3.39Å; V199-F203 HydrophobicContact CB-CD2 4.33Å; V199-F203 HydrophobicContact CG1-CD2 3.33Å; V199-F203 HydrophobicContact CG1-CE2 3.74Å; V199-F203 HydrophobicContact CG1-CG 4.27Å; V199-F203 PolarHBondContact O-N 3.29Å; V199-F239 HydrophobicContact CG1-CE1 4.2Å; V199-F239 HydrophobicContact CG1-CZ 4.28Å |
| 200 | K | 66.4 | Low | 68.6 | Low | 82 Ų | 82 | 84.5 Ų | 84.5 | 36% | 0.357 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -49.3 | -40.4 | 174.3 | -173.1 | -168.9 | 179.7 | 178.9 | 0 | 112.4 | I197 L198 R202 S204 T240 | I197-K200 WeakPolarHBondContact O-CB 3.32Å; I197-K200 PolarHBondContact O-N 3.24Å; L198-K200 PolarHBondContact O-N 2.98Å; L198-K200 VanDerWaalsContact O-N 3.16Å; K200-R202 VanDerWaalsContact C-N 3.26Å; K200-R202 PolarHBondContact O-N 2.83Å; K200-S204 PolarHBondContact O-OG 2.98Å; K200-T240 WeakPolarHBondContact CD-OG1 3.48Å; K200-T240 WeakPolarHBondContact CE-OG1 3.24Å |
| 201 | L | 59.7 | Low | 65.8 | Low | 143 Ų | 143 | 87.6 Ų | 87.6 | 75% | 0.749 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -70 | -23.3 | -176.3 | -64 | 173.7 | 0 | 0 | 0 | 112.7 | L198 V199 | L198-L201 WeakPolarHBondContact O-CB 3.35Å; L198-L201 PolarHBondContact O-N 3.24Å; V199-L201 PolarHBondContact O-N 3.07Å; V199-L201 VanDerWaalsContact O-N 3.14Å |
| 202 | R | 63.3 | Low | 63 | Low | 208 Ų | 208 | 92 Ų | 92 | 79% | 0.785 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -102.1 | -31.4 | -172.7 | -160.5 | 62.7 | 173.9 | 166.8 | 1 | 114.3 | V199 K200 | V199-R202 PolarHBondContact O-N 3.39Å; K200-R202 VanDerWaalsContact C-N 3.26Å; K200-R202 PolarHBondContact O-N 2.83Å |
| 203 | F | 60.6 | Low | 60.5 | Low | 40 Ų | 40 | 102.3 Ų | 102.3 | 18% | 0.175 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -97.5 | 1.3 | -171.2 | -75.8 | -85.6 | 0 | 0 | 0 | 115.6 | I145 V199 C205 | I145-F203 HydrophobicContact CD1-CB 4.11Å; I145-F203 HydrophobicContact CD1-CD1 3.5Å; I145-F203 HydrophobicContact CD1-CD2 4.36Å; I145-F203 HydrophobicContact CD1-CE1 3.92Å; I145-F203 HydrophobicContact CD1-CG 3.73Å; I145-F203 HydrophobicContact CD1-CZ 4.49Å; V199-F203 HydrophobicContact CB-CD2 4.33Å; V199-F203 HydrophobicContact CG1-CD2 3.33Å; V199-F203 HydrophobicContact CG1-CE2 3.74Å; V199-F203 HydrophobicContact CG1-CG 4.27Å; V199-F203 PolarHBondContact O-N 3.29Å; F203-C205 PolarHBondContact O-N 3.45Å |
| 204 | S | 52.5 | Low | 58 | Low | 55 Ų | 55 | 105.7 Ų | 105.7 | 39% | 0.385 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -6.1 | -178 | -63 | 0 | 0 | 0 | 0 | 115.2 | K200 T219 | K200-S204 PolarHBondContact O-OG 2.98Å; S204-T219 WeakPolarHBondContact O-CG2 3.33Å |
| 205 | C | 44.1 | Very low | 55.7 | Low | 93 Ų | 93 | 111 Ų | 111 | 63% | 0.628 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -144.7 | 32.8 | -174.2 | -109.3 | 0 | 0 | 0 | 0 | 115.3 | F203 | F203-C205 PolarHBondContact O-N 3.45Š|
| 206 | Q | 46.2 | Very low | 53.7 | Low | 136 Ų | 136 | 117.7 Ų | 117.7 | 64% | 0.636 | 56% | 0.562 | S | S | * | * | trans | -114.4 | 97.7 | -176.5 | -124.9 | 166.8 | -19 | 0 | 0 | 114.6 | ||||
| 207 | H | 43.8 | Very low | 51.8 | Low | 146 Ų | 146 | 120.6 Ų | 120.6 | 68% | 0.676 | 58% | 0.582 | S | S | * | * | trans | 49 | 90.8 | 148.8 | -108.8 | 59.5 | 0 | 0 | 0 | 118.2 | ||||
| 208 | S | 36 | Very low | 50.3 | Low | 78 Ų | 78 | 125.5 Ų | 125.5 | 55% | 0.545 | 60% | 0.6 | S | S | . | * | trans | -65.6 | 145.7 | 147.7 | -68.3 | 0 | 0 | 0 | 0 | 109.4 | H210 | S208-H210 PolarHBondContact O-N 3.41Š| ||
| 209 | F | 42.2 | Very low | 49 | Very low | 122 Ų | 122 | 123.8 Ų | 123.8 | 54% | 0.535 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -56.7 | 10.4 | -169.9 | -95.1 | -113.3 | 0 | 0 | 0 | 118.8 | P13 T144 | P13-F209 HydrophobicContact CB-CE1 3.94Å; P13-F209 HydrophobicContact CB-CZ 3.57Å; P13-F209 HydrophobicContact CG-CD1 4.36Å; P13-F209 HydrophobicContact CG-CE1 3.38Å; P13-F209 HydrophobicContact CG-CE2 3.76Å; P13-F209 HydrophobicContact CG-CZ 3.03Å; T144-F209 HydrophobicContact CG2-CE2 4.35Å |
| 210 | H | 40 | Very low | 48.2 | Very low | 157 Ų | 157 | 125.4 Ų | 125.4 | 73% | 0.727 | 60% | 0.603 | S | S | * | * | trans | -97.3 | 125.5 | -177.5 | -93.9 | -82 | 0 | 0 | 0 | 111.8 | S208 D212 | S208-H210 PolarHBondContact O-N 3.41Å; H210-D212 PolarHBondContact O-N 2.88Å | ||
| 211 | N | 36.2 | Very low | 47.9 | Very low | 162 Ų | 162 | 125.9 Ų | 125.9 | 87% | 0.866 | 62% | 0.615 | S | S | * | * | trans | -61.3 | 26.5 | 176.8 | -85.9 | -25.4 | 0 | 0 | 0 | 115.3 | ||||
| 212 | D | 35.1 | Very low | 48 | Very low | 117 Ų | 117 | 121.2 Ų | 121.2 | 63% | 0.626 | 59% | 0.592 | S | S | * | * | trans | -97.9 | 122.6 | 174.3 | -82.8 | -42.4 | 0 | 0 | 0 | 110.3 | H210 D214 | H210-D212 PolarHBondContact O-N 2.88Å; D212-D214 HydrophobicContact CB-CB 4.27Å; D212-D214 PolarHBondContact O-N 3.27Å | ||
| 213 | F | 40 | Very low | 47.9 | Very low | 217 Ų | 217 | 113 Ų | 113 | 95% | 0.952 | 56% | 0.562 | S | S | * | * | trans | -62.6 | 40.6 | 162.6 | -93.1 | -90.6 | 0 | 0 | 0 | 111.6 | R215 | F213-R215 PolarHBondContact O-N 3.24Š| ||
| 214 | D | 40.5 | Very low | 47.8 | Very low | 109 Ų | 109 | 115.5 Ų | 115.5 | 58% | 0.583 | 57% | 0.574 | S | S | * | * | trans | -81.4 | 111.2 | 179 | -121.8 | -14.3 | 0 | 0 | 0 | 108.7 | D212 Y216 | D212-D214 HydrophobicContact CB-CB 4.27Å; D212-D214 PolarHBondContact O-N 3.27Å; D214-Y216 PolarHBondContact O-N 2.91Å | ||
| 215 | R | 43.4 | Very low | 48.1 | Very low | 241 Ų | 241 | 117.2 Ų | 117.2 | 91% | 0.909 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -57.4 | -5 | 171.9 | -91 | 179.2 | -178.7 | 177.7 | 1.5 | 113.4 | F213 | F213-R215 PolarHBondContact O-N 3.24Š|
| 216 | Y | 47.6 | Very low | 48.8 | Very low | 188 Ų | 188 | 117.3 Ų | 117.3 | 74% | 0.737 | 58% | 0.576 | S | S | * | * | trans | -101.6 | 78.2 | 176.3 | -58.9 | -76.1 | 0 | 0 | 0 | 110.3 | D214 K218 | D214-Y216 PolarHBondContact O-N 2.91Å; Y216-K218 VanDerWaalsContact C-N 3.35Å; Y216-K218 PolarHBondContact O-N 2.87Å | ||
| 217 | C | 47.8 | Very low | 49.6 | Very low | 63 Ų | 63 | 116.7 Ų | 116.7 | 43% | 0.426 | 58% | 0.577 | S | S | . | * | trans | -67.5 | 94.6 | 168.6 | -168.1 | 0 | 0 | 0 | 0 | 108.7 | T219 | C217-T219 PolarHBondContact O-N 3.45Š| ||
| 218 | K | 53.3 | Low | 50.2 | Low | 189 Ų | 189 | 114.2 Ų | 114.2 | 82% | 0.822 | 56% | 0.562 | S | S | * | * | trans | -66.7 | 105.1 | 164.4 | -79.2 | -175.2 | -179.6 | 175.5 | 0 | 106.8 | Y216 | Y216-K218 VanDerWaalsContact C-N 3.35Å; Y216-K218 PolarHBondContact O-N 2.87Å | ||
| 219 | T | 53.8 | Low | 50.8 | Low | 41 Ų | 41 | 116 Ų | 116 | 25% | 0.252 | 58% | 0.575 | S | S | . | * | trans | -57.8 | 130.3 | 176.7 | 47.5 | 0 | 0 | 0 | 0 | 108.9 | S204 C217 Q224 | S204-T219 WeakPolarHBondContact O-CG2 3.33Å; C217-T219 PolarHBondContact O-N 3.45Å; T219-Q224 PolarHBondContact O-NE2 2.86Å; T219-Q224 WeakPolarHBondContact OG1-CG 3.27Å | ||
| 220 | P | 59.2 | Low | 51.7 | Low | 46 Ų | 46 | 114.2 Ų | 114.2 | 30% | 0.299 | 57% | 0.574 | S | S | . | * | trans | -51.6 | 146.8 | 172.9 | -23.5 | 30 | 0 | 0 | 0 | 109.7 | V222 F223 | P220-V222 PolarHBondContact O-N 2.68Å; P220-F223 HydrophobicContact CB-CD2 4.14Å; P220-F223 HydrophobicContact CG-CD2 4.05Å; P220-F223 HydrophobicContact CG-CE2 4.37Å; P220-F223 PolarHBondContact O-N 3.04Å | ||
| 221 | P | 61.2 | Low | 52.9 | Low | 92 Ų | 92 | 113.9 Ų | 113.9 | 60% | 0.597 | 59% | 0.585 | S | S | * | * | G | 310 helix | trans | -50.7 | -28.6 | -178.1 | -27.3 | 33.3 | 0 | 0 | 0 | 113.8 | F223 Q224 | P221-F223 PolarHBondContact O-N 3.45Å; P221-Q224 PolarHBondContact O-N 2.87Å; P221-Q224 VanDerWaalsContact O-N 3.09Å |
| 222 | V | 62.1 | Low | 53.7 | Low | 46 Ų | 46 | 112 Ų | 112 | 28% | 0.279 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -58.5 | -29.7 | 176.1 | -173.8 | 0 | 0 | 0 | 0 | 113.2 | P220 F239 | P220-V222 PolarHBondContact O-N 2.68Å; V222-F239 HydrophobicContact CG1-CB 4.29Å; V222-F239 HydrophobicContact CG1-CD2 4.38Å; V222-F239 WeakPolarHBondContact O-CB 3.31Å; V222-F239 PolarHBondContact O-N 2.92Å |
| 223 | F | 59.9 | Low | 54.5 | Low | 35 Ų | 35 | 111.7 Ų | 111.7 | 15% | 0.154 | 58% | 0.575 | C | S | . | * | G | 310 helix | trans | -97.2 | -5.9 | 178.8 | -65.2 | -80.1 | 0 | 0 | 0 | 113.3 | I145 P220 P221 C237 F239 | I145-F223 HydrophobicContact CG1-CZ 4.37Å; P220-F223 HydrophobicContact CB-CD2 4.14Å; P220-F223 HydrophobicContact CG-CD2 4.05Å; P220-F223 HydrophobicContact CG-CE2 4.37Å; P220-F223 PolarHBondContact O-N 3.04Å; P221-F223 PolarHBondContact O-N 3.45Å; F223-C237 VanDerWaalsContact C-SG 3.56Å; F223-C237 PolarHBondContact O-SG 3.34Å; F223-F239 HydrophobicContact CD1-CB 3.84Å; F223-F239 HydrophobicContact CD1-CD1 4.1Å; F223-F239 HydrophobicContact CD1-CD2 4.07Å; F223-F239 AromaticContact CD1-CG 3.72Å; F223-F239 HydrophobicContact CD1-CG 3.72Å; F223-F239 HydrophobicContact CE1-CB 4.01Å; F223-F239 AromaticContact CE1-CD1 3.7Å; F223-F239 HydrophobicContact CE1-CD1 3.7Å; F223-F239 AromaticContact CE1-CD2 3.36Å; F223-F239 HydrophobicContact CE1-CD2 3.36Å; F223-F239 AromaticContact CE1-CE1 3.94Å; F223-F239 HydrophobicContact CE1-CE1 3.94Å; F223-F239 AromaticContact CE1-CE2 3.64Å; F223-F239 HydrophobicContact CE1-CE2 3.64Å; F223-F239 AromaticContact CE1-CG 3.38Å; F223-F239 HydrophobicContact CE1-CG 3.38Å; F223-F239 AromaticContact CE1-CZ 3.91Å; F223-F239 HydrophobicContact CE1-CZ 3.91Å; F223-F239 AromaticContact CZ-CD2 3.7Å; F223-F239 HydrophobicContact CZ-CD2 3.7Å; F223-F239 AromaticContact CZ-CE2 3.8Å; F223-F239 HydrophobicContact CZ-CE2 3.8Å; F223-F239 HydrophobicContact CZ-CG 4.19Å; F223-F239 HydrophobicContact CZ-CZ 4.35Å |
| 224 | Q | 58.3 | Low | 55 | Low | 92 Ų | 92 | 106.8 Ų | 106.8 | 43% | 0.43 | 55% | 0.553 | S | S | . | * | S | Bend | trans | -83.6 | 133.5 | 176.9 | -64.3 | -177.2 | 1.6 | 0 | 0 | 110.3 | T219 P221 Q226 P238 | T219-Q224 PolarHBondContact O-NE2 2.86Å; T219-Q224 WeakPolarHBondContact OG1-CG 3.27Å; P221-Q224 PolarHBondContact O-N 2.87Å; P221-Q224 VanDerWaalsContact O-N 3.09Å; Q224-Q226 PolarHBondContact O-N 2.95Å; Q224-P238 WeakPolarHBondContact O-CD 3.42Å |
| 225 | P | 59.5 | Low | 55.6 | Low | 91 Ų | 91 | 104.9 Ų | 104.9 | 59% | 0.591 | 55% | 0.549 | S | S | * | . | trans | -62.6 | 132.2 | 179.7 | 25.3 | -32.3 | 0 | 0 | 0 | 111.2 | ||||
| 226 | Q | 58.6 | Low | 56.3 | Low | 96 Ų | 96 | 96 Ų | 96 | 45% | 0.449 | 52% | 0.521 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 139 | 173.2 | -71.4 | -174.9 | -17.6 | 0 | 0 | 109.5 | Q224 Y228 V236 P238 | Q224-Q226 PolarHBondContact O-N 2.95Å; Q226-Y228 HydrophobicContact CB-CE2 3.97Å; Q226-Y228 WeakPolarHBondContact O-CD2 3.37Å; Q226-Y228 PolarHBondContact OE1-OH 2.68Å; Q226-V236 PolarHBondContact N-O 3.39Å; Q226-V236 PolarHBondContact O-N 3.09Å; Q226-P238 HydrophobicContact CB-CG 4.18Å; Q226-P238 HydrophobicContact CG-CG 3.82Å |
| 227 | N | 63.2 | Low | 57.1 | Low | 123 Ų | 123 | 87.7 Ų | 87.7 | 66% | 0.658 | 49% | 0.49 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.7 | 117.6 | 178.2 | -66.8 | -22.2 | 0 | 0 | 0 | 109.1 | S235 | N227-S235 WeakPolarHBondContact OD1-CB 3.05Å; N227-S235 PolarHBondContact OD1-OG 3.38Å |
| 228 | Y | 57.5 | Low | 58.3 | Low | 93 Ų | 93 | 85.1 Ų | 85.1 | 37% | 0.365 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.2 | 123.3 | 175.4 | -65.7 | -91.1 | 0 | 0 | 0 | 109.2 | Q226 V230 F234 V236 | Q226-Y228 HydrophobicContact CB-CE2 3.97Å; Q226-Y228 WeakPolarHBondContact O-CD2 3.37Å; Q226-Y228 PolarHBondContact OE1-OH 2.68Å; Y228-V230 PolarHBondContact O-N 3.36Å; Y228-V230 VanDerWaalsContact O-N 3.14Å; Y228-F234 PolarHBondContact N-O 3.46Å; Y228-V236 HydrophobicContact CD2-CB 4.37Å; Y228-V236 HydrophobicContact CE2-CB 4.35Å |
| 229 | S | 47.9 | Very low | 59.4 | Low | 117 Ų | 117 | 76.4 Ų | 76.4 | 82% | 0.818 | 44% | 0.435 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 77.6 | 174.2 | 57.5 | 0 | 0 | 0 | 0 | 110.4 | ||
| 230 | V | 60.8 | Low | 60.6 | Low | 84 Ų | 84 | 75.7 Ų | 75.7 | 51% | 0.509 | 43% | 0.43 | S | S | . | . | S | Bend | trans | -92.7 | 172.4 | 158.8 | -63.6 | 0 | 0 | 0 | 0 | 108 | Y228 M232 F234 | Y228-V230 PolarHBondContact O-N 3.36Å; Y228-V230 VanDerWaalsContact O-N 3.14Å; V230-M232 WeakPolarHBondContact CG2-O 3.31Å; V230-M232 CarbonylContact O-C 3.35Å; V230-M232 VanDerWaalsContact O-C 3.29Å; V230-M232 PolarHBondContact O-N 2.93Å; V230-F234 HydrophobicContact CG2-CD2 4.45Å |
| 231 | P | 64.3 | Low | 61.8 | Low | 150 Ų | 150 | 77.5 Ų | 77.5 | 97% | 0.974 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -52.3 | -12.8 | -175.6 | -26.4 | 33.5 | 0 | 0 | 0 | 115.3 | ||
| 232 | M | 53.5 | Low | 63 | Low | 123 Ų | 123 | 74 Ų | 74 | 61% | 0.606 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -127.6 | 124.1 | 165.3 | -173.3 | 171.5 | -80.4 | 0 | 0 | 108.7 | V230 F234 | V230-M232 WeakPolarHBondContact CG2-O 3.31Å; V230-M232 CarbonylContact O-C 3.35Å; V230-M232 VanDerWaalsContact O-C 3.29Å; V230-M232 PolarHBondContact O-N 2.93Å; M232-F234 HydrophobicContact CB-CD2 4.11Å; M232-F234 HydrophobicContact CB-CE2 3.59Å; M232-F234 HydrophobicContact CB-CZ 4.22Å; M232-F234 HydrophobicContact CG-CD2 4.05Å; M232-F234 HydrophobicContact CG-CE1 4.22Å; M232-F234 HydrophobicContact CG-CE2 3.42Å; M232-F234 VanDerWaalsContact CG-CE2 3.42Å; M232-F234 HydrophobicContact CG-CZ 3.55Å; M232-F234 VanDerWaalsContact O-CD2 3.3Å; M232-F234 WeakPolarHBondContact O-CD2 3.37Å; M232-F234 PolarHBondContact O-N 2.92Å; M232-F234 VanDerWaalsContact O-N 3.16Å; M232-F234 HydrophobicContact SD-CE1 3.94Å; M232-F234 HydrophobicContact SD-CE2 3.46Å; M232-F234 WeakPolarHBondContact SD-CE2 3.43Å; M232-F234 HydrophobicContact SD-CZ 3.08Å; M232-F234 WeakPolarHBondContact SD-CZ 3.5Å |
| 233 | V | 52 | Low | 64.2 | Low | 109 Ų | 109 | 71.9 Ų | 71.9 | 66% | 0.661 | 40% | 0.4 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 112.7 | -179.7 | -179.5 | 0 | 0 | 0 | 0 | 109 | ||
| 234 | F | 50.5 | Low | 65.7 | Low | 114 Ų | 114 | 73.1 Ų | 73.1 | 50% | 0.5 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 133.3 | 171.1 | -67.2 | -75.7 | 0 | 0 | 0 | 110 | Y228 V230 M232 V236 | Y228-F234 PolarHBondContact N-O 3.46Å; V230-F234 HydrophobicContact CG2-CD2 4.45Å; M232-F234 HydrophobicContact CB-CD2 4.11Å; M232-F234 HydrophobicContact CB-CE2 3.59Å; M232-F234 HydrophobicContact CB-CZ 4.22Å; M232-F234 HydrophobicContact CG-CD2 4.05Å; M232-F234 HydrophobicContact CG-CE1 4.22Å; M232-F234 HydrophobicContact CG-CE2 3.42Å; M232-F234 VanDerWaalsContact CG-CE2 3.42Å; M232-F234 HydrophobicContact CG-CZ 3.55Å; M232-F234 VanDerWaalsContact O-CD2 3.3Å; M232-F234 WeakPolarHBondContact O-CD2 3.37Å; M232-F234 PolarHBondContact O-N 2.92Å; M232-F234 VanDerWaalsContact O-N 3.16Å; M232-F234 HydrophobicContact SD-CE1 3.94Å; M232-F234 HydrophobicContact SD-CE2 3.46Å; M232-F234 WeakPolarHBondContact SD-CE2 3.43Å; M232-F234 HydrophobicContact SD-CZ 3.08Å; M232-F234 WeakPolarHBondContact SD-CZ 3.5Å; F234-V236 HydrophobicContact CB-CG2 4.33Å |
| 235 | S | 54 | Low | 67.3 | Low | 70 Ų | 70 | 71.4 Ų | 71.4 | 49% | 0.49 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 107.7 | 172.1 | -159.2 | 0 | 0 | 0 | 0 | 108.5 | N227 | N227-S235 WeakPolarHBondContact OD1-CB 3.05Å; N227-S235 PolarHBondContact OD1-OG 3.38Å |
| 236 | V | 57.8 | Low | 68.9 | Low | 55 Ų | 55 | 67.1 Ų | 67.1 | 33% | 0.333 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 127.3 | 179 | -173.8 | 0 | 0 | 0 | 0 | 108 | Q226 Y228 F234 P238 | Q226-V236 PolarHBondContact N-O 3.39Å; Q226-V236 PolarHBondContact O-N 3.09Å; Y228-V236 HydrophobicContact CD2-CB 4.37Å; Y228-V236 HydrophobicContact CE2-CB 4.35Å; F234-V236 HydrophobicContact CB-CG2 4.33Å; V236-P238 WeakPolarHBondContact O-CD 3.25Å |
| 237 | C | 65 | Low | 70.6 | Confident | 13 Ų | 13 | 62.5 Ų | 62.5 | 9% | 0.088 | 35% | 0.352 | C | S | . | . | trans | -65.1 | 121.7 | 170.4 | -179.8 | 0 | 0 | 0 | 0 | 107.9 | F223 F239 T240 | F223-C237 VanDerWaalsContact C-SG 3.56Å; F223-C237 PolarHBondContact O-SG 3.34Å; C237-F239 PolarHBondContact O-N 3.36Å; C237-F239 VanDerWaalsContact O-N 3.08Å; C237-T240 WeakPolarHBondContact O-CB 3.24Å; C237-T240 PolarHBondContact O-N 3.47Å; C237-T240 PolarHBondContact O-OG1 3.21Å | ||
| 238 | P | 71.9 | Confident | 72.2 | Confident | 9 Ų | 9 | 60.2 Ų | 60.2 | 6% | 0.058 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -50.5 | -38.5 | -178.5 | -28 | 35.1 | 0 | 0 | 0 | 112 | Q224 Q226 V236 T240 L241 H242 | Q224-P238 WeakPolarHBondContact O-CD 3.42Å; Q226-P238 HydrophobicContact CB-CG 4.18Å; Q226-P238 HydrophobicContact CG-CG 3.82Å; V236-P238 WeakPolarHBondContact O-CD 3.25Å; P238-T240 PolarHBondContact O-N 3.29Å; P238-L241 WeakPolarHBondContact O-CB 3.45Å; P238-L241 PolarHBondContact O-N 3.4Å; P238-H242 PolarHBondContact O-CE1 2.85Å; P238-H242 PolarHBondContact O-N 3.15Å; P238-H242 PolarHBondContact O-ND1 3.33Å |
| 239 | F | 77.2 | Confident | 74 | Confident | 5 Ų | 5 | 57.7 Ų | 57.7 | 2% | 0.022 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -53.2 | -36.6 | 173.9 | -174.9 | -104.1 | 0 | 0 | 0 | 114.5 | I145 L149 V199 V222 F223 C237 L241 H242 A243 | I145-F239 HydrophobicContact CD1-CE2 4.3Å; I145-F239 HydrophobicContact CD1-CZ 4.04Å; I145-F239 HydrophobicContact CG1-CE2 3.66Å; I145-F239 HydrophobicContact CG1-CZ 3.93Å; L149-F239 HydrophobicContact CD2-CE2 4.21Å; L149-F239 HydrophobicContact CD2-CZ 3.82Å; V199-F239 HydrophobicContact CG1-CE1 4.2Å; V199-F239 HydrophobicContact CG1-CZ 4.28Å; V222-F239 HydrophobicContact CG1-CB 4.29Å; V222-F239 HydrophobicContact CG1-CD2 4.38Å; V222-F239 WeakPolarHBondContact O-CB 3.31Å; V222-F239 PolarHBondContact O-N 2.92Å; F223-F239 HydrophobicContact CD1-CB 3.84Å; F223-F239 HydrophobicContact CD1-CD1 4.1Å; F223-F239 HydrophobicContact CD1-CD2 4.07Å; F223-F239 AromaticContact CD1-CG 3.72Å; F223-F239 HydrophobicContact CD1-CG 3.72Å; F223-F239 HydrophobicContact CE1-CB 4.01Å; F223-F239 AromaticContact CE1-CD1 3.7Å; F223-F239 HydrophobicContact CE1-CD1 3.7Å; F223-F239 AromaticContact CE1-CD2 3.36Å; F223-F239 HydrophobicContact CE1-CD2 3.36Å; F223-F239 AromaticContact CE1-CE1 3.94Å; F223-F239 HydrophobicContact CE1-CE1 3.94Å; F223-F239 AromaticContact CE1-CE2 3.64Å; F223-F239 HydrophobicContact CE1-CE2 3.64Å; F223-F239 AromaticContact CE1-CG 3.38Å; F223-F239 HydrophobicContact CE1-CG 3.38Å; F223-F239 AromaticContact CE1-CZ 3.91Å; F223-F239 HydrophobicContact CE1-CZ 3.91Å; F223-F239 AromaticContact CZ-CD2 3.7Å; F223-F239 HydrophobicContact CZ-CD2 3.7Å; F223-F239 AromaticContact CZ-CE2 3.8Å; F223-F239 HydrophobicContact CZ-CE2 3.8Å; F223-F239 HydrophobicContact CZ-CG 4.19Å; F223-F239 HydrophobicContact CZ-CZ 4.35Å; C237-F239 PolarHBondContact O-N 3.36Å; C237-F239 VanDerWaalsContact O-N 3.08Å; F239-L241 VanDerWaalsContact C-N 3.33Å; F239-L241 PolarHBondContact O-N 3.38Å; F239-H242 PolarHBondContact O-N 2.83Å; F239-A243 HydrophobicContact CE1-CB 4.44Å; F239-A243 WeakPolarHBondContact O-CB 3.39Å; F239-A243 PolarHBondContact O-N 3.22Å |
| 240 | T | 78.6 | Confident | 76.2 | Confident | 26 Ų | 26 | 52.1 Ų | 52.1 | 16% | 0.16 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -65.2 | -39.7 | 178.7 | -51.9 | 0 | 0 | 0 | 0 | 111 | K200 C237 P238 A243 L244 | K200-T240 WeakPolarHBondContact CD-OG1 3.48Å; K200-T240 WeakPolarHBondContact CE-OG1 3.24Å; C237-T240 WeakPolarHBondContact O-CB 3.24Å; C237-T240 PolarHBondContact O-N 3.47Å; C237-T240 PolarHBondContact O-OG1 3.21Å; P238-T240 PolarHBondContact O-N 3.29Å; T240-A243 PolarHBondContact O-N 2.98Å; T240-L244 WeakPolarHBondContact O-CB 3.34Å; T240-L244 PolarHBondContact O-N 3.29Å |
| 241 | L | 83.5 | Confident | 77.9 | Confident | 84 Ų | 84 | 48.2 Ų | 48.2 | 44% | 0.44 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -65.9 | -45.7 | 175.4 | -176 | 66.6 | 0 | 0 | 0 | 110.9 | P238 F239 A243 L244 I245 | P238-L241 WeakPolarHBondContact O-CB 3.45Å; P238-L241 PolarHBondContact O-N 3.4Å; F239-L241 VanDerWaalsContact C-N 3.33Å; F239-L241 PolarHBondContact O-N 3.38Å; L241-A243 PolarHBondContact O-N 3.16Å; L241-L244 PolarHBondContact O-N 3.36Å; L241-I245 HydrophobicContact CD1-CD1 4.39Å; L241-I245 HydrophobicContact CG-CD1 4.05Å; L241-I245 WeakPolarHBondContact O-CG1 3.45Å; L241-I245 PolarHBondContact O-N 3.46Å |
| 242 | H | 86.8 | Confident | 79.3 | Confident | 20 Ų | 20 | 44.7 Ų | 44.7 | 9% | 0.093 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.2 | -47.8 | 175.4 | -60.3 | 118.6 | 0 | 0 | 0 | 111.9 | W146 P238 F239 L244 I245 L246 F300 I304 | W146-H242 HydrophobicContact CH2-CB 4.17Å; W146-H242 HydrophobicContact CZ3-CB 4.45Å; P238-H242 PolarHBondContact O-CE1 2.85Å; P238-H242 PolarHBondContact O-N 3.15Å; P238-H242 PolarHBondContact O-ND1 3.33Å; F239-H242 PolarHBondContact O-N 2.83Å; H242-L244 VanDerWaalsContact C-N 3.33Å; H242-L244 PolarHBondContact O-N 3.09Å; H242-I245 PolarHBondContact O-N 3.49Å; H242-L246 WeakPolarHBondContact O-CB 3.45Å; H242-L246 VanDerWaalsContact O-CG 3.25Å; H242-L246 WeakPolarHBondContact O-CG 3.24Å; H242-L246 PolarHBondContact O-N 3.16Å; H242-F300 HydrophobicContact CB-CE1 3.98Å; H242-F300 HydrophobicContact CB-CZ 4.32Å; H242-F300 AromaticContact CD2-CE1 3.64Å; H242-F300 AromaticContact CD2-CZ 3.58Å; H242-I304 WeakPolarHBondContact CD2-CD1 3.3Å; H242-I304 WeakPolarHBondContact NE2-CD1 3.21Å |
| 243 | A | 88.3 | Confident | 81.2 | Confident | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.008 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.6 | -40 | 179 | 0 | 0 | 0 | 0 | 0 | 112.2 | L149 F239 T240 L241 L246 A247 | L149-A243 HydrophobicContact CD2-CB 3.95Å; F239-A243 HydrophobicContact CE1-CB 4.44Å; F239-A243 WeakPolarHBondContact O-CB 3.39Å; F239-A243 PolarHBondContact O-N 3.22Å; T240-A243 PolarHBondContact O-N 2.98Å; L241-A243 PolarHBondContact O-N 3.16Å; A243-L246 PolarHBondContact O-N 3.11Å; A243-A247 VanDerWaalsContact O-CB 3.27Å; A243-A247 WeakPolarHBondContact O-CB 3.24Å; A243-A247 PolarHBondContact O-N 3.44Å |
| 244 | L | 90.8 | Very high | 83.1 | Confident | 61 Ų | 61 | 37.3 Ų | 37.3 | 32% | 0.319 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65.5 | -43.6 | 176.6 | -177.2 | 140.1 | 0 | 0 | 0 | 111.8 | T240 L241 H242 A247 L248 | T240-L244 WeakPolarHBondContact O-CB 3.34Å; T240-L244 PolarHBondContact O-N 3.29Å; L241-L244 PolarHBondContact O-N 3.36Å; H242-L244 VanDerWaalsContact C-N 3.33Å; H242-L244 PolarHBondContact O-N 3.09Å; L244-A247 PolarHBondContact O-N 3.39Å; L244-L248 HydrophobicContact CD2-CD1 3.68Å; L244-L248 HydrophobicContact CD2-CG 4.35Å; L244-L248 HydrophobicContact CG-CD1 4.49Å; L244-L248 WeakPolarHBondContact O-CG 3.5Å; L244-L248 PolarHBondContact O-N 2.94Å |
| 245 | I | 92.3 | Very high | 85.1 | Confident | 55 Ų | 55 | 32.1 Ų | 32.1 | 28% | 0.282 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62.2 | -45.4 | 176.2 | -68 | 165.6 | 0 | 0 | 0 | 110.7 | L241 H242 A247 L248 F249 F296 F300 | L241-I245 HydrophobicContact CD1-CD1 4.39Å; L241-I245 HydrophobicContact CG-CD1 4.05Å; L241-I245 WeakPolarHBondContact O-CG1 3.45Å; L241-I245 PolarHBondContact O-N 3.46Å; H242-I245 PolarHBondContact O-N 3.49Å; I245-A247 VanDerWaalsContact C-N 3.31Å; I245-A247 PolarHBondContact O-N 3.04Å; I245-L248 PolarHBondContact O-N 2.88Å; I245-F249 PolarHBondContact O-N 3.28Å; I245-F296 HydrophobicContact CG2-CE1 4.34Å; I245-F296 HydrophobicContact CG2-CZ 3.86Å; I245-F300 HydrophobicContact CB-CE2 4.15Å; I245-F300 HydrophobicContact CB-CZ 3.88Å; I245-F300 HydrophobicContact CD1-CE2 3.84Å; I245-F300 HydrophobicContact CD1-CZ 3.77Å; I245-F300 HydrophobicContact CG1-CZ 4.43Å; I245-F300 HydrophobicContact CG2-CD2 4.16Å; I245-F300 HydrophobicContact CG2-CE2 3.55Å; I245-F300 HydrophobicContact CG2-CZ 3.74Å |
| 246 | L | 93.5 | Very high | 86.9 | Confident | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.5 | -40.4 | 175.2 | -68.4 | 174.3 | 0 | 0 | 0 | 111.7 | W146 L149 P150 L153 H242 A243 F249 A250 M293 F296 V297 F300 | W146-L246 HydrophobicContact CE3-CD1 4.38Å; W146-L246 HydrophobicContact CZ3-CD1 4.17Å; L149-L246 HydrophobicContact CD2-CD1 3.92Å; L149-L246 HydrophobicContact CG-CD1 4.41Å; P150-L246 HydrophobicContact CG-CD1 4.19Å; P150-L246 HydrophobicContact CG-CD2 4.44Å; L153-L246 HydrophobicContact CD1-CB 3.87Å; H242-L246 WeakPolarHBondContact O-CB 3.45Å; H242-L246 VanDerWaalsContact O-CG 3.25Å; H242-L246 WeakPolarHBondContact O-CG 3.24Å; H242-L246 PolarHBondContact O-N 3.16Å; A243-L246 PolarHBondContact O-N 3.11Å; L246-F249 PolarHBondContact O-N 3.35Å; L246-A250 WeakPolarHBondContact O-CB 3.26Å; L246-A250 PolarHBondContact O-N 3.1Å; L246-M293 HydrophobicContact CB-CE 4.07Å; L246-M293 HydrophobicContact CD2-CE 3.97Å; L246-F296 HydrophobicContact CD2-CD1 4.11Å; L246-F296 HydrophobicContact CD2-CE1 3.88Å; L246-V297 HydrophobicContact CD2-CG2 3.75Å; L246-F300 HydrophobicContact CD2-CD1 4.09Å; L246-F300 HydrophobicContact CD2-CE1 4.42Å; L246-F300 HydrophobicContact CG-CD1 4.5Å; L246-F300 HydrophobicContact CG-CE1 4.35Å |
| 247 | A | 94.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.6 | -40.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L153 T192 V193 A243 L244 I245 A250 S251 | L153-A247 HydrophobicContact CD1-CB 4.25Å; L153-A247 HydrophobicContact CD2-CB 4.16Å; T192-A247 HydrophobicContact CG2-CB 4.1Å; V193-A247 HydrophobicContact CG2-CB 4.47Å; A243-A247 VanDerWaalsContact O-CB 3.27Å; A243-A247 WeakPolarHBondContact O-CB 3.24Å; A243-A247 PolarHBondContact O-N 3.44Å; L244-A247 PolarHBondContact O-N 3.39Å; I245-A247 VanDerWaalsContact C-N 3.31Å; I245-A247 PolarHBondContact O-N 3.04Å; A247-A250 PolarHBondContact O-N 3.04Å; A247-S251 WeakPolarHBondContact O-CB 3.43Å; A247-S251 PolarHBondContact O-N 3.38Å; A247-S251 PolarHBondContact O-OG 2.69Å |
| 248 | L | 95 | Very high | 89.6 | Confident | 75 Ų | 75 | 31.1 Ų | 31.1 | 39% | 0.393 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -62.5 | -44.8 | 173.9 | -72.4 | 175.3 | 0 | 0 | 0 | 111.1 | V193 L244 I245 S251 L252 | V193-L248 HydrophobicContact CG2-CD2 4.13Å; L244-L248 HydrophobicContact CD2-CD1 3.68Å; L244-L248 HydrophobicContact CD2-CG 4.35Å; L244-L248 HydrophobicContact CG-CD1 4.49Å; L244-L248 WeakPolarHBondContact O-CG 3.5Å; L244-L248 PolarHBondContact O-N 2.94Å; I245-L248 PolarHBondContact O-N 2.88Å; L248-S251 PolarHBondContact O-OG 3.05Å; L248-L252 VanDerWaalsContact O-CB 3.3Å; L248-L252 WeakPolarHBondContact O-CB 3.5Å; L248-L252 WeakPolarHBondContact O-CG 3.38Å; L248-L252 PolarHBondContact O-N 2.93Å |
| 249 | F | 95.9 | Very high | 90.5 | Very high | 40 Ų | 40 | 31.4 Ų | 31.4 | 18% | 0.175 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.4 | -47.7 | 175.7 | -172.1 | -84.4 | 0 | 0 | 0 | 111.9 | I245 L246 S251 I253 G254 M293 F296 | I245-F249 PolarHBondContact O-N 3.28Å; L246-F249 PolarHBondContact O-N 3.35Å; F249-S251 VanDerWaalsContact C-N 3.25Å; F249-S251 PolarHBondContact O-N 3.01Å; F249-I253 HydrophobicContact CD1-CB 4.4Å; F249-I253 HydrophobicContact CD2-CB 4.03Å; F249-I253 HydrophobicContact CD2-CG1 4.11Å; F249-I253 HydrophobicContact CD2-CG2 4.41Å; F249-I253 HydrophobicContact CE1-CB 4.22Å; F249-I253 HydrophobicContact CE1-CG2 4.17Å; F249-I253 HydrophobicContact CE2-CB 3.84Å; F249-I253 HydrophobicContact CE2-CG1 4.14Å; F249-I253 HydrophobicContact CE2-CG2 3.7Å; F249-I253 HydrophobicContact CG-CB 4.31Å; F249-I253 HydrophobicContact CZ-CB 3.93Å; F249-I253 HydrophobicContact CZ-CG2 3.56Å; F249-I253 WeakPolarHBondContact O-CA 3.32Å; F249-I253 PolarHBondContact O-N 3.4Å; F249-G254 PolarHBondContact O-N 3.46Å; F249-M293 HydrophobicContact CD1-SD 3.7Å; F249-M293 HydrophobicContact CE1-SD 4.27Å; F249-F296 HydrophobicContact CB-CD1 3.66Å; F249-F296 HydrophobicContact CB-CE1 3.36Å; F249-F296 HydrophobicContact CB-CE2 4.46Å; F249-F296 HydrophobicContact CB-CG 4.31Å; F249-F296 HydrophobicContact CB-CZ 3.82Å; F249-F296 HydrophobicContact CD1-CB 3.85Å; F249-F296 AromaticContact CD1-CD1 3.52Å; F249-F296 HydrophobicContact CD1-CD1 3.52Å; F249-F296 HydrophobicContact CD1-CD2 4.43Å; F249-F296 HydrophobicContact CD1-CE1 4.17Å; F249-F296 AromaticContact CD1-CG 3.66Å; F249-F296 HydrophobicContact CD1-CG 3.66Å; F249-F296 HydrophobicContact CD2-CB 4.22Å; F249-F296 AromaticContact CD2-CD1 3.77Å; F249-F296 HydrophobicContact CD2-CD1 3.77Å; F249-F296 AromaticContact CD2-CD2 3.42Å; F249-F296 HydrophobicContact CD2-CD2 3.42Å; F249-F296 VanDerWaalsContact CD2-CD2 3.42Å; F249-F296 AromaticContact CD2-CE1 3.91Å; F249-F296 HydrophobicContact CD2-CE1 3.91Å; F249-F296 AromaticContact CD2-CE2 3.59Å; F249-F296 HydrophobicContact CD2-CE2 3.59Å; F249-F296 AromaticContact CD2-CG 3.51Å; F249-F296 HydrophobicContact CD2-CG 3.51Å; F249-F296 AromaticContact CD2-CZ 3.83Å; F249-F296 HydrophobicContact CD2-CZ 3.83Å; F249-F296 HydrophobicContact CE1-CB 3.47Å; F249-F296 VanDerWaalsContact CE1-CB 3.47Å; F249-F296 HydrophobicContact CE1-CD1 4.09Å; F249-F296 HydrophobicContact CE1-CD2 4.48Å; F249-F296 AromaticContact CE1-CG 3.77Å; F249-F296 HydrophobicContact CE1-CG 3.77Å; F249-F296 HydrophobicContact CE2-CB 3.88Å; F249-F296 HydrophobicContact CE2-CD1 4.3Å; F249-F296 AromaticContact CE2-CD2 3.48Å; F249-F296 HydrophobicContact CE2-CD2 3.48Å; F249-F296 VanDerWaalsContact CE2-CD2 3.48Å; F249-F296 HydrophobicContact CE2-CE2 4.07Å; F249-F296 AromaticContact CE2-CG 3.61Å; F249-F296 HydrophobicContact CE2-CG 3.61Å; F249-F296 HydrophobicContact CG-CB 4.21Å; F249-F296 AromaticContact CG-CD1 3.34Å; F249-F296 HydrophobicContact CG-CD1 3.34Å; F249-F296 AromaticContact CG-CD2 3.93Å; F249-F296 HydrophobicContact CG-CD2 3.93Å; F249-F296 AromaticContact CG-CE1 3.54Å; F249-F296 HydrophobicContact CG-CE1 3.54Å; F249-F296 HydrophobicContact CG-CE2 4.12Å; F249-F296 AromaticContact CG-CG 3.54Å; F249-F296 HydrophobicContact CG-CG 3.54Å; F249-F296 AromaticContact CG-CZ 3.94Å; F249-F296 HydrophobicContact CG-CZ 3.94Å; F249-F296 HydrophobicContact CZ-CB 3.49Å; F249-F296 VanDerWaalsContact CZ-CB 3.49Å; F249-F296 HydrophobicContact CZ-CD1 4.45Å; F249-F296 HydrophobicContact CZ-CD2 4.05Å; F249-F296 AromaticContact CZ-CG 3.75Å; F249-F296 HydrophobicContact CZ-CG 3.75Å |
| 250 | A | 95.2 | Very high | 91.2 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.3 | -34.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L153 I154 T192 L246 A247 P255 M293 | L153-A250 HydrophobicContact CB-CB 3.88Å; I154-A250 HydrophobicContact CD1-CB 3.74Å; I154-A250 HydrophobicContact CG1-CB 4.2Å; T192-A250 HydrophobicContact CG2-CB 4.42Å; L246-A250 WeakPolarHBondContact O-CB 3.26Å; L246-A250 PolarHBondContact O-N 3.1Å; A247-A250 PolarHBondContact O-N 3.04Å; A250-P255 WeakPolarHBondContact O-CD 3.41Å; A250-M293 HydrophobicContact CB-CE 3.98Å; A250-M293 HydrophobicContact CB-SD 4.06Å |
| 251 | S | 94.7 | Very high | 91.8 | Very high | 1 Ų | 1 | 36.4 Ų | 36.4 | 1% | 0.007 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -85.6 | -40.8 | -180 | 53.7 | 0 | 0 | 0 | 0 | 114.2 | N157 F185 A189 A247 L248 F249 P255 | N157-S251 WeakPolarHBondContact OD1-CA 3.19Å; N157-S251 WeakPolarHBondContact OD1-CB 3.35Å; F185-S251 WeakPolarHBondContact CE2-O 3.3Å; A189-S251 VanDerWaalsContact CA-CB 3.47Å; A247-S251 WeakPolarHBondContact O-CB 3.43Å; A247-S251 PolarHBondContact O-N 3.38Å; A247-S251 PolarHBondContact O-OG 2.69Å; L248-S251 PolarHBondContact O-OG 3.05Å; F249-S251 VanDerWaalsContact C-N 3.25Å; F249-S251 PolarHBondContact O-N 3.01Å; S251-P255 WeakPolarHBondContact O-CD 3.48Å; S251-P255 VanDerWaalsContact O-CG 3.32Å; S251-P255 WeakPolarHBondContact O-CG 3.47Å |
| 252 | L | 93.7 | Very high | 92.2 | Very high | 77 Ų | 77 | 33.4 Ų | 33.4 | 40% | 0.403 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -87.3 | -44.3 | -174.8 | -61.6 | 177.6 | 0 | 0 | 0 | 112.6 | F185 L248 F256 | F185-L252 HydrophobicContact CE1-CD2 4.09Å; F185-L252 HydrophobicContact CZ-CD2 4.22Å; L248-L252 VanDerWaalsContact O-CB 3.3Å; L248-L252 WeakPolarHBondContact O-CB 3.5Å; L248-L252 WeakPolarHBondContact O-CG 3.38Å; L248-L252 PolarHBondContact O-N 2.93Å; L252-F256 WeakPolarHBondContact O-CD2 3.44Å; L252-F256 VanDerWaalsContact O-CE2 3.3Å; L252-F256 WeakPolarHBondContact O-CE2 3.33Å |
| 253 | I | 94.1 | Very high | 92.4 | Very high | 77 Ų | 77 | 33.4 Ų | 33.4 | 40% | 0.395 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -103 | -37.3 | -172.5 | -54.2 | -58 | 0 | 0 | 0 | 111.5 | F249 P255 F256 | F249-I253 HydrophobicContact CD1-CB 4.4Å; F249-I253 HydrophobicContact CD2-CB 4.03Å; F249-I253 HydrophobicContact CD2-CG1 4.11Å; F249-I253 HydrophobicContact CD2-CG2 4.41Å; F249-I253 HydrophobicContact CE1-CB 4.22Å; F249-I253 HydrophobicContact CE1-CG2 4.17Å; F249-I253 HydrophobicContact CE2-CB 3.84Å; F249-I253 HydrophobicContact CE2-CG1 4.14Å; F249-I253 HydrophobicContact CE2-CG2 3.7Å; F249-I253 HydrophobicContact CG-CB 4.31Å; F249-I253 HydrophobicContact CZ-CB 3.93Å; F249-I253 HydrophobicContact CZ-CG2 3.56Å; F249-I253 WeakPolarHBondContact O-CA 3.32Å; F249-I253 PolarHBondContact O-N 3.4Å; I253-P255 VanDerWaalsContact C-CD 3.45Å; I253-P255 VanDerWaalsContact C-N 3.33Å; I253-F256 WeakPolarHBondContact O-CB 3.41Å; I253-F256 PolarHBondContact O-N 3.31Å |
| 254 | G | 92.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -45 | -48 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | F249 F256 G257 | F249-G254 PolarHBondContact O-N 3.46Å; G254-F256 PolarHBondContact O-N 3.04Å; G254-F256 VanDerWaalsContact O-N 3.1Å; G254-G257 PolarHBondContact O-N 3.27Å; G254-G257 VanDerWaalsContact O-N 3.07Å |
| 255 | P | 91.6 | Very high | 92.6 | Very high | 5 Ų | 5 | 33.6 Ų | 33.6 | 3% | 0.032 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.7 | -19.9 | -178.5 | -28.1 | 39.6 | 0 | 0 | 0 | 115 | N157 F185 A250 S251 I253 G257 G258 F259 | N157-P255 WeakPolarHBondContact ND2-CG 3.32Å; F185-P255 HydrophobicContact CD2-CG 4.39Å; F185-P255 HydrophobicContact CE2-CB 4.17Å; F185-P255 HydrophobicContact CE2-CG 3.93Å; A250-P255 WeakPolarHBondContact O-CD 3.41Å; S251-P255 WeakPolarHBondContact O-CD 3.48Å; S251-P255 VanDerWaalsContact O-CG 3.32Å; S251-P255 WeakPolarHBondContact O-CG 3.47Å; I253-P255 VanDerWaalsContact C-CD 3.45Å; I253-P255 VanDerWaalsContact C-N 3.33Å; P255-G257 VanDerWaalsContact C-N 3.25Å; P255-G257 PolarHBondContact O-N 2.9Å; P255-G258 PolarHBondContact O-N 3.39Å; P255-G258 VanDerWaalsContact O-N 3.17Å; P255-F259 HydrophobicContact CB-CE2 4.2Å; P255-F259 HydrophobicContact CB-CZ 4.21Å; P255-F259 WeakPolarHBondContact O-CD2 3.48Å; P255-F259 PolarHBondContact O-N 3.41Å; P255-F259 VanDerWaalsContact O-N 3.07Å |
| 256 | F | 91.2 | Very high | 92.5 | Very high | 108 Ų | 108 | 37.5 Ų | 37.5 | 47% | 0.474 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -67.1 | -26.3 | 176.1 | -75.9 | -101.5 | 0 | 0 | 0 | 112.7 | L252 I253 G254 G258 F259 F260 | L252-F256 WeakPolarHBondContact O-CD2 3.44Å; L252-F256 VanDerWaalsContact O-CE2 3.3Å; L252-F256 WeakPolarHBondContact O-CE2 3.33Å; I253-F256 WeakPolarHBondContact O-CB 3.41Å; I253-F256 PolarHBondContact O-N 3.31Å; G254-F256 PolarHBondContact O-N 3.04Å; G254-F256 VanDerWaalsContact O-N 3.1Å; F256-G258 VanDerWaalsContact C-N 3.31Å; F256-G258 PolarHBondContact O-N 3.46Å; F256-F259 HydrophobicContact CB-CD2 4.25Å; F256-F259 AromaticContact CD1-CD2 3.86Å; F256-F259 HydrophobicContact CD1-CD2 3.86Å; F256-F259 HydrophobicContact CD1-CE2 4.42Å; F256-F259 HydrophobicContact CD2-CD2 4.28Å; F256-F259 HydrophobicContact CD2-CE2 4.18Å; F256-F259 HydrophobicContact CE1-CD2 4.26Å; F256-F259 HydrophobicContact CE2-CE2 4.3Å; F256-F259 AromaticContact CG-CD2 3.87Å; F256-F259 HydrophobicContact CG-CD2 3.87Å; F256-F259 HydrophobicContact CG-CE2 4.24Å; F256-F259 HydrophobicContact CZ-CE2 4.48Å; F256-F259 PolarHBondContact O-N 3.1Å; F256-F260 WeakPolarHBondContact O-CB 3.44Å; F256-F260 PolarHBondContact O-N 3.03Å |
| 257 | G | 91.4 | Very high | 92.4 | Very high | 7 Ų | 7 | 41 Ų | 41 | 7% | 0.072 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.5 | -45.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | G254 P255 F260 A261 | G254-G257 PolarHBondContact O-N 3.27Å; G254-G257 VanDerWaalsContact O-N 3.07Å; P255-G257 VanDerWaalsContact C-N 3.25Å; P255-G257 PolarHBondContact O-N 2.9Å; G257-F260 PolarHBondContact O-N 2.89Å; G257-A261 WeakPolarHBondContact O-CB 3.47Å; G257-A261 PolarHBondContact O-N 3.35Å |
| 258 | G | 89.6 | Confident | 92.2 | Very high | 2 Ų | 2 | 44.1 Ų | 44.1 | 2% | 0.021 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -70.6 | -30.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | P255 F256 S262 D288 | P255-G258 PolarHBondContact O-N 3.39Å; P255-G258 VanDerWaalsContact O-N 3.17Å; F256-G258 VanDerWaalsContact C-N 3.31Å; F256-G258 PolarHBondContact O-N 3.46Å; G258-S262 VanDerWaalsContact O-CB 3.3Å; G258-S262 WeakPolarHBondContact O-CB 3.27Å; G258-S262 PolarHBondContact O-N 2.9Å; G258-S262 PolarHBondContact O-OG 3.46Å; G258-D288 VanDerWaalsContact CA-OD2 3.26Å; G258-D288 WeakPolarHBondContact CA-OD2 3.48Å |
| 259 | F | 90.9 | Very high | 92 | Very high | 14 Ų | 14 | 50.1 Ų | 50.1 | 6% | 0.061 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.3 | -42.5 | 171.1 | -58.7 | -41.5 | 0 | 0 | 0 | 111.6 | L173 I174 K180 P255 F256 S262 G263 | L173-F259 HydrophobicContact CD2-CE1 4.17Å; L173-F259 HydrophobicContact CD2-CE2 4.26Å; L173-F259 HydrophobicContact CD2-CZ 3.46Å; L173-F259 VanDerWaalsContact CD2-CZ 3.46Å; L173-F259 HydrophobicContact CG-CZ 4.4Å; I174-F259 HydrophobicContact CG2-CD1 4.05Å; I174-F259 HydrophobicContact CG2-CE1 4.07Å; K180-F259 HydrophobicContact CB-CE1 4.43Å; K180-F259 HydrophobicContact CD-CD1 4.01Å; K180-F259 HydrophobicContact CD-CE1 3.28Å; K180-F259 HydrophobicContact CD-CZ 4.14Å; K180-F259 HydrophobicContact CG-CE1 4.46Å; P255-F259 HydrophobicContact CB-CE2 4.2Å; P255-F259 HydrophobicContact CB-CZ 4.21Å; P255-F259 WeakPolarHBondContact O-CD2 3.48Å; P255-F259 PolarHBondContact O-N 3.41Å; P255-F259 VanDerWaalsContact O-N 3.07Å; F256-F259 HydrophobicContact CB-CD2 4.25Å; F256-F259 AromaticContact CD1-CD2 3.86Å; F256-F259 HydrophobicContact CD1-CD2 3.86Å; F256-F259 HydrophobicContact CD1-CE2 4.42Å; F256-F259 HydrophobicContact CD2-CD2 4.28Å; F256-F259 HydrophobicContact CD2-CE2 4.18Å; F256-F259 HydrophobicContact CE1-CD2 4.26Å; F256-F259 HydrophobicContact CE2-CE2 4.3Å; F256-F259 AromaticContact CG-CD2 3.87Å; F256-F259 HydrophobicContact CG-CD2 3.87Å; F256-F259 HydrophobicContact CG-CE2 4.24Å; F256-F259 HydrophobicContact CZ-CE2 4.48Å; F256-F259 PolarHBondContact O-N 3.1Å; F259-S262 WeakPolarHBondContact O-CB 3.36Å; F259-S262 PolarHBondContact O-N 3.25Å; F259-G263 PolarHBondContact O-N 3.17Å |
| 260 | F | 91.8 | Very high | 91.7 | Very high | 135 Ų | 135 | 50.2 Ų | 50.2 | 59% | 0.592 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -61 | -49.4 | 176.5 | 176.9 | -96.4 | 0 | 0 | 0 | 111.2 | F256 G257 S262 G263 F264 | F256-F260 WeakPolarHBondContact O-CB 3.44Å; F256-F260 PolarHBondContact O-N 3.03Å; G257-F260 PolarHBondContact O-N 2.89Å; F260-S262 VanDerWaalsContact C-N 3.31Å; F260-S262 PolarHBondContact O-N 3.07Å; F260-G263 WeakPolarHBondContact O-CA 3.49Å; F260-G263 PolarHBondContact O-N 3.39Å; F260-G263 VanDerWaalsContact O-N 3.07Å; F260-F264 PolarHBondContact O-N 2.99Å |
| 261 | A | 91.3 | Very high | 91.3 | Very high | 2 Ų | 2 | 57.1 Ų | 57.1 | 2% | 0.017 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | G257 G263 F264 K265 F273 D288 | G257-A261 WeakPolarHBondContact O-CB 3.47Å; G257-A261 PolarHBondContact O-N 3.35Å; A261-G263 PolarHBondContact O-N 3.42Å; A261-F264 WeakPolarHBondContact O-CB 3.26Å; A261-F264 PolarHBondContact O-N 2.86Å; A261-K265 WeakPolarHBondContact O-CG 3.42Å; A261-K265 PolarHBondContact O-N 3.27Å; A261-F273 HydrophobicContact CB-CE2 4Å; A261-F273 HydrophobicContact CB-CZ 4.34Å; A261-D288 HydrophobicContact CB-CB 3.54Å; A261-D288 WeakPolarHBondContact CB-OD2 3.26Å |
| 262 | S | 90.5 | Very high | 90.9 | Very high | 20 Ų | 20 | 60.2 Ų | 60.2 | 14% | 0.14 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 173 | -63.9 | 0 | 0 | 0 | 0 | 112 | G258 F259 F260 K265 R266 | G258-S262 VanDerWaalsContact O-CB 3.3Å; G258-S262 WeakPolarHBondContact O-CB 3.27Å; G258-S262 PolarHBondContact O-N 2.9Å; G258-S262 PolarHBondContact O-OG 3.46Å; F259-S262 WeakPolarHBondContact O-CB 3.36Å; F259-S262 PolarHBondContact O-N 3.25Å; F260-S262 VanDerWaalsContact C-N 3.31Å; F260-S262 PolarHBondContact O-N 3.07Å; S262-K265 PolarHBondContact O-N 3.07Å; S262-R266 WeakPolarHBondContact O-CG 3.27Å; S262-R266 PolarHBondContact O-N 3.45Å |
| 263 | G | 91.9 | Very high | 90.6 | Very high | 20 Ų | 20 | 56.9 Ų | 56.9 | 21% | 0.206 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 177 | 0 | 0 | 0 | 0 | 0 | 113.3 | F259 F260 A261 K265 R266 A267 | F259-G263 PolarHBondContact O-N 3.17Å; F260-G263 WeakPolarHBondContact O-CA 3.49Å; F260-G263 PolarHBondContact O-N 3.39Å; F260-G263 VanDerWaalsContact O-N 3.07Å; A261-G263 PolarHBondContact O-N 3.42Å; G263-K265 VanDerWaalsContact C-N 3.34Å; G263-K265 PolarHBondContact O-N 3.07Å; G263-R266 PolarHBondContact O-N 2.87Å; G263-A267 PolarHBondContact O-N 3.16Å |
| 264 | F | 92.1 | Very high | 90.2 | Very high | 46 Ų | 46 | 54.4 Ų | 54.4 | 20% | 0.202 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -54.6 | -50 | 173.6 | -178.4 | -84.8 | 0 | 0 | 0 | 111.4 | W121 F260 A261 R266 A267 F268 F273 | W121-F264 HydrophobicContact CH2-CE1 4.08Å; W121-F264 AromaticContact CH2-CE2 3.79Å; W121-F264 HydrophobicContact CH2-CE2 3.79Å; W121-F264 AromaticContact CH2-CZ 3.2Å; W121-F264 HydrophobicContact CH2-CZ 3.2Å; W121-F264 HydrophobicContact CZ2-CE1 4.24Å; W121-F264 HydrophobicContact CZ2-CE2 4.26Å; W121-F264 AromaticContact CZ2-CZ 3.41Å; W121-F264 HydrophobicContact CZ2-CZ 3.41Å; W121-F264 VanDerWaalsContact CZ2-CZ 3.41Å; W121-F264 HydrophobicContact CZ3-CE2 4.2Å; W121-F264 HydrophobicContact CZ3-CZ 4.06Å; F260-F264 PolarHBondContact O-N 2.99Å; A261-F264 WeakPolarHBondContact O-CB 3.26Å; A261-F264 PolarHBondContact O-N 2.86Å; F264-R266 VanDerWaalsContact C-N 3.31Å; F264-R266 PolarHBondContact O-N 3.42Å; F264-A267 WeakPolarHBondContact O-CB 3.22Å; F264-A267 PolarHBondContact O-N 3.39Å; F264-F268 HydrophobicContact CD1-CD2 4Å; F264-F268 HydrophobicContact CD1-CE2 4.37Å; F264-F268 HydrophobicContact CD2-CD2 4.29Å; F264-F268 AromaticContact CD2-CE2 3.84Å; F264-F268 HydrophobicContact CD2-CE2 3.84Å; F264-F268 AromaticContact CE1-CD2 3.82Å; F264-F268 HydrophobicContact CE1-CD2 3.82Å; F264-F268 HydrophobicContact CE1-CE2 4.11Å; F264-F268 HydrophobicContact CE2-CD2 4.14Å; F264-F268 AromaticContact CE2-CE2 3.57Å; F264-F268 HydrophobicContact CE2-CE2 3.57Å; F264-F268 HydrophobicContact CG-CD2 4.26Å; F264-F268 HydrophobicContact CG-CE2 4.26Å; F264-F268 AromaticContact CZ-CD2 3.93Å; F264-F268 HydrophobicContact CZ-CD2 3.93Å; F264-F268 AromaticContact CZ-CE2 3.75Å; F264-F268 HydrophobicContact CZ-CE2 3.75Å; F264-F268 VanDerWaalsContact O-CD2 3.25Å; F264-F268 WeakPolarHBondContact O-CD2 3.25Å; F264-F268 PolarHBondContact O-N 3.15Å; F264-F273 HydrophobicContact CB-CZ 4.49Å; F264-F273 AromaticContact CD1-CE1 3.43Å; F264-F273 HydrophobicContact CD1-CE1 3.43Å; F264-F273 VanDerWaalsContact CD1-CE1 3.43Å; F264-F273 AromaticContact CD1-CZ 3.62Å; F264-F273 HydrophobicContact CD1-CZ 3.62Å; F264-F273 HydrophobicContact CE1-CD1 4.38Å; F264-F273 AromaticContact CE1-CE1 3.48Å; F264-F273 HydrophobicContact CE1-CE1 3.48Å; F264-F273 VanDerWaalsContact CE1-CE1 3.48Å; F264-F273 HydrophobicContact CE1-CZ 4.16Å; F264-F273 HydrophobicContact CG-CE1 4.41Å; F264-F273 HydrophobicContact CG-CZ 4.31Å; F264-F273 HydrophobicContact CZ-CE1 4.45Å |
| 265 | K | 91.5 | Very high | 89.7 | Confident | 20 Ų | 20 | 58.5 Ų | 58.5 | 9% | 0.087 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.7 | -42.5 | 179.1 | -70 | -173.5 | -58.2 | 176.2 | 0 | 112.4 | A261 S262 G263 F268 K269 I270 K271 F273 D285 | A261-K265 WeakPolarHBondContact O-CG 3.42Å; A261-K265 PolarHBondContact O-N 3.27Å; S262-K265 PolarHBondContact O-N 3.07Å; G263-K265 VanDerWaalsContact C-N 3.34Å; G263-K265 PolarHBondContact O-N 3.07Å; K265-F268 PolarHBondContact O-N 3.4Å; K265-K269 PolarHBondContact O-N 2.96Å; K265-K269 VanDerWaalsContact O-N 3.16Å; K265-I270 CarbonylContact C-O 3.48Å; K265-I270 HydrophobicContact CB-CD1 4.46Å; K265-I270 HydrophobicContact CB-CG1 3.88Å; K265-I270 HydrophobicContact CG-CD1 4.14Å; K265-I270 HydrophobicContact CG-CG1 4.08Å; K265-I270 VanDerWaalsContact O-CG1 3.31Å; K265-I270 WeakPolarHBondContact O-CG1 3.49Å; K265-I270 PolarHBondContact O-N 3.35Å; K265-I270 VanDerWaalsContact O-O 3.08Å; K265-K271 VanDerWaalsContact CD-O 3.25Å; K265-K271 WeakPolarHBondContact CD-O 3.47Å; K265-K271 WeakPolarHBondContact CE-O 3.41Å; K265-K271 PolarHBondContact NZ-O 3.44Å; K265-F273 HydrophobicContact CD-CD2 3.66Å; K265-F273 HydrophobicContact CD-CE2 3.59Å; K265-F273 HydrophobicContact CD-CG 4.44Å; K265-F273 HydrophobicContact CD-CZ 4.35Å; K265-F273 HydrophobicContact CG-CD2 4Å; K265-F273 HydrophobicContact CG-CE1 4.45Å; K265-F273 HydrophobicContact CG-CE2 3.58Å; K265-F273 HydrophobicContact CG-CZ 3.83Å; K265-D285 WeakPolarHBondContact CD-OD1 3.15Å; K265-D285 WeakPolarHBondContact CE-OD1 3.39Å; K265-D285 IonicContact NZ-OD1 2.51Å; K265-D285 PolarHBondContact NZ-OD1 3.18Å |
| 266 | R | 90.7 | Very high | 89.1 | Confident | 138 Ų | 138 | 62 Ų | 62 | 52% | 0.521 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -67.4 | -38.3 | 177.8 | -60.7 | -55 | 167.1 | -160.3 | -6.1 | 112.8 | L176 S262 G263 F264 F268 K269 | L176-R266 HydrophobicContact CD1-CB 4.36Å; L176-R266 HydrophobicContact CD1-CG 4.2Å; S262-R266 WeakPolarHBondContact O-CG 3.27Å; S262-R266 PolarHBondContact O-N 3.45Å; G263-R266 PolarHBondContact O-N 2.87Å; F264-R266 VanDerWaalsContact C-N 3.31Å; F264-R266 PolarHBondContact O-N 3.42Å; R266-F268 PolarHBondContact O-N 3.03Å; R266-K269 PolarHBondContact O-N 3.29Å; R266-K269 VanDerWaalsContact O-N 3.1Å |
| 267 | A | 91.4 | Very high | 88.2 | Confident | 75 Ų | 75 | 60.1 Ų | 60.1 | 62% | 0.62 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -58.7 | -36.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | G263 F264 | G263-A267 PolarHBondContact O-N 3.16Å; F264-A267 WeakPolarHBondContact O-CB 3.22Å; F264-A267 PolarHBondContact O-N 3.39Å |
| 268 | F | 90 | Very high | 87 | Confident | 65 Ų | 65 | 65.2 Ų | 65.2 | 29% | 0.285 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.8 | 10.5 | 178.4 | -63 | -65.5 | 0 | 0 | 0 | 114.6 | I38 W121 F264 K265 R266 I270 | I38-F268 HydrophobicContact CD1-CB 3.91Å; I38-F268 HydrophobicContact CD1-CD1 3.29Å; I38-F268 HydrophobicContact CD1-CD2 4.47Å; I38-F268 HydrophobicContact CD1-CE1 3.93Å; I38-F268 HydrophobicContact CD1-CG 3.62Å; I38-F268 HydrophobicContact CG1-CD1 4.25Å; W121-F268 AromaticContact CH2-CD2 4Å; W121-F268 HydrophobicContact CH2-CD2 4Å; W121-F268 HydrophobicContact CH2-CE1 4.21Å; W121-F268 AromaticContact CH2-CE2 3.58Å; W121-F268 HydrophobicContact CH2-CE2 3.58Å; W121-F268 AromaticContact CH2-CZ 3.71Å; W121-F268 HydrophobicContact CH2-CZ 3.71Å; W121-F268 HydrophobicContact CZ3-CD2 4.5Å; W121-F268 AromaticContact CZ3-CE1 3.96Å; W121-F268 HydrophobicContact CZ3-CE1 3.96Å; W121-F268 AromaticContact CZ3-CE2 3.69Å; W121-F268 HydrophobicContact CZ3-CE2 3.69Å; W121-F268 AromaticContact CZ3-CZ 3.39Å; W121-F268 HydrophobicContact CZ3-CZ 3.39Å; F264-F268 HydrophobicContact CD1-CD2 4Å; F264-F268 HydrophobicContact CD1-CE2 4.37Å; F264-F268 HydrophobicContact CD2-CD2 4.29Å; F264-F268 AromaticContact CD2-CE2 3.84Å; F264-F268 HydrophobicContact CD2-CE2 3.84Å; F264-F268 AromaticContact CE1-CD2 3.82Å; F264-F268 HydrophobicContact CE1-CD2 3.82Å; F264-F268 HydrophobicContact CE1-CE2 4.11Å; F264-F268 HydrophobicContact CE2-CD2 4.14Å; F264-F268 AromaticContact CE2-CE2 3.57Å; F264-F268 HydrophobicContact CE2-CE2 3.57Å; F264-F268 HydrophobicContact CG-CD2 4.26Å; F264-F268 HydrophobicContact CG-CE2 4.26Å; F264-F268 AromaticContact CZ-CD2 3.93Å; F264-F268 HydrophobicContact CZ-CD2 3.93Å; F264-F268 AromaticContact CZ-CE2 3.75Å; F264-F268 HydrophobicContact CZ-CE2 3.75Å; F264-F268 VanDerWaalsContact O-CD2 3.25Å; F264-F268 WeakPolarHBondContact O-CD2 3.25Å; F264-F268 PolarHBondContact O-N 3.15Å; K265-F268 PolarHBondContact O-N 3.4Å; R266-F268 PolarHBondContact O-N 3.03Å; F268-I270 HydrophobicContact CB-CG1 4.35Å; F268-I270 PolarHBondContact O-N 2.95Å |
| 269 | K | 90.6 | Very high | 86.1 | Confident | 200 Ų | 200 | 69.4 Ų | 69.4 | 87% | 0.87 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.6 | 32.6 | -179.5 | -57.5 | 179.9 | 179.3 | -179.2 | 0 | 113.5 | K265 R266 | K265-K269 PolarHBondContact O-N 2.96Å; K265-K269 VanDerWaalsContact O-N 3.16Å; R266-K269 PolarHBondContact O-N 3.29Å; R266-K269 VanDerWaalsContact O-N 3.1Å |
| 270 | I | 89.3 | Confident | 85.1 | Confident | 43 Ų | 43 | 73.9 Ų | 73.9 | 22% | 0.221 | 42% | 0.416 | C | S | . | . | trans | -106.2 | 159.3 | 173.5 | 61.2 | 172 | 0 | 0 | 0 | 110.4 | I34 K265 F268 | I34-I270 HydrophobicContact CD1-CD1 3.49Å; I34-I270 VanDerWaalsContact CD1-CD1 3.49Å; I34-I270 HydrophobicContact CG1-CD1 4Å; I34-I270 HydrophobicContact CG2-CD1 4.05Å; K265-I270 CarbonylContact C-O 3.48Å; K265-I270 HydrophobicContact CB-CD1 4.46Å; K265-I270 HydrophobicContact CB-CG1 3.88Å; K265-I270 HydrophobicContact CG-CD1 4.14Å; K265-I270 HydrophobicContact CG-CG1 4.08Å; K265-I270 VanDerWaalsContact O-CG1 3.31Å; K265-I270 WeakPolarHBondContact O-CG1 3.49Å; K265-I270 PolarHBondContact O-N 3.35Å; K265-I270 VanDerWaalsContact O-O 3.08Å; F268-I270 HydrophobicContact CB-CG1 4.35Å; F268-I270 PolarHBondContact O-N 2.95Å | ||
| 271 | K | 86.1 | Confident | 84.6 | Confident | 144 Ų | 144 | 67.9 Ų | 67.9 | 63% | 0.626 | 39% | 0.391 | S | S | * | . | S | Bend | trans | -100.3 | -41.9 | 179.1 | -173.7 | -175.6 | 169.8 | -170.5 | 0 | 112.6 | K265 | K265-K271 VanDerWaalsContact CD-O 3.25Å; K265-K271 WeakPolarHBondContact CD-O 3.47Å; K265-K271 WeakPolarHBondContact CE-O 3.41Å; K265-K271 PolarHBondContact NZ-O 3.44Å |
| 272 | D | 87.3 | Confident | 84.2 | Confident | 67 Ų | 67 | 67.8 Ų | 67.8 | 36% | 0.358 | 39% | 0.391 | S | S | . | . | trans | -134.4 | 149.9 | -173.1 | -54.9 | -53 | 0 | 0 | 0 | 108.5 | G274 | D272-G274 VanDerWaalsContact C-N 3.26Å; D272-G274 PolarHBondContact O-N 3.25Å | ||
| 273 | F | 87 | Confident | 84.2 | Confident | 7 Ų | 7 | 68 Ų | 68 | 3% | 0.031 | 39% | 0.39 | C | S | . | . | S | Bend | trans | -72.2 | -24.3 | 179.4 | -80.2 | -84.9 | 0 | 0 | 0 | 112.8 | E30 I31 I34 A261 F264 K265 M284 D285 | E30-F273 HydrophobicContact CB-CB 4.33Å; I31-F273 HydrophobicContact CG1-CD1 3.96Å; I31-F273 HydrophobicContact CG1-CE1 4.13Å; I34-F273 HydrophobicContact CD1-CB 4.34Å; I34-F273 HydrophobicContact CD1-CD1 3.61Å; I34-F273 HydrophobicContact CD1-CE1 4.4Å; I34-F273 HydrophobicContact CD1-CG 4.35Å; A261-F273 HydrophobicContact CB-CE2 4Å; A261-F273 HydrophobicContact CB-CZ 4.34Å; F264-F273 HydrophobicContact CB-CZ 4.49Å; F264-F273 AromaticContact CD1-CE1 3.43Å; F264-F273 HydrophobicContact CD1-CE1 3.43Å; F264-F273 VanDerWaalsContact CD1-CE1 3.43Å; F264-F273 AromaticContact CD1-CZ 3.62Å; F264-F273 HydrophobicContact CD1-CZ 3.62Å; F264-F273 HydrophobicContact CE1-CD1 4.38Å; F264-F273 AromaticContact CE1-CE1 3.48Å; F264-F273 HydrophobicContact CE1-CE1 3.48Å; F264-F273 VanDerWaalsContact CE1-CE1 3.48Å; F264-F273 HydrophobicContact CE1-CZ 4.16Å; F264-F273 HydrophobicContact CG-CE1 4.41Å; F264-F273 HydrophobicContact CG-CZ 4.31Å; F264-F273 HydrophobicContact CZ-CE1 4.45Å; K265-F273 HydrophobicContact CD-CD2 3.66Å; K265-F273 HydrophobicContact CD-CE2 3.59Å; K265-F273 HydrophobicContact CD-CG 4.44Å; K265-F273 HydrophobicContact CD-CZ 4.35Å; K265-F273 HydrophobicContact CG-CD2 4Å; K265-F273 HydrophobicContact CG-CE1 4.45Å; K265-F273 HydrophobicContact CG-CE2 3.58Å; K265-F273 HydrophobicContact CG-CZ 3.83Å; F273-M284 HydrophobicContact CB-CB 3.86Å; F273-M284 HydrophobicContact CB-CG 4.39Å; F273-M284 HydrophobicContact CD1-CB 4.33Å; F273-M284 HydrophobicContact CD1-CG 3.99Å; F273-M284 HydrophobicContact CD2-CB 3.87Å; F273-M284 HydrophobicContact CD2-CG 3.64Å; F273-M284 HydrophobicContact CE1-CG 4.13Å; F273-M284 HydrophobicContact CE2-CG 3.83Å; F273-M284 HydrophobicContact CG-CB 3.77Å; F273-M284 HydrophobicContact CG-CG 3.76Å; F273-M284 HydrophobicContact CZ-CG 4.07Å; F273-D285 WeakPolarHBondContact CD2-OD1 3.4Å; F273-D285 PolarHBondContact N-OD2 2.97Å |
| 274 | G | 84.9 | Confident | 84.1 | Confident | 24 Ų | 24 | 67.7 Ų | 67.7 | 25% | 0.247 | 38% | 0.384 | C | S | . | . | trans | -165.8 | -172 | -179.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | D272 G281 G282 | D272-G274 VanDerWaalsContact C-N 3.26Å; D272-G274 PolarHBondContact O-N 3.25Å; G274-G281 CarbonylContact O-C 3.24Å; G274-G281 VanDerWaalsContact O-C 3.24Å; G274-G282 PolarHBondContact O-N 3.05Å; G274-G282 VanDerWaalsContact O-N 3.12Å | ||
| 275 | A | 83 | Confident | 83.8 | Confident | 87 Ų | 87 | 66.6 Ų | 66.6 | 72% | 0.719 | 38% | 0.38 | S | S | * | . | trans | -128.1 | 28.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I277 | A275-I277 PolarHBondContact O-N 3.39Š| ||
| 276 | V | 77.9 | Confident | 83.5 | Confident | 79 Ų | 79 | 71 Ų | 71 | 48% | 0.479 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -58.6 | -39 | -175.2 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | E30 | E30-V276 WeakPolarHBondContact OE1-CG2 3.47Š|
| 277 | I | 72.3 | Confident | 83.4 | Confident | 68 Ų | 68 | 66.6 Ų | 66.6 | 35% | 0.349 | 38% | 0.38 | S | S | . | . | B | Isolated β-bridge | trans | -109.3 | 111.2 | 175.4 | -52.3 | 175.4 | 0 | 0 | 0 | 107.9 | A275 G279 H280 G281 | A275-I277 PolarHBondContact O-N 3.39Å; I277-G279 PolarHBondContact O-N 3.07Å; I277-H280 HydrophobicContact CB-CB 3.81Å; I277-H280 HydrophobicContact CG2-CB 3.56Å; I277-H280 PolarHBondContact O-N 3.42Å; I277-G281 PolarHBondContact N-O 3.42Å; I277-G281 PolarHBondContact O-N 3.36Å |
| 278 | P | 67.5 | Low | 83.3 | Confident | 114 Ų | 114 | 63.9 Ų | 63.9 | 74% | 0.74 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | 129.4 | -178.1 | 21.6 | -31.1 | 0 | 0 | 0 | 110.5 | H280 | P278-H280 PolarHBondContact O-N 3.23Å; P278-H280 PolarHBondContact O-ND1 2.99Å; P278-H280 VanDerWaalsContact O-ND1 3.14Å |
| 279 | G | 69.4 | Low | 83.2 | Confident | 89 Ų | 89 | 60.9 Ų | 60.9 | 92% | 0.918 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.7 | -7.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | I277 | I277-G279 PolarHBondContact O-N 3.07Š|
| 280 | H | 70 | Confident | 83.2 | Confident | 109 Ų | 109 | 52.2 Ų | 52.2 | 51% | 0.505 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.8 | -4.5 | -173.8 | -70.1 | 75.9 | 0 | 0 | 0 | 114.3 | I277 P278 R286 | I277-H280 HydrophobicContact CB-CB 3.81Å; I277-H280 HydrophobicContact CG2-CB 3.56Å; I277-H280 PolarHBondContact O-N 3.42Å; P278-H280 PolarHBondContact O-N 3.23Å; P278-H280 PolarHBondContact O-ND1 2.99Å; P278-H280 VanDerWaalsContact O-ND1 3.14Å; H280-R286 PolarHBondContact O-NE 3.43Å; H280-R286 PolarHBondContact O-NH2 3.18Å |
| 281 | G | 81.1 | Confident | 83.1 | Confident | 8 Ų | 8 | 51.9 Ų | 51.9 | 8% | 0.082 | 30% | 0.304 | C | S | . | . | B | Isolated β-bridge | trans | 89.1 | -159.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | G274 I277 | G274-G281 CarbonylContact O-C 3.24Å; G274-G281 VanDerWaalsContact O-C 3.24Å; I277-G281 PolarHBondContact N-O 3.42Å; I277-G281 PolarHBondContact O-N 3.36Å |
| 282 | G | 84.8 | Confident | 83.3 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 29% | 0.291 | C | S | . | . | trans | -79.6 | 168.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | E30 G274 M284 D285 | E30-G282 WeakPolarHBondContact OE1-CA 3.46Å; G274-G282 PolarHBondContact O-N 3.05Å; G274-G282 VanDerWaalsContact O-N 3.12Å; G282-M284 VanDerWaalsContact C-N 3.32Å; G282-D285 WeakPolarHBondContact CA-OD2 3.4Å; G282-D285 PolarHBondContact N-OD2 3Å; G282-D285 WeakPolarHBondContact O-CB 3.46Å; G282-D285 PolarHBondContact O-N 3.23Å | ||
| 283 | L | 88.8 | Confident | 83.7 | Confident | 25 Ų | 25 | 45.1 Ų | 45.1 | 13% | 0.131 | 27% | 0.274 | C | S | . | . | S | Bend | trans | -67.3 | -38.2 | 171.1 | -164 | 64.5 | 0 | 0 | 0 | 110.9 | I23 K26 E30 D285 R286 F287 | I23-L283 HydrophobicContact CB-CD2 4.04Å; I23-L283 HydrophobicContact CG1-CD2 4.07Å; I23-L283 HydrophobicContact CG2-CD2 3.85Å; I23-L283 HydrophobicContact CG2-CG 4.22Å; K26-L283 HydrophobicContact CB-CD2 3.54Å; K26-L283 HydrophobicContact CG-CD2 4.42Å; E30-L283 VanDerWaalsContact CD-N 3.29Å; E30-L283 PolarHBondContact OE1-N 2.67Å; E30-L283 PolarHBondContact OE2-N 2.65Å; L283-D285 PolarHBondContact O-N 3.28Å; L283-R286 PolarHBondContact O-N 3.33Å; L283-F287 HydrophobicContact CD1-CD2 3.92Å; L283-F287 HydrophobicContact CD1-CE2 3.55Å; L283-F287 HydrophobicContact CG-CD2 3.91Å; L283-F287 HydrophobicContact CG-CE2 4.01Å; L283-F287 WeakPolarHBondContact O-CD2 3.38Å; L283-F287 PolarHBondContact O-N 3.37Å |
| 284 | M | 90 | Very high | 84 | Confident | 14 Ų | 14 | 45.1 Ų | 45.1 | 7% | 0.069 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.8 | -32.2 | 176.1 | -178.3 | 62.1 | -179.4 | 0 | 0 | 112.2 | C27 E30 I31 I129 F273 G282 R286 F287 D288 L291 | C27-M284 HydrophobicContact CB-CB 4.47Å; C27-M284 HydrophobicContact CB-SD 4.47Å; E30-M284 PolarHBondContact OE2-N 3Å; I31-M284 HydrophobicContact CD1-CE 4.03Å; I31-M284 HydrophobicContact CD1-CG 4.14Å; I31-M284 HydrophobicContact CD1-SD 3.99Å; I31-M284 HydrophobicContact CG1-CG 4.34Å; I129-M284 HydrophobicContact CD1-CE 4.13Å; I129-M284 HydrophobicContact CD1-SD 3.86Å; F273-M284 HydrophobicContact CB-CB 3.86Å; F273-M284 HydrophobicContact CB-CG 4.39Å; F273-M284 HydrophobicContact CD1-CB 4.33Å; F273-M284 HydrophobicContact CD1-CG 3.99Å; F273-M284 HydrophobicContact CD2-CB 3.87Å; F273-M284 HydrophobicContact CD2-CG 3.64Å; F273-M284 HydrophobicContact CE1-CG 4.13Å; F273-M284 HydrophobicContact CE2-CG 3.83Å; F273-M284 HydrophobicContact CG-CB 3.77Å; F273-M284 HydrophobicContact CG-CG 3.76Å; F273-M284 HydrophobicContact CZ-CG 4.07Å; G282-M284 VanDerWaalsContact C-N 3.32Å; M284-R286 PolarHBondContact O-N 3.44Å; M284-R286 VanDerWaalsContact O-N 3.15Å; M284-F287 PolarHBondContact O-N 2.97Å; M284-D288 PolarHBondContact O-N 3.21Å; M284-L291 HydrophobicContact CE-CD1 3.66Å; M284-L291 HydrophobicContact SD-CD1 4.2Å |
| 285 | D | 85.7 | Confident | 84.4 | Confident | 22 Ų | 22 | 45.8 Ų | 45.8 | 12% | 0.118 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.7 | -12.2 | 175.1 | -66.3 | -64.2 | 0 | 0 | 0 | 113.7 | K265 F273 G282 L283 | K265-D285 WeakPolarHBondContact CD-OD1 3.15Å; K265-D285 WeakPolarHBondContact CE-OD1 3.39Å; K265-D285 IonicContact NZ-OD1 2.51Å; K265-D285 PolarHBondContact NZ-OD1 3.18Å; F273-D285 WeakPolarHBondContact CD2-OD1 3.4Å; F273-D285 PolarHBondContact N-OD2 2.97Å; G282-D285 WeakPolarHBondContact CA-OD2 3.4Å; G282-D285 PolarHBondContact N-OD2 3Å; G282-D285 WeakPolarHBondContact O-CB 3.46Å; G282-D285 PolarHBondContact O-N 3.23Å; L283-D285 PolarHBondContact O-N 3.28Å |
| 286 | R | 86.8 | Confident | 85 | Confident | 114 Ų | 114 | 43.7 Ų | 43.7 | 43% | 0.43 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -109.5 | -16.2 | -177.8 | -57.3 | -60.8 | 173.8 | 174.5 | -4.6 | 113.8 | H280 L283 M284 | H280-R286 PolarHBondContact O-NE 3.43Å; H280-R286 PolarHBondContact O-NH2 3.18Å; L283-R286 PolarHBondContact O-N 3.33Å; M284-R286 PolarHBondContact O-N 3.44Å; M284-R286 VanDerWaalsContact O-N 3.15Å |
| 287 | F | 87.9 | Confident | 85.7 | Confident | 44 Ų | 44 | 39.9 Ų | 39.9 | 19% | 0.193 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -119.5 | 6.8 | -176 | -71 | -83.2 | 0 | 0 | 0 | 112.8 | M1 I23 L283 M284 Q290 L291 | M1-F287 HydrophobicContact CE-CZ 4.12Å; I23-F287 HydrophobicContact CD1-CE1 3.82Å; I23-F287 HydrophobicContact CD1-CE2 4.01Å; I23-F287 HydrophobicContact CD1-CZ 3.48Å; I23-F287 VanDerWaalsContact CD1-CZ 3.48Å; I23-F287 HydrophobicContact CG1-CE2 4.23Å; I23-F287 HydrophobicContact CG1-CZ 4.2Å; I23-F287 HydrophobicContact CG2-CD1 4.36Å; I23-F287 HydrophobicContact CG2-CD2 3.83Å; I23-F287 HydrophobicContact CG2-CE2 4.06Å; I23-F287 HydrophobicContact CG2-CG 4.01Å; I23-F287 HydrophobicContact CG2-CZ 4.42Å; L283-F287 HydrophobicContact CD1-CD2 3.92Å; L283-F287 HydrophobicContact CD1-CE2 3.55Å; L283-F287 HydrophobicContact CG-CD2 3.91Å; L283-F287 HydrophobicContact CG-CE2 4.01Å; L283-F287 WeakPolarHBondContact O-CD2 3.38Å; L283-F287 PolarHBondContact O-N 3.37Å; M284-F287 PolarHBondContact O-N 2.97Å; F287-Q290 HydrophobicContact CD1-CB 4.34Å; F287-Q290 HydrophobicContact CD1-CG 4.03Å; F287-Q290 WeakPolarHBondContact O-CB 3.36Å; F287-Q290 PolarHBondContact O-N 3.14Å; F287-Q290 VanDerWaalsContact O-N 3.13Å; F287-L291 PolarHBondContact O-N 3.46Å |
| 288 | D | 88.1 | Confident | 86.7 | Confident | 19 Ų | 19 | 39.1 Ų | 39.1 | 10% | 0.102 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.4 | -44.9 | 180 | 53.4 | 5 | 0 | 0 | 0 | 113.6 | G258 A261 M284 Q290 | G258-D288 VanDerWaalsContact CA-OD2 3.26Å; G258-D288 WeakPolarHBondContact CA-OD2 3.48Å; A261-D288 HydrophobicContact CB-CB 3.54Å; A261-D288 WeakPolarHBondContact CB-OD2 3.26Å; M284-D288 PolarHBondContact O-N 3.21Å; D288-Q290 VanDerWaalsContact C-N 3.28Å; D288-Q290 PolarHBondContact O-N 2.9Å |
| 289 | C | 88.4 | Confident | 87.9 | Confident | 2 Ų | 2 | 37.6 Ų | 37.6 | 1% | 0.014 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.6 | -28.5 | 174.3 | -63.9 | 0 | 0 | 0 | 0 | 112.5 | I154 L291 M293 | I154-C289 HydrophobicContact CG2-CB 3.73Å; C289-L291 VanDerWaalsContact C-N 3.32Å; C289-L291 PolarHBondContact O-N 3.26Å; C289-M293 PolarHBondContact O-N 3.46Å |
| 290 | Q | 90.6 | Very high | 89 | Confident | 18 Ų | 18 | 34.5 Ų | 34.5 | 8% | 0.084 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -72.2 | -26.2 | -177.3 | -61.2 | -69.9 | -6.7 | 0 | 0 | 112.5 | V151 I154 F287 D288 L292 M293 G294 | V151-Q290 PolarHBondContact O-NE2 3.25Å; I154-Q290 VanDerWaalsContact CB-NE2 3.32Å; I154-Q290 HydrophobicContact CG2-CG 4.38Å; I154-Q290 VanDerWaalsContact CG2-NE2 3.27Å; F287-Q290 HydrophobicContact CD1-CB 4.34Å; F287-Q290 HydrophobicContact CD1-CG 4.03Å; F287-Q290 WeakPolarHBondContact O-CB 3.36Å; F287-Q290 PolarHBondContact O-N 3.14Å; F287-Q290 VanDerWaalsContact O-N 3.13Å; D288-Q290 VanDerWaalsContact C-N 3.28Å; D288-Q290 PolarHBondContact O-N 2.9Å; Q290-L292 PolarHBondContact O-N 2.91Å; Q290-M293 PolarHBondContact O-N 2.92Å; Q290-G294 PolarHBondContact O-N 2.92Å |
| 291 | L | 86.6 | Confident | 89.8 | Confident | 35 Ų | 35 | 29.9 Ų | 29.9 | 18% | 0.183 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -58.8 | -48.7 | 177.7 | -64.2 | 175.5 | 0 | 0 | 0 | 111.3 | I129 Q132 M284 F287 C289 M293 | I129-L291 HydrophobicContact CD1-CD1 4.02Å; I129-L291 HydrophobicContact CD1-CD2 4.23Å; Q132-L291 HydrophobicContact CB-CD2 3.66Å; Q132-L291 HydrophobicContact CG-CB 4.26Å; Q132-L291 HydrophobicContact CG-CD2 3.94Å; Q132-L291 PolarHBondContact OE1-O 2.95Å; M284-L291 HydrophobicContact CE-CD1 3.66Å; M284-L291 HydrophobicContact SD-CD1 4.2Å; F287-L291 PolarHBondContact O-N 3.46Å; C289-L291 VanDerWaalsContact C-N 3.32Å; C289-L291 PolarHBondContact O-N 3.26Å; L291-M293 VanDerWaalsContact C-N 3.35Å |
| 292 | L | 91.7 | Very high | 90 | Very high | 69 Ų | 69 | 36.4 Ų | 36.4 | 36% | 0.361 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -67.9 | -37.7 | 177.3 | -71.1 | 178.1 | 0 | 0 | 0 | 112 | Q290 T295 F296 | Q290-L292 PolarHBondContact O-N 2.91Å; L292-T295 PolarHBondContact O-N 3.21Å; L292-F296 PolarHBondContact O-N 2.76Å |
| 293 | M | 94.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63.8 | -43.5 | -179 | -168.3 | 63.1 | -178.3 | 0 | 0 | 112 | P150 I154 L246 F249 A250 C289 Q290 L291 T295 F296 V297 | P150-M293 HydrophobicContact CB-CE 3.47Å; P150-M293 VanDerWaalsContact CB-CE 3.47Å; P150-M293 HydrophobicContact CB-CG 3.69Å; P150-M293 HydrophobicContact CB-SD 4.41Å; P150-M293 HydrophobicContact CG-CE 3.98Å; I154-M293 HydrophobicContact CD1-CB 4.2Å; I154-M293 HydrophobicContact CD1-CG 4.28Å; I154-M293 HydrophobicContact CD1-SD 4.31Å; I154-M293 HydrophobicContact CG1-CB 4Å; I154-M293 HydrophobicContact CG1-CG 3.85Å; I154-M293 HydrophobicContact CG1-SD 4.35Å; L246-M293 HydrophobicContact CB-CE 4.07Å; L246-M293 HydrophobicContact CD2-CE 3.97Å; F249-M293 HydrophobicContact CD1-SD 3.7Å; F249-M293 HydrophobicContact CE1-SD 4.27Å; A250-M293 HydrophobicContact CB-CE 3.98Å; A250-M293 HydrophobicContact CB-SD 4.06Å; C289-M293 PolarHBondContact O-N 3.46Å; Q290-M293 PolarHBondContact O-N 2.92Å; L291-M293 VanDerWaalsContact C-N 3.35Å; M293-T295 PolarHBondContact O-N 3.41Å; M293-F296 PolarHBondContact O-N 3.2Å; M293-V297 HydrophobicContact CE-CG2 4.11Å; M293-V297 HydrophobicContact CG-CG2 4.41Å; M293-V297 WeakPolarHBondContact O-CG2 3.34Å; M293-V297 PolarHBondContact O-N 3.22Å |
| 294 | G | 93.2 | Very high | 89.7 | Confident | 7 Ų | 7 | 44 Ų | 44 | 7% | 0.072 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.5 | -44.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | N139 Q290 R298 | N139-G294 PolarHBondContact ND2-O 3.35Å; Q290-G294 PolarHBondContact O-N 2.92Å; G294-R298 PolarHBondContact O-N 3.34Å |
| 295 | T | 93.4 | Very high | 88.7 | Confident | 38 Ų | 38 | 45.1 Ų | 45.1 | 23% | 0.233 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.9 | -49 | 174.5 | -66 | 0 | 0 | 0 | 0 | 111.7 | Q132 L135 L292 M293 V297 R298 V299 | Q132-T295 PolarHBondContact NE2-OG1 2.91Å; Q132-T295 PolarHBondContact OE1-OG1 2.84Å; L135-T295 HydrophobicContact CD1-CG2 4.1Å; L135-T295 WeakPolarHBondContact CD1-OG1 3.47Å; L292-T295 PolarHBondContact O-N 3.21Å; M293-T295 PolarHBondContact O-N 3.41Å; T295-V297 VanDerWaalsContact C-N 3.33Å; T295-V297 PolarHBondContact O-N 3.17Å; T295-R298 PolarHBondContact O-N 3.46Å; T295-R298 VanDerWaalsContact O-N 3.16Å; T295-V299 HydrophobicContact CG2-CG2 4.31Å; T295-V299 WeakPolarHBondContact O-CG2 3.35Å; T295-V299 PolarHBondContact O-N 3.46Å |
| 296 | F | 95.3 | Very high | 87.9 | Confident | 43 Ų | 43 | 47.4 Ų | 47.4 | 19% | 0.189 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.6 | -46.7 | -177 | 174.3 | -111.7 | 0 | 0 | 0 | 111.7 | I245 L246 F249 L292 M293 R298 V299 F300 | I245-F296 HydrophobicContact CG2-CE1 4.34Å; I245-F296 HydrophobicContact CG2-CZ 3.86Å; L246-F296 HydrophobicContact CD2-CD1 4.11Å; L246-F296 HydrophobicContact CD2-CE1 3.88Å; F249-F296 HydrophobicContact CB-CD1 3.66Å; F249-F296 HydrophobicContact CB-CE1 3.36Å; F249-F296 HydrophobicContact CB-CE2 4.46Å; F249-F296 HydrophobicContact CB-CG 4.31Å; F249-F296 HydrophobicContact CB-CZ 3.82Å; F249-F296 HydrophobicContact CD1-CB 3.85Å; F249-F296 AromaticContact CD1-CD1 3.52Å; F249-F296 HydrophobicContact CD1-CD1 3.52Å; F249-F296 HydrophobicContact CD1-CD2 4.43Å; F249-F296 HydrophobicContact CD1-CE1 4.17Å; F249-F296 AromaticContact CD1-CG 3.66Å; F249-F296 HydrophobicContact CD1-CG 3.66Å; F249-F296 HydrophobicContact CD2-CB 4.22Å; F249-F296 AromaticContact CD2-CD1 3.77Å; F249-F296 HydrophobicContact CD2-CD1 3.77Å; F249-F296 AromaticContact CD2-CD2 3.42Å; F249-F296 HydrophobicContact CD2-CD2 3.42Å; F249-F296 VanDerWaalsContact CD2-CD2 3.42Å; F249-F296 AromaticContact CD2-CE1 3.91Å; F249-F296 HydrophobicContact CD2-CE1 3.91Å; F249-F296 AromaticContact CD2-CE2 3.59Å; F249-F296 HydrophobicContact CD2-CE2 3.59Å; F249-F296 AromaticContact CD2-CG 3.51Å; F249-F296 HydrophobicContact CD2-CG 3.51Å; F249-F296 AromaticContact CD2-CZ 3.83Å; F249-F296 HydrophobicContact CD2-CZ 3.83Å; F249-F296 HydrophobicContact CE1-CB 3.47Å; F249-F296 VanDerWaalsContact CE1-CB 3.47Å; F249-F296 HydrophobicContact CE1-CD1 4.09Å; F249-F296 HydrophobicContact CE1-CD2 4.48Å; F249-F296 AromaticContact CE1-CG 3.77Å; F249-F296 HydrophobicContact CE1-CG 3.77Å; F249-F296 HydrophobicContact CE2-CB 3.88Å; F249-F296 HydrophobicContact CE2-CD1 4.3Å; F249-F296 AromaticContact CE2-CD2 3.48Å; F249-F296 HydrophobicContact CE2-CD2 3.48Å; F249-F296 VanDerWaalsContact CE2-CD2 3.48Å; F249-F296 HydrophobicContact CE2-CE2 4.07Å; F249-F296 AromaticContact CE2-CG 3.61Å; F249-F296 HydrophobicContact CE2-CG 3.61Å; F249-F296 HydrophobicContact CG-CB 4.21Å; F249-F296 AromaticContact CG-CD1 3.34Å; F249-F296 HydrophobicContact CG-CD1 3.34Å; F249-F296 AromaticContact CG-CD2 3.93Å; F249-F296 HydrophobicContact CG-CD2 3.93Å; F249-F296 AromaticContact CG-CE1 3.54Å; F249-F296 HydrophobicContact CG-CE1 3.54Å; F249-F296 HydrophobicContact CG-CE2 4.12Å; F249-F296 AromaticContact CG-CG 3.54Å; F249-F296 HydrophobicContact CG-CG 3.54Å; F249-F296 AromaticContact CG-CZ 3.94Å; F249-F296 HydrophobicContact CG-CZ 3.94Å; F249-F296 HydrophobicContact CZ-CB 3.49Å; F249-F296 VanDerWaalsContact CZ-CB 3.49Å; F249-F296 HydrophobicContact CZ-CD1 4.45Å; F249-F296 HydrophobicContact CZ-CD2 4.05Å; F249-F296 AromaticContact CZ-CG 3.75Å; F249-F296 HydrophobicContact CZ-CG 3.75Å; L292-F296 PolarHBondContact O-N 2.76Å; M293-F296 PolarHBondContact O-N 3.2Å; F296-R298 VanDerWaalsContact C-N 3.29Å; F296-R298 PolarHBondContact O-N 2.92Å; F296-V299 PolarHBondContact O-N 3.48Å; F296-F300 HydrophobicContact CZ-CD2 4.4Å; F296-F300 WeakPolarHBondContact O-CB 3.35Å; F296-F300 PolarHBondContact O-N 2.84Å |
| 297 | V | 94 | Very high | 87 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58.6 | -43 | 178.2 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | N139 W146 P150 L246 M293 T295 F300 I301 | N139-V297 HydrophobicContact CB-CG1 4.2Å; W146-V297 HydrophobicContact CB-CG1 4.28Å; W146-V297 HydrophobicContact CE3-CG1 4.35Å; W146-V297 WeakPolarHBondContact O-CG1 3.43Å; P150-V297 HydrophobicContact CB-CG2 3.72Å; P150-V297 HydrophobicContact CG-CB 4.47Å; P150-V297 HydrophobicContact CG-CG1 4.35Å; P150-V297 HydrophobicContact CG-CG2 3.33Å; L246-V297 HydrophobicContact CD2-CG2 3.75Å; M293-V297 HydrophobicContact CE-CG2 4.11Å; M293-V297 HydrophobicContact CG-CG2 4.41Å; M293-V297 WeakPolarHBondContact O-CG2 3.34Å; M293-V297 PolarHBondContact O-N 3.22Å; T295-V297 VanDerWaalsContact C-N 3.33Å; T295-V297 PolarHBondContact O-N 3.17Å; V297-F300 WeakPolarHBondContact O-CB 3.48Å; V297-F300 PolarHBondContact O-N 3.26Å; V297-I301 HydrophobicContact CG1-CD1 3.65Å; V297-I301 HydrophobicContact CG1-CG1 4.31Å; V297-I301 VanDerWaalsContact O-CG1 3.29Å; V297-I301 WeakPolarHBondContact O-CG1 3.47Å; V297-I301 PolarHBondContact O-N 2.82Å |
| 298 | R | 92.9 | Very high | 86.1 | Confident | 52 Ų | 52 | 46.9 Ų | 46.9 | 20% | 0.196 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.7 | -46.3 | 179.7 | -179 | 52 | 177.8 | 169.6 | -5.6 | 111.7 | L135 N139 E142 G294 T295 F296 F300 H302 | L135-R298 HydrophobicContact CB-CB 4.27Å; L135-R298 HydrophobicContact CD2-CB 4.47Å; L135-R298 HydrophobicContact CD2-CG 3.94Å; N139-R298 WeakPolarHBondContact OD1-CA 3.2Å; N139-R298 VanDerWaalsContact OD1-CB 3.28Å; N139-R298 WeakPolarHBondContact OD1-CB 3.07Å; N139-R298 PolarHBondContact OD1-N 3.05Å; E142-R298 IonicContact OE1-NH1 2.83Å; E142-R298 PolarHBondContact OE1-NH1 3.43Å; G294-R298 PolarHBondContact O-N 3.34Å; T295-R298 PolarHBondContact O-N 3.46Å; T295-R298 VanDerWaalsContact O-N 3.16Å; F296-R298 VanDerWaalsContact C-N 3.29Å; F296-R298 PolarHBondContact O-N 2.92Å; R298-F300 VanDerWaalsContact C-N 3.3Å; R298-F300 PolarHBondContact O-N 3.43Å; R298-H302 WeakPolarHBondContact O-CB 3.35Å; R298-H302 PolarHBondContact O-N 3.32Å; R298-H302 VanDerWaalsContact O-N 3.15Å |
| 299 | V | 93 | Very high | 85.1 | Confident | 82 Ų | 82 | 48.4 Ų | 48.4 | 50% | 0.497 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.4 | -42.6 | 175.6 | 174.2 | 0 | 0 | 0 | 0 | 110.2 | T295 F296 H302 T303 | T295-V299 HydrophobicContact CG2-CG2 4.31Å; T295-V299 WeakPolarHBondContact O-CG2 3.35Å; T295-V299 PolarHBondContact O-N 3.46Å; F296-V299 PolarHBondContact O-N 3.48Å; V299-H302 PolarHBondContact O-N 2.94Å; V299-T303 PolarHBondContact O-N 3.31Å; V299-T303 PolarHBondContact O-OG1 3.5Å |
| 300 | F | 92 | Very high | 84.4 | Confident | 24 Ų | 24 | 53.6 Ų | 53.6 | 11% | 0.105 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.8 | -48.9 | -178.7 | -175.7 | -118.2 | 0 | 0 | 0 | 112.8 | W146 H242 I245 L246 F296 V297 R298 H302 T303 I304 | W146-F300 HydrophobicContact CH2-CE1 4.44Å; W146-F300 HydrophobicContact CZ3-CD1 4.06Å; W146-F300 HydrophobicContact CZ3-CE1 4.11Å; H242-F300 HydrophobicContact CB-CE1 3.98Å; H242-F300 HydrophobicContact CB-CZ 4.32Å; H242-F300 AromaticContact CD2-CE1 3.64Å; H242-F300 AromaticContact CD2-CZ 3.58Å; I245-F300 HydrophobicContact CB-CE2 4.15Å; I245-F300 HydrophobicContact CB-CZ 3.88Å; I245-F300 HydrophobicContact CD1-CE2 3.84Å; I245-F300 HydrophobicContact CD1-CZ 3.77Å; I245-F300 HydrophobicContact CG1-CZ 4.43Å; I245-F300 HydrophobicContact CG2-CD2 4.16Å; I245-F300 HydrophobicContact CG2-CE2 3.55Å; I245-F300 HydrophobicContact CG2-CZ 3.74Å; L246-F300 HydrophobicContact CD2-CD1 4.09Å; L246-F300 HydrophobicContact CD2-CE1 4.42Å; L246-F300 HydrophobicContact CG-CD1 4.5Å; L246-F300 HydrophobicContact CG-CE1 4.35Å; F296-F300 HydrophobicContact CZ-CD2 4.4Å; F296-F300 WeakPolarHBondContact O-CB 3.35Å; F296-F300 PolarHBondContact O-N 2.84Å; V297-F300 WeakPolarHBondContact O-CB 3.48Å; V297-F300 PolarHBondContact O-N 3.26Å; R298-F300 VanDerWaalsContact C-N 3.3Å; R298-F300 PolarHBondContact O-N 3.43Å; F300-H302 VanDerWaalsContact C-N 3.3Å; F300-H302 PolarHBondContact O-N 2.81Å; F300-T303 PolarHBondContact O-N 2.67Å; F300-T303 VanDerWaalsContact O-N 3.16Å; F300-I304 HydrophobicContact CD1-CD1 3.71Å; F300-I304 HydrophobicContact CD2-CD1 4.3Å; F300-I304 HydrophobicContact CE1-CD1 3.53Å; F300-I304 HydrophobicContact CE2-CD1 4.1Å; F300-I304 HydrophobicContact CE2-CG1 4.46Å; F300-I304 HydrophobicContact CG-CD1 4.12Å; F300-I304 HydrophobicContact CZ-CD1 3.75Å; F300-I304 HydrophobicContact CZ-CG1 4.47Å; F300-I304 WeakPolarHBondContact O-CD1 3.39Å; F300-I304 WeakPolarHBondContact O-CG1 3.49Å; F300-I304 PolarHBondContact O-N 3.36Å |
| 301 | I | 86.7 | Confident | 83.8 | Confident | 12 Ų | 12 | 56.5 Ų | 56.5 | 6% | 0.062 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 176.7 | -66.2 | 164 | 0 | 0 | 0 | 110.9 | E142 W146 V297 T303 I304 G305 | E142-I301 HydrophobicContact CB-CD1 4.27Å; E142-I301 HydrophobicContact CG-CG2 4.27Å; W146-I301 HydrophobicContact CB-CD1 3.63Å; W146-I301 HydrophobicContact CD2-CD1 3.49Å; W146-I301 VanDerWaalsContact CD2-CD1 3.49Å; W146-I301 HydrophobicContact CD2-CG1 3.65Å; W146-I301 HydrophobicContact CE3-CD1 3.79Å; W146-I301 HydrophobicContact CE3-CG1 3.68Å; W146-I301 HydrophobicContact CG-CD1 3.41Å; W146-I301 VanDerWaalsContact CG-CD1 3.41Å; W146-I301 HydrophobicContact CG-CG1 4.12Å; W146-I301 HydrophobicContact CH2-CG1 4.3Å; W146-I301 HydrophobicContact CZ2-CG1 4.28Å; W146-I301 HydrophobicContact CZ3-CG1 4.01Å; V297-I301 HydrophobicContact CG1-CD1 3.65Å; V297-I301 HydrophobicContact CG1-CG1 4.31Å; V297-I301 VanDerWaalsContact O-CG1 3.29Å; V297-I301 WeakPolarHBondContact O-CG1 3.47Å; V297-I301 PolarHBondContact O-N 2.82Å; I301-T303 VanDerWaalsContact C-N 3.29Å; I301-T303 PolarHBondContact O-N 3.5Å; I301-I304 PolarHBondContact O-N 3Å; I301-G305 PolarHBondContact O-N 3.07Å |
| 302 | H | 85.8 | Confident | 83.2 | Confident | 145 Ų | 145 | 60.6 Ų | 60.6 | 67% | 0.671 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -64.2 | -36.1 | 178.1 | -171 | -81.3 | 0 | 0 | 0 | 112 | R298 V299 F300 | R298-H302 WeakPolarHBondContact O-CB 3.35Å; R298-H302 PolarHBondContact O-N 3.32Å; R298-H302 VanDerWaalsContact O-N 3.15Å; V299-H302 PolarHBondContact O-N 2.94Å; F300-H302 VanDerWaalsContact C-N 3.3Å; F300-H302 PolarHBondContact O-N 2.81Å |
| 303 | T | 86.5 | Confident | 82.3 | Confident | 109 Ų | 109 | 65.1 Ų | 65.1 | 67% | 0.669 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -69.9 | -37.8 | 177.4 | -60.5 | 0 | 0 | 0 | 0 | 112.9 | V299 F300 I301 G305 | V299-T303 PolarHBondContact O-N 3.31Å; V299-T303 PolarHBondContact O-OG1 3.5Å; F300-T303 PolarHBondContact O-N 2.67Å; F300-T303 VanDerWaalsContact O-N 3.16Å; I301-T303 VanDerWaalsContact C-N 3.29Å; I301-T303 PolarHBondContact O-N 3.5Å; T303-G305 VanDerWaalsContact C-N 3.27Å; T303-G305 PolarHBondContact O-N 2.85Å |
| 304 | I | 81.2 | Confident | 81.6 | Confident | 75 Ų | 75 | 67.4 Ų | 67.4 | 39% | 0.385 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -66.1 | -35.2 | 179.4 | -64.6 | 152 | 0 | 0 | 0 | 110.8 | W146 H242 F300 I301 | W146-I304 HydrophobicContact CH2-CD1 4.25Å; H242-I304 WeakPolarHBondContact CD2-CD1 3.3Å; H242-I304 WeakPolarHBondContact NE2-CD1 3.21Å; F300-I304 HydrophobicContact CD1-CD1 3.71Å; F300-I304 HydrophobicContact CD2-CD1 4.3Å; F300-I304 HydrophobicContact CE1-CD1 3.53Å; F300-I304 HydrophobicContact CE2-CD1 4.1Å; F300-I304 HydrophobicContact CE2-CG1 4.46Å; F300-I304 HydrophobicContact CG-CD1 4.12Å; F300-I304 HydrophobicContact CZ-CD1 3.75Å; F300-I304 HydrophobicContact CZ-CG1 4.47Å; F300-I304 WeakPolarHBondContact O-CD1 3.39Å; F300-I304 WeakPolarHBondContact O-CG1 3.49Å; F300-I304 PolarHBondContact O-N 3.36Å; I301-I304 PolarHBondContact O-N 3Å |
| 305 | G | 69 | Low | 81 | Confident | 37 Ų | 37 | 72.4 Ų | 72.4 | 38% | 0.381 | 38% | 0.38 | S | S | . | . | trans | 68.9 | 119.5 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | I301 T303 P307 | I301-G305 PolarHBondContact O-N 3.07Å; T303-G305 VanDerWaalsContact C-N 3.27Å; T303-G305 PolarHBondContact O-N 2.85Å; G305-P307 WeakPolarHBondContact O-CD 3.36Å | ||
| 306 | D | 67.9 | Low | 80.2 | Confident | 70 Ų | 70 | 77.9 Ų | 77.9 | 37% | 0.374 | 41% | 0.407 | S | S | . | . | trans | -100 | 110.1 | 170.1 | -169.2 | -15.9 | 0 | 0 | 0 | 109.1 | S308 K309 H310 | D306-S308 PolarHBondContact O-N 3.48Å; D306-S308 VanDerWaalsContact OD1-CB 3.29Å; D306-S308 WeakPolarHBondContact OD1-CB 3.36Å; D306-S308 PolarHBondContact OD1-N 3.46Å; D306-S308 PolarHBondContact OD1-OG 2.92Å; D306-S308 PolarHBondContact OD2-OG 3.26Å; D306-K309 HydrophobicContact CB-CD 4.38Å; D306-K309 HydrophobicContact CB-CG 4.29Å; D306-K309 PolarHBondContact O-N 3.37Å; D306-H310 PolarHBondContact O-ND1 2.98Å | ||
| 307 | P | 68 | Low | 79.6 | Confident | 94 Ų | 94 | 79.4 Ų | 79.4 | 61% | 0.61 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -61.6 | -27.6 | 179.1 | 24.4 | -32.7 | 0 | 0 | 0 | 111.9 | G305 K309 H310 V311 | G305-P307 WeakPolarHBondContact O-CD 3.36Å; P307-K309 PolarHBondContact O-N 3.06Å; P307-H310 WeakPolarHBondContact O-CB 3.25Å; P307-H310 PolarHBondContact O-N 3.26Å; P307-H310 VanDerWaalsContact O-N 3.12Å; P307-V311 PolarHBondContact O-N 3.16Å |
| 308 | S | 69.8 | Low | 79.1 | Confident | 53 Ų | 53 | 84.1 Ų | 84.1 | 37% | 0.371 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.7 | -31.6 | -178.6 | 70.4 | 0 | 0 | 0 | 0 | 112.9 | D306 V311 Q312 | D306-S308 PolarHBondContact O-N 3.48Å; D306-S308 VanDerWaalsContact OD1-CB 3.29Å; D306-S308 WeakPolarHBondContact OD1-CB 3.36Å; D306-S308 PolarHBondContact OD1-N 3.46Å; D306-S308 PolarHBondContact OD1-OG 2.92Å; D306-S308 PolarHBondContact OD2-OG 3.26Å; S308-V311 WeakPolarHBondContact O-CB 3.45Å; S308-V311 PolarHBondContact O-N 3.38Å; S308-Q312 WeakPolarHBondContact O-CG 3.41Å; S308-Q312 PolarHBondContact O-N 2.93Å |
| 309 | K | 67.6 | Low | 78.9 | Confident | 51 Ų | 51 | 86.6 Ų | 86.6 | 22% | 0.222 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -71.1 | -34.6 | 177.1 | -65.5 | -177.1 | -165.1 | 152.4 | 0 | 113.2 | E142 D306 P307 V311 Q312 R313 | E142-K309 IonicContact OE1-NZ 3.59Å; E142-K309 PolarHBondContact OE1-NZ 2.93Å; E142-K309 WeakPolarHBondContact OE2-CE 3.25Å; E142-K309 IonicContact OE2-NZ 3.69Å; E142-K309 PolarHBondContact OE2-NZ 2.67Å; D306-K309 HydrophobicContact CB-CD 4.38Å; D306-K309 HydrophobicContact CB-CG 4.29Å; D306-K309 PolarHBondContact O-N 3.37Å; P307-K309 PolarHBondContact O-N 3.06Å; K309-V311 VanDerWaalsContact C-N 3.28Å; K309-Q312 PolarHBondContact O-N 2.85Å; K309-R313 WeakPolarHBondContact O-CB 3.31Å; K309-R313 WeakPolarHBondContact O-CG 3.41Å; K309-R313 PolarHBondContact O-N 3.24Å |
| 310 | H | 72.8 | Confident | 78.8 | Confident | 112 Ų | 112 | 88 Ų | 88 | 52% | 0.519 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.5 | -43.3 | 174.8 | -63.7 | 85.4 | 0 | 0 | 0 | 109.2 | D306 P307 R313 I314 | D306-H310 PolarHBondContact O-ND1 2.98Å; P307-H310 WeakPolarHBondContact O-CB 3.25Å; P307-H310 PolarHBondContact O-N 3.26Å; P307-H310 VanDerWaalsContact O-N 3.12Å; H310-R313 PolarHBondContact O-N 3.11Å; H310-I314 WeakPolarHBondContact O-CD1 3.47Å; H310-I314 VanDerWaalsContact O-CG1 3.23Å; H310-I314 WeakPolarHBondContact O-CG1 3.33Å; H310-I314 PolarHBondContact O-N 3.38Å |
| 311 | V | 77.3 | Confident | 78.6 | Confident | 79 Ų | 79 | 91.2 Ų | 91.2 | 48% | 0.479 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61 | -47.7 | 174 | -179.5 | 0 | 0 | 0 | 0 | 111.4 | P307 S308 K309 R313 I314 L315 | P307-V311 PolarHBondContact O-N 3.16Å; S308-V311 WeakPolarHBondContact O-CB 3.45Å; S308-V311 PolarHBondContact O-N 3.38Å; K309-V311 VanDerWaalsContact C-N 3.28Å; V311-R313 VanDerWaalsContact C-N 3.32Å; V311-R313 PolarHBondContact O-N 3.32Å; V311-I314 WeakPolarHBondContact O-CB 3.43Å; V311-I314 PolarHBondContact O-N 3.49Å; V311-I314 VanDerWaalsContact O-N 3.12Å; V311-L315 HydrophobicContact CG1-CD1 4.09Å; V311-L315 HydrophobicContact CG1-CG 4.36Å; V311-L315 WeakPolarHBondContact O-CG 3.34Å; V311-L315 PolarHBondContact O-N 3.11Å |
| 312 | Q | 74 | Confident | 78.7 | Confident | 120 Ų | 120 | 93.4 Ų | 93.4 | 56% | 0.561 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.8 | -40.9 | 177.5 | -75 | 178.7 | -6.6 | 0 | 0 | 112.8 | S308 K309 I314 L315 L316 | S308-Q312 WeakPolarHBondContact O-CG 3.41Å; S308-Q312 PolarHBondContact O-N 2.93Å; K309-Q312 PolarHBondContact O-N 2.85Å; Q312-I314 VanDerWaalsContact C-N 3.32Å; Q312-I314 PolarHBondContact O-N 3.05Å; Q312-L315 PolarHBondContact O-N 2.84Å; Q312-L316 WeakPolarHBondContact O-CG 3.33Å; Q312-L316 PolarHBondContact O-N 3.39Å |
| 313 | R | 72.8 | Confident | 78.9 | Confident | 164 Ų | 164 | 90.5 Ų | 90.5 | 62% | 0.619 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63 | -39.6 | 174.9 | -75.2 | 178.1 | 178.1 | 180 | -1.1 | 112 | K309 H310 V311 L316 | K309-R313 WeakPolarHBondContact O-CB 3.31Å; K309-R313 WeakPolarHBondContact O-CG 3.41Å; K309-R313 PolarHBondContact O-N 3.24Å; H310-R313 PolarHBondContact O-N 3.11Å; V311-R313 VanDerWaalsContact C-N 3.32Å; V311-R313 PolarHBondContact O-N 3.32Å; R313-L316 PolarHBondContact O-N 3.25Å |
| 314 | I | 81.2 | Confident | 79.2 | Confident | 49 Ų | 49 | 89.3 Ų | 89.3 | 25% | 0.251 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 174.1 | -65.7 | 161 | 0 | 0 | 0 | 109.6 | H310 V311 Q312 L316 M317 Q322 V325 | H310-I314 WeakPolarHBondContact O-CD1 3.47Å; H310-I314 VanDerWaalsContact O-CG1 3.23Å; H310-I314 WeakPolarHBondContact O-CG1 3.33Å; H310-I314 PolarHBondContact O-N 3.38Å; V311-I314 WeakPolarHBondContact O-CB 3.43Å; V311-I314 PolarHBondContact O-N 3.49Å; V311-I314 VanDerWaalsContact O-N 3.12Å; Q312-I314 VanDerWaalsContact C-N 3.32Å; Q312-I314 PolarHBondContact O-N 3.05Å; I314-L316 PolarHBondContact O-N 3.38Å; I314-L316 VanDerWaalsContact O-N 3.09Å; I314-M317 VanDerWaalsContact O-CB 3.28Å; I314-M317 WeakPolarHBondContact O-CB 3.38Å; I314-M317 PolarHBondContact O-N 3.2Å; I314-Q322 HydrophobicContact CG2-CG 4.4Å; I314-Q322 VanDerWaalsContact O-CG 3.24Å; I314-Q322 WeakPolarHBondContact O-CG 3.07Å; I314-V325 HydrophobicContact CD1-CG1 3.74Å; I314-V325 HydrophobicContact CG1-CG1 4.05Å; I314-V325 HydrophobicContact CG2-CB 4.42Å; I314-V325 HydrophobicContact CG2-CG1 4.21Å |
| 315 | L | 80.7 | Confident | 79.6 | Confident | 111 Ų | 111 | 87.9 Ų | 87.9 | 58% | 0.581 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -62.7 | -17.5 | 179.5 | -67.7 | 173.1 | 0 | 0 | 0 | 114.4 | V311 Q312 Q322 | V311-L315 HydrophobicContact CG1-CD1 4.09Å; V311-L315 HydrophobicContact CG1-CG 4.36Å; V311-L315 WeakPolarHBondContact O-CG 3.34Å; V311-L315 PolarHBondContact O-N 3.11Å; Q312-L315 PolarHBondContact O-N 2.84Å; L315-Q322 PolarHBondContact O-NE2 3.05Å |
| 316 | L | 76.6 | Confident | 80.7 | Confident | 154 Ų | 154 | 91.4 Ų | 91.4 | 81% | 0.806 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.8 | -10.9 | 174.4 | -69.5 | 171 | 0 | 0 | 0 | 113.8 | Q312 R313 I314 | Q312-L316 WeakPolarHBondContact O-CG 3.33Å; Q312-L316 PolarHBondContact O-N 3.39Å; R313-L316 PolarHBondContact O-N 3.25Å; I314-L316 PolarHBondContact O-N 3.38Å; I314-L316 VanDerWaalsContact O-N 3.09Å |
| 317 | M | 81.5 | Confident | 81.8 | Confident | 75 Ų | 75 | 95 Ų | 95 | 37% | 0.369 | 48% | 0.482 | S | S | . | . | S | Bend | trans | -74.7 | 169.5 | 179.1 | -62.3 | 178.3 | -178 | 0 | 0 | 111.8 | I314 E321 Q322 V325 | I314-M317 VanDerWaalsContact O-CB 3.28Å; I314-M317 WeakPolarHBondContact O-CB 3.38Å; I314-M317 PolarHBondContact O-N 3.2Å; M317-E321 HydrophobicContact CB-CB 3.99Å; M317-E321 HydrophobicContact SD-CB 4.47Å; M317-Q322 HydrophobicContact CB-CG 4.07Å; M317-Q322 PolarHBondContact O-NE2 3.35Å; M317-V325 HydrophobicContact SD-CG2 4.38Å |
| 318 | N | 84.8 | Confident | 82.9 | Confident | 99 Ų | 99 | 95.8 Ų | 95.8 | 53% | 0.529 | 48% | 0.477 | S | S | . | . | trans | -65.4 | 149 | 173.5 | -67.8 | -44.1 | 0 | 0 | 0 | 110.7 | T320 E321 Q322 | N318-T320 PolarHBondContact O-N 3.12Å; N318-E321 HydrophobicContact CB-CG 4.27Å; N318-E321 WeakPolarHBondContact CB-OE2 3.45Å; N318-E321 PolarHBondContact N-OE2 2.83Å; N318-E321 WeakPolarHBondContact O-CB 3.14Å; N318-E321 PolarHBondContact O-N 3.34Å; N318-Q322 WeakPolarHBondContact O-CG 3.49Å; N318-Q322 PolarHBondContact O-N 2.92Å | ||
| 319 | P | 88.6 | Confident | 83.9 | Confident | 103 Ų | 103 | 98 Ų | 98 | 67% | 0.669 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -54 | -33.2 | -178.4 | -28.1 | 35.2 | 0 | 0 | 0 | 114.6 | L323 | P319-L323 WeakPolarHBondContact O-CB 3.2Å; P319-L323 PolarHBondContact O-N 3.14Å; P319-L323 VanDerWaalsContact O-N 3.13Å |
| 320 | T | 90 | Very high | 85 | Confident | 111 Ų | 111 | 99.2 Ų | 99.2 | 68% | 0.681 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.9 | -41.3 | 175.6 | 49.9 | 0 | 0 | 0 | 0 | 112.5 | N318 L323 E324 | N318-T320 PolarHBondContact O-N 3.12Å; T320-L323 PolarHBondContact O-N 2.67Å; T320-E324 PolarHBondContact O-N 3.5Å; T320-E324 VanDerWaalsContact O-N 3.12Å |
| 321 | E | 88.2 | Confident | 85.8 | Confident | 93 Ų | 93 | 100.3 Ų | 100.3 | 44% | 0.435 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.5 | -41.1 | 177.4 | -63.7 | 170.6 | 151.8 | 0 | 0 | 110.6 | M317 N318 L323 E324 V325 | M317-E321 HydrophobicContact CB-CB 3.99Å; M317-E321 HydrophobicContact SD-CB 4.47Å; N318-E321 HydrophobicContact CB-CG 4.27Å; N318-E321 WeakPolarHBondContact CB-OE2 3.45Å; N318-E321 PolarHBondContact N-OE2 2.83Å; N318-E321 WeakPolarHBondContact O-CB 3.14Å; N318-E321 PolarHBondContact O-N 3.34Å; E321-L323 VanDerWaalsContact C-N 3.3Å; E321-L323 PolarHBondContact O-N 3.46Å; E321-E324 PolarHBondContact O-N 3.15Å; E321-V325 WeakPolarHBondContact O-CG2 3.09Å; E321-V325 PolarHBondContact O-N 3.01Å |
| 322 | Q | 88 | Confident | 86.5 | Confident | 57 Ų | 57 | 100 Ų | 100 | 27% | 0.266 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.6 | -45.7 | 175 | -67.7 | -174.7 | 22.2 | 0 | 0 | 111.7 | I314 L315 M317 N318 V325 F326 | I314-Q322 HydrophobicContact CG2-CG 4.4Å; I314-Q322 VanDerWaalsContact O-CG 3.24Å; I314-Q322 WeakPolarHBondContact O-CG 3.07Å; L315-Q322 PolarHBondContact O-NE2 3.05Å; M317-Q322 HydrophobicContact CB-CG 4.07Å; M317-Q322 PolarHBondContact O-NE2 3.35Å; N318-Q322 WeakPolarHBondContact O-CG 3.49Å; N318-Q322 PolarHBondContact O-N 2.92Å; Q322-V325 PolarHBondContact O-N 3.38Å; Q322-F326 WeakPolarHBondContact O-CB 3.14Å; Q322-F326 PolarHBondContact O-N 3.41Å |
| 323 | L | 90.6 | Very high | 87.3 | Confident | 85 Ų | 85 | 97 Ų | 97 | 45% | 0.445 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.1 | -37.3 | -180 | -161.1 | 99.8 | 0 | 0 | 0 | 111.9 | P319 T320 E321 F326 R327 | P319-L323 WeakPolarHBondContact O-CB 3.2Å; P319-L323 PolarHBondContact O-N 3.14Å; P319-L323 VanDerWaalsContact O-N 3.13Å; T320-L323 PolarHBondContact O-N 2.67Å; E321-L323 VanDerWaalsContact C-N 3.3Å; E321-L323 PolarHBondContact O-N 3.46Å; L323-F326 PolarHBondContact O-N 3.04Å; L323-R327 WeakPolarHBondContact O-CG 3.44Å; L323-R327 PolarHBondContact O-N 3.03Å |
| 324 | E | 91.8 | Very high | 88 | Confident | 84 Ų | 84 | 92 Ų | 92 | 39% | 0.393 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.7 | -46.5 | 176 | -175.7 | 55.5 | -152.5 | 0 | 0 | 111.4 | T320 E321 F326 R327 Q328 | T320-E324 PolarHBondContact O-N 3.5Å; T320-E324 VanDerWaalsContact O-N 3.12Å; E321-E324 PolarHBondContact O-N 3.15Å; E324-F326 VanDerWaalsContact C-N 3.31Å; E324-F326 PolarHBondContact O-N 3.11Å; E324-R327 PolarHBondContact O-N 2.92Å; E324-R327 IonicContact OE2-NH1 2.76Å; E324-Q328 WeakPolarHBondContact O-CG 3.29Å; E324-Q328 PolarHBondContact O-N 2.85Å; E324-Q328 PolarHBondContact OE1-NE2 3.29Å |
| 325 | V | 90.6 | Very high | 88.4 | Confident | 44 Ų | 44 | 93.5 Ų | 93.5 | 27% | 0.267 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 174.4 | 173.2 | 0 | 0 | 0 | 0 | 111 | I314 M317 E321 Q322 R327 Q328 L329 | I314-V325 HydrophobicContact CD1-CG1 3.74Å; I314-V325 HydrophobicContact CG1-CG1 4.05Å; I314-V325 HydrophobicContact CG2-CB 4.42Å; I314-V325 HydrophobicContact CG2-CG1 4.21Å; M317-V325 HydrophobicContact SD-CG2 4.38Å; E321-V325 WeakPolarHBondContact O-CG2 3.09Å; E321-V325 PolarHBondContact O-N 3.01Å; Q322-V325 PolarHBondContact O-N 3.38Å; V325-R327 PolarHBondContact O-N 3.44Å; V325-Q328 PolarHBondContact O-N 3.1Å; V325-L329 WeakPolarHBondContact O-CB 3.24Å; V325-L329 PolarHBondContact O-N 3.12Å |
| 326 | F | 91.5 | Very high | 88.8 | Confident | 112 Ų | 112 | 91.3 Ų | 91.3 | 49% | 0.491 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60 | -45.4 | 177.1 | 175.8 | -98.9 | 0 | 0 | 0 | 112.3 | Q322 L323 E324 L329 H330 | Q322-F326 WeakPolarHBondContact O-CB 3.14Å; Q322-F326 PolarHBondContact O-N 3.41Å; L323-F326 PolarHBondContact O-N 3.04Å; E324-F326 VanDerWaalsContact C-N 3.31Å; E324-F326 PolarHBondContact O-N 3.11Å; F326-L329 PolarHBondContact O-N 3.01Å; F326-H330 WeakPolarHBondContact O-CB 3.4Å; F326-H330 PolarHBondContact O-N 3.06Å |
| 327 | R | 91.8 | Very high | 89.3 | Confident | 146 Ų | 146 | 85.6 Ų | 85.6 | 55% | 0.551 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.6 | -43.9 | 177.2 | -73.4 | 172.5 | -177 | 163 | -4.8 | 112.2 | L323 E324 V325 H330 H331 | L323-R327 WeakPolarHBondContact O-CG 3.44Å; L323-R327 PolarHBondContact O-N 3.03Å; E324-R327 PolarHBondContact O-N 2.92Å; E324-R327 IonicContact OE2-NH1 2.76Å; V325-R327 PolarHBondContact O-N 3.44Å; R327-H330 PolarHBondContact O-N 3.43Å; R327-H331 WeakPolarHBondContact O-CB 3.35Å; R327-H331 PolarHBondContact O-N 3.34Å |
| 328 | Q | 91.5 | Very high | 89.4 | Confident | 110 Ų | 110 | 87.8 Ų | 87.8 | 51% | 0.514 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.9 | -41.2 | 177.6 | -70.6 | 179.2 | 11.1 | 0 | 0 | 111.9 | E324 V325 S332 | E324-Q328 WeakPolarHBondContact O-CG 3.29Å; E324-Q328 PolarHBondContact O-N 2.85Å; E324-Q328 PolarHBondContact OE1-NE2 3.29Å; V325-Q328 PolarHBondContact O-N 3.1Å; Q328-S332 WeakPolarHBondContact O-CB 3.31Å; Q328-S332 PolarHBondContact O-N 2.93Å; Q328-S332 PolarHBondContact O-OG 2.75Å |
| 329 | L | 90.7 | Very high | 89.1 | Confident | 99 Ų | 99 | 84.7 Ų | 84.7 | 52% | 0.518 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.7 | -46.3 | 175.5 | -174.4 | 65.6 | 0 | 0 | 0 | 111.2 | V325 F326 H331 S332 L333 | V325-L329 WeakPolarHBondContact O-CB 3.24Å; V325-L329 PolarHBondContact O-N 3.12Å; F326-L329 PolarHBondContact O-N 3.01Å; L329-H331 PolarHBondContact O-N 3.36Å; L329-S332 PolarHBondContact O-N 3.16Å; L329-L333 HydrophobicContact CD1-CD1 4.23Å; L329-L333 HydrophobicContact CD1-CG 4.27Å; L329-L333 HydrophobicContact CG-CD1 3.91Å; L329-L333 HydrophobicContact CG-CG 4.34Å; L329-L333 WeakPolarHBondContact O-CB 3.29Å; L329-L333 VanDerWaalsContact O-CG 3.28Å; L329-L333 WeakPolarHBondContact O-CG 3.49Å; L329-L333 PolarHBondContact O-N 3.3Å |
| 330 | H | 90.2 | Very high | 88 | Confident | 76 Ų | 76 | 85.9 Ų | 85.9 | 35% | 0.352 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -58.6 | -47.6 | 176.4 | -178.3 | -79.1 | 0 | 0 | 0 | 111.7 | F326 R327 S332 L333 S334 L339 | F326-H330 WeakPolarHBondContact O-CB 3.4Å; F326-H330 PolarHBondContact O-N 3.06Å; R327-H330 PolarHBondContact O-N 3.43Å; H330-S332 VanDerWaalsContact C-N 3.32Å; H330-S332 PolarHBondContact O-N 3.48Å; H330-L333 PolarHBondContact O-N 3.32Å; H330-S334 VanDerWaalsContact O-CB 3.25Å; H330-S334 WeakPolarHBondContact O-CB 3.13Å; H330-S334 PolarHBondContact O-N 3.23Å; H330-L339 WeakPolarHBondContact O-CD1 3.2Å |
| 331 | H | 90.5 | Very high | 86.8 | Confident | 136 Ų | 136 | 88.1 Ų | 88.1 | 63% | 0.63 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -59.9 | -43 | 176.9 | -175.5 | -85.7 | 0 | 0 | 0 | 111.7 | R327 L329 S334 A335 | R327-H331 WeakPolarHBondContact O-CB 3.35Å; R327-H331 PolarHBondContact O-N 3.34Å; L329-H331 PolarHBondContact O-N 3.36Å; H331-S334 PolarHBondContact O-N 3.2Å; H331-A335 VanDerWaalsContact O-CB 3.3Å; H331-A335 WeakPolarHBondContact O-CB 3.44Å; H331-A335 PolarHBondContact O-N 3.25Å |
| 332 | S | 91 | Very high | 85.5 | Confident | 71 Ų | 71 | 91.5 Ų | 91.5 | 50% | 0.497 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.2 | -43.4 | 179.3 | -57.7 | 0 | 0 | 0 | 0 | 112.5 | Q328 L329 H330 A335 A336 | Q328-S332 WeakPolarHBondContact O-CB 3.31Å; Q328-S332 PolarHBondContact O-N 2.93Å; Q328-S332 PolarHBondContact O-OG 2.75Å; L329-S332 PolarHBondContact O-N 3.16Å; H330-S332 VanDerWaalsContact C-N 3.32Å; H330-S332 PolarHBondContact O-N 3.48Å; S332-A335 PolarHBondContact O-N 3.3Å; S332-A336 WeakPolarHBondContact O-CB 3.49Å; S332-A336 PolarHBondContact O-N 3.14Å |
| 333 | L | 90 | Very high | 83.8 | Confident | 59 Ų | 59 | 95.3 Ų | 95.3 | 31% | 0.309 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -70.3 | -33.8 | 178 | -66.8 | 174.2 | 0 | 0 | 0 | 112.1 | L329 H330 A336 G337 L338 L339 | L329-L333 HydrophobicContact CD1-CD1 4.23Å; L329-L333 HydrophobicContact CD1-CG 4.27Å; L329-L333 HydrophobicContact CG-CD1 3.91Å; L329-L333 HydrophobicContact CG-CG 4.34Å; L329-L333 WeakPolarHBondContact O-CB 3.29Å; L329-L333 VanDerWaalsContact O-CG 3.28Å; L329-L333 WeakPolarHBondContact O-CG 3.49Å; L329-L333 PolarHBondContact O-N 3.3Å; H330-L333 PolarHBondContact O-N 3.32Å; L333-A336 PolarHBondContact O-N 3.02Å; L333-G337 PolarHBondContact O-N 3.34Å; L333-L338 HydrophobicContact CD2-CB 4.48Å; L333-L338 HydrophobicContact CD2-CD1 3.78Å; L333-L338 PolarHBondContact O-N 2.94Å; L333-L339 HydrophobicContact CB-CD1 3.61Å; L333-L339 HydrophobicContact CB-CD2 4.33Å; L333-L339 HydrophobicContact CB-CG 3.66Å; L333-L339 HydrophobicContact CD1-CD2 4.44Å |
| 334 | S | 88.4 | Confident | 81.9 | Confident | 59 Ų | 59 | 101.2 Ų | 101.2 | 41% | 0.413 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.2 | -45 | 173.5 | -179.6 | 0 | 0 | 0 | 0 | 111.3 | H330 H331 A336 G337 | H330-S334 VanDerWaalsContact O-CB 3.25Å; H330-S334 WeakPolarHBondContact O-CB 3.13Å; H330-S334 PolarHBondContact O-N 3.23Å; H331-S334 PolarHBondContact O-N 3.2Å; S334-A336 PolarHBondContact O-N 3.3Å; S334-G337 PolarHBondContact O-N 3.01Å |
| 335 | A | 89.2 | Confident | 81.4 | Confident | 80 Ų | 80 | 102.1 Ų | 102.1 | 66% | 0.661 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.3 | -31.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | H331 S332 G337 | H331-A335 VanDerWaalsContact O-CB 3.3Å; H331-A335 WeakPolarHBondContact O-CB 3.44Å; H331-A335 PolarHBondContact O-N 3.25Å; S332-A335 PolarHBondContact O-N 3.3Å; A335-G337 VanDerWaalsContact C-N 3.26Å; A335-G337 PolarHBondContact O-N 2.89Å |
| 336 | A | 89.5 | Confident | 80.9 | Confident | 65 Ų | 65 | 105.2 Ų | 105.2 | 54% | 0.537 | 57% | 0.569 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.6 | -3.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | S332 L333 S334 L338 | S332-A336 WeakPolarHBondContact O-CB 3.49Å; S332-A336 PolarHBondContact O-N 3.14Å; L333-A336 PolarHBondContact O-N 3.02Å; S334-A336 PolarHBondContact O-N 3.3Å; A336-L338 HydrophobicContact CB-CD1 4.01Å; A336-L338 HydrophobicContact CB-CG 4.03Å; A336-L338 PolarHBondContact O-N 3.02Å |
| 337 | G | 86.5 | Confident | 80.3 | Confident | 34 Ų | 34 | 104.8 Ų | 104.8 | 35% | 0.351 | 57% | 0.574 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 71.1 | 11.1 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | L333 S334 A335 L339 N340 | L333-G337 PolarHBondContact O-N 3.34Å; S334-G337 PolarHBondContact O-N 3.01Å; A335-G337 VanDerWaalsContact C-N 3.26Å; A335-G337 PolarHBondContact O-N 2.89Å; G337-L339 VanDerWaalsContact C-N 3.35Å; G337-N340 PolarHBondContact O-ND2 3.17Å |
| 338 | L | 83.9 | Confident | 79.6 | Confident | 120 Ų | 120 | 102.4 Ų | 102.4 | 63% | 0.628 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -17.6 | -176.4 | -65.5 | 172.3 | 0 | 0 | 0 | 112.9 | L333 A336 | L333-L338 HydrophobicContact CD2-CB 4.48Å; L333-L338 HydrophobicContact CD2-CD1 3.78Å; L333-L338 PolarHBondContact O-N 2.94Å; A336-L338 HydrophobicContact CB-CD1 4.01Å; A336-L338 HydrophobicContact CB-CG 4.03Å; A336-L338 PolarHBondContact O-N 3.02Å |
| 339 | L | 78.5 | Confident | 78.9 | Confident | 34 Ų | 34 | 101.9 Ų | 101.9 | 18% | 0.178 | 58% | 0.579 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -98.4 | 5.8 | -178.8 | -67.7 | 175.8 | 0 | 0 | 0 | 114.4 | H330 L333 G337 N341 F342 | H330-L339 WeakPolarHBondContact O-CD1 3.2Å; L333-L339 HydrophobicContact CB-CD1 3.61Å; L333-L339 HydrophobicContact CB-CD2 4.33Å; L333-L339 HydrophobicContact CB-CG 3.66Å; L333-L339 HydrophobicContact CD1-CD2 4.44Å; G337-L339 VanDerWaalsContact C-N 3.35Å; L339-N341 PolarHBondContact O-N 2.84Å; L339-F342 HydrophobicContact CD2-CB 4.02Å; L339-F342 HydrophobicContact CD2-CD2 4.24Å; L339-F342 HydrophobicContact CD2-CG 4.3Å; L339-F342 PolarHBondContact O-N 3.49Å |
| 340 | N | 66.5 | Low | 78.1 | Confident | 128 Ų | 128 | 102.1 Ų | 102.1 | 68% | 0.684 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | -13.9 | -173.1 | -70.5 | -9.2 | 0 | 0 | 0 | 114.6 | G337 | G337-N340 PolarHBondContact O-ND2 3.17Š|
| 341 | N | 63.9 | Low | 77.2 | Confident | 159 Ų | 159 | 103.9 Ų | 103.9 | 85% | 0.85 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.4 | 6.5 | 174.7 | -72.1 | -11.8 | 0 | 0 | 0 | 114.2 | L339 | L339-N341 PolarHBondContact O-N 2.84Š|
| 342 | F | 60.2 | Low | 76.2 | Confident | 164 Ų | 164 | 101.5 Ų | 101.5 | 72% | 0.719 | 60% | 0.597 | S | S | * | * | trans | -103.7 | 90.1 | 178.2 | -87 | -84.5 | 0 | 0 | 0 | 109.8 | L339 | L339-F342 HydrophobicContact CD2-CB 4.02Å; L339-F342 HydrophobicContact CD2-CD2 4.24Å; L339-F342 HydrophobicContact CD2-CG 4.3Å; L339-F342 PolarHBondContact O-N 3.49Å | ||
| 343 | T | 52.9 | Low | 75 | Confident | 137 Ų | 137 | 104 Ų | 104 | 84% | 0.84 | 61% | 0.605 | S | S | * | * | trans | -78.8 | 125.3 | 158.4 | 48.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 344 | L | 50.1 | Low | 73.6 | Confident | 209 Ų | 209 | 108.1 Ų | 108.1 | 100% | 1.094 | 63% | 0.632 | S | S | * | * | trans | -55.3 | 0 | 174.5 | -87.2 | 162.4 | 0 | 0 | 0 | 112.9 |
Retrieved 344 of 344 residues in 999.2 ms
(Link to these results)