| 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 | 60.5 | Low | 84.8 | Confident | 208 Ų | 208 | 98.7 Ų | 98.7 | 100% | 1.025 | 47% | 0.474 | S | S | * | . | 0 | -56.4 | 0 | -161.6 | 178.8 | -125.5 | 0 | 0 | 112.3 | R3 A4 V5 | M1-R3 PolarHBondContact O-N 2.87Å; M1-A4 PolarHBondContact O-N 3.1Å; M1-V5 HydrophobicContact CG-CG2 4.49Å; M1-V5 PolarHBondContact O-N 3.21Å | |||
| 2 | F | 73.3 | Confident | 85.6 | Confident | 173 Ų | 173 | 92.3 Ų | 92.3 | 76% | 0.759 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -47.9 | -53.3 | -178.5 | -171.6 | -101.9 | 0 | 0 | 0 | 113.9 | A4 V5 T6 | F2-A4 VanDerWaalsContact C-N 3.29Å; F2-A4 PolarHBondContact O-N 3.06Å; F2-V5 PolarHBondContact O-N 2.87Å; F2-T6 PolarHBondContact O-N 3.3Å; F2-T6 PolarHBondContact O-OG1 3.36Å |
| 3 | R | 81.5 | Confident | 86.3 | Confident | 208 Ų | 208 | 94.8 Ų | 94.8 | 79% | 0.785 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -54.8 | -39.3 | 178.6 | -170.7 | 176.7 | -178.9 | 178.7 | 1.7 | 113.9 | M1 M7 | M1-R3 PolarHBondContact O-N 2.87Å; R3-M7 HydrophobicContact CG-CG 4.49Å; R3-M7 WeakPolarHBondContact O-CB 3.43Å; R3-M7 WeakPolarHBondContact O-CG 3.25Å; R3-M7 PolarHBondContact O-N 2.84Å |
| 4 | A | 81.5 | Confident | 87.1 | Confident | 52 Ų | 52 | 92.4 Ų | 92.4 | 43% | 0.43 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -70.7 | -39.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | M1 F2 M7 K8 | M1-A4 PolarHBondContact O-N 3.1Å; F2-A4 VanDerWaalsContact C-N 3.29Å; F2-A4 PolarHBondContact O-N 3.06Å; A4-M7 PolarHBondContact O-N 3Å; A4-K8 WeakPolarHBondContact O-CB 3.49Å; A4-K8 PolarHBondContact O-N 3.19Å |
| 5 | V | 85 | Confident | 87.8 | Confident | 66 Ų | 66 | 86.2 Ų | 86.2 | 40% | 0.4 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.5 | -44.3 | 175.5 | 179.2 | 0 | 0 | 0 | 0 | 110.6 | M1 F2 K8 Y9 | M1-V5 HydrophobicContact CG-CG2 4.49Å; M1-V5 PolarHBondContact O-N 3.21Å; F2-V5 PolarHBondContact O-N 2.87Å; V5-K8 WeakPolarHBondContact O-CB 3.46Å; V5-K8 PolarHBondContact O-N 3.06Å; V5-Y9 HydrophobicContact CG1-CD2 3.78Å; V5-Y9 HydrophobicContact CG1-CE2 3.49Å; V5-Y9 VanDerWaalsContact CG1-CE2 3.49Å; V5-Y9 VanDerWaalsContact O-CD2 3.24Å; V5-Y9 WeakPolarHBondContact O-CD2 3.3Å; V5-Y9 PolarHBondContact O-N 2.83Å; V5-Y9 VanDerWaalsContact O-N 3.13Å |
| 6 | T | 88.6 | Confident | 88.3 | Confident | 62 Ų | 62 | 81.9 Ų | 81.9 | 38% | 0.38 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.5 | -48.2 | 174.8 | -49.4 | 0 | 0 | 0 | 0 | 111.2 | F2 K8 Y9 L10 | F2-T6 PolarHBondContact O-N 3.3Å; F2-T6 PolarHBondContact O-OG1 3.36Å; T6-K8 VanDerWaalsContact C-N 3.3Å; T6-K8 PolarHBondContact O-N 3.27Å; T6-Y9 PolarHBondContact O-N 2.88Å; T6-L10 WeakPolarHBondContact O-CB 3.37Å; T6-L10 PolarHBondContact O-N 3.04Å |
| 7 | M | 90.2 | Very high | 88.8 | Confident | 53 Ų | 53 | 83.2 Ų | 83.2 | 26% | 0.261 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.3 | -38.7 | 177.9 | -72.1 | -64.2 | -71.3 | 0 | 0 | 112.1 | R3 A4 S11 L254 Y258 | R3-M7 HydrophobicContact CG-CG 4.49Å; R3-M7 WeakPolarHBondContact O-CB 3.43Å; R3-M7 WeakPolarHBondContact O-CG 3.25Å; R3-M7 PolarHBondContact O-N 2.84Å; A4-M7 PolarHBondContact O-N 3Å; M7-S11 WeakPolarHBondContact O-CB 3.5Å; M7-S11 PolarHBondContact O-N 3.45Å; M7-S11 PolarHBondContact O-OG 3.36Å; M7-L254 HydrophobicContact CE-CD1 4.4Å; M7-L254 HydrophobicContact CE-CD2 4.28Å; M7-Y258 HydrophobicContact CB-CD1 3.94Å; M7-Y258 HydrophobicContact CB-CD2 4.25Å; M7-Y258 HydrophobicContact CB-CE1 4.18Å; M7-Y258 HydrophobicContact CB-CE2 4.49Å; M7-Y258 HydrophobicContact CB-CG 3.98Å; M7-Y258 HydrophobicContact CE-CD2 4.48Å; M7-Y258 HydrophobicContact CE-CE2 3.92Å; M7-Y258 HydrophobicContact CG-CE1 4.47Å |
| 8 | K | 91.3 | Very high | 89.3 | Confident | 54 Ų | 54 | 79.1 Ų | 79.1 | 24% | 0.235 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -57.9 | -55.2 | 175.4 | 179 | -167.7 | 172.9 | -168.1 | 0 | 111.2 | A4 V5 T6 S11 L12 A259 | A4-K8 WeakPolarHBondContact O-CB 3.49Å; A4-K8 PolarHBondContact O-N 3.19Å; V5-K8 WeakPolarHBondContact O-CB 3.46Å; V5-K8 PolarHBondContact O-N 3.06Å; T6-K8 VanDerWaalsContact C-N 3.3Å; T6-K8 PolarHBondContact O-N 3.27Å; K8-S11 PolarHBondContact O-OG 3.49Å; K8-L12 HydrophobicContact CG-CD1 4.17Å; K8-L12 WeakPolarHBondContact O-CD1 3.27Å; K8-L12 VanDerWaalsContact O-CG 3.3Å; K8-L12 WeakPolarHBondContact O-CG 3.45Å; K8-L12 PolarHBondContact O-N 3.37Å; K8-A259 HydrophobicContact CG-CB 3.79Å |
| 9 | Y | 92.1 | Very high | 89.7 | Confident | 122 Ų | 122 | 76.2 Ų | 76.2 | 48% | 0.478 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -73.2 | -38.8 | -176.6 | -67.3 | -61.6 | 0 | 0 | 0 | 112.9 | V5 T6 S11 L12 F13 | V5-Y9 HydrophobicContact CG1-CD2 3.78Å; V5-Y9 HydrophobicContact CG1-CE2 3.49Å; V5-Y9 VanDerWaalsContact CG1-CE2 3.49Å; V5-Y9 VanDerWaalsContact O-CD2 3.24Å; V5-Y9 WeakPolarHBondContact O-CD2 3.3Å; V5-Y9 PolarHBondContact O-N 2.83Å; V5-Y9 VanDerWaalsContact O-N 3.13Å; T6-Y9 PolarHBondContact O-N 2.88Å; Y9-S11 VanDerWaalsContact C-N 3.35Å; Y9-S11 PolarHBondContact O-N 3.32Å; Y9-L12 PolarHBondContact O-N 2.89Å; Y9-F13 WeakPolarHBondContact O-CB 3.49Å; Y9-F13 PolarHBondContact O-N 3.34Å |
| 10 | L | 94.4 | Very high | 90 | Very high | 85 Ų | 85 | 73.6 Ų | 73.6 | 45% | 0.445 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61 | -44.9 | 176.2 | -178.8 | 61.8 | 0 | 0 | 0 | 111.3 | T6 F13 I14 | T6-L10 WeakPolarHBondContact O-CB 3.37Å; T6-L10 PolarHBondContact O-N 3.04Å; L10-F13 PolarHBondContact O-N 3.42Å; L10-I14 HydrophobicContact CD1-CD1 3.94Å; L10-I14 HydrophobicContact CD1-CG1 4.28Å; L10-I14 HydrophobicContact CG-CD1 3.84Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.39Å; L10-I14 PolarHBondContact O-N 2.86Å |
| 11 | S | 94.4 | Very high | 90.2 | Very high | 3 Ų | 3 | 74.3 Ų | 74.3 | 2% | 0.021 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.3 | -39.5 | 178.8 | 63.1 | 0 | 0 | 0 | 0 | 113.2 | M7 K8 Y9 L15 V255 | M7-S11 WeakPolarHBondContact O-CB 3.5Å; M7-S11 PolarHBondContact O-N 3.45Å; M7-S11 PolarHBondContact O-OG 3.36Å; K8-S11 PolarHBondContact O-OG 3.49Å; Y9-S11 VanDerWaalsContact C-N 3.35Å; Y9-S11 PolarHBondContact O-N 3.32Å; S11-L15 VanDerWaalsContact O-CB 3.26Å; S11-L15 WeakPolarHBondContact O-CB 3.47Å; S11-L15 PolarHBondContact O-N 3.16Å; S11-V255 VanDerWaalsContact C-CG2 3.46Å; S11-V255 VanDerWaalsContact O-CG2 3.31Å; S11-V255 WeakPolarHBondContact O-CG2 3.41Å |
| 12 | L | 94.3 | Very high | 92 | Very high | 22 Ų | 22 | 66.4 Ų | 66.4 | 12% | 0.115 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62 | -45.5 | 173.9 | -75.1 | 162.9 | 0 | 0 | 0 | 111.2 | K8 Y9 L15 V16 V255 A259 L263 A267 | K8-L12 HydrophobicContact CG-CD1 4.17Å; K8-L12 WeakPolarHBondContact O-CD1 3.27Å; K8-L12 VanDerWaalsContact O-CG 3.3Å; K8-L12 WeakPolarHBondContact O-CG 3.45Å; K8-L12 PolarHBondContact O-N 3.37Å; Y9-L12 PolarHBondContact O-N 2.89Å; L12-L15 PolarHBondContact O-N 3.41Å; L12-V16 WeakPolarHBondContact O-CG2 3.28Å; L12-V16 PolarHBondContact O-N 3.4Å; L12-V255 HydrophobicContact CD2-CG1 3.51Å; L12-V255 HydrophobicContact CG-CG1 4.12Å; L12-A259 HydrophobicContact CD1-CB 4.36Å; L12-L263 HydrophobicContact CD1-CB 4.47Å; L12-L263 HydrophobicContact CD1-CD2 3.96Å; L12-L263 HydrophobicContact CD2-CB 4.14Å; L12-A267 HydrophobicContact CD2-CB 3.87Å |
| 13 | F | 95.3 | Very high | 92.8 | Very high | 124 Ų | 124 | 60.8 Ų | 60.8 | 54% | 0.544 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.3 | -52.9 | 177.1 | -178.5 | -93.2 | 0 | 0 | 0 | 111.1 | Y9 L10 L15 V16 F17 | Y9-F13 WeakPolarHBondContact O-CB 3.49Å; Y9-F13 PolarHBondContact O-N 3.34Å; L10-F13 PolarHBondContact O-N 3.42Å; F13-L15 VanDerWaalsContact C-N 3.28Å; F13-L15 PolarHBondContact O-N 2.89Å; F13-V16 WeakPolarHBondContact O-CB 3.41Å; F13-V16 PolarHBondContact O-N 3.15Å; F13-V16 VanDerWaalsContact O-N 3.12Å; F13-F17 AromaticContact CD1-CD2 3.97Å; F13-F17 HydrophobicContact CD1-CD2 3.97Å; F13-F17 HydrophobicContact CD1-CE2 4.08Å; F13-F17 HydrophobicContact CD2-CD2 4.37Å; F13-F17 AromaticContact CD2-CE2 3.86Å; F13-F17 HydrophobicContact CD2-CE2 3.86Å; F13-F17 AromaticContact CE1-CD2 3.7Å; F13-F17 HydrophobicContact CE1-CD2 3.7Å; F13-F17 AromaticContact CE1-CE2 3.55Å; F13-F17 HydrophobicContact CE1-CE2 3.55Å; F13-F17 HydrophobicContact CE1-CZ 4.46Å; F13-F17 HydrophobicContact CE2-CD2 4.16Å; F13-F17 AromaticContact CE2-CE2 3.33Å; F13-F17 HydrophobicContact CE2-CE2 3.33Å; F13-F17 HydrophobicContact CE2-CZ 4.14Å; F13-F17 HydrophobicContact CG-CD2 4.3Å; F13-F17 HydrophobicContact CG-CE2 4.23Å; F13-F17 AromaticContact CZ-CD2 3.82Å; F13-F17 HydrophobicContact CZ-CD2 3.82Å; F13-F17 AromaticContact CZ-CE2 3.14Å; F13-F17 HydrophobicContact CZ-CE2 3.14Å; F13-F17 AromaticContact CZ-CZ 3.84Å; F13-F17 HydrophobicContact CZ-CZ 3.84Å; F13-F17 WeakPolarHBondContact O-CD2 3.15Å; F13-F17 PolarHBondContact O-N 3.05Å |
| 14 | I | 97.4 | Very high | 93.3 | Very high | 61 Ų | 61 | 52.3 Ų | 52.3 | 31% | 0.313 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -59.7 | -40 | 179 | -62.6 | 166.4 | 0 | 0 | 0 | 110.9 | L10 V16 F17 Q18 F247 L251 | L10-I14 HydrophobicContact CD1-CD1 3.94Å; L10-I14 HydrophobicContact CD1-CG1 4.28Å; L10-I14 HydrophobicContact CG-CD1 3.84Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.39Å; L10-I14 PolarHBondContact O-N 2.86Å; I14-V16 PolarHBondContact O-N 2.89Å; I14-F17 PolarHBondContact O-N 3.34Å; I14-Q18 WeakPolarHBondContact O-CB 3.48Å; I14-Q18 PolarHBondContact O-N 3.31Å; I14-F247 HydrophobicContact CG2-CE1 4.47Å; I14-F247 HydrophobicContact CG2-CZ 4.39Å; I14-L251 HydrophobicContact CB-CD2 4.38Å; I14-L251 HydrophobicContact CG2-CD1 3.68Å; I14-L251 HydrophobicContact CG2-CD2 3.75Å; I14-L251 HydrophobicContact CG2-CG 4.39Å |
| 15 | L | 97 | Very high | 93.9 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.7 | -40.6 | 177.1 | -179 | 67 | 0 | 0 | 0 | 112.2 | S11 L12 F13 Q18 N19 L251 V252 V255 K264 A267 | S11-L15 VanDerWaalsContact O-CB 3.26Å; S11-L15 WeakPolarHBondContact O-CB 3.47Å; S11-L15 PolarHBondContact O-N 3.16Å; L12-L15 PolarHBondContact O-N 3.41Å; F13-L15 VanDerWaalsContact C-N 3.28Å; F13-L15 PolarHBondContact O-N 2.89Å; L15-Q18 PolarHBondContact O-N 3.06Å; L15-N19 VanDerWaalsContact O-CB 3.28Å; L15-N19 WeakPolarHBondContact O-CB 3.24Å; L15-N19 PolarHBondContact O-N 2.94Å; L15-L251 HydrophobicContact CD1-CB 4.1Å; L15-V252 HydrophobicContact CD1-CG2 3.89Å; L15-V255 HydrophobicContact CB-CG2 3.93Å; L15-V255 HydrophobicContact CD2-CB 4.18Å; L15-V255 HydrophobicContact CD2-CG1 4.19Å; L15-V255 HydrophobicContact CD2-CG2 3.8Å; L15-V255 HydrophobicContact CG-CG2 4.43Å; L15-K264 HydrophobicContact CD2-CG 4.08Å; L15-A267 HydrophobicContact CD2-CB 4.25Å |
| 16 | V | 96.4 | Very high | 94.2 | Very high | 18 Ų | 18 | 48.6 Ų | 48.6 | 11% | 0.109 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.4 | -48.1 | 176.5 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | L12 F13 I14 L20 A267 V270 S271 L274 | L12-V16 WeakPolarHBondContact O-CG2 3.28Å; L12-V16 PolarHBondContact O-N 3.4Å; F13-V16 WeakPolarHBondContact O-CB 3.41Å; F13-V16 PolarHBondContact O-N 3.15Å; F13-V16 VanDerWaalsContact O-N 3.12Å; I14-V16 PolarHBondContact O-N 2.89Å; V16-L20 VanDerWaalsContact O-CB 3.31Å; V16-L20 WeakPolarHBondContact O-CB 3.48Å; V16-L20 PolarHBondContact O-N 3.3Å; V16-A267 HydrophobicContact CG2-CB 3.82Å; V16-V270 HydrophobicContact CG1-CG1 4.03Å; V16-V270 HydrophobicContact CG2-CG1 4.47Å; V16-S271 WeakPolarHBondContact O-CB 3.36Å; V16-L274 HydrophobicContact CG1-CD1 3.48Å; V16-L274 VanDerWaalsContact CG1-CD1 3.48Å |
| 17 | F | 96.6 | Very high | 94.1 | Very high | 103 Ų | 103 | 51.5 Ų | 51.5 | 45% | 0.452 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -68.2 | -42.2 | 179.5 | -79.9 | -83 | 0 | 0 | 0 | 112.9 | F13 I14 L20 L21 | F13-F17 AromaticContact CD1-CD2 3.97Å; F13-F17 HydrophobicContact CD1-CD2 3.97Å; F13-F17 HydrophobicContact CD1-CE2 4.08Å; F13-F17 HydrophobicContact CD2-CD2 4.37Å; F13-F17 AromaticContact CD2-CE2 3.86Å; F13-F17 HydrophobicContact CD2-CE2 3.86Å; F13-F17 AromaticContact CE1-CD2 3.7Å; F13-F17 HydrophobicContact CE1-CD2 3.7Å; F13-F17 AromaticContact CE1-CE2 3.55Å; F13-F17 HydrophobicContact CE1-CE2 3.55Å; F13-F17 HydrophobicContact CE1-CZ 4.46Å; F13-F17 HydrophobicContact CE2-CD2 4.16Å; F13-F17 AromaticContact CE2-CE2 3.33Å; F13-F17 HydrophobicContact CE2-CE2 3.33Å; F13-F17 HydrophobicContact CE2-CZ 4.14Å; F13-F17 HydrophobicContact CG-CD2 4.3Å; F13-F17 HydrophobicContact CG-CE2 4.23Å; F13-F17 AromaticContact CZ-CD2 3.82Å; F13-F17 HydrophobicContact CZ-CD2 3.82Å; F13-F17 AromaticContact CZ-CE2 3.14Å; F13-F17 HydrophobicContact CZ-CE2 3.14Å; F13-F17 AromaticContact CZ-CZ 3.84Å; F13-F17 HydrophobicContact CZ-CZ 3.84Å; F13-F17 WeakPolarHBondContact O-CD2 3.15Å; F13-F17 PolarHBondContact O-N 3.05Å; I14-F17 PolarHBondContact O-N 3.34Å; F17-L20 WeakPolarHBondContact O-CB 3.44Å; F17-L20 PolarHBondContact O-N 2.87Å; F17-L21 WeakPolarHBondContact O-CB 3.36Å; F17-L21 PolarHBondContact O-N 3.13Å |
| 18 | Q | 97.7 | Very high | 94 | Very high | 10 Ų | 10 | 53.7 Ų | 53.7 | 5% | 0.047 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.5 | -45.4 | 177.2 | 175.9 | -79.7 | -40.7 | 0 | 0 | 111.1 | I14 L15 L21 Y22 L244 F247 L251 | I14-Q18 WeakPolarHBondContact O-CB 3.48Å; I14-Q18 PolarHBondContact O-N 3.31Å; L15-Q18 PolarHBondContact O-N 3.06Å; Q18-L21 PolarHBondContact O-N 3.16Å; Q18-Y22 WeakPolarHBondContact O-CB 3.16Å; Q18-Y22 PolarHBondContact O-N 3.22Å; Q18-L244 PolarHBondContact NE2-O 2.93Å; Q18-F247 HydrophobicContact CB-CD1 4.45Å; Q18-F247 HydrophobicContact CB-CE1 4.44Å; Q18-F247 HydrophobicContact CG-CD1 3.75Å; Q18-F247 HydrophobicContact CG-CE1 4.22Å; Q18-L251 HydrophobicContact CB-CD1 3.7Å; Q18-L251 HydrophobicContact CG-CD1 3.83Å |
| 19 | N | 96.5 | Very high | 93.9 | Very high | 23 Ų | 23 | 51.7 Ų | 51.7 | 12% | 0.123 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.9 | -41.3 | 177.4 | -82.2 | -20.8 | 0 | 0 | 0 | 111.6 | L15 L21 Y22 I23 C268 S271 | L15-N19 VanDerWaalsContact O-CB 3.28Å; L15-N19 WeakPolarHBondContact O-CB 3.24Å; L15-N19 PolarHBondContact O-N 2.94Å; N19-L21 PolarHBondContact O-N 3.46Å; N19-Y22 PolarHBondContact O-N 3.06Å; N19-I23 WeakPolarHBondContact O-CB 3.39Å; N19-I23 WeakPolarHBondContact O-CD1 3.48Å; N19-I23 WeakPolarHBondContact O-CG1 3.47Å; N19-I23 PolarHBondContact O-N 2.94Å; N19-C268 PolarHBondContact ND2-SG 3.34Å; N19-C268 VanDerWaalsContact ND2-SG 3.43Å; N19-S271 VanDerWaalsContact CB-OG 3.28Å; N19-S271 WeakPolarHBondContact CB-OG 3.48Å |
| 20 | L | 95 | Very high | 93.6 | Very high | 25 Ų | 25 | 52 Ų | 52 | 13% | 0.131 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -53.9 | -53.5 | 173.5 | 167.9 | 62.2 | 0 | 0 | 0 | 110.8 | V16 F17 Y22 I23 L24 L274 S275 | V16-L20 VanDerWaalsContact O-CB 3.31Å; V16-L20 WeakPolarHBondContact O-CB 3.48Å; V16-L20 PolarHBondContact O-N 3.3Å; F17-L20 WeakPolarHBondContact O-CB 3.44Å; F17-L20 PolarHBondContact O-N 2.87Å; L20-Y22 PolarHBondContact O-N 2.98Å; L20-I23 PolarHBondContact O-N 3.01Å; L20-L24 HydrophobicContact CD1-CD1 3.74Å; L20-L24 HydrophobicContact CD1-CG 4.19Å; L20-L24 HydrophobicContact CG-CD1 4.17Å; L20-L24 WeakPolarHBondContact O-CG 3.41Å; L20-L24 PolarHBondContact O-N 3.4Å; L20-L24 VanDerWaalsContact O-N 3.08Å; L20-L274 HydrophobicContact CD1-CB 3.96Å; L20-L274 HydrophobicContact CD2-CB 4.09Å; L20-S275 VanDerWaalsContact CD1-N 3.27Å |
| 21 | L | 95.7 | Very high | 93.1 | Very high | 88 Ų | 88 | 52 Ų | 52 | 46% | 0.461 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -62.2 | -44.8 | -179.7 | -176.2 | 60.3 | 0 | 0 | 0 | 111.4 | F17 Q18 N19 I23 L24 C25 L244 | F17-L21 WeakPolarHBondContact O-CB 3.36Å; F17-L21 PolarHBondContact O-N 3.13Å; Q18-L21 PolarHBondContact O-N 3.16Å; N19-L21 PolarHBondContact O-N 3.46Å; L21-I23 PolarHBondContact O-N 3.15Å; L21-L24 PolarHBondContact O-N 2.95Å; L21-C25 WeakPolarHBondContact O-CB 3.47Å; L21-C25 PolarHBondContact O-N 3.33Å; L21-C25 PolarHBondContact O-SG 3.44Å; L21-L244 HydrophobicContact CD2-CD1 4.12Å; L21-L244 HydrophobicContact CD2-CD2 3.66Å; L21-L244 HydrophobicContact CG-CD1 3.86Å; L21-L244 HydrophobicContact CG-CD2 4.18Å |
| 22 | Y | 96.9 | Very high | 92.6 | Very high | 42 Ų | 42 | 55.4 Ų | 55.4 | 17% | 0.165 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.3 | -45.9 | 177.6 | 173.9 | -106.6 | 0 | 0 | 0 | 112.5 | Q18 N19 L20 L24 C25 M26 V241 L244 H245 | Q18-Y22 WeakPolarHBondContact O-CB 3.16Å; Q18-Y22 PolarHBondContact O-N 3.22Å; N19-Y22 PolarHBondContact O-N 3.06Å; L20-Y22 PolarHBondContact O-N 2.98Å; Y22-L24 PolarHBondContact O-N 3.04Å; Y22-C25 PolarHBondContact O-N 3.04Å; Y22-M26 HydrophobicContact CD1-CG 4.36Å; Y22-M26 HydrophobicContact CD2-CG 3.89Å; Y22-M26 HydrophobicContact CE1-CG 3.86Å; Y22-M26 HydrophobicContact CE2-CG 3.32Å; Y22-M26 HydrophobicContact CE2-SD 3.95Å; Y22-M26 HydrophobicContact CG-CG 4.37Å; Y22-M26 VanDerWaalsContact O-CB 3.27Å; Y22-M26 WeakPolarHBondContact O-CB 3Å; Y22-M26 WeakPolarHBondContact O-CG 3.48Å; Y22-M26 PolarHBondContact O-N 3.11Å; Y22-V241 HydrophobicContact CE2-CG1 3.95Å; Y22-L244 HydrophobicContact CD2-CB 4.13Å; Y22-H245 HydrophobicContact CD2-CB 4.24Å; Y22-H245 HydrophobicContact CE2-CB 3.69Å; Y22-H245 AromaticContact CE2-CD2 3.79Å; Y22-H245 AromaticContact CZ-CD2 3.47Å; Y22-H245 VanDerWaalsContact CZ-CD2 3.47Å; Y22-H245 PolarHBondContact OH-CD2 3.44Å; Y22-H245 VanDerWaalsContact OH-CD2 3.31Å |
| 23 | I | 91.7 | Very high | 91.7 | Very high | 55 Ų | 55 | 61.6 Ų | 61.6 | 28% | 0.282 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 179.2 | -67.7 | 163.1 | 0 | 0 | 0 | 110.4 | N19 L20 L21 M26 R27 I272 S275 | N19-I23 WeakPolarHBondContact O-CB 3.39Å; N19-I23 WeakPolarHBondContact O-CD1 3.48Å; N19-I23 WeakPolarHBondContact O-CG1 3.47Å; N19-I23 PolarHBondContact O-N 2.94Å; L20-I23 PolarHBondContact O-N 3.01Å; L21-I23 PolarHBondContact O-N 3.15Å; I23-M26 PolarHBondContact O-N 3.03Å; I23-R27 WeakPolarHBondContact O-CB 3.14Å; I23-R27 PolarHBondContact O-N 3.27Å; I23-I272 HydrophobicContact CD1-CG1 4.1Å; I23-S275 VanDerWaalsContact CG2-OG 3.28Å; I23-S275 WeakPolarHBondContact CG2-OG 3.31Å |
| 24 | L | 91.4 | Very high | 90.8 | Very high | 30 Ų | 30 | 58.9 Ų | 58.9 | 16% | 0.157 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.7 | -47.1 | 178.6 | -68.2 | 173.3 | 0 | 0 | 0 | 111.6 | L20 L21 Y22 R27 H28 S275 F278 | L20-L24 HydrophobicContact CD1-CD1 3.74Å; L20-L24 HydrophobicContact CD1-CG 4.19Å; L20-L24 HydrophobicContact CG-CD1 4.17Å; L20-L24 WeakPolarHBondContact O-CG 3.41Å; L20-L24 PolarHBondContact O-N 3.4Å; L20-L24 VanDerWaalsContact O-N 3.08Å; L21-L24 PolarHBondContact O-N 2.95Å; Y22-L24 PolarHBondContact O-N 3.04Å; L24-R27 PolarHBondContact O-N 3.39Å; L24-H28 WeakPolarHBondContact O-CB 3.43Å; L24-H28 PolarHBondContact O-N 3.33Å; L24-S275 VanDerWaalsContact CD2-OG 3.31Å; L24-S275 WeakPolarHBondContact CD2-OG 3.31Å; L24-F278 HydrophobicContact CD1-CB 4.12Å; L24-F278 HydrophobicContact CD1-CD1 3.48Å; L24-F278 VanDerWaalsContact CD1-CD1 3.48Å; L24-F278 HydrophobicContact CD1-CD2 4.07Å; L24-F278 HydrophobicContact CD1-CE1 3.85Å; L24-F278 HydrophobicContact CD1-CE2 4.38Å; L24-F278 HydrophobicContact CD1-CG 3.61Å; L24-F278 HydrophobicContact CD1-CZ 4.29Å; L24-F278 HydrophobicContact CD2-CB 4.38Å; L24-F278 HydrophobicContact CD2-CD1 3.64Å; L24-F278 HydrophobicContact CD2-CE1 4.33Å; L24-F278 HydrophobicContact CD2-CG 4.26Å; L24-F278 HydrophobicContact CG-CD1 4.21Å |
| 25 | C | 93.4 | Very high | 89.9 | Confident | 16 Ų | 16 | 62 Ų | 62 | 11% | 0.108 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.1 | -43 | 176.9 | -70.5 | 0 | 0 | 0 | 0 | 111.9 | L21 Y22 H28 A29 F237 V241 L244 | L21-C25 WeakPolarHBondContact O-CB 3.47Å; L21-C25 PolarHBondContact O-N 3.33Å; L21-C25 PolarHBondContact O-SG 3.44Å; Y22-C25 PolarHBondContact O-N 3.04Å; C25-H28 PolarHBondContact O-N 2.83Å; C25-A29 VanDerWaalsContact O-CB 3.26Å; C25-A29 WeakPolarHBondContact O-CB 3.47Å; C25-A29 PolarHBondContact O-N 2.99Å; C25-F237 HydrophobicContact CB-CE1 4.28Å; C25-F237 HydrophobicContact CB-CZ 3.92Å; C25-F237 WeakPolarHBondContact O-CE1 3.41Å; C25-V241 HydrophobicContact CB-CG2 3.97Å; C25-L244 HydrophobicContact CB-CD1 4.18Å |
| 26 | M | 91.3 | Very high | 89.3 | Confident | 24 Ų | 24 | 67.7 Ų | 67.7 | 12% | 0.118 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -62.9 | -44.3 | 176.5 | -85.2 | -65.8 | -72.7 | 0 | 0 | 112.4 | Y22 I23 H28 A29 R30 F37 M42 V241 | Y22-M26 HydrophobicContact CD1-CG 4.36Å; Y22-M26 HydrophobicContact CD2-CG 3.89Å; Y22-M26 HydrophobicContact CE1-CG 3.86Å; Y22-M26 HydrophobicContact CE2-CG 3.32Å; Y22-M26 HydrophobicContact CE2-SD 3.95Å; Y22-M26 HydrophobicContact CG-CG 4.37Å; Y22-M26 VanDerWaalsContact O-CB 3.27Å; Y22-M26 WeakPolarHBondContact O-CB 3Å; Y22-M26 WeakPolarHBondContact O-CG 3.48Å; Y22-M26 PolarHBondContact O-N 3.11Å; I23-M26 PolarHBondContact O-N 3.03Å; M26-H28 VanDerWaalsContact C-N 3.33Å; M26-A29 PolarHBondContact O-N 3.24Å; M26-R30 WeakPolarHBondContact O-CB 3.47Å; M26-R30 WeakPolarHBondContact O-CG 3.36Å; M26-R30 PolarHBondContact O-N 3.46Å; M26-F37 HydrophobicContact CE-CZ 4.26Å; M26-F37 HydrophobicContact SD-CZ 4.13Å; M26-M42 HydrophobicContact CE-SD 4.39Å; M26-M42 HydrophobicContact SD-SD 3.98Å; M26-V241 HydrophobicContact CG-CG1 3.95Å; M26-V241 HydrophobicContact SD-CG1 3.24Å; M26-V241 WeakPolarHBondContact SD-CG1 3.44Å |
| 27 | R | 87.1 | Confident | 88.9 | Confident | 123 Ų | 123 | 67.1 Ų | 67.1 | 46% | 0.464 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.1 | -46 | 176.8 | -176.2 | 176.6 | 176.6 | -177.3 | -1.2 | 110.4 | I23 L24 R30 S31 S279 | I23-R27 WeakPolarHBondContact O-CB 3.14Å; I23-R27 PolarHBondContact O-N 3.27Å; L24-R27 PolarHBondContact O-N 3.39Å; R27-R30 PolarHBondContact O-N 3.34Å; R27-S31 WeakPolarHBondContact O-CB 3.31Å; R27-S31 PolarHBondContact O-N 2.95Å; R27-S31 PolarHBondContact O-OG 3.39Å; R27-S279 PolarHBondContact NH1-OG 3.28Å |
| 28 | H | 88.8 | Confident | 88.5 | Confident | 99 Ų | 99 | 63 Ų | 63 | 46% | 0.458 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.3 | -47.3 | 176.9 | -175.2 | 65 | 0 | 0 | 0 | 112.1 | L24 C25 M26 R30 S31 R32 F237 | L24-H28 WeakPolarHBondContact O-CB 3.43Å; L24-H28 PolarHBondContact O-N 3.33Å; C25-H28 PolarHBondContact O-N 2.83Å; M26-H28 VanDerWaalsContact C-N 3.33Å; H28-R30 PolarHBondContact O-N 3.49Å; H28-S31 WeakPolarHBondContact CA-OG 3.37Å; H28-S31 PolarHBondContact O-N 3.41Å; H28-S31 VanDerWaalsContact O-N 3.11Å; H28-S31 PolarHBondContact O-OG 2.57Å; H28-R32 WeakPolarHBondContact O-CG 3.22Å; H28-R32 PolarHBondContact O-N 3.39Å; H28-F237 HydrophobicContact CB-CE1 4.45Å; H28-F237 AromaticContact CD2-CE1 3.78Å; H28-F237 AromaticContact CD2-CZ 3.78Å |
| 29 | A | 88.4 | Confident | 88.1 | Confident | 13 Ų | 13 | 64.4 Ų | 64.4 | 11% | 0.107 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -57.5 | -39 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | C25 M26 F37 F237 V241 | C25-A29 VanDerWaalsContact O-CB 3.26Å; C25-A29 WeakPolarHBondContact O-CB 3.47Å; C25-A29 PolarHBondContact O-N 2.99Å; M26-A29 PolarHBondContact O-N 3.24Å; A29-F37 HydrophobicContact CB-CE1 3.98Å; A29-F237 HydrophobicContact CB-CD1 4.02Å; A29-F237 HydrophobicContact CB-CE1 3.92Å; A29-V241 HydrophobicContact CB-CG2 4.31Å |
| 30 | R | 85.6 | Confident | 87.9 | Confident | 129 Ų | 129 | 64.5 Ų | 64.5 | 49% | 0.487 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -80.8 | -20.9 | 178.1 | -71.3 | -175.6 | 170.3 | -168.2 | -2.7 | 114.6 | M26 R27 H28 M36 S39 | M26-R30 WeakPolarHBondContact O-CB 3.47Å; M26-R30 WeakPolarHBondContact O-CG 3.36Å; M26-R30 PolarHBondContact O-N 3.46Å; R27-R30 PolarHBondContact O-N 3.34Å; H28-R30 PolarHBondContact O-N 3.49Å; R30-M36 HydrophobicContact CG-CE 4.45Å; R30-S39 PolarHBondContact NH2-OG 3.34Å |
| 31 | S | 84.3 | Confident | 87.8 | Confident | 84 Ų | 84 | 63.3 Ų | 63.3 | 59% | 0.587 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -89.4 | -6.3 | 178.1 | 65.3 | 0 | 0 | 0 | 0 | 113.8 | R27 H28 | R27-S31 WeakPolarHBondContact O-CB 3.31Å; R27-S31 PolarHBondContact O-N 2.95Å; R27-S31 PolarHBondContact O-OG 3.39Å; H28-S31 WeakPolarHBondContact CA-OG 3.37Å; H28-S31 PolarHBondContact O-N 3.41Å; H28-S31 VanDerWaalsContact O-N 3.11Å; H28-S31 PolarHBondContact O-OG 2.57Å |
| 32 | R | 83.3 | Confident | 87.8 | Confident | 74 Ų | 74 | 59.2 Ų | 59.2 | 28% | 0.279 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -70.5 | 150.7 | 178.4 | -78.8 | 174.5 | 57.2 | -175.8 | -10.3 | 110.9 | H28 T34 D235 | H28-R32 WeakPolarHBondContact O-CG 3.22Å; H28-R32 PolarHBondContact O-N 3.39Å; R32-T34 WeakPolarHBondContact CB-OG1 3.4Å; R32-T34 PolarHBondContact NE-OG1 3.48Å; R32-T34 VanDerWaalsContact NH2-CG2 3.29Å; R32-T34 PolarHBondContact NH2-OG1 3.03Å; R32-T34 PolarHBondContact O-N 3.31Å; R32-D235 IonicContact CZ-OD2 2.67Å; R32-D235 IonicContact NH1-OD1 3.54Å; R32-D235 IonicContact NH1-OD2 2.67Å; R32-D235 PolarHBondContact NH1-OD2 2.79Å; R32-D235 IonicContact NH2-OD2 2.7Å; R32-D235 PolarHBondContact NH2-OD2 2.88Å |
| 33 | T | 75.8 | Confident | 87.6 | Confident | 153 Ų | 153 | 60.1 Ų | 60.1 | 94% | 0.939 | 31% | 0.31 | S | S | * | . | S | Bend | trans | -75.8 | -6 | 175.2 | 52.1 | 0 | 0 | 0 | 0 | 113.5 | ||
| 34 | T | 77.1 | Confident | 87.9 | Confident | 67 Ų | 67 | 58 Ų | 58 | 41% | 0.411 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -71.3 | 160.5 | 175.6 | 49.8 | 0 | 0 | 0 | 0 | 111.5 | R32 M36 | R32-T34 WeakPolarHBondContact CB-OG1 3.4Å; R32-T34 PolarHBondContact NE-OG1 3.48Å; R32-T34 VanDerWaalsContact NH2-CG2 3.29Å; R32-T34 PolarHBondContact NH2-OG1 3.03Å; R32-T34 PolarHBondContact O-N 3.31Å; T34-M36 PolarHBondContact O-N 3.25Å |
| 35 | E | 78.2 | Confident | 88.1 | Confident | 127 Ų | 127 | 58.5 Ų | 58.5 | 59% | 0.593 | 30% | 0.302 | S | S | * | . | P | Polyproline II helix | trans | -51.2 | 130.8 | 176.6 | -63.9 | -179.3 | 159.7 | 0 | 0 | 111.4 | F37 H232 | E35-F37 PolarHBondContact O-N 2.72Å; E35-H232 IonicContact OE1-CE1 3.45Å; E35-H232 IonicContact OE2-CE1 2.7Å; E35-H232 PolarHBondContact OE2-CE1 2.99Å; E35-H232 IonicContact OE2-ND1 3.1Å; E35-H232 PolarHBondContact OE2-ND1 3.17Å; E35-H232 IonicContact OE2-NE2 3.95Å |
| 36 | M | 83.5 | Confident | 88.4 | Confident | 119 Ų | 119 | 57.8 Ų | 57.8 | 59% | 0.586 | 30% | 0.297 | S | S | * | . | P | Polyproline II helix | trans | -79.1 | 122.7 | -174.7 | -176.4 | 172.8 | 170.7 | 0 | 0 | 109.9 | R30 T34 | R30-M36 HydrophobicContact CG-CE 4.45Å; T34-M36 PolarHBondContact O-N 3.25Å |
| 37 | F | 88.1 | Confident | 88.7 | Confident | 6 Ų | 6 | 57.5 Ų | 57.5 | 3% | 0.026 | 30% | 0.295 | C | S | . | . | P | Polyproline II helix | trans | -65.3 | 148.7 | 176.4 | 66.6 | -88.5 | 0 | 0 | 0 | 112.1 | M26 A29 E35 S39 M42 H232 F234 V238 | M26-F37 HydrophobicContact CE-CZ 4.26Å; M26-F37 HydrophobicContact SD-CZ 4.13Å; A29-F37 HydrophobicContact CB-CE1 3.98Å; E35-F37 PolarHBondContact O-N 2.72Å; F37-S39 PolarHBondContact O-N 2.69Å; F37-M42 HydrophobicContact CD2-CB 3.86Å; F37-M42 HydrophobicContact CD2-CG 4.27Å; F37-M42 HydrophobicContact CE2-CB 3.8Å; F37-M42 HydrophobicContact CE2-CG 3.89Å; F37-M42 HydrophobicContact CE2-SD 3.74Å; F37-M42 HydrophobicContact CZ-SD 4.24Å; F37-H232 WeakPolarHBondContact CA-O 3.37Å; F37-F234 HydrophobicContact CB-CD2 4.01Å; F37-F234 HydrophobicContact CB-CE2 3.99Å; F37-V238 HydrophobicContact CB-CG1 4.32Å; F37-V238 HydrophobicContact CB-CG2 4.3Å; F37-V238 HydrophobicContact CD1-CG1 4.33Å; F37-V238 HydrophobicContact CD1-CG2 3.63Å; F37-V238 HydrophobicContact CD2-CG1 4.39Å; F37-V238 HydrophobicContact CE1-CG2 4.23Å; F37-V238 HydrophobicContact CG-CG1 4.09Å; F37-V238 HydrophobicContact CG-CG2 4.1Å |
| 38 | N | 88.9 | Confident | 89.2 | Confident | 15 Ų | 15 | 53.5 Ų | 53.5 | 8% | 0.08 | 29% | 0.285 | C | S | . | . | P | Polyproline II helix | trans | -71.1 | 122.5 | 173.3 | -170.3 | -48.4 | 0 | 0 | 0 | 110.8 | S40 S41 M42 D224 | N38-S40 PolarHBondContact O-N 2.93Å; N38-S40 PolarHBondContact OD1-N 2.99Å; N38-S40 PolarHBondContact OD1-OG 3.33Å; N38-S41 PolarHBondContact O-N 3.18Å; N38-M42 PolarHBondContact O-N 3.37Å; N38-M42 VanDerWaalsContact O-N 3.14Å; N38-D224 PolarHBondContact ND2-OD2 2.91Å |
| 39 | S | 89.5 | Confident | 89.7 | Confident | 40 Ų | 40 | 51.4 Ų | 51.4 | 28% | 0.28 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -67.3 | -33.1 | -175.8 | -67.4 | 0 | 0 | 0 | 0 | 113.5 | R30 F37 M42 V43 | R30-S39 PolarHBondContact NH2-OG 3.34Å; F37-S39 PolarHBondContact O-N 2.69Å; S39-M42 PolarHBondContact O-N 2.93Å; S39-V43 WeakPolarHBondContact O-CG2 3.42Å; S39-V43 PolarHBondContact O-N 3.4Å; S39-V43 VanDerWaalsContact O-N 3.12Å |
| 40 | S | 91.7 | Very high | 90.1 | Very high | 25 Ų | 25 | 52.1 Ų | 52.1 | 18% | 0.175 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -70.8 | -38 | 177.6 | 62.2 | 0 | 0 | 0 | 0 | 111.7 | N38 M42 V43 I44 Q217 D221 | N38-S40 PolarHBondContact O-N 2.93Å; N38-S40 PolarHBondContact OD1-N 2.99Å; N38-S40 PolarHBondContact OD1-OG 3.33Å; S40-M42 PolarHBondContact O-N 3.3Å; S40-V43 PolarHBondContact O-N 3.5Å; S40-I44 PolarHBondContact O-N 3.06Å; S40-Q217 WeakPolarHBondContact OG-CG 3.22Å; S40-Q217 PolarHBondContact OG-NE2 3.37Å; S40-D221 WeakPolarHBondContact CB-OD2 3.48Å; S40-D221 PolarHBondContact OG-OD2 3.47Å |
| 41 | S | 94.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 174.5 | -60.2 | 0 | 0 | 0 | 0 | 111.5 | N38 V43 I44 M45 Q217 Y230 | N38-S41 PolarHBondContact O-N 3.18Å; S41-V43 VanDerWaalsContact C-N 3.34Å; S41-V43 PolarHBondContact O-N 2.95Å; S41-I44 PolarHBondContact O-N 3.47Å; S41-M45 WeakPolarHBondContact O-CB 3.38Å; S41-M45 PolarHBondContact O-N 2.93Å; S41-Q217 VanDerWaalsContact CA-NE2 3.33Å; S41-Q217 PolarHBondContact OG-NE2 2.73Å; S41-Y230 PolarHBondContact OG-O 2.72Å |
| 42 | M | 94.4 | Very high | 91.4 | Very high | 3 Ų | 3 | 49.5 Ų | 49.5 | 2% | 0.015 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.7 | -44.5 | 175.6 | -174.1 | -135.5 | 90.4 | 0 | 0 | 111.6 | M26 F37 N38 S39 S40 M45 S46 V241 I242 H245 | M26-M42 HydrophobicContact CE-SD 4.39Å; M26-M42 HydrophobicContact SD-SD 3.98Å; F37-M42 HydrophobicContact CD2-CB 3.86Å; F37-M42 HydrophobicContact CD2-CG 4.27Å; F37-M42 HydrophobicContact CE2-CB 3.8Å; F37-M42 HydrophobicContact CE2-CG 3.89Å; F37-M42 HydrophobicContact CE2-SD 3.74Å; F37-M42 HydrophobicContact CZ-SD 4.24Å; N38-M42 PolarHBondContact O-N 3.37Å; N38-M42 VanDerWaalsContact O-N 3.14Å; S39-M42 PolarHBondContact O-N 2.93Å; S40-M42 PolarHBondContact O-N 3.3Å; M42-M45 PolarHBondContact O-N 3.22Å; M42-S46 WeakPolarHBondContact O-CB 3.37Å; M42-S46 PolarHBondContact O-N 2.94Å; M42-V241 HydrophobicContact SD-CG1 3.78Å; M42-I242 HydrophobicContact CB-CG1 4.48Å; M42-I242 HydrophobicContact CG-CD1 4.33Å; M42-I242 HydrophobicContact CG-CG1 3.56Å; M42-H245 HydrophobicContact CE-CB 4.01Å |
| 43 | V | 93.9 | Very high | 92.1 | Very high | 60 Ų | 60 | 48.5 Ų | 48.5 | 36% | 0.364 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65 | -48.8 | 179.4 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | S39 S40 S41 M45 S46 E47 | S39-V43 WeakPolarHBondContact O-CG2 3.42Å; S39-V43 PolarHBondContact O-N 3.4Å; S39-V43 VanDerWaalsContact O-N 3.12Å; S40-V43 PolarHBondContact O-N 3.5Å; S41-V43 VanDerWaalsContact C-N 3.34Å; S41-V43 PolarHBondContact O-N 2.95Å; V43-M45 VanDerWaalsContact C-N 3.31Å; V43-M45 PolarHBondContact O-N 2.8Å; V43-S46 WeakPolarHBondContact O-CB 3.49Å; V43-S46 PolarHBondContact O-N 3.25Å; V43-S46 VanDerWaalsContact O-N 3.09Å; V43-S46 PolarHBondContact O-OG 3.31Å; V43-E47 WeakPolarHBondContact O-CG 3.29Å; V43-E47 PolarHBondContact O-N 3.33Å |
| 44 | I | 96.5 | Very high | 93.1 | Very high | 12 Ų | 12 | 41.2 Ų | 41.2 | 6% | 0.062 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60.8 | -42 | 178.7 | -70.2 | 164.8 | 0 | 0 | 0 | 111 | S40 S41 S46 E47 C48 I214 Q217 | S40-I44 PolarHBondContact O-N 3.06Å; S41-I44 PolarHBondContact O-N 3.47Å; I44-S46 VanDerWaalsContact C-N 3.29Å; I44-S46 PolarHBondContact O-N 3.36Å; I44-E47 WeakPolarHBondContact O-CB 3.37Å; I44-E47 PolarHBondContact O-N 2.96Å; I44-E47 VanDerWaalsContact O-N 3.11Å; I44-C48 PolarHBondContact O-N 3.4Å; I44-C48 PolarHBondContact O-SG 3.28Å; I44-C48 VanDerWaalsContact O-SG 3.36Å; I44-I214 HydrophobicContact CD1-CG1 4.16Å; I44-I214 HydrophobicContact CG2-CG1 4.38Å; I44-Q217 HydrophobicContact CD1-CB 3.84Å; I44-Q217 VanDerWaalsContact CD1-CD 3.44Å; I44-Q217 HydrophobicContact CD1-CG 4.24Å |
| 45 | M | 97.2 | Very high | 94.1 | Very high | 40 Ų | 40 | 39.7 Ų | 39.7 | 20% | 0.197 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.6 | -37.3 | 176.6 | -166.3 | 52.8 | 67 | 0 | 0 | 112.2 | S41 M42 V43 C48 L49 Y230 F231 W239 I242 | S41-M45 WeakPolarHBondContact O-CB 3.38Å; S41-M45 PolarHBondContact O-N 2.93Å; M42-M45 PolarHBondContact O-N 3.22Å; V43-M45 VanDerWaalsContact C-N 3.31Å; V43-M45 PolarHBondContact O-N 2.8Å; M45-C48 PolarHBondContact O-N 3.43Å; M45-C48 HydrophobicContact SD-CB 4.47Å; M45-L49 WeakPolarHBondContact O-CB 3.25Å; M45-L49 PolarHBondContact O-N 3.22Å; M45-Y230 HydrophobicContact CE-CE1 4.45Å; M45-F231 HydrophobicContact CE-CE1 3.48Å; M45-F231 VanDerWaalsContact CE-CE1 3.48Å; M45-F231 HydrophobicContact CE-CZ 3.65Å; M45-W239 HydrophobicContact CE-CH2 4.39Å; M45-W239 HydrophobicContact CG-CH2 3.92Å; M45-W239 HydrophobicContact CG-CZ3 3.54Å; M45-W239 HydrophobicContact SD-CH2 4.17Å; M45-W239 HydrophobicContact SD-CZ3 4.1Å; M45-I242 HydrophobicContact CB-CD1 4.19Å; M45-I242 HydrophobicContact CB-CG2 4.31Å; M45-I242 HydrophobicContact CG-CD1 4.07Å; M45-I242 HydrophobicContact CG-CG2 4.07Å |
| 46 | S | 98 | Very high | 95 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -67.9 | -33.8 | 174.3 | 79.1 | 0 | 0 | 0 | 0 | 112.9 | M42 V43 I44 L49 K50 H245 A246 | M42-S46 WeakPolarHBondContact O-CB 3.37Å; M42-S46 PolarHBondContact O-N 2.94Å; V43-S46 WeakPolarHBondContact O-CB 3.49Å; V43-S46 PolarHBondContact O-N 3.25Å; V43-S46 VanDerWaalsContact O-N 3.09Å; V43-S46 PolarHBondContact O-OG 3.31Å; I44-S46 VanDerWaalsContact C-N 3.29Å; I44-S46 PolarHBondContact O-N 3.36Å; S46-L49 PolarHBondContact O-N 3.35Å; S46-K50 WeakPolarHBondContact O-CG 3.29Å; S46-K50 PolarHBondContact O-N 2.95Å; S46-H245 WeakPolarHBondContact CB-ND1 3.24Å; S46-H245 PolarHBondContact OG-CE1 3.14Å; S46-H245 PolarHBondContact OG-ND1 3.11Å; S46-A246 WeakPolarHBondContact O-CB 3.37Å |
| 47 | E | 97.8 | Very high | 95.6 | Very high | 18 Ų | 18 | 32.9 Ų | 32.9 | 8% | 0.084 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -67.9 | -42.5 | 172.8 | -63.5 | -55.7 | 141 | 0 | 0 | 111.2 | V43 I44 L49 K50 F51 I210 | V43-E47 WeakPolarHBondContact O-CG 3.29Å; V43-E47 PolarHBondContact O-N 3.33Å; I44-E47 WeakPolarHBondContact O-CB 3.37Å; I44-E47 PolarHBondContact O-N 2.96Å; I44-E47 VanDerWaalsContact O-N 3.11Å; E47-L49 VanDerWaalsContact C-N 3.33Å; E47-L49 PolarHBondContact O-N 2.87Å; E47-K50 PolarHBondContact O-N 2.91Å; E47-K50 VanDerWaalsContact OE1-CE 3.27Å; E47-K50 WeakPolarHBondContact OE1-CE 3.35Å; E47-K50 IonicContact OE1-NZ 2.89Å; E47-K50 PolarHBondContact OE1-NZ 3.2Å; E47-K50 WeakPolarHBondContact OE2-CE 3.39Å; E47-K50 IonicContact OE2-NZ 2.64Å; E47-K50 PolarHBondContact OE2-NZ 3.02Å; E47-F51 WeakPolarHBondContact O-CB 3.14Å; E47-F51 PolarHBondContact O-N 3.44Å; E47-I210 HydrophobicContact CB-CD1 4.14Å; E47-I210 HydrophobicContact CB-CG1 3.6Å |
| 48 | C | 98.3 | Very high | 96 | Very high | 39 Ų | 39 | 32.7 Ų | 32.7 | 26% | 0.264 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -58.8 | -45 | 173.1 | -69 | 0 | 0 | 0 | 0 | 111.3 | I44 M45 K50 F51 L52 | I44-C48 PolarHBondContact O-N 3.4Å; I44-C48 PolarHBondContact O-SG 3.28Å; I44-C48 VanDerWaalsContact O-SG 3.36Å; M45-C48 PolarHBondContact O-N 3.43Å; M45-C48 HydrophobicContact SD-CB 4.47Å; C48-K50 PolarHBondContact O-N 3.33Å; C48-F51 WeakPolarHBondContact O-CB 3.3Å; C48-F51 PolarHBondContact O-N 3.19Å; C48-L52 WeakPolarHBondContact O-CB 3.39Å; C48-L52 VanDerWaalsContact O-CG 3.3Å; C48-L52 WeakPolarHBondContact O-CG 3.34Å; C48-L52 PolarHBondContact O-N 2.88Å |
| 49 | L | 98.3 | Very high | 96.3 | Very high | 56 Ų | 56 | 35.1 Ų | 35.1 | 29% | 0.293 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -63.5 | -41.8 | 177.4 | -176.6 | 60.8 | 0 | 0 | 0 | 112 | M45 S46 E47 T53 I242 F243 A246 | M45-L49 WeakPolarHBondContact O-CB 3.25Å; M45-L49 PolarHBondContact O-N 3.22Å; S46-L49 PolarHBondContact O-N 3.35Å; E47-L49 VanDerWaalsContact C-N 3.33Å; E47-L49 PolarHBondContact O-N 2.87Å; L49-T53 VanDerWaalsContact O-CB 3.29Å; L49-T53 WeakPolarHBondContact O-CB 3.11Å; L49-T53 PolarHBondContact O-N 3.05Å; L49-T53 PolarHBondContact O-OG1 3.5Å; L49-I242 HydrophobicContact CD2-CG2 4.26Å; L49-F243 HydrophobicContact CD2-CB 4.35Å; L49-F243 HydrophobicContact CD2-CD2 4.26Å; L49-A246 HydrophobicContact CB-CB 4.13Å; L49-A246 HydrophobicContact CD2-CB 3.83Å; L49-A246 HydrophobicContact CG-CB 4.07Å |
| 50 | K | 98.2 | Very high | 96.7 | Very high | 27 Ų | 27 | 40.2 Ų | 40.2 | 12% | 0.117 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.2 | -46.4 | 173 | -77.9 | -172.2 | -74.1 | 169.6 | 0 | 111.9 | S46 E47 C48 T53 C54 A206 A246 L250 | S46-K50 WeakPolarHBondContact O-CG 3.29Å; S46-K50 PolarHBondContact O-N 2.95Å; E47-K50 PolarHBondContact O-N 2.91Å; E47-K50 VanDerWaalsContact OE1-CE 3.27Å; E47-K50 WeakPolarHBondContact OE1-CE 3.35Å; E47-K50 IonicContact OE1-NZ 2.89Å; E47-K50 PolarHBondContact OE1-NZ 3.2Å; E47-K50 WeakPolarHBondContact OE2-CE 3.39Å; E47-K50 IonicContact OE2-NZ 2.64Å; E47-K50 PolarHBondContact OE2-NZ 3.02Å; C48-K50 PolarHBondContact O-N 3.33Å; K50-T53 PolarHBondContact O-N 2.81Å; K50-C54 PolarHBondContact O-N 3.41Å; K50-C54 PolarHBondContact O-SG 3.22Å; K50-A206 HydrophobicContact CB-CB 4.37Å; K50-A246 WeakPolarHBondContact CD-O 3.48Å; K50-A246 HydrophobicContact CG-CB 3.73Å; K50-A246 VanDerWaalsContact CG-O 3.3Å; K50-A246 WeakPolarHBondContact CG-O 3.27Å; K50-L250 HydrophobicContact CB-CD2 4.38Å; K50-L250 HydrophobicContact CD-CD2 4.34Å; K50-L250 HydrophobicContact CD-CG 4.33Å; K50-L250 HydrophobicContact CG-CD2 4.18Å; K50-L250 HydrophobicContact CG-CG 4.08Å |
| 51 | F | 98.1 | Very high | 96.8 | Very high | 58 Ų | 58 | 42.7 Ų | 42.7 | 25% | 0.254 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -58.6 | -53.2 | 178.5 | -178.8 | -89.7 | 0 | 0 | 0 | 110.6 | E47 C48 T53 C54 V55 I203 A206 F207 I210 | E47-F51 WeakPolarHBondContact O-CB 3.14Å; E47-F51 PolarHBondContact O-N 3.44Å; C48-F51 WeakPolarHBondContact O-CB 3.3Å; C48-F51 PolarHBondContact O-N 3.19Å; F51-T53 PolarHBondContact O-N 3.34Å; F51-C54 PolarHBondContact O-N 3.3Å; F51-V55 HydrophobicContact CD1-CG2 4.14Å; F51-V55 HydrophobicContact CE1-CG2 3.81Å; F51-V55 HydrophobicContact CZ-CG2 4.09Å; F51-V55 WeakPolarHBondContact O-CG2 3.44Å; F51-V55 PolarHBondContact O-N 3.11Å; F51-I203 HydrophobicContact CD2-CG2 4.02Å; F51-I203 HydrophobicContact CE2-CG2 3.55Å; F51-I203 HydrophobicContact CZ-CG2 4.3Å; F51-A206 HydrophobicContact CB-CB 3.93Å; F51-A206 HydrophobicContact CD2-CB 4.42Å; F51-F207 HydrophobicContact CD2-CB 4.29Å; F51-F207 HydrophobicContact CE2-CB 4.11Å; F51-F207 HydrophobicContact CE2-CD2 4.47Å; F51-I210 HydrophobicContact CB-CD1 4.37Å |
| 52 | L | 98.2 | Very high | 96.8 | Very high | 101 Ų | 101 | 45.5 Ų | 45.5 | 53% | 0.529 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 178.5 | -70.1 | 173.9 | 0 | 0 | 0 | 111.7 | C48 C54 V55 S56 | C48-L52 WeakPolarHBondContact O-CB 3.39Å; C48-L52 VanDerWaalsContact O-CG 3.3Å; C48-L52 WeakPolarHBondContact O-CG 3.34Å; C48-L52 PolarHBondContact O-N 2.88Å; L52-C54 VanDerWaalsContact C-N 3.32Å; L52-C54 PolarHBondContact O-N 3.29Å; L52-V55 PolarHBondContact O-N 3.47Å; L52-S56 WeakPolarHBondContact O-CB 3.45Å; L52-S56 PolarHBondContact O-N 2.77Å; L52-S56 PolarHBondContact O-OG 2.88Å; L52-S56 VanDerWaalsContact O-OG 3.04Å |
| 53 | T | 97.9 | Very high | 96.7 | Very high | 53 Ų | 53 | 48.3 Ų | 48.3 | 33% | 0.325 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -57.5 | -45.5 | 177.8 | -58 | 0 | 0 | 0 | 0 | 111.3 | L49 K50 F51 S56 V57 L250 | L49-T53 VanDerWaalsContact O-CB 3.29Å; L49-T53 WeakPolarHBondContact O-CB 3.11Å; L49-T53 PolarHBondContact O-N 3.05Å; L49-T53 PolarHBondContact O-OG1 3.5Å; K50-T53 PolarHBondContact O-N 2.81Å; F51-T53 PolarHBondContact O-N 3.34Å; T53-S56 PolarHBondContact O-N 3.1Å; T53-V57 VanDerWaalsContact O-CG2 3.29Å; T53-V57 WeakPolarHBondContact O-CG2 3.47Å; T53-V57 PolarHBondContact O-N 3.27Å; T53-L250 HydrophobicContact CG2-CD1 4.13Å |
| 54 | C | 97.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -68 | -39.6 | 179.5 | -63.3 | 0 | 0 | 0 | 0 | 112 | K50 F51 L52 V57 L58 W199 N202 I203 L250 | K50-C54 PolarHBondContact O-N 3.41Å; K50-C54 PolarHBondContact O-SG 3.22Å; F51-C54 PolarHBondContact O-N 3.3Å; L52-C54 VanDerWaalsContact C-N 3.32Å; L52-C54 PolarHBondContact O-N 3.29Å; C54-V57 PolarHBondContact O-N 2.82Å; C54-L58 WeakPolarHBondContact O-CG 3.31Å; C54-L58 PolarHBondContact O-N 3.3Å; C54-W199 HydrophobicContact CB-CE3 4.33Å; C54-N202 VanDerWaalsContact SG-CB 3.54Å; C54-I203 HydrophobicContact CB-CD1 4.07Å; C54-I203 HydrophobicContact CB-CG1 3.45Å; C54-I203 VanDerWaalsContact CB-CG1 3.45Å; C54-L250 VanDerWaalsContact SG-CD2 3.57Å |
| 55 | V | 97.3 | Very high | 96.4 | Very high | 35 Ų | 35 | 56.1 Ų | 56.1 | 21% | 0.212 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.3 | -46.9 | 174.4 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | F51 L52 V57 L58 S59 L64 I203 | F51-V55 HydrophobicContact CD1-CG2 4.14Å; F51-V55 HydrophobicContact CE1-CG2 3.81Å; F51-V55 HydrophobicContact CZ-CG2 4.09Å; F51-V55 WeakPolarHBondContact O-CG2 3.44Å; F51-V55 PolarHBondContact O-N 3.11Å; L52-V55 PolarHBondContact O-N 3.47Å; V55-V57 PolarHBondContact O-N 2.99Å; V55-L58 PolarHBondContact O-N 3.36Å; V55-S59 PolarHBondContact O-N 3.04Å; V55-S59 PolarHBondContact O-OG 3.05Å; V55-S59 VanDerWaalsContact O-OG 3.07Å; V55-L64 HydrophobicContact CG1-CD1 4.3Å; V55-L64 HydrophobicContact CG1-CD2 4.5Å; V55-I203 HydrophobicContact CG2-CD1 3.79Å; V55-I203 HydrophobicContact CG2-CG1 4.19Å |
| 56 | S | 97.3 | Very high | 96.1 | Very high | 65 Ų | 65 | 60 Ų | 60 | 46% | 0.455 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58.6 | -45.3 | 177.4 | -64 | 0 | 0 | 0 | 0 | 111.9 | L52 T53 L58 S59 I60 | L52-S56 WeakPolarHBondContact O-CB 3.45Å; L52-S56 PolarHBondContact O-N 2.77Å; L52-S56 PolarHBondContact O-OG 2.88Å; L52-S56 VanDerWaalsContact O-OG 3.04Å; T53-S56 PolarHBondContact O-N 3.1Å; S56-L58 PolarHBondContact O-N 2.88Å; S56-S59 PolarHBondContact O-N 3.34Å; S56-I60 WeakPolarHBondContact O-CD1 3.41Å; S56-I60 VanDerWaalsContact O-CG1 3.27Å; S56-I60 WeakPolarHBondContact O-CG1 3.33Å; S56-I60 PolarHBondContact O-N 3.43Å |
| 57 | V | 97 | Very high | 95.7 | Very high | 38 Ų | 38 | 60.1 Ų | 60.1 | 23% | 0.23 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.5 | -45.1 | 176.2 | 171.8 | 0 | 0 | 0 | 0 | 111 | T53 C54 V55 S59 I60 T61 W199 | T53-V57 VanDerWaalsContact O-CG2 3.29Å; T53-V57 WeakPolarHBondContact O-CG2 3.47Å; T53-V57 PolarHBondContact O-N 3.27Å; C54-V57 PolarHBondContact O-N 2.82Å; V55-V57 PolarHBondContact O-N 2.99Å; V57-S59 VanDerWaalsContact C-N 3.35Å; V57-S59 PolarHBondContact O-N 3.33Å; V57-I60 PolarHBondContact O-N 3.13Å; V57-T61 HydrophobicContact CG1-CG2 4.43Å; V57-T61 WeakPolarHBondContact O-CG2 3.06Å; V57-T61 PolarHBondContact O-N 2.99Å; V57-T61 PolarHBondContact O-OG1 3.44Å; V57-W199 HydrophobicContact CB-CD2 4.29Å; V57-W199 HydrophobicContact CB-CE3 4.36Å; V57-W199 HydrophobicContact CG1-CD2 3.83Å; V57-W199 HydrophobicContact CG1-CE3 4.35Å; V57-W199 HydrophobicContact CG1-CG 4.05Å; V57-W199 HydrophobicContact CG1-CZ2 4.13Å; V57-W199 HydrophobicContact CG2-CE3 4.4Å; V57-W199 HydrophobicContact CG2-CH2 4.27Å; V57-W199 HydrophobicContact CG2-CZ3 4.2Å |
| 58 | L | 96.4 | Very high | 95.4 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.005 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -70.1 | -29.2 | 179.2 | -68 | -175.7 | 0 | 0 | 0 | 114 | C54 V55 S56 G62 D63 L64 C67 W199 H200 I203 | C54-L58 WeakPolarHBondContact O-CG 3.31Å; C54-L58 PolarHBondContact O-N 3.3Å; V55-L58 PolarHBondContact O-N 3.36Å; S56-L58 PolarHBondContact O-N 2.88Å; L58-G62 PolarHBondContact O-N 2.72Å; L58-G62 VanDerWaalsContact O-N 3.16Å; L58-D63 HydrophobicContact CD2-CB 4.04Å; L58-D63 PolarHBondContact O-N 3.42Å; L58-L64 HydrophobicContact CB-CB 4.24Å; L58-L64 HydrophobicContact CB-CD1 4.34Å; L58-L64 PolarHBondContact O-N 2.84Å; L58-L64 VanDerWaalsContact O-N 3.1Å; L58-C67 HydrophobicContact CD1-CB 3.94Å; L58-W199 HydrophobicContact CD1-CB 4.35Å; L58-W199 HydrophobicContact CD2-CB 3.75Å; L58-W199 HydrophobicContact CD2-CG 4.42Å; L58-W199 HydrophobicContact CG-CB 3.95Å; L58-H200 WeakPolarHBondContact CD1-ND1 3.14Å; L58-H200 VanDerWaalsContact CD2-CE1 3.47Å; L58-H200 WeakPolarHBondContact CD2-CE1 3.39Å; L58-H200 WeakPolarHBondContact CD2-ND1 3.47Å; L58-I203 HydrophobicContact CD1-CD1 3.43Å; L58-I203 VanDerWaalsContact CD1-CD1 3.43Å; L58-I203 HydrophobicContact CG-CD1 4.42Å |
| 59 | S | 95.4 | Very high | 95 | Very high | 66 Ų | 66 | 69.2 Ų | 69.2 | 46% | 0.462 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -65.6 | -43.6 | 171.1 | -65.7 | 0 | 0 | 0 | 0 | 110.7 | V55 S56 V57 G62 L64 | V55-S59 PolarHBondContact O-N 3.04Å; V55-S59 PolarHBondContact O-OG 3.05Å; V55-S59 VanDerWaalsContact O-OG 3.07Å; S56-S59 PolarHBondContact O-N 3.34Å; V57-S59 VanDerWaalsContact C-N 3.35Å; V57-S59 PolarHBondContact O-N 3.33Å; S59-G62 PolarHBondContact O-N 3.48Å; S59-L64 WeakPolarHBondContact OG-CD2 3.49Å |
| 60 | I | 96.2 | Very high | 94.5 | Very high | 147 Ų | 147 | 69.3 Ų | 69.3 | 75% | 0.754 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -68.4 | -39.4 | 179.1 | -66.5 | 164.2 | 0 | 0 | 0 | 111.3 | S56 V57 G62 | S56-I60 WeakPolarHBondContact O-CD1 3.41Å; S56-I60 VanDerWaalsContact O-CG1 3.27Å; S56-I60 WeakPolarHBondContact O-CG1 3.33Å; S56-I60 PolarHBondContact O-N 3.43Å; V57-I60 PolarHBondContact O-N 3.13Å; I60-G62 VanDerWaalsContact C-N 3.25Å; I60-G62 PolarHBondContact O-N 3.01Å |
| 61 | T | 95 | Very high | 94 | Very high | 78 Ų | 78 | 70.4 Ų | 70.4 | 48% | 0.479 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -6.5 | 177.5 | 68 | 0 | 0 | 0 | 0 | 113.7 | V57 D63 | V57-T61 HydrophobicContact CG1-CG2 4.43Å; V57-T61 WeakPolarHBondContact O-CG2 3.06Å; V57-T61 PolarHBondContact O-N 2.99Å; V57-T61 PolarHBondContact O-OG1 3.44Å; T61-D63 PolarHBondContact O-N 3.26Å; T61-D63 PolarHBondContact OG1-OD2 3.36Å; T61-D63 VanDerWaalsContact OG1-OD2 3.14Å |
| 62 | G | 92.9 | Very high | 93.4 | Very high | 59 Ų | 59 | 74.3 Ų | 74.3 | 61% | 0.608 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.6 | 5.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | L58 S59 I60 | L58-G62 PolarHBondContact O-N 2.72Å; L58-G62 VanDerWaalsContact O-N 3.16Å; S59-G62 PolarHBondContact O-N 3.48Å; I60-G62 VanDerWaalsContact C-N 3.25Å; I60-G62 PolarHBondContact O-N 3.01Å |
| 63 | D | 92.6 | Very high | 93 | Very high | 61 Ų | 61 | 76.6 Ų | 76.6 | 33% | 0.326 | 41% | 0.408 | S | S | . | . | trans | -88.7 | -1.8 | -177.2 | -73.3 | -55.3 | 0 | 0 | 0 | 113.7 | L58 T61 K65 K66 C67 | L58-D63 HydrophobicContact CD2-CB 4.04Å; L58-D63 PolarHBondContact O-N 3.42Å; T61-D63 PolarHBondContact O-N 3.26Å; T61-D63 PolarHBondContact OG1-OD2 3.36Å; T61-D63 VanDerWaalsContact OG1-OD2 3.14Å; D63-K65 PolarHBondContact O-N 3.31Å; D63-K66 WeakPolarHBondContact O-CB 3.45Å; D63-K66 PolarHBondContact O-N 3.22Å; D63-K66 VanDerWaalsContact O-N 3.09Å; D63-C67 PolarHBondContact O-N 3.39Å | ||
| 64 | L | 92.5 | Very high | 92.5 | Very high | 64 Ų | 64 | 77.9 Ų | 77.9 | 34% | 0.335 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -59.3 | -42.9 | -177.3 | -176.7 | 64.7 | 0 | 0 | 0 | 112.8 | V55 L58 S59 K66 C67 L68 | V55-L64 HydrophobicContact CG1-CD1 4.3Å; V55-L64 HydrophobicContact CG1-CD2 4.5Å; L58-L64 HydrophobicContact CB-CB 4.24Å; L58-L64 HydrophobicContact CB-CD1 4.34Å; L58-L64 PolarHBondContact O-N 2.84Å; L58-L64 VanDerWaalsContact O-N 3.1Å; S59-L64 WeakPolarHBondContact OG-CD2 3.49Å; L64-K66 VanDerWaalsContact C-N 3.27Å; L64-K66 PolarHBondContact O-N 3.48Å; L64-C67 VanDerWaalsContact O-CB 3.29Å; L64-C67 WeakPolarHBondContact O-CB 3.31Å; L64-C67 PolarHBondContact O-N 3.35Å; L64-L68 PolarHBondContact O-N 3.39Å |
| 65 | K | 92.1 | Very high | 92.2 | Very high | 172 Ų | 172 | 81.6 Ų | 81.6 | 75% | 0.748 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -62.8 | -36.3 | 176.9 | -70.4 | -178.2 | 179.8 | 177.6 | 0 | 111.6 | D63 K69 | D63-K65 PolarHBondContact O-N 3.31Å; K65-K69 WeakPolarHBondContact O-CG 3.44Å; K65-K69 PolarHBondContact O-N 3.45Å; K65-K69 VanDerWaalsContact O-N 3.11Å |
| 66 | K | 90.3 | Very high | 91.9 | Very high | 122 Ų | 122 | 86 Ų | 86 | 53% | 0.53 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.7 | -42.5 | 175.3 | -177.6 | 178.8 | 178.9 | -179.6 | 0 | 110.5 | D63 L64 L68 K69 L70 | D63-K66 WeakPolarHBondContact O-CB 3.45Å; D63-K66 PolarHBondContact O-N 3.22Å; D63-K66 VanDerWaalsContact O-N 3.09Å; L64-K66 VanDerWaalsContact C-N 3.27Å; L64-K66 PolarHBondContact O-N 3.48Å; K66-L68 PolarHBondContact O-N 2.99Å; K66-K69 PolarHBondContact O-N 3.27Å; K66-L70 HydrophobicContact CG-CD1 3.96Å; K66-L70 VanDerWaalsContact O-CD1 3.27Å; K66-L70 WeakPolarHBondContact O-CD1 3.48Å; K66-L70 PolarHBondContact O-N 2.96Å |
| 67 | C | 90.5 | Very high | 91.6 | Very high | 3 Ų | 3 | 84.7 Ų | 84.7 | 2% | 0.02 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -55.6 | -51.3 | 174 | -170.2 | 0 | 0 | 0 | 0 | 111.9 | L58 D63 L64 K69 L70 I71 H200 | L58-C67 HydrophobicContact CD1-CB 3.94Å; D63-C67 PolarHBondContact O-N 3.39Å; L64-C67 VanDerWaalsContact O-CB 3.29Å; L64-C67 WeakPolarHBondContact O-CB 3.31Å; L64-C67 PolarHBondContact O-N 3.35Å; C67-K69 PolarHBondContact O-N 2.99Å; C67-L70 PolarHBondContact O-N 3.28Å; C67-I71 WeakPolarHBondContact O-CG1 3.34Å; C67-I71 PolarHBondContact O-N 3.46Å; C67-H200 VanDerWaalsContact CA-CD2 3.42Å; C67-H200 WeakPolarHBondContact CA-CD2 3.3Å; C67-H200 VanDerWaalsContact CA-NE2 3.26Å; C67-H200 WeakPolarHBondContact CA-NE2 3.33Å; C67-H200 VanDerWaalsContact CB-CD2 3.45Å; C67-H200 WeakPolarHBondContact CB-CD2 3.36Å; C67-H200 VanDerWaalsContact CB-NE2 3.29Å; C67-H200 WeakPolarHBondContact CB-NE2 3.49Å; C67-H200 PolarHBondContact N-NE2 2.99Å; C67-H200 PolarHBondContact SG-CD2 3.07Å |
| 68 | L | 90.2 | Very high | 91.3 | Very high | 100 Ų | 100 | 83.8 Ų | 83.8 | 52% | 0.524 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.4 | -43.6 | -178.7 | -173.4 | 63 | 0 | 0 | 0 | 111.9 | L64 K66 L70 I71 Q72 | L64-L68 PolarHBondContact O-N 3.39Å; K66-L68 PolarHBondContact O-N 2.99Å; L68-L70 PolarHBondContact O-N 2.92Å; L68-I71 PolarHBondContact O-N 3.3Å; L68-Q72 WeakPolarHBondContact O-CG 3.33Å; L68-Q72 PolarHBondContact O-N 3.17Å |
| 69 | K | 90 | Very high | 91.2 | Very high | 147 Ų | 147 | 88.9 Ų | 88.9 | 64% | 0.639 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61.6 | -41 | 175 | -73.4 | -178.9 | -179.4 | -173.1 | 0 | 112.5 | K65 K66 C67 Q72 H73 | K65-K69 WeakPolarHBondContact O-CG 3.44Å; K65-K69 PolarHBondContact O-N 3.45Å; K65-K69 VanDerWaalsContact O-N 3.11Å; K66-K69 PolarHBondContact O-N 3.27Å; C67-K69 PolarHBondContact O-N 2.99Å; K69-Q72 PolarHBondContact O-N 3.3Å; K69-H73 WeakPolarHBondContact O-CB 3.47Å; K69-H73 PolarHBondContact O-N 2.79Å |
| 70 | L | 87.7 | Confident | 91.2 | Very high | 58 Ų | 58 | 89.8 Ų | 89.8 | 30% | 0.304 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.4 | -36.3 | 178.4 | -98.5 | 69.9 | 0 | 0 | 0 | 112.6 | K66 C67 L68 N74 K196 | K66-L70 HydrophobicContact CG-CD1 3.96Å; K66-L70 VanDerWaalsContact O-CD1 3.27Å; K66-L70 WeakPolarHBondContact O-CD1 3.48Å; K66-L70 PolarHBondContact O-N 2.96Å; C67-L70 PolarHBondContact O-N 3.28Å; L68-L70 PolarHBondContact O-N 2.92Å; L70-N74 PolarHBondContact O-N 3.48Å; L70-N74 VanDerWaalsContact O-N 3.17Å; L70-K196 HydrophobicContact CD2-CG 4.1Å |
| 71 | I | 87.8 | Confident | 91.2 | Very high | 51 Ų | 51 | 82.9 Ų | 82.9 | 26% | 0.262 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64 | -45 | 174.4 | -72 | 168.3 | 0 | 0 | 0 | 110.1 | C67 L68 V78 | C67-I71 WeakPolarHBondContact O-CG1 3.34Å; C67-I71 PolarHBondContact O-N 3.46Å; L68-I71 PolarHBondContact O-N 3.3Å; I71-V78 HydrophobicContact CB-CG2 4.4Å; I71-V78 HydrophobicContact CG1-CG2 4.25Å; I71-V78 HydrophobicContact CG2-CG2 4.18Å |
| 72 | Q | 87.4 | Confident | 91.2 | Very high | 139 Ų | 139 | 80.8 Ų | 80.8 | 65% | 0.65 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -65.5 | -37.7 | 178.1 | -72.5 | 175.5 | -21.7 | 0 | 0 | 112.8 | L68 K69 | L68-Q72 WeakPolarHBondContact O-CG 3.33Å; L68-Q72 PolarHBondContact O-N 3.17Å; K69-Q72 PolarHBondContact O-N 3.3Å |
| 73 | H | 88.2 | Confident | 91.4 | Very high | 150 Ų | 150 | 81.2 Ų | 81.2 | 69% | 0.694 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -73.5 | -36.8 | -177.3 | -170.3 | -73 | 0 | 0 | 0 | 112.9 | K69 P75 | K69-H73 WeakPolarHBondContact O-CB 3.47Å; K69-H73 PolarHBondContact O-N 2.79Å; H73-P75 VanDerWaalsContact C-CD 3.46Å; H73-P75 WeakPolarHBondContact O-CD 3.19Å |
| 74 | N | 87.8 | Confident | 91.6 | Very high | 79 Ų | 79 | 78.5 Ų | 78.5 | 42% | 0.422 | 39% | 0.387 | S | S | . | . | trans | -125.5 | 66.1 | -174.5 | -71.2 | -12.5 | 0 | 0 | 0 | 112 | L70 L76 D77 V78 | L70-N74 PolarHBondContact O-N 3.48Å; L70-N74 VanDerWaalsContact O-N 3.17Å; N74-L76 PolarHBondContact O-N 2.74Å; N74-D77 HydrophobicContact CB-CB 4.16Å; N74-D77 PolarHBondContact O-N 3Å; N74-V78 PolarHBondContact O-N 2.85Å | ||
| 75 | P | 90.5 | Very high | 91.8 | Very high | 79 Ų | 79 | 75.9 Ų | 75.9 | 51% | 0.513 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.3 | -29.6 | -177.8 | 26.8 | -35.3 | 0 | 0 | 0 | 112.6 | H73 D77 V78 L79 | H73-P75 VanDerWaalsContact C-CD 3.46Å; H73-P75 WeakPolarHBondContact O-CD 3.19Å; P75-D77 VanDerWaalsContact C-N 3.33Å; P75-D77 PolarHBondContact O-N 3.06Å; P75-V78 WeakPolarHBondContact O-CB 3.23Å; P75-V78 PolarHBondContact O-N 3.49Å; P75-L79 PolarHBondContact O-N 3.27Å |
| 76 | L | 91.8 | Very high | 92 | Very high | 127 Ų | 127 | 71.2 Ų | 71.2 | 67% | 0.665 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -63.4 | -39.6 | 177 | -65.1 | 179.3 | 0 | 0 | 0 | 112.2 | N74 V78 L79 M80 | N74-L76 PolarHBondContact O-N 2.74Å; L76-V78 VanDerWaalsContact C-N 3.27Å; L76-V78 PolarHBondContact O-N 2.92Å; L76-L79 PolarHBondContact O-N 3.31Å; L76-M80 WeakPolarHBondContact O-CG 3.47Å; L76-M80 PolarHBondContact O-N 3.49Å |
| 77 | D | 90.8 | Very high | 92.4 | Very high | 37 Ų | 37 | 66.5 Ų | 66.5 | 20% | 0.198 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -69.8 | -28.2 | 177.7 | 178.1 | 64 | 0 | 0 | 0 | 111.8 | N74 P75 K196 R201 | N74-D77 HydrophobicContact CB-CB 4.16Å; N74-D77 PolarHBondContact O-N 3Å; P75-D77 VanDerWaalsContact C-N 3.33Å; P75-D77 PolarHBondContact O-N 3.06Å; D77-K196 VanDerWaalsContact OD2-CE 3.23Å; D77-K196 WeakPolarHBondContact OD2-CE 3.47Å; D77-K196 IonicContact OD2-NZ 2.72Å; D77-K196 PolarHBondContact OD2-NZ 3.33Å; D77-R201 VanDerWaalsContact CG-NH1 3.29Å; D77-R201 VanDerWaalsContact CG-NH2 3.29Å; D77-R201 IonicContact OD1-CZ 3.51Å; D77-R201 IonicContact OD1-NH1 3.36Å; D77-R201 PolarHBondContact OD1-NH1 2.84Å; D77-R201 IonicContact OD1-NH2 2.75Å; D77-R201 PolarHBondContact OD1-NH2 3.05Å; D77-R201 IonicContact OD2-CZ 3.21Å; D77-R201 IonicContact OD2-NH1 2.71Å; D77-R201 PolarHBondContact OD2-NH1 3.19Å; D77-R201 IonicContact OD2-NH2 3.04Å; D77-R201 PolarHBondContact OD2-NH2 3.26Å |
| 78 | V | 92 | Very high | 92.6 | Very high | 19 Ų | 19 | 69.8 Ų | 69.8 | 12% | 0.115 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -72.3 | -43.9 | 169.7 | -178.4 | 0 | 0 | 0 | 0 | 110.2 | I71 N74 P75 L76 M80 T81 E204 | I71-V78 HydrophobicContact CB-CG2 4.4Å; I71-V78 HydrophobicContact CG1-CG2 4.25Å; I71-V78 HydrophobicContact CG2-CG2 4.18Å; N74-V78 PolarHBondContact O-N 2.85Å; P75-V78 WeakPolarHBondContact O-CB 3.23Å; P75-V78 PolarHBondContact O-N 3.49Å; L76-V78 VanDerWaalsContact C-N 3.27Å; L76-V78 PolarHBondContact O-N 2.92Å; V78-M80 PolarHBondContact O-N 3.12Å; V78-T81 WeakPolarHBondContact O-CB 3.45Å; V78-T81 PolarHBondContact O-N 3.49Å; V78-T81 PolarHBondContact O-OG1 3.45Å; V78-E204 HydrophobicContact CG1-CG 4.31Å; V78-E204 HydrophobicContact CG2-CG 4.34Å |
| 79 | L | 94.3 | Very high | 92.8 | Very high | 108 Ų | 108 | 66.8 Ų | 66.8 | 57% | 0.565 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -60.3 | -33.1 | 177.7 | -173.8 | 63.4 | 0 | 0 | 0 | 111.9 | P75 L76 T81 F82 | P75-L79 PolarHBondContact O-N 3.27Å; L76-L79 PolarHBondContact O-N 3.31Å; L79-T81 PolarHBondContact O-N 2.96Å; L79-F82 HydrophobicContact CD1-CD2 4.43Å; L79-F82 WeakPolarHBondContact O-CB 3.48Å; L79-F82 PolarHBondContact O-N 2.97Å |
| 80 | M | 95.4 | Very high | 93.2 | Very high | 86 Ų | 86 | 63.9 Ų | 63.9 | 42% | 0.424 | 33% | 0.327 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -24.7 | 173.8 | -69.7 | 178.9 | -178.1 | 0 | 0 | 113.2 | L76 V78 F82 I83 P84 F186 L190 | L76-M80 WeakPolarHBondContact O-CG 3.47Å; L76-M80 PolarHBondContact O-N 3.49Å; V78-M80 PolarHBondContact O-N 3.12Å; M80-F82 PolarHBondContact O-N 2.88Å; M80-I83 HydrophobicContact CB-CD1 4.4Å; M80-I83 HydrophobicContact CG-CD1 4.42Å; M80-I83 WeakPolarHBondContact O-CB 3.47Å; M80-I83 PolarHBondContact O-N 3.4Å; M80-P84 VanDerWaalsContact O-CD 3.29Å; M80-P84 WeakPolarHBondContact O-CD 3.15Å; M80-F186 HydrophobicContact CB-CE1 4.46Å; M80-F186 HydrophobicContact CB-CZ 4.49Å; M80-F186 WeakPolarHBondContact O-CE1 3.41Å; M80-L190 HydrophobicContact CB-CD2 3.85Å |
| 81 | T | 94.5 | Very high | 93.6 | Very high | 1 Ų | 1 | 61.3 Ų | 61.3 | 1% | 0.006 | 31% | 0.313 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -17.2 | 176 | 72.6 | 0 | 0 | 0 | 0 | 113.2 | V78 L79 I83 P84 L190 E204 L205 | V78-T81 WeakPolarHBondContact O-CB 3.45Å; V78-T81 PolarHBondContact O-N 3.49Å; V78-T81 PolarHBondContact O-OG1 3.45Å; L79-T81 PolarHBondContact O-N 2.96Å; T81-I83 VanDerWaalsContact C-N 3.34Å; T81-P84 VanDerWaalsContact O-CD 3.31Å; T81-P84 WeakPolarHBondContact O-CD 3.39Å; T81-P84 WeakPolarHBondContact O-CG 3.35Å; T81-L190 HydrophobicContact CG2-CD1 4.31Å; T81-E204 HydrophobicContact CG2-CB 3.85Å; T81-E204 PolarHBondContact OG1-O 2.86Å; T81-L205 HydrophobicContact CG2-CD2 4.49Å |
| 82 | F | 96.8 | Very high | 93.9 | Very high | 34 Ų | 34 | 62.6 Ų | 62.6 | 15% | 0.149 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -73 | -27.8 | 172.7 | -75.4 | -105.2 | 0 | 0 | 0 | 112.5 | L79 M80 A85 I86 F207 A208 V211 I212 | L79-F82 HydrophobicContact CD1-CD2 4.43Å; L79-F82 WeakPolarHBondContact O-CB 3.48Å; L79-F82 PolarHBondContact O-N 2.97Å; M80-F82 PolarHBondContact O-N 2.88Å; F82-A85 WeakPolarHBondContact O-CB 3.35Å; F82-A85 PolarHBondContact O-N 2.81Å; F82-I86 HydrophobicContact CB-CD1 4.36Å; F82-I86 VanDerWaalsContact O-CG1 3.31Å; F82-I86 WeakPolarHBondContact O-CG1 3.35Å; F82-I86 PolarHBondContact O-N 2.99Å; F82-F207 HydrophobicContact CE2-CD1 4.32Å; F82-F207 HydrophobicContact CE2-CE1 4.45Å; F82-F207 AromaticContact CZ-CD1 3.97Å; F82-F207 HydrophobicContact CZ-CD1 3.97Å; F82-F207 AromaticContact CZ-CE1 3.88Å; F82-F207 HydrophobicContact CZ-CE1 3.88Å; F82-A208 HydrophobicContact CB-CB 4.49Å; F82-A208 HydrophobicContact CD1-CB 3.95Å; F82-A208 HydrophobicContact CD2-CB 3.77Å; F82-A208 HydrophobicContact CE1-CB 4.06Å; F82-A208 HydrophobicContact CE2-CB 3.87Å; F82-A208 HydrophobicContact CG-CB 3.81Å; F82-A208 HydrophobicContact CZ-CB 4.02Å; F82-V211 HydrophobicContact CE1-CB 3.93Å; F82-V211 HydrophobicContact CE1-CG1 3.8Å; F82-V211 HydrophobicContact CZ-CB 4.38Å; F82-V211 HydrophobicContact CZ-CG1 4.41Å; F82-I212 HydrophobicContact CD1-CD1 4.07Å; F82-I212 HydrophobicContact CD1-CG1 3.92Å; F82-I212 HydrophobicContact CE1-CG1 4.39Å |
| 83 | I | 97 | Very high | 94.2 | Very high | 69 Ų | 69 | 60.1 Ų | 60.1 | 35% | 0.354 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -55.1 | -56.2 | 180 | -62.3 | 171.2 | 0 | 0 | 0 | 111.7 | M80 T81 A85 I86 I87 F186 | M80-I83 HydrophobicContact CB-CD1 4.4Å; M80-I83 HydrophobicContact CG-CD1 4.42Å; M80-I83 WeakPolarHBondContact O-CB 3.47Å; M80-I83 PolarHBondContact O-N 3.4Å; T81-I83 VanDerWaalsContact C-N 3.34Å; I83-A85 VanDerWaalsContact C-N 3.3Å; I83-A85 PolarHBondContact O-N 3.41Å; I83-I86 PolarHBondContact O-N 3.39Å; I83-I87 HydrophobicContact CG2-CD1 3.74Å; I83-I87 HydrophobicContact CG2-CG1 4.48Å; I83-I87 VanDerWaalsContact O-CG1 3.26Å; I83-I87 WeakPolarHBondContact O-CG1 3.41Å; I83-I87 PolarHBondContact O-N 3.11Å; I83-F186 HydrophobicContact CB-CD1 4.45Å; I83-F186 HydrophobicContact CB-CE1 3.97Å; I83-F186 HydrophobicContact CB-CZ 4.26Å; I83-F186 HydrophobicContact CD1-CE1 4.12Å; I83-F186 HydrophobicContact CD1-CE2 4.41Å; I83-F186 HydrophobicContact CD1-CZ 3.66Å; I83-F186 HydrophobicContact CG2-CD1 4.34Å; I83-F186 HydrophobicContact CG2-CE1 4.15Å; I83-F186 HydrophobicContact CG2-CE2 4.46Å; I83-F186 HydrophobicContact CG2-CZ 4.23Å |
| 84 | P | 96.2 | Very high | 94.6 | Very high | 3 Ų | 3 | 54.8 Ų | 54.8 | 2% | 0.019 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.3 | -35.3 | 178 | 24.8 | -34.1 | 0 | 0 | 0 | 112.5 | M80 T81 I87 Y88 F186 L190 L205 | M80-P84 VanDerWaalsContact O-CD 3.29Å; M80-P84 WeakPolarHBondContact O-CD 3.15Å; T81-P84 VanDerWaalsContact O-CD 3.31Å; T81-P84 WeakPolarHBondContact O-CD 3.39Å; T81-P84 WeakPolarHBondContact O-CG 3.35Å; P84-I87 PolarHBondContact O-N 2.95Å; P84-Y88 HydrophobicContact CB-CD2 4.44Å; P84-Y88 HydrophobicContact CB-CE2 4.31Å; P84-Y88 WeakPolarHBondContact O-CB 3.39Å; P84-Y88 WeakPolarHBondContact O-CD2 3.42Å; P84-Y88 PolarHBondContact O-N 2.99Å; P84-F186 HydrophobicContact CG-CD1 4.32Å; P84-L190 HydrophobicContact CG-CD1 3.94Å; P84-L205 HydrophobicContact CG-CD2 4.33Å |
| 85 | A | 95.8 | Very high | 94.9 | Very high | 10 Ų | 10 | 52.1 Ų | 52.1 | 8% | 0.083 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62 | -45.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F82 I83 Y88 V89 A208 I212 | F82-A85 WeakPolarHBondContact O-CB 3.35Å; F82-A85 PolarHBondContact O-N 2.81Å; I83-A85 VanDerWaalsContact C-N 3.3Å; I83-A85 PolarHBondContact O-N 3.41Å; A85-Y88 PolarHBondContact O-N 3.35Å; A85-V89 PolarHBondContact O-N 2.86Å; A85-A208 HydrophobicContact CB-CB 4.29Å; A85-I212 HydrophobicContact CB-CG1 4.46Å |
| 86 | I | 97.9 | Very high | 94.9 | Very high | 74 Ų | 74 | 53.2 Ų | 53.2 | 38% | 0.379 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.3 | -45.5 | 176 | -66.8 | 165.5 | 0 | 0 | 0 | 110.5 | F82 I83 Y88 V89 I90 I212 | F82-I86 HydrophobicContact CB-CD1 4.36Å; F82-I86 VanDerWaalsContact O-CG1 3.31Å; F82-I86 WeakPolarHBondContact O-CG1 3.35Å; F82-I86 PolarHBondContact O-N 2.99Å; I83-I86 PolarHBondContact O-N 3.39Å; I86-Y88 VanDerWaalsContact C-N 3.33Å; I86-Y88 PolarHBondContact O-N 3.23Å; I86-V89 PolarHBondContact O-N 3.43Å; I86-I90 HydrophobicContact CG2-CD1 3.9Å; I86-I90 WeakPolarHBondContact O-CG1 2.94Å; I86-I90 PolarHBondContact O-N 2.96Å; I86-I212 HydrophobicContact CD1-CD1 4.38Å; I86-I212 HydrophobicContact CG1-CD1 3.92Å; I86-I212 HydrophobicContact CG1-CG1 4.13Å |
| 87 | I | 98.2 | Very high | 95 | Very high | 22 Ų | 22 | 49.7 Ų | 49.7 | 11% | 0.113 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.7 | -43.9 | 178.3 | -64.7 | 167.4 | 0 | 0 | 0 | 110.7 | I83 P84 V89 I90 Q91 L179 L182 A183 | I83-I87 HydrophobicContact CG2-CD1 3.74Å; I83-I87 HydrophobicContact CG2-CG1 4.48Å; I83-I87 VanDerWaalsContact O-CG1 3.26Å; I83-I87 WeakPolarHBondContact O-CG1 3.41Å; I83-I87 PolarHBondContact O-N 3.11Å; P84-I87 PolarHBondContact O-N 2.95Å; I87-V89 VanDerWaalsContact C-N 3.32Å; I87-V89 PolarHBondContact O-N 3.14Å; I87-I90 PolarHBondContact O-N 3.08Å; I87-Q91 WeakPolarHBondContact O-CB 3.08Å; I87-Q91 PolarHBondContact O-N 3.07Å; I87-L179 HydrophobicContact CG2-CB 3.73Å; I87-L179 HydrophobicContact CG2-CD2 4.07Å; I87-L179 HydrophobicContact CG2-CG 4.35Å; I87-L179 WeakPolarHBondContact CG2-O 3.43Å; I87-L182 HydrophobicContact CD1-CD2 4.09Å; I87-L182 HydrophobicContact CD1-CG 4.27Å; I87-A183 HydrophobicContact CB-CB 4.06Å; I87-A183 HydrophobicContact CG2-CB 3.7Å |
| 88 | Y | 95.4 | Very high | 95.1 | Very high | 73 Ų | 73 | 47.9 Ų | 47.9 | 29% | 0.286 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.5 | -35.5 | 177.7 | -79.5 | -55.8 | 0 | 0 | 0 | 112.6 | P84 A85 I86 N92 A183 C184 | P84-Y88 HydrophobicContact CB-CD2 4.44Å; P84-Y88 HydrophobicContact CB-CE2 4.31Å; P84-Y88 WeakPolarHBondContact O-CB 3.39Å; P84-Y88 WeakPolarHBondContact O-CD2 3.42Å; P84-Y88 PolarHBondContact O-N 2.99Å; A85-Y88 PolarHBondContact O-N 3.35Å; I86-Y88 VanDerWaalsContact C-N 3.33Å; I86-Y88 PolarHBondContact O-N 3.23Å; Y88-N92 VanDerWaalsContact O-CB 3.31Å; Y88-N92 WeakPolarHBondContact O-CB 3.47Å; Y88-N92 PolarHBondContact O-N 2.84Å; Y88-N92 PolarHBondContact O-ND2 3.41Å; Y88-A183 HydrophobicContact CD1-CB 4.13Å; Y88-A183 HydrophobicContact CD2-CB 4.16Å; Y88-A183 HydrophobicContact CE1-CB 3.75Å; Y88-A183 HydrophobicContact CE2-CB 3.79Å; Y88-A183 HydrophobicContact CG-CB 4.3Å; Y88-C184 PolarHBondContact OH-N 2.99Å; Y88-C184 PolarHBondContact OH-SG 3Å |
| 89 | V | 94.4 | Very high | 95 | Very high | 36 Ų | 36 | 51.8 Ų | 51.8 | 22% | 0.218 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -65.5 | -49.3 | 174.2 | 165.8 | 0 | 0 | 0 | 0 | 111.5 | A85 I86 I87 Q91 N92 R93 I212 V216 | A85-V89 PolarHBondContact O-N 2.86Å; I86-V89 PolarHBondContact O-N 3.43Å; I87-V89 VanDerWaalsContact C-N 3.32Å; I87-V89 PolarHBondContact O-N 3.14Å; V89-Q91 VanDerWaalsContact C-N 3.31Å; V89-Q91 PolarHBondContact O-N 2.91Å; V89-N92 PolarHBondContact O-N 3.35Å; V89-R93 WeakPolarHBondContact O-CG 3.41Å; V89-R93 PolarHBondContact O-N 2.94Å; V89-I212 HydrophobicContact CB-CG2 4.43Å; V89-I212 HydrophobicContact CG2-CG2 3.73Å; V89-V216 HydrophobicContact CG1-CB 4.48Å; V89-V216 HydrophobicContact CG1-CG1 3.98Å; V89-V216 HydrophobicContact CG1-CG2 3.64Å; V89-V216 HydrophobicContact CG2-CG2 4.26Å |
| 90 | I | 96.7 | Very high | 94.8 | Very high | 86 Ų | 86 | 49.7 Ų | 49.7 | 44% | 0.441 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.5 | -46.2 | 178.3 | -64.2 | 168.7 | 0 | 0 | 0 | 109.8 | I86 I87 N92 R93 L94 L179 | I86-I90 HydrophobicContact CG2-CD1 3.9Å; I86-I90 WeakPolarHBondContact O-CG1 2.94Å; I86-I90 PolarHBondContact O-N 2.96Å; I87-I90 PolarHBondContact O-N 3.08Å; I90-N92 VanDerWaalsContact C-N 3.35Å; I90-N92 PolarHBondContact O-N 3.13Å; I90-R93 PolarHBondContact O-N 3.36Å; I90-L94 HydrophobicContact CG2-CD1 4.37Å; I90-L94 WeakPolarHBondContact O-CG 3.33Å; I90-L94 PolarHBondContact O-N 3.38Å; I90-L179 HydrophobicContact CB-CD1 4.35Å; I90-L179 HydrophobicContact CG2-CD1 3.72Å |
| 91 | Q | 97.1 | Very high | 94.6 | Very high | 4 Ų | 4 | 46.3 Ų | 46.3 | 2% | 0.019 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -54.2 | -50 | 174.8 | 177.5 | -165.9 | -19 | 0 | 0 | 111.3 | I87 V89 R93 L94 L95 Y111 A176 L179 S180 | I87-Q91 WeakPolarHBondContact O-CB 3.08Å; I87-Q91 PolarHBondContact O-N 3.07Å; V89-Q91 VanDerWaalsContact C-N 3.31Å; V89-Q91 PolarHBondContact O-N 2.91Å; Q91-R93 VanDerWaalsContact C-N 3.29Å; Q91-R93 PolarHBondContact O-N 3.14Å; Q91-L94 WeakPolarHBondContact O-CB 3.39Å; Q91-L94 PolarHBondContact O-N 3.36Å; Q91-L95 HydrophobicContact CG-CD1 4.38Å; Q91-L95 WeakPolarHBondContact O-CG 3.43Å; Q91-L95 PolarHBondContact O-N 2.97Å; Q91-Y111 PolarHBondContact NE2-OH 3.4Å; Q91-A176 HydrophobicContact CG-CB 4.14Å; Q91-A176 WeakPolarHBondContact CG-O 3.35Å; Q91-L179 HydrophobicContact CB-CB 4.19Å; Q91-S180 VanDerWaalsContact CD-CB 3.49Å; Q91-S180 PolarHBondContact NE2-OG 2.86Å; Q91-S180 VanDerWaalsContact OE1-CA 3.23Å |
| 92 | N | 93.9 | Very high | 94.3 | Very high | 79 Ų | 79 | 46.7 Ų | 46.7 | 42% | 0.422 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.5 | -34.9 | -178.7 | -74.8 | -20.6 | 0 | 0 | 0 | 112.3 | Y88 V89 I90 L95 I96 | Y88-N92 VanDerWaalsContact O-CB 3.31Å; Y88-N92 WeakPolarHBondContact O-CB 3.47Å; Y88-N92 PolarHBondContact O-N 2.84Å; Y88-N92 PolarHBondContact O-ND2 3.41Å; V89-N92 PolarHBondContact O-N 3.35Å; I90-N92 VanDerWaalsContact C-N 3.35Å; I90-N92 PolarHBondContact O-N 3.13Å; N92-L95 PolarHBondContact O-N 3.02Å; N92-I96 WeakPolarHBondContact O-CG1 3.39Å; N92-I96 PolarHBondContact O-N 3.24Å; N92-I96 VanDerWaalsContact O-N 3.13Å |
| 93 | R | 93.2 | Very high | 93.8 | Very high | 86 Ų | 86 | 47.9 Ų | 47.9 | 33% | 0.325 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -65.8 | -43.5 | 173.5 | -66.4 | -65.9 | 178.7 | -114 | 7.5 | 111.8 | V89 I90 Q91 L95 I96 T97 V216 T220 | V89-R93 WeakPolarHBondContact O-CG 3.41Å; V89-R93 PolarHBondContact O-N 2.94Å; I90-R93 PolarHBondContact O-N 3.36Å; Q91-R93 VanDerWaalsContact C-N 3.29Å; Q91-R93 PolarHBondContact O-N 3.14Å; R93-L95 VanDerWaalsContact C-N 3.28Å; R93-L95 PolarHBondContact O-N 3.1Å; R93-I96 PolarHBondContact O-N 3.16Å; R93-T97 PolarHBondContact O-N 2.63Å; R93-T97 VanDerWaalsContact O-N 3.1Å; R93-T97 PolarHBondContact O-OG1 2.94Å; R93-V216 PolarHBondContact NH2-O 2.67Å; R93-T220 PolarHBondContact NH2-OG1 3.01Å |
| 94 | L | 96.5 | Very high | 93.2 | Very high | 38 Ų | 38 | 47.1 Ų | 47.1 | 20% | 0.199 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.5 | -36.1 | 173.7 | -67.3 | 174.9 | 0 | 0 | 0 | 112.4 | I90 Q91 T97 A98 C172 C175 A176 L179 | I90-L94 HydrophobicContact CG2-CD1 4.37Å; I90-L94 WeakPolarHBondContact O-CG 3.33Å; I90-L94 PolarHBondContact O-N 3.38Å; Q91-L94 WeakPolarHBondContact O-CB 3.39Å; Q91-L94 PolarHBondContact O-N 3.36Å; L94-T97 PolarHBondContact O-N 3.19Å; L94-A98 VanDerWaalsContact O-CB 3.28Å; L94-A98 WeakPolarHBondContact O-CB 3.3Å; L94-A98 PolarHBondContact O-N 3.44Å; L94-C172 HydrophobicContact CB-CB 4.43Å; L94-C172 HydrophobicContact CD2-CB 4.33Å; L94-C175 HydrophobicContact CD1-CB 3.78Å; L94-A176 HydrophobicContact CB-CB 3.93Å; L94-L179 HydrophobicContact CD1-CD1 3.85Å |
| 95 | L | 94.9 | Very high | 92.7 | Very high | 24 Ų | 24 | 49.7 Ų | 49.7 | 13% | 0.126 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.5 | -40.7 | 176.4 | -69.1 | 175.1 | 0 | 0 | 0 | 112.6 | Q91 N92 R93 A98 L99 F107 Y111 A176 | Q91-L95 HydrophobicContact CG-CD1 4.38Å; Q91-L95 WeakPolarHBondContact O-CG 3.43Å; Q91-L95 PolarHBondContact O-N 2.97Å; N92-L95 PolarHBondContact O-N 3.02Å; R93-L95 VanDerWaalsContact C-N 3.28Å; R93-L95 PolarHBondContact O-N 3.1Å; L95-A98 PolarHBondContact O-N 2.93Å; L95-L99 WeakPolarHBondContact O-CB 3.35Å; L95-L99 PolarHBondContact O-N 3.47Å; L95-F107 HydrophobicContact CD2-CE2 3.82Å; L95-F107 HydrophobicContact CD2-CZ 3.89Å; L95-Y111 HydrophobicContact CD1-CE1 4.2Å; L95-Y111 HydrophobicContact CD1-CE2 4.11Å; L95-Y111 HydrophobicContact CD2-CD1 4.17Å; L95-Y111 HydrophobicContact CD2-CD2 3.5Å; L95-Y111 VanDerWaalsContact CD2-CD2 3.5Å; L95-Y111 HydrophobicContact CD2-CE1 4.13Å; L95-Y111 HydrophobicContact CD2-CE2 3.51Å; L95-Y111 HydrophobicContact CD2-CG 3.86Å; L95-Y111 HydrophobicContact CG-CE2 4.34Å; L95-A176 HydrophobicContact CD2-CB 3.59Å; L95-A176 HydrophobicContact CG-CB 3.92Å |
| 96 | I | 91.1 | Very high | 92.3 | Very high | 102 Ų | 102 | 51.9 Ų | 51.9 | 52% | 0.523 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 175.8 | -65.9 | 164.8 | 0 | 0 | 0 | 109.8 | N92 R93 A98 L99 S100 | N92-I96 WeakPolarHBondContact O-CG1 3.39Å; N92-I96 PolarHBondContact O-N 3.24Å; N92-I96 VanDerWaalsContact O-N 3.13Å; R93-I96 PolarHBondContact O-N 3.16Å; I96-A98 VanDerWaalsContact C-N 3.33Å; I96-A98 PolarHBondContact O-N 2.87Å; I96-L99 PolarHBondContact O-N 3.18Å; I96-S100 PolarHBondContact O-N 3.29Å; I96-S100 PolarHBondContact O-OG 3.47Å |
| 97 | T | 92.1 | Very high | 92 | Very high | 52 Ų | 52 | 49.6 Ų | 49.6 | 32% | 0.319 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -63.3 | -37.4 | 176.3 | -54.3 | 0 | 0 | 0 | 0 | 112.3 | R93 L94 S100 N101 | R93-T97 PolarHBondContact O-N 2.63Å; R93-T97 VanDerWaalsContact O-N 3.1Å; R93-T97 PolarHBondContact O-OG1 2.94Å; L94-T97 PolarHBondContact O-N 3.19Å; T97-S100 PolarHBondContact O-N 3.05Å; T97-S100 PolarHBondContact O-OG 3.33Å; T97-N101 WeakPolarHBondContact O-CB 3.39Å; T97-N101 PolarHBondContact O-N 3.11Å; T97-N101 PolarHBondContact O-ND2 3.44Å |
| 98 | A | 93.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.7 | -45.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L94 L95 I96 S100 N101 L102 F107 G169 C172 A173 | L94-A98 VanDerWaalsContact O-CB 3.28Å; L94-A98 WeakPolarHBondContact O-CB 3.3Å; L94-A98 PolarHBondContact O-N 3.44Å; L95-A98 PolarHBondContact O-N 2.93Å; I96-A98 VanDerWaalsContact C-N 3.33Å; I96-A98 PolarHBondContact O-N 2.87Å; A98-S100 VanDerWaalsContact C-N 3.29Å; A98-S100 PolarHBondContact O-N 3.25Å; A98-N101 PolarHBondContact O-N 2.8Å; A98-N101 VanDerWaalsContact O-N 3.13Å; A98-L102 WeakPolarHBondContact O-CB 3.39Å; A98-L102 PolarHBondContact O-N 3.4Å; A98-F107 HydrophobicContact CB-CD2 3.75Å; A98-F107 HydrophobicContact CB-CE2 3.85Å; A98-G169 WeakPolarHBondContact CB-O 3.42Å; A98-C172 HydrophobicContact CB-CB 3.91Å; A98-A173 HydrophobicContact CB-CB 4Å |
| 99 | L | 89.6 | Confident | 91.2 | Very high | 101 Ų | 101 | 48.9 Ų | 48.9 | 53% | 0.529 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.2 | -31.9 | 178.7 | -172.2 | 65.6 | 0 | 0 | 0 | 112.4 | L95 I96 N101 F107 | L95-L99 WeakPolarHBondContact O-CB 3.35Å; L95-L99 PolarHBondContact O-N 3.47Å; I96-L99 PolarHBondContact O-N 3.18Å; L99-N101 VanDerWaalsContact C-N 3.26Å; L99-N101 PolarHBondContact O-N 2.89Å; L99-F107 HydrophobicContact CB-CD2 4.45Å; L99-F107 HydrophobicContact CB-CE2 4.39Å; L99-F107 HydrophobicContact CD1-CD1 4.05Å; L99-F107 HydrophobicContact CD1-CE1 4.36Å; L99-F107 HydrophobicContact CD1-CG 4.2Å |
| 100 | S | 90.3 | Very high | 91.1 | Very high | 63 Ų | 63 | 47.6 Ų | 47.6 | 44% | 0.441 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -75.3 | -13.8 | 176.1 | 69.3 | 0 | 0 | 0 | 0 | 113.9 | I96 T97 A98 | I96-S100 PolarHBondContact O-N 3.29Å; I96-S100 PolarHBondContact O-OG 3.47Å; T97-S100 PolarHBondContact O-N 3.05Å; T97-S100 PolarHBondContact O-OG 3.33Å; A98-S100 VanDerWaalsContact C-N 3.29Å; A98-S100 PolarHBondContact O-N 3.25Å |
| 101 | N | 91.1 | Very high | 91 | Very high | 15 Ų | 15 | 45 Ų | 45 | 8% | 0.08 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -119.3 | -4.7 | -174.1 | -76.2 | -86.8 | 0 | 0 | 0 | 114 | T97 A98 L99 A163 N165 | T97-N101 WeakPolarHBondContact O-CB 3.39Å; T97-N101 PolarHBondContact O-N 3.11Å; T97-N101 PolarHBondContact O-ND2 3.44Å; A98-N101 PolarHBondContact O-N 2.8Å; A98-N101 VanDerWaalsContact O-N 3.13Å; L99-N101 VanDerWaalsContact C-N 3.26Å; L99-N101 PolarHBondContact O-N 2.89Å; N101-A163 PolarHBondContact OD1-O 2.91Å; N101-N165 PolarHBondContact OD1-N 2.91Å |
| 102 | L | 89 | Confident | 90.8 | Very high | 9 Ų | 9 | 45.1 Ų | 45.1 | 5% | 0.047 | 25% | 0.25 | C | C | . | . | S | Bend | trans | -130.6 | 156.1 | -179 | -69 | 177.6 | 0 | 0 | 0 | 110.9 | A98 T106 F107 P166 G169 A173 | A98-L102 WeakPolarHBondContact O-CB 3.39Å; A98-L102 PolarHBondContact O-N 3.4Å; L102-T106 HydrophobicContact CD1-CG2 4.25Å; L102-T106 HydrophobicContact CD2-CG2 3.86Å; L102-F107 HydrophobicContact CB-CB 4.02Å; L102-F107 HydrophobicContact CD1-CB 4.26Å; L102-P166 HydrophobicContact CD2-CB 4.09Å; L102-G169 VanDerWaalsContact CD1-C 3.46Å; L102-A173 HydrophobicContact CD1-CB 4.31Å |
| 103 | D | 86.6 | Confident | 90.8 | Very high | 60 Ų | 60 | 44.1 Ų | 44.1 | 32% | 0.321 | 24% | 0.244 | S | C | . | . | trans | -75.2 | 158.2 | 169.7 | 63.6 | -77.9 | 0 | 0 | 0 | 108.4 | V105 T106 F107 Y164 | D103-V105 PolarHBondContact O-N 3.1Å; D103-V105 WeakPolarHBondContact OD2-CA 3.46Å; D103-V105 VanDerWaalsContact OD2-CB 3.26Å; D103-V105 WeakPolarHBondContact OD2-CB 3.5Å; D103-V105 PolarHBondContact OD2-N 2.95Å; D103-V105 VanDerWaalsContact OD2-N 3.08Å; D103-T106 VanDerWaalsContact CG-OG1 3.31Å; D103-T106 PolarHBondContact O-N 3.02Å; D103-T106 WeakPolarHBondContact OD1-CB 3.31Å; D103-T106 PolarHBondContact OD1-OG1 3.42Å; D103-T106 PolarHBondContact OD2-N 3.36Å; D103-T106 PolarHBondContact OD2-OG1 3.16Å; D103-F107 VanDerWaalsContact O-CB 3.31Å; D103-F107 WeakPolarHBondContact O-CB 3.31Å; D103-F107 PolarHBondContact O-N 3.39Å; D103-Y164 VanDerWaalsContact CA-OH 3.24Å; D103-Y164 WeakPolarHBondContact CA-OH 3.35Å; D103-Y164 VanDerWaalsContact CB-OH 3.25Å; D103-Y164 WeakPolarHBondContact CB-OH 3.38Å; D103-Y164 PolarHBondContact N-OH 2.91Å | ||
| 104 | A | 84.5 | Confident | 90.9 | Very high | 53 Ų | 53 | 42.2 Ų | 42.2 | 44% | 0.438 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.2 | -34 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q108 P151 | A104-Q108 WeakPolarHBondContact O-CB 3.29Å; A104-Q108 PolarHBondContact O-N 3.12Å; A104-P151 HydrophobicContact CB-CG 4.12Å |
| 105 | V | 85.3 | Confident | 90.8 | Very high | 56 Ų | 56 | 40.6 Ų | 40.6 | 34% | 0.339 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -68.4 | -54.2 | 179.3 | -174.7 | 0 | 0 | 0 | 0 | 109.6 | D103 F107 Q108 V109 P151 | D103-V105 PolarHBondContact O-N 3.1Å; D103-V105 WeakPolarHBondContact OD2-CA 3.46Å; D103-V105 VanDerWaalsContact OD2-CB 3.26Å; D103-V105 WeakPolarHBondContact OD2-CB 3.5Å; D103-V105 PolarHBondContact OD2-N 2.95Å; D103-V105 VanDerWaalsContact OD2-N 3.08Å; V105-F107 PolarHBondContact O-N 2.68Å; V105-Q108 PolarHBondContact O-N 3.43Å; V105-V109 WeakPolarHBondContact O-CG2 3.28Å; V105-V109 PolarHBondContact O-N 2.64Å; V105-P151 HydrophobicContact CG2-CG 3.64Å |
| 106 | T | 88.4 | Confident | 90.8 | Very high | 57 Ų | 57 | 41.5 Ų | 41.5 | 35% | 0.35 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62.6 | -44.6 | -178.1 | -55.9 | 0 | 0 | 0 | 0 | 111.6 | L102 D103 Q108 A110 | L102-T106 HydrophobicContact CD1-CG2 4.25Å; L102-T106 HydrophobicContact CD2-CG2 3.86Å; D103-T106 VanDerWaalsContact CG-OG1 3.31Å; D103-T106 PolarHBondContact O-N 3.02Å; D103-T106 WeakPolarHBondContact OD1-CB 3.31Å; D103-T106 PolarHBondContact OD1-OG1 3.42Å; D103-T106 PolarHBondContact OD2-N 3.36Å; D103-T106 PolarHBondContact OD2-OG1 3.16Å; T106-Q108 VanDerWaalsContact C-N 3.34Å; T106-Q108 PolarHBondContact O-N 2.99Å; T106-A110 VanDerWaalsContact O-CB 3.28Å; T106-A110 WeakPolarHBondContact O-CB 3.42Å; T106-A110 PolarHBondContact O-N 3.27Å |
| 107 | F | 89.8 | Confident | 91.1 | Very high | 26 Ų | 26 | 37.4 Ų | 37.4 | 11% | 0.114 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -56.1 | -49.2 | 175 | 167.8 | -98.9 | 0 | 0 | 0 | 111.4 | L95 A98 L99 L102 D103 V105 A110 Y111 | L95-F107 HydrophobicContact CD2-CE2 3.82Å; L95-F107 HydrophobicContact CD2-CZ 3.89Å; A98-F107 HydrophobicContact CB-CD2 3.75Å; A98-F107 HydrophobicContact CB-CE2 3.85Å; L99-F107 HydrophobicContact CB-CD2 4.45Å; L99-F107 HydrophobicContact CB-CE2 4.39Å; L99-F107 HydrophobicContact CD1-CD1 4.05Å; L99-F107 HydrophobicContact CD1-CE1 4.36Å; L99-F107 HydrophobicContact CD1-CG 4.2Å; L102-F107 HydrophobicContact CB-CB 4.02Å; L102-F107 HydrophobicContact CD1-CB 4.26Å; D103-F107 VanDerWaalsContact O-CB 3.31Å; D103-F107 WeakPolarHBondContact O-CB 3.31Å; D103-F107 PolarHBondContact O-N 3.39Å; V105-F107 PolarHBondContact O-N 2.68Å; F107-A110 PolarHBondContact O-N 3.36Å; F107-Y111 WeakPolarHBondContact O-CB 3.26Å; F107-Y111 PolarHBondContact O-N 2.78Å |
| 108 | Q | 87.1 | Confident | 91.3 | Very high | 29 Ų | 29 | 35 Ų | 35 | 14% | 0.136 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.4 | -49.9 | -175.7 | -177.1 | 62.2 | 16.2 | 0 | 0 | 111.1 | A104 V105 T106 A110 Y111 Q112 E149 | A104-Q108 WeakPolarHBondContact O-CB 3.29Å; A104-Q108 PolarHBondContact O-N 3.12Å; V105-Q108 PolarHBondContact O-N 3.43Å; T106-Q108 VanDerWaalsContact C-N 3.34Å; T106-Q108 PolarHBondContact O-N 2.99Å; Q108-A110 VanDerWaalsContact C-N 3.34Å; Q108-A110 PolarHBondContact O-N 3.14Å; Q108-Y111 PolarHBondContact O-N 3.49Å; Q108-Q112 VanDerWaalsContact O-CG 3.24Å; Q108-Q112 WeakPolarHBondContact O-CG 3.4Å; Q108-Q112 PolarHBondContact O-N 3.21Å; Q108-Q112 VanDerWaalsContact O-N 3.12Å; Q108-E149 HydrophobicContact CG-CB 3.93Å; Q108-E149 PolarHBondContact NE2-OE1 3.39Å; Q108-E149 PolarHBondContact NE2-OE2 3.5Å; Q108-E149 PolarHBondContact OE1-OE2 2.71Å |
| 109 | V | 90.6 | Very high | 91.4 | Very high | 51 Ų | 51 | 35 Ų | 35 | 31% | 0.309 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -60.4 | -45.4 | 179.2 | 176.8 | 0 | 0 | 0 | 0 | 110.9 | V105 Y111 Q112 F142 A146 | V105-V109 WeakPolarHBondContact O-CG2 3.28Å; V105-V109 PolarHBondContact O-N 2.64Å; V109-Y111 PolarHBondContact O-N 2.86Å; V109-Q112 PolarHBondContact O-N 2.94Å; V109-F142 HydrophobicContact CG1-CE2 4.38Å; V109-F142 HydrophobicContact CG1-CZ 3.74Å; V109-F142 WeakPolarHBondContact O-CE2 3.36Å; V109-A146 HydrophobicContact CG2-CB 4.09Å |
| 110 | A | 92.7 | Very high | 91.7 | Very high | 9 Ų | 9 | 34.1 Ų | 34.1 | 7% | 0.074 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63 | -42.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T106 F107 Q108 Q112 L113 L170 A173 | T106-A110 VanDerWaalsContact O-CB 3.28Å; T106-A110 WeakPolarHBondContact O-CB 3.42Å; T106-A110 PolarHBondContact O-N 3.27Å; F107-A110 PolarHBondContact O-N 3.36Å; Q108-A110 VanDerWaalsContact C-N 3.34Å; Q108-A110 PolarHBondContact O-N 3.14Å; A110-Q112 VanDerWaalsContact C-N 3.27Å; A110-Q112 PolarHBondContact O-N 3.04Å; A110-L113 VanDerWaalsContact O-CB 3.29Å; A110-L113 WeakPolarHBondContact O-CB 3.48Å; A110-L113 WeakPolarHBondContact O-CD1 3.43Å; A110-L113 WeakPolarHBondContact O-CG 3.23Å; A110-L113 PolarHBondContact O-N 3.48Å; A110-L170 HydrophobicContact CB-CD1 3.75Å; A110-A173 HydrophobicContact CB-CB 3.73Å |
| 111 | Y | 93.3 | Very high | 92.1 | Very high | 31 Ų | 31 | 33.3 Ų | 33.3 | 12% | 0.122 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -70 | -23.9 | -179.3 | -176.2 | -133.4 | 0 | 0 | 0 | 113.1 | Q91 L95 F107 Q108 V109 L113 K114 A176 | Q91-Y111 PolarHBondContact NE2-OH 3.4Å; L95-Y111 HydrophobicContact CD1-CE1 4.2Å; L95-Y111 HydrophobicContact CD1-CE2 4.11Å; L95-Y111 HydrophobicContact CD2-CD1 4.17Å; L95-Y111 HydrophobicContact CD2-CD2 3.5Å; L95-Y111 VanDerWaalsContact CD2-CD2 3.5Å; L95-Y111 HydrophobicContact CD2-CE1 4.13Å; L95-Y111 HydrophobicContact CD2-CE2 3.51Å; L95-Y111 HydrophobicContact CD2-CG 3.86Å; L95-Y111 HydrophobicContact CG-CE2 4.34Å; F107-Y111 WeakPolarHBondContact O-CB 3.26Å; F107-Y111 PolarHBondContact O-N 2.78Å; Q108-Y111 PolarHBondContact O-N 3.49Å; V109-Y111 PolarHBondContact O-N 2.86Å; Y111-L113 PolarHBondContact O-N 2.84Å; Y111-K114 HydrophobicContact CD1-CD 4.37Å; Y111-K114 HydrophobicContact CD2-CD 4.35Å; Y111-K114 HydrophobicContact CE1-CD 4.01Å; Y111-K114 HydrophobicContact CE2-CD 3.93Å; Y111-K114 WeakPolarHBondContact O-CB 3.33Å; Y111-K114 WeakPolarHBondContact O-CG 3.5Å; Y111-K114 PolarHBondContact O-N 2.93Å; Y111-K114 VanDerWaalsContact O-N 3.13Å; Y111-A176 HydrophobicContact CE2-CB 4.45Å |
| 112 | Q | 93.3 | Very high | 92.2 | Very high | 6 Ų | 6 | 32.7 Ų | 32.7 | 3% | 0.028 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.2 | -9.1 | 175.6 | -68.5 | -61.8 | 81.5 | 0 | 0 | 114.3 | Q108 V109 A110 K114 L115 F142 V145 | Q108-Q112 VanDerWaalsContact O-CG 3.24Å; Q108-Q112 WeakPolarHBondContact O-CG 3.4Å; Q108-Q112 PolarHBondContact O-N 3.21Å; Q108-Q112 VanDerWaalsContact O-N 3.12Å; V109-Q112 PolarHBondContact O-N 2.94Å; A110-Q112 VanDerWaalsContact C-N 3.27Å; A110-Q112 PolarHBondContact O-N 3.04Å; Q112-K114 PolarHBondContact O-N 2.87Å; Q112-L115 WeakPolarHBondContact O-CB 3.33Å; Q112-L115 WeakPolarHBondContact O-CG 3.4Å; Q112-L115 PolarHBondContact O-N 3.35Å; Q112-L115 VanDerWaalsContact O-N 3.1Å; Q112-F142 HydrophobicContact CB-CD2 3.73Å; Q112-F142 HydrophobicContact CB-CE2 3.85Å; Q112-V145 HydrophobicContact CG-CG1 4.42Å |
| 113 | L | 94.8 | Very high | 92.5 | Very high | 59 Ų | 59 | 35.1 Ų | 35.1 | 31% | 0.309 | 19% | 0.19 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.2 | -19.7 | 165.7 | -67.1 | 175.6 | 0 | 0 | 0 | 112.9 | A110 Y111 L115 F116 T117 F142 V174 | A110-L113 VanDerWaalsContact O-CB 3.29Å; A110-L113 WeakPolarHBondContact O-CB 3.48Å; A110-L113 WeakPolarHBondContact O-CD1 3.43Å; A110-L113 WeakPolarHBondContact O-CG 3.23Å; A110-L113 PolarHBondContact O-N 3.48Å; Y111-L113 PolarHBondContact O-N 2.84Å; L113-L115 PolarHBondContact O-N 3.47Å; L113-L115 VanDerWaalsContact O-N 3.08Å; L113-F116 HydrophobicContact CD2-CD2 4.11Å; L113-F116 HydrophobicContact CD2-CE2 4.48Å; L113-F116 PolarHBondContact O-N 3.35Å; L113-T117 PolarHBondContact O-N 3.29Å; L113-F142 HydrophobicContact CD2-CE2 4.43Å; L113-V174 HydrophobicContact CD1-CG2 4Å |
| 114 | K | 95 | Very high | 92.8 | Very high | 45 Ų | 45 | 38.1 Ų | 38.1 | 20% | 0.196 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -56.2 | -26.3 | 175.4 | 74.9 | -168.8 | 177.8 | -152 | 0 | 113.2 | Y111 Q112 T117 T118 | Y111-K114 HydrophobicContact CD1-CD 4.37Å; Y111-K114 HydrophobicContact CD2-CD 4.35Å; Y111-K114 HydrophobicContact CE1-CD 4.01Å; Y111-K114 HydrophobicContact CE2-CD 3.93Å; Y111-K114 WeakPolarHBondContact O-CB 3.33Å; Y111-K114 WeakPolarHBondContact O-CG 3.5Å; Y111-K114 PolarHBondContact O-N 2.93Å; Y111-K114 VanDerWaalsContact O-N 3.13Å; Q112-K114 PolarHBondContact O-N 2.87Å; K114-T117 VanDerWaalsContact CA-OG1 3.28Å; K114-T117 WeakPolarHBondContact CA-OG1 3.37Å; K114-T117 PolarHBondContact O-OG1 3.39Å; K114-T118 WeakPolarHBondContact O-CB 3.34Å; K114-T118 PolarHBondContact O-N 3.06Å; K114-T118 PolarHBondContact O-OG1 3.34Å |
| 115 | L | 94 | Very high | 93.3 | Very high | 5 Ų | 5 | 38.4 Ų | 38.4 | 3% | 0.026 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.1 | -45.4 | 174.9 | -64.1 | 175.4 | 0 | 0 | 0 | 110.8 | Q112 L113 A119 L141 F142 | Q112-L115 WeakPolarHBondContact O-CB 3.33Å; Q112-L115 WeakPolarHBondContact O-CG 3.4Å; Q112-L115 PolarHBondContact O-N 3.35Å; Q112-L115 VanDerWaalsContact O-N 3.1Å; L113-L115 PolarHBondContact O-N 3.47Å; L113-L115 VanDerWaalsContact O-N 3.08Å; L115-A119 PolarHBondContact O-N 3.25Å; L115-L141 HydrophobicContact CD1-CB 4.39Å; L115-L141 HydrophobicContact CD1-CD2 3.9Å; L115-L141 HydrophobicContact CD1-CG 3.97Å; L115-L141 HydrophobicContact CD2-CD2 3.81Å; L115-L141 HydrophobicContact CG-CD2 4.47Å; L115-F142 HydrophobicContact CD1-CB 4.21Å |
| 116 | F | 96.2 | Very high | 93.6 | Very high | 42 Ų | 42 | 37 Ų | 37 | 18% | 0.184 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -74.4 | -42.7 | 179.3 | -57.8 | -62.9 | 0 | 0 | 0 | 111.6 | L113 T118 A119 L120 W135 L138 I139 F142 | L113-F116 HydrophobicContact CD2-CD2 4.11Å; L113-F116 HydrophobicContact CD2-CE2 4.48Å; L113-F116 PolarHBondContact O-N 3.35Å; F116-T118 VanDerWaalsContact C-N 3.32Å; F116-T118 PolarHBondContact O-N 3.25Å; F116-A119 PolarHBondContact O-N 3.5Å; F116-A119 VanDerWaalsContact O-N 3.13Å; F116-L120 WeakPolarHBondContact O-CG 3.37Å; F116-L120 PolarHBondContact O-N 3.19Å; F116-W135 HydrophobicContact CD1-CE3 4.36Å; F116-W135 AromaticContact CD1-CZ3 3.85Å; F116-W135 HydrophobicContact CD1-CZ3 3.85Å; F116-L138 HydrophobicContact CD1-CB 4.46Å; F116-L138 HydrophobicContact CE1-CB 4.15Å; F116-I139 HydrophobicContact CE1-CG1 3.88Å; F116-I139 HydrophobicContact CZ-CG1 4.13Å; F116-F142 HydrophobicContact CE2-CB 3.99Å; F116-F142 HydrophobicContact CE2-CD1 4.46Å; F116-F142 AromaticContact CE2-CD2 3.81Å; F116-F142 HydrophobicContact CE2-CD2 3.81Å; F116-F142 HydrophobicContact CE2-CE2 4.41Å; F116-F142 AromaticContact CE2-CG 3.83Å; F116-F142 HydrophobicContact CE2-CG 3.83Å; F116-F142 HydrophobicContact CZ-CB 3.85Å; F116-F142 HydrophobicContact CZ-CG 4.1Å |
| 117 | T | 96.7 | Very high | 93.7 | Very high | 17 Ų | 17 | 44.9 Ų | 44.9 | 10% | 0.104 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.9 | -38.9 | 178.5 | 65 | 0 | 0 | 0 | 0 | 111.2 | L113 K114 A119 L120 F121 S177 I178 | L113-T117 PolarHBondContact O-N 3.29Å; K114-T117 VanDerWaalsContact CA-OG1 3.28Å; K114-T117 WeakPolarHBondContact CA-OG1 3.37Å; K114-T117 PolarHBondContact O-OG1 3.39Å; T117-A119 VanDerWaalsContact C-N 3.33Å; T117-A119 PolarHBondContact O-N 3.29Å; T117-L120 PolarHBondContact O-N 2.94Å; T117-F121 WeakPolarHBondContact O-CB 3.47Å; T117-F121 WeakPolarHBondContact O-CD2 3.24Å; T117-F121 PolarHBondContact O-N 2.86Å; T117-S177 PolarHBondContact OG1-O 3.23Å; T117-I178 HydrophobicContact CG2-CB 4.41Å; T117-I178 HydrophobicContact CG2-CG1 3.82Å |
| 118 | T | 96.2 | Very high | 93.5 | Very high | 2 Ų | 2 | 47 Ų | 47 | 1% | 0.012 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60.1 | -43.2 | 173.3 | -58 | 0 | 0 | 0 | 0 | 110.9 | K114 F116 S122 G181 C184 V185 N261 I262 | K114-T118 WeakPolarHBondContact O-CB 3.34Å; K114-T118 PolarHBondContact O-N 3.06Å; K114-T118 PolarHBondContact O-OG1 3.34Å; F116-T118 VanDerWaalsContact C-N 3.32Å; F116-T118 PolarHBondContact O-N 3.25Å; T118-S122 VanDerWaalsContact O-CB 3.23Å; T118-S122 WeakPolarHBondContact O-CB 3.15Å; T118-S122 PolarHBondContact O-N 2.89Å; T118-G181 WeakPolarHBondContact OG1-CA 3.46Å; T118-C184 HydrophobicContact CG2-CB 4.34Å; T118-V185 HydrophobicContact CG2-CG2 4.08Å; T118-V185 VanDerWaalsContact O-CG2 3.3Å; T118-V185 WeakPolarHBondContact O-CG2 3.4Å; T118-N261 HydrophobicContact CG2-CB 4.07Å; T118-I262 HydrophobicContact CG2-CG1 4.2Å |
| 119 | A | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.3 | -45.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L115 F116 T117 S122 M123 W135 L138 I262 | L115-A119 PolarHBondContact O-N 3.25Å; F116-A119 PolarHBondContact O-N 3.5Å; F116-A119 VanDerWaalsContact O-N 3.13Å; T117-A119 VanDerWaalsContact C-N 3.33Å; T117-A119 PolarHBondContact O-N 3.29Å; A119-S122 WeakPolarHBondContact O-CB 3.22Å; A119-S122 PolarHBondContact O-N 3.32Å; A119-M123 WeakPolarHBondContact O-CG 3.48Å; A119-M123 PolarHBondContact O-N 2.93Å; A119-W135 HydrophobicContact CB-CH2 3.91Å; A119-W135 HydrophobicContact CB-CZ2 4.21Å; A119-W135 HydrophobicContact CB-CZ3 4.46Å; A119-L138 HydrophobicContact CB-CD1 3.58Å; A119-I262 HydrophobicContact CB-CD1 4.23Å |
| 120 | L | 96.3 | Very high | 93.4 | Very high | 82 Ų | 82 | 47.9 Ų | 47.9 | 43% | 0.429 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.4 | -51.7 | 176.7 | -71.2 | 174.8 | 0 | 0 | 0 | 111.5 | F116 T117 S122 M123 L124 W135 | F116-L120 WeakPolarHBondContact O-CG 3.37Å; F116-L120 PolarHBondContact O-N 3.19Å; T117-L120 PolarHBondContact O-N 2.94Å; L120-S122 VanDerWaalsContact C-N 3.27Å; L120-S122 PolarHBondContact O-N 3.37Å; L120-M123 HydrophobicContact CD2-CE 3.8Å; L120-M123 WeakPolarHBondContact O-CB 3.49Å; L120-M123 PolarHBondContact O-N 3.47Å; L120-M123 VanDerWaalsContact O-N 3.14Å; L120-L124 WeakPolarHBondContact O-CG 3.47Å; L120-L124 PolarHBondContact O-N 3.38Å; L120-W135 HydrophobicContact CD2-CH2 3.85Å; L120-W135 HydrophobicContact CD2-CZ2 4.22Å; L120-W135 HydrophobicContact CG-CH2 4.08Å |
| 121 | F | 97.3 | Very high | 93.4 | Very high | 45 Ų | 45 | 48.6 Ų | 48.6 | 20% | 0.197 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.5 | -32.8 | 177.2 | -73.6 | -57.9 | 0 | 0 | 0 | 112.1 | T117 M123 L124 I125 I178 L182 V185 | T117-F121 WeakPolarHBondContact O-CB 3.47Å; T117-F121 WeakPolarHBondContact O-CD2 3.24Å; T117-F121 PolarHBondContact O-N 2.86Å; F121-M123 VanDerWaalsContact C-N 3.3Å; F121-M123 PolarHBondContact O-N 3.14Å; F121-L124 HydrophobicContact CD1-CD1 4.43Å; F121-L124 PolarHBondContact O-N 3.46Å; F121-I125 HydrophobicContact CB-CD1 4.19Å; F121-I125 HydrophobicContact CD1-CD1 4.09Å; F121-I125 HydrophobicContact CG-CD1 4.47Å; F121-I125 WeakPolarHBondContact O-CB 3.3Å; F121-I125 PolarHBondContact O-N 2.88Å; F121-I178 HydrophobicContact CE2-CG2 3.88Å; F121-I178 WeakPolarHBondContact CE2-O 3.39Å; F121-I178 HydrophobicContact CZ-CG2 3.95Å; F121-L182 HydrophobicContact CD1-CD1 3.98Å; F121-L182 HydrophobicContact CD2-CB 4Å; F121-L182 HydrophobicContact CE1-CD1 4Å; F121-L182 HydrophobicContact CE2-CB 3.82Å; F121-L182 HydrophobicContact CG-CD1 4.28Å; F121-L182 HydrophobicContact CZ-CB 4.18Å; F121-L182 HydrophobicContact CZ-CD1 4.31Å; F121-V185 HydrophobicContact CB-CB 4.02Å; F121-V185 HydrophobicContact CB-CG1 4.3Å; F121-V185 HydrophobicContact CB-CG2 3.82Å |
| 122 | S | 94.7 | Very high | 93.3 | Very high | 2 Ų | 2 | 56.3 Ų | 56.3 | 1% | 0.014 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.8 | -38.9 | 174.6 | -163.8 | 0 | 0 | 0 | 0 | 111.5 | T118 A119 L120 L126 R127 K128 | T118-S122 VanDerWaalsContact O-CB 3.23Å; T118-S122 WeakPolarHBondContact O-CB 3.15Å; T118-S122 PolarHBondContact O-N 2.89Å; A119-S122 WeakPolarHBondContact O-CB 3.22Å; A119-S122 PolarHBondContact O-N 3.32Å; L120-S122 VanDerWaalsContact C-N 3.27Å; L120-S122 PolarHBondContact O-N 3.37Å; S122-L126 CarbonylContact O-C 3.54Å; S122-L126 WeakPolarHBondContact O-CA 3.48Å; S122-L126 WeakPolarHBondContact O-CB 3.35Å; S122-L126 PolarHBondContact O-N 3.43Å; S122-R127 PolarHBondContact O-N 3.18Å; S122-K128 PolarHBondContact O-N 3.16Å |
| 123 | M | 93.8 | Very high | 93.3 | Very high | 60 Ų | 60 | 60.4 Ų | 60.4 | 30% | 0.296 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -68.8 | -41.7 | 172.8 | -65.4 | -169.3 | -53 | 0 | 0 | 112.2 | A119 L120 F121 R127 K128 V130 W135 | A119-M123 WeakPolarHBondContact O-CG 3.48Å; A119-M123 PolarHBondContact O-N 2.93Å; L120-M123 HydrophobicContact CD2-CE 3.8Å; L120-M123 WeakPolarHBondContact O-CB 3.49Å; L120-M123 PolarHBondContact O-N 3.47Å; L120-M123 VanDerWaalsContact O-N 3.14Å; F121-M123 VanDerWaalsContact C-N 3.3Å; F121-M123 PolarHBondContact O-N 3.14Å; M123-R127 WeakPolarHBondContact O-CA 3.33Å; M123-R127 PolarHBondContact O-N 2.89Å; M123-K128 VanDerWaalsContact CG-O 3.31Å; M123-K128 WeakPolarHBondContact CG-O 3.35Å; M123-V130 HydrophobicContact CG-CB 4.45Å; M123-V130 HydrophobicContact CG-CG2 3.84Å; M123-V130 HydrophobicContact SD-CB 4.09Å; M123-V130 HydrophobicContact SD-CG2 4.11Å; M123-W135 HydrophobicContact CE-CH2 4.44Å; M123-W135 HydrophobicContact CE-CZ2 3.54Å; M123-W135 HydrophobicContact SD-CZ2 4.08Å |
| 124 | L | 94.4 | Very high | 93.2 | Very high | 124 Ų | 124 | 58.1 Ų | 58.1 | 65% | 0.649 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -74.3 | -48.6 | -175.4 | -67 | 172.5 | 0 | 0 | 0 | 112.9 | L120 F121 | L120-L124 WeakPolarHBondContact O-CG 3.47Å; L120-L124 PolarHBondContact O-N 3.38Å; F121-L124 HydrophobicContact CD1-CD1 4.43Å; F121-L124 PolarHBondContact O-N 3.46Å |
| 125 | I | 93.5 | Very high | 93.2 | Very high | 59 Ų | 59 | 59.2 Ų | 59.2 | 30% | 0.303 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -88.4 | -47.9 | -171.8 | -59.2 | 175.2 | 0 | 0 | 0 | 110.9 | F121 L182 V185 M189 | F121-I125 HydrophobicContact CB-CD1 4.19Å; F121-I125 HydrophobicContact CD1-CD1 4.09Å; F121-I125 HydrophobicContact CG-CD1 4.47Å; F121-I125 WeakPolarHBondContact O-CB 3.3Å; F121-I125 PolarHBondContact O-N 2.88Å; I125-L182 HydrophobicContact CD1-CD1 3.63Å; I125-V185 HydrophobicContact CB-CG1 3.94Å; I125-V185 HydrophobicContact CD1-CG1 4.18Å; I125-V185 HydrophobicContact CG2-CG1 4.31Å; I125-M189 HydrophobicContact CG2-SD 3.56Å; I125-M189 VanDerWaalsContact CG2-SD 3.56Å |
| 126 | L | 92.6 | Very high | 93.3 | Very high | 27 Ų | 27 | 64 Ų | 64 | 14% | 0.141 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -91.3 | -4.5 | -177.4 | -60.7 | 175.4 | 0 | 0 | 0 | 113.1 | S122 K128 V185 E188 M189 | S122-L126 CarbonylContact O-C 3.54Å; S122-L126 WeakPolarHBondContact O-CA 3.48Å; S122-L126 WeakPolarHBondContact O-CB 3.35Å; S122-L126 PolarHBondContact O-N 3.43Å; L126-K128 HydrophobicContact CB-CD 4.28Å; L126-K128 HydrophobicContact CB-CG 4.04Å; L126-K128 HydrophobicContact CD1-CD 4.5Å; L126-K128 PolarHBondContact O-N 3.34Å; L126-K128 VanDerWaalsContact O-N 3.11Å; L126-V185 HydrophobicContact CD1-CG1 3.86Å; L126-V185 HydrophobicContact CG-CG1 3.8Å; L126-E188 HydrophobicContact CD1-CB 4.05Å; L126-E188 HydrophobicContact CD1-CG 3.55Å; L126-M189 HydrophobicContact CD2-CB 3.71Å; L126-M189 HydrophobicContact CD2-CG 3.97Å |
| 127 | R | 90.9 | Very high | 93.3 | Very high | 221 Ų | 221 | 62 Ų | 62 | 83% | 0.834 | 29% | 0.293 | S | S | * | . | trans | 52.5 | 31.8 | -177.1 | -61.7 | -176.7 | 176 | 154.7 | -1.6 | 113.1 | S122 M123 P129 | S122-R127 PolarHBondContact O-N 3.18Å; M123-R127 WeakPolarHBondContact O-CA 3.33Å; M123-R127 PolarHBondContact O-N 2.89Å; R127-P129 WeakPolarHBondContact O-CD 3.33Å | ||
| 128 | K | 85.6 | Confident | 93.2 | Very high | 71 Ų | 71 | 61.3 Ų | 61.3 | 31% | 0.309 | 29% | 0.289 | S | S | . | . | trans | -90 | 112.3 | 177.9 | -72.2 | -174.3 | -180 | 179.5 | 0 | 109.6 | S122 M123 L126 E188 | S122-K128 PolarHBondContact O-N 3.16Å; M123-K128 VanDerWaalsContact CG-O 3.31Å; M123-K128 WeakPolarHBondContact CG-O 3.35Å; L126-K128 HydrophobicContact CB-CD 4.28Å; L126-K128 HydrophobicContact CB-CG 4.04Å; L126-K128 HydrophobicContact CD1-CD 4.5Å; L126-K128 PolarHBondContact O-N 3.34Å; L126-K128 VanDerWaalsContact O-N 3.11Å; K128-E188 IonicContact NZ-OE1 2.72Å; K128-E188 PolarHBondContact NZ-OE1 3.14Å | ||
| 129 | P | 87.7 | Confident | 93.2 | Very high | 80 Ų | 80 | 64.9 Ų | 64.9 | 52% | 0.519 | 31% | 0.307 | S | S | . | . | trans | -64.6 | 145.4 | 177.4 | 27 | -33.5 | 0 | 0 | 0 | 110.5 | R127 P310 | R127-P129 WeakPolarHBondContact O-CD 3.33Å; P129-P310 HydrophobicContact CB-CB 4.19Å; P129-P310 HydrophobicContact CG-CB 3.95Å; P129-P310 HydrophobicContact CG-CG 4.19Å; P129-P310 VanDerWaalsContact O-CG 3.27Å; P129-P310 WeakPolarHBondContact O-CG 3.37Å | ||
| 130 | V | 87.7 | Confident | 93.2 | Very high | 19 Ų | 19 | 66.4 Ų | 66.4 | 12% | 0.115 | 32% | 0.315 | C | S | . | . | trans | -112.4 | 126.2 | 172.8 | 179.4 | 0 | 0 | 0 | 0 | 107.8 | M123 Q134 W135 I262 | M123-V130 HydrophobicContact CG-CB 4.45Å; M123-V130 HydrophobicContact CG-CG2 3.84Å; M123-V130 HydrophobicContact SD-CB 4.09Å; M123-V130 HydrophobicContact SD-CG2 4.11Å; V130-Q134 HydrophobicContact CG1-CB 3.56Å; V130-W135 HydrophobicContact CG1-CD2 4.37Å; V130-W135 HydrophobicContact CG1-CG 4.11Å; V130-I262 HydrophobicContact CG2-CD1 4.49Å | ||
| 131 | S | 91 | Very high | 93.2 | Very high | 23 Ų | 23 | 62.5 Ų | 62.5 | 16% | 0.161 | 29% | 0.294 | C | S | . | . | trans | -69 | 158 | -177.4 | 83.5 | 0 | 0 | 0 | 0 | 111.5 | M133 Q134 W135 Y308 | S131-M133 PolarHBondContact O-N 3.35Å; S131-M133 PolarHBondContact OG-N 2.86Å; S131-Q134 VanDerWaalsContact N-OE1 3.16Å; S131-Q134 WeakPolarHBondContact O-CB 3.44Å; S131-Q134 PolarHBondContact O-N 3.19Å; S131-Q134 WeakPolarHBondContact OG-CB 3.42Å; S131-Q134 WeakPolarHBondContact OG-CG 3.34Å; S131-Q134 PolarHBondContact OG-N 3.04Å; S131-W135 PolarHBondContact O-N 3.48Å; S131-Y308 PolarHBondContact OG-O 3.27Å | ||
| 132 | K | 92.2 | Very high | 93 | Very high | 193 Ų | 193 | 62.3 Ų | 62.3 | 84% | 0.839 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -57.4 | -37.4 | 175 | -66.2 | -174.1 | 179.5 | -176.7 | 0 | 112 | W135 F136 | K132-W135 PolarHBondContact O-N 2.94Å; K132-F136 PolarHBondContact O-N 3.14Å |
| 133 | M | 93 | Very high | 92.9 | Very high | 93 Ų | 93 | 65.6 Ų | 65.6 | 46% | 0.458 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -69.3 | -34.9 | 176.2 | -69.3 | -59.4 | 178.1 | 0 | 0 | 112.4 | S131 F136 A137 Y308 | S131-M133 PolarHBondContact O-N 3.35Å; S131-M133 PolarHBondContact OG-N 2.86Å; M133-F136 PolarHBondContact O-N 3.23Å; M133-A137 WeakPolarHBondContact O-CB 3.28Å; M133-A137 PolarHBondContact O-N 3.38Å; M133-Y308 HydrophobicContact CB-CD2 4.26Å; M133-Y308 HydrophobicContact CB-CG 3.88Å; M133-Y308 HydrophobicContact CG-CD1 4.2Å; M133-Y308 HydrophobicContact CG-CD2 4.48Å; M133-Y308 HydrophobicContact CG-CG 4.04Å |
| 134 | Q | 93 | Very high | 92.8 | Very high | 11 Ų | 11 | 62.7 Ų | 62.7 | 5% | 0.051 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -69.3 | -36.5 | 173.9 | -78.3 | 177.5 | -26.1 | 0 | 0 | 112.5 | V130 S131 A137 L138 Y305 Y308 | V130-Q134 HydrophobicContact CG1-CB 3.56Å; S131-Q134 VanDerWaalsContact N-OE1 3.16Å; S131-Q134 WeakPolarHBondContact O-CB 3.44Å; S131-Q134 PolarHBondContact O-N 3.19Å; S131-Q134 WeakPolarHBondContact OG-CB 3.42Å; S131-Q134 WeakPolarHBondContact OG-CG 3.34Å; S131-Q134 PolarHBondContact OG-N 3.04Å; Q134-A137 WeakPolarHBondContact O-CB 3.26Å; Q134-A137 PolarHBondContact O-N 3Å; Q134-L138 WeakPolarHBondContact O-CG 3.34Å; Q134-L138 PolarHBondContact O-N 3.32Å; Q134-Y305 HydrophobicContact CB-CD2 3.74Å; Q134-Y305 HydrophobicContact CB-CE2 3.56Å; Q134-Y305 HydrophobicContact CG-CD1 4.3Å; Q134-Y305 HydrophobicContact CG-CD2 3.71Å; Q134-Y305 HydrophobicContact CG-CE1 4.25Å; Q134-Y305 HydrophobicContact CG-CE2 3.7Å; Q134-Y305 HydrophobicContact CG-CG 4.02Å; Q134-Y305 PolarHBondContact NE2-O 3.46Å; Q134-Y308 WeakPolarHBondContact CG-O 3.19Å |
| 135 | W | 95.3 | Very high | 92.6 | Very high | 67 Ų | 67 | 57 Ų | 57 | 25% | 0.254 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -60.7 | -46.1 | 169.6 | -84.6 | 106.8 | 0 | 0 | 0 | 111.7 | F116 A119 L120 M123 V130 S131 K132 A137 L138 I139 | F116-W135 HydrophobicContact CD1-CE3 4.36Å; F116-W135 AromaticContact CD1-CZ3 3.85Å; F116-W135 HydrophobicContact CD1-CZ3 3.85Å; A119-W135 HydrophobicContact CB-CH2 3.91Å; A119-W135 HydrophobicContact CB-CZ2 4.21Å; A119-W135 HydrophobicContact CB-CZ3 4.46Å; L120-W135 HydrophobicContact CD2-CH2 3.85Å; L120-W135 HydrophobicContact CD2-CZ2 4.22Å; L120-W135 HydrophobicContact CG-CH2 4.08Å; M123-W135 HydrophobicContact CE-CH2 4.44Å; M123-W135 HydrophobicContact CE-CZ2 3.54Å; M123-W135 HydrophobicContact SD-CZ2 4.08Å; V130-W135 HydrophobicContact CG1-CD2 4.37Å; V130-W135 HydrophobicContact CG1-CG 4.11Å; S131-W135 PolarHBondContact O-N 3.48Å; K132-W135 PolarHBondContact O-N 2.94Å; W135-A137 VanDerWaalsContact C-N 3.32Å; W135-A137 PolarHBondContact O-N 3.37Å; W135-L138 HydrophobicContact CE3-CD1 4.32Å; W135-L138 WeakPolarHBondContact O-CB 3.39Å; W135-L138 PolarHBondContact O-N 3.26Å; W135-L138 VanDerWaalsContact O-N 3.15Å; W135-I139 WeakPolarHBondContact O-CG1 3.24Å; W135-I139 PolarHBondContact O-N 3.44Å |
| 136 | F | 95.9 | Very high | 92.4 | Very high | 107 Ų | 107 | 54.8 Ų | 54.8 | 47% | 0.469 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 174.9 | -177.6 | -120.7 | 0 | 0 | 0 | 111.9 | K132 M133 L138 I139 L140 L304 | K132-F136 PolarHBondContact O-N 3.14Å; M133-F136 PolarHBondContact O-N 3.23Å; F136-L138 PolarHBondContact O-N 3.16Å; F136-I139 PolarHBondContact O-N 3.1Å; F136-L140 HydrophobicContact CD1-CD1 4.18Å; F136-L140 HydrophobicContact CE1-CD1 3.68Å; F136-L140 HydrophobicContact CE1-CG 4.27Å; F136-L140 HydrophobicContact CE2-CD2 4.46Å; F136-L140 HydrophobicContact CE2-CG 4.34Å; F136-L140 HydrophobicContact CZ-CD1 3.93Å; F136-L140 HydrophobicContact CZ-CD2 4.17Å; F136-L140 HydrophobicContact CZ-CG 4.09Å; F136-L140 PolarHBondContact O-N 3.41Å; F136-L304 HydrophobicContact CD1-CD2 3.53Å; F136-L304 HydrophobicContact CE1-CD2 4.1Å; F136-L304 HydrophobicContact CG-CD2 4.47Å |
| 137 | A | 95.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.6 | -44.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | M133 Q134 W135 I139 L140 L141 F266 S301 L304 Y305 | M133-A137 WeakPolarHBondContact O-CB 3.28Å; M133-A137 PolarHBondContact O-N 3.38Å; Q134-A137 WeakPolarHBondContact O-CB 3.26Å; Q134-A137 PolarHBondContact O-N 3Å; W135-A137 VanDerWaalsContact C-N 3.32Å; W135-A137 PolarHBondContact O-N 3.37Å; A137-I139 VanDerWaalsContact C-N 3.3Å; A137-I139 PolarHBondContact O-N 3.26Å; A137-L140 CarbonylContact O-C 3.59Å; A137-L140 WeakPolarHBondContact O-CB 3.35Å; A137-L140 PolarHBondContact O-N 3.43Å; A137-L140 VanDerWaalsContact O-N 3.16Å; A137-L141 PolarHBondContact O-N 3.41Å; A137-F266 HydrophobicContact CB-CZ 4.47Å; A137-S301 PolarHBondContact O-OG 2.84Å; A137-L304 HydrophobicContact CB-CB 4.14Å; A137-L304 HydrophobicContact CB-CD2 3.86Å; A137-L304 HydrophobicContact CB-CG 4.1Å; A137-Y305 HydrophobicContact CB-CD2 4.12Å; A137-Y305 HydrophobicContact CB-CG 4.47Å |
| 138 | L | 95.2 | Very high | 91.7 | Very high | 2 Ų | 2 | 45.5 Ų | 45.5 | 1% | 0.01 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.4 | -38.4 | 176.7 | -72.9 | 170.7 | 0 | 0 | 0 | 112.8 | F116 A119 Q134 W135 F136 L141 F142 I262 F266 Y305 | F116-L138 HydrophobicContact CD1-CB 4.46Å; F116-L138 HydrophobicContact CE1-CB 4.15Å; A119-L138 HydrophobicContact CB-CD1 3.58Å; Q134-L138 WeakPolarHBondContact O-CG 3.34Å; Q134-L138 PolarHBondContact O-N 3.32Å; W135-L138 HydrophobicContact CE3-CD1 4.32Å; W135-L138 WeakPolarHBondContact O-CB 3.39Å; W135-L138 PolarHBondContact O-N 3.26Å; W135-L138 VanDerWaalsContact O-N 3.15Å; F136-L138 PolarHBondContact O-N 3.16Å; L138-L141 PolarHBondContact O-N 3Å; L138-F142 PolarHBondContact O-N 3.47Å; L138-I262 HydrophobicContact CD2-CG2 3.95Å; L138-F266 HydrophobicContact CD2-CE2 3.79Å; L138-F266 HydrophobicContact CD2-CZ 4.23Å; L138-Y305 HydrophobicContact CD1-CE2 4.42Å; L138-Y305 HydrophobicContact CD2-CE2 4.37Å; L138-Y305 HydrophobicContact CG-CD2 4.37Å; L138-Y305 HydrophobicContact CG-CE2 4.16Å |
| 139 | I | 96.3 | Very high | 91.3 | Very high | 77 Ų | 77 | 45.1 Ų | 45.1 | 40% | 0.395 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.4 | -46.6 | 174.3 | -65.2 | 167.1 | 0 | 0 | 0 | 110.4 | F116 W135 F136 A137 L141 F142 I143 | F116-I139 HydrophobicContact CE1-CG1 3.88Å; F116-I139 HydrophobicContact CZ-CG1 4.13Å; W135-I139 WeakPolarHBondContact O-CG1 3.24Å; W135-I139 PolarHBondContact O-N 3.44Å; F136-I139 PolarHBondContact O-N 3.1Å; A137-I139 VanDerWaalsContact C-N 3.3Å; A137-I139 PolarHBondContact O-N 3.26Å; I139-L141 VanDerWaalsContact C-N 3.31Å; I139-L141 PolarHBondContact O-N 3.02Å; I139-F142 WeakPolarHBondContact O-CB 3.26Å; I139-F142 PolarHBondContact O-N 3.01Å; I139-I143 HydrophobicContact CG2-CD1 4.07Å; I139-I143 WeakPolarHBondContact O-CG1 3.13Å; I139-I143 PolarHBondContact O-N 3.19Å |
| 140 | L | 96.2 | Very high | 90.4 | Very high | 32 Ų | 32 | 43.1 Ų | 43.1 | 17% | 0.168 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.9 | -42.6 | 174.5 | -69.7 | 177.3 | 0 | 0 | 0 | 111.4 | F136 A137 F142 I143 G144 I297 L304 | F136-L140 HydrophobicContact CD1-CD1 4.18Å; F136-L140 HydrophobicContact CE1-CD1 3.68Å; F136-L140 HydrophobicContact CE1-CG 4.27Å; F136-L140 HydrophobicContact CE2-CD2 4.46Å; F136-L140 HydrophobicContact CE2-CG 4.34Å; F136-L140 HydrophobicContact CZ-CD1 3.93Å; F136-L140 HydrophobicContact CZ-CD2 4.17Å; F136-L140 HydrophobicContact CZ-CG 4.09Å; F136-L140 PolarHBondContact O-N 3.41Å; A137-L140 CarbonylContact O-C 3.59Å; A137-L140 WeakPolarHBondContact O-CB 3.35Å; A137-L140 PolarHBondContact O-N 3.43Å; A137-L140 VanDerWaalsContact O-N 3.16Å; L140-F142 VanDerWaalsContact C-N 3.32Å; L140-F142 PolarHBondContact O-N 3.25Å; L140-I143 PolarHBondContact O-N 3.34Å; L140-G144 PolarHBondContact O-N 2.8Å; L140-I297 HydrophobicContact CB-CG2 3.95Å; L140-I297 HydrophobicContact CD2-CG2 4.29Å; L140-I297 WeakPolarHBondContact O-CG2 3.44Å; L140-L304 HydrophobicContact CD1-CD2 4.23Å |
| 141 | L | 94.4 | Very high | 89 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60.4 | -44.8 | 178.4 | -174.6 | 66.3 | 0 | 0 | 0 | 110.9 | L115 A137 L138 I139 G144 V145 F266 C269 V298 S301 | L115-L141 HydrophobicContact CD1-CB 4.39Å; L115-L141 HydrophobicContact CD1-CD2 3.9Å; L115-L141 HydrophobicContact CD1-CG 3.97Å; L115-L141 HydrophobicContact CD2-CD2 3.81Å; L115-L141 HydrophobicContact CG-CD2 4.47Å; A137-L141 PolarHBondContact O-N 3.41Å; L138-L141 PolarHBondContact O-N 3Å; I139-L141 VanDerWaalsContact C-N 3.31Å; I139-L141 PolarHBondContact O-N 3.02Å; L141-G144 PolarHBondContact O-N 3.12Å; L141-V145 HydrophobicContact CD1-CG2 4.16Å; L141-V145 HydrophobicContact CG-CG2 4.37Å; L141-V145 WeakPolarHBondContact O-CG2 3.45Å; L141-V145 PolarHBondContact O-N 2.91Å; L141-F266 HydrophobicContact CB-CE1 4.08Å; L141-F266 HydrophobicContact CB-CZ 4.13Å; L141-F266 HydrophobicContact CD1-CD1 3.9Å; L141-F266 HydrophobicContact CD1-CE1 3.92Å; L141-F266 HydrophobicContact CD2-CD1 3.86Å; L141-F266 HydrophobicContact CD2-CD2 3.94Å; L141-F266 HydrophobicContact CD2-CE1 3.75Å; L141-F266 HydrophobicContact CD2-CE2 3.8Å; L141-F266 HydrophobicContact CD2-CG 3.97Å; L141-F266 HydrophobicContact CD2-CZ 3.71Å; L141-F266 HydrophobicContact CG-CD1 4.4Å; L141-F266 HydrophobicContact CG-CE1 4.13Å; L141-F266 HydrophobicContact CG-CZ 4.38Å; L141-C269 HydrophobicContact CD1-CB 3.88Å; L141-V298 HydrophobicContact CD1-CB 4.41Å; L141-V298 HydrophobicContact CD1-CG1 3.81Å; L141-V298 HydrophobicContact CD1-CG2 4.19Å; L141-S301 WeakPolarHBondContact CB-OG 3.29Å; L141-S301 PolarHBondContact N-OG 3.28Å |
| 142 | F | 94 | Very high | 87.1 | Confident | 41 Ų | 41 | 47.1 Ų | 47.1 | 18% | 0.18 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -56.8 | -49.9 | 176.1 | 171 | -93.6 | 0 | 0 | 0 | 111.5 | V109 Q112 L113 L115 F116 L138 I139 L140 A146 | V109-F142 HydrophobicContact CG1-CE2 4.38Å; V109-F142 HydrophobicContact CG1-CZ 3.74Å; V109-F142 WeakPolarHBondContact O-CE2 3.36Å; Q112-F142 HydrophobicContact CB-CD2 3.73Å; Q112-F142 HydrophobicContact CB-CE2 3.85Å; L113-F142 HydrophobicContact CD2-CE2 4.43Å; L115-F142 HydrophobicContact CD1-CB 4.21Å; F116-F142 HydrophobicContact CE2-CB 3.99Å; F116-F142 HydrophobicContact CE2-CD1 4.46Å; F116-F142 AromaticContact CE2-CD2 3.81Å; F116-F142 HydrophobicContact CE2-CD2 3.81Å; F116-F142 HydrophobicContact CE2-CE2 4.41Å; F116-F142 AromaticContact CE2-CG 3.83Å; F116-F142 HydrophobicContact CE2-CG 3.83Å; F116-F142 HydrophobicContact CZ-CB 3.85Å; F116-F142 HydrophobicContact CZ-CG 4.1Å; L138-F142 PolarHBondContact O-N 3.47Å; I139-F142 WeakPolarHBondContact O-CB 3.26Å; I139-F142 PolarHBondContact O-N 3.01Å; L140-F142 VanDerWaalsContact C-N 3.32Å; L140-F142 PolarHBondContact O-N 3.25Å; F142-A146 VanDerWaalsContact O-CB 3.23Å; F142-A146 WeakPolarHBondContact O-CB 3.31Å; F142-A146 PolarHBondContact O-N 3.11Å |
| 143 | I | 92.9 | Very high | 84.6 | Confident | 70 Ų | 70 | 44.9 Ų | 44.9 | 36% | 0.359 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.7 | -45.2 | 178 | -63.2 | 167.8 | 0 | 0 | 0 | 110.8 | I139 L140 V145 A146 T147 I297 | I139-I143 HydrophobicContact CG2-CD1 4.07Å; I139-I143 WeakPolarHBondContact O-CG1 3.13Å; I139-I143 PolarHBondContact O-N 3.19Å; L140-I143 PolarHBondContact O-N 3.34Å; I143-V145 PolarHBondContact O-N 3.31Å; I143-A146 PolarHBondContact O-N 3.48Å; I143-T147 HydrophobicContact CG2-CG2 4.35Å; I143-T147 WeakPolarHBondContact O-CB 3.31Å; I143-T147 VanDerWaalsContact O-CG2 3.29Å; I143-T147 WeakPolarHBondContact O-CG2 3.42Å; I143-T147 PolarHBondContact O-N 2.66Å; I143-T147 PolarHBondContact O-OG1 3.12Å; I143-I297 HydrophobicContact CG2-CD1 4.12Å |
| 144 | G | 92.1 | Very high | 82.2 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62 | -44.5 | -179 | 0 | 0 | 0 | 0 | 0 | 112.7 | L140 L141 T147 V148 | L140-G144 PolarHBondContact O-N 2.8Å; L141-G144 PolarHBondContact O-N 3.12Å; G144-T147 WeakPolarHBondContact CA-OG1 3.16Å; G144-T147 PolarHBondContact O-N 3.32Å; G144-T147 PolarHBondContact O-OG1 3.34Å; G144-V148 WeakPolarHBondContact O-CB 3.38Å; G144-V148 VanDerWaalsContact O-CG2 3.31Å; G144-V148 WeakPolarHBondContact O-CG2 3.43Å; G144-V148 PolarHBondContact O-N 3.13Å |
| 145 | V | 89.8 | Confident | 79.6 | Confident | 5 Ų | 5 | 50.5 Ų | 50.5 | 3% | 0.03 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -72.9 | -38.8 | 177.9 | -177 | 0 | 0 | 0 | 0 | 111.7 | Q112 L141 I143 T147 V148 E149 C269 V298 | Q112-V145 HydrophobicContact CG-CG1 4.42Å; L141-V145 HydrophobicContact CD1-CG2 4.16Å; L141-V145 HydrophobicContact CG-CG2 4.37Å; L141-V145 WeakPolarHBondContact O-CG2 3.45Å; L141-V145 PolarHBondContact O-N 2.91Å; I143-V145 PolarHBondContact O-N 3.31Å; V145-T147 VanDerWaalsContact C-N 3.27Å; V145-T147 PolarHBondContact O-N 2.95Å; V145-V148 PolarHBondContact O-N 3.49Å; V145-E149 HydrophobicContact CG1-CG 4.29Å; V145-E149 WeakPolarHBondContact CG1-OE1 3.43Å; V145-E149 PolarHBondContact O-N 3.21Å; V145-C269 HydrophobicContact CG2-CB 3.86Å; V145-C269 VanDerWaalsContact CG2-SG 3.54Å; V145-V298 HydrophobicContact CG2-CG2 4.06Å |
| 146 | A | 88.7 | Confident | 77 | Confident | 12 Ų | 12 | 56.7 Ų | 56.7 | 10% | 0.099 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.1 | -39.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V109 F142 I143 S150 | V109-A146 HydrophobicContact CG2-CB 4.09Å; F142-A146 VanDerWaalsContact O-CB 3.23Å; F142-A146 WeakPolarHBondContact O-CB 3.31Å; F142-A146 PolarHBondContact O-N 3.11Å; I143-A146 PolarHBondContact O-N 3.48Å; A146-S150 WeakPolarHBondContact O-CB 3.28Å; A146-S150 PolarHBondContact O-N 2.75Å; A146-S150 PolarHBondContact O-OG 3.17Å |
| 147 | T | 86.7 | Confident | 74.5 | Confident | 36 Ų | 36 | 56.4 Ų | 56.4 | 22% | 0.221 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -75.2 | -37.2 | 178.9 | 48.4 | 0 | 0 | 0 | 0 | 113.3 | I143 G144 V145 G294 | I143-T147 HydrophobicContact CG2-CG2 4.35Å; I143-T147 WeakPolarHBondContact O-CB 3.31Å; I143-T147 VanDerWaalsContact O-CG2 3.29Å; I143-T147 WeakPolarHBondContact O-CG2 3.42Å; I143-T147 PolarHBondContact O-N 2.66Å; I143-T147 PolarHBondContact O-OG1 3.12Å; G144-T147 WeakPolarHBondContact CA-OG1 3.16Å; G144-T147 PolarHBondContact O-N 3.32Å; G144-T147 PolarHBondContact O-OG1 3.34Å; V145-T147 VanDerWaalsContact C-N 3.27Å; V145-T147 PolarHBondContact O-N 2.95Å; T147-G294 WeakPolarHBondContact OG1-CA 3.37Å |
| 148 | V | 82.9 | Confident | 71.9 | Confident | 17 Ų | 17 | 63.9 Ų | 63.9 | 10% | 0.103 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -66.7 | -42.9 | 176.1 | 163.3 | 0 | 0 | 0 | 0 | 112.2 | G144 V145 I273 F291 | G144-V148 WeakPolarHBondContact O-CB 3.38Å; G144-V148 VanDerWaalsContact O-CG2 3.31Å; G144-V148 WeakPolarHBondContact O-CG2 3.43Å; G144-V148 PolarHBondContact O-N 3.13Å; V145-V148 PolarHBondContact O-N 3.49Å; V148-I273 HydrophobicContact CG1-CG1 4.48Å; V148-I273 HydrophobicContact CG2-CG1 4.34Å; V148-F291 HydrophobicContact CB-CD2 4.37Å; V148-F291 HydrophobicContact CG1-CD2 3.77Å; V148-F291 HydrophobicContact CG1-CE2 3.71Å; V148-F291 HydrophobicContact CG2-CD2 4.22Å; V148-F291 HydrophobicContact CG2-CE2 4.4Å |
| 149 | E | 77.1 | Confident | 69.7 | Low | 63 Ų | 63 | 71.7 Ų | 71.7 | 29% | 0.294 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -94.2 | -4.3 | -172.4 | -70.1 | -165.6 | -139.9 | 0 | 0 | 114.4 | Q108 V145 P151 I272 | Q108-E149 HydrophobicContact CG-CB 3.93Å; Q108-E149 PolarHBondContact NE2-OE1 3.39Å; Q108-E149 PolarHBondContact NE2-OE2 3.5Å; Q108-E149 PolarHBondContact OE1-OE2 2.71Å; V145-E149 HydrophobicContact CG1-CG 4.29Å; V145-E149 WeakPolarHBondContact CG1-OE1 3.43Å; V145-E149 PolarHBondContact O-N 3.21Å; E149-P151 WeakPolarHBondContact O-CD 3.23Å; E149-P151 VanDerWaalsContact O-N 3.12Å; E149-I272 HydrophobicContact CG-CG2 4.36Å; E149-I272 WeakPolarHBondContact OE1-CD1 3.32Å |
| 150 | S | 68 | Low | 67.1 | Low | 37 Ų | 37 | 72.7 Ų | 72.7 | 26% | 0.259 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -59.4 | 117.4 | 172 | -74.4 | 0 | 0 | 0 | 0 | 109.2 | A146 V152 | A146-S150 WeakPolarHBondContact O-CB 3.28Å; A146-S150 PolarHBondContact O-N 2.75Å; A146-S150 PolarHBondContact O-OG 3.17Å; S150-V152 VanDerWaalsContact C-N 3.34Å; S150-V152 WeakPolarHBondContact O-CG2 3.39Å; S150-V152 PolarHBondContact O-N 3.16Å |
| 151 | P | 58.8 | Low | 64.6 | Low | 49 Ų | 49 | 76.8 Ų | 76.8 | 32% | 0.318 | 43% | 0.425 | S | S | . | . | trans | -64.1 | 93.2 | 175.4 | 25.1 | -36.4 | 0 | 0 | 0 | 109.8 | A104 V105 E149 N153 | A104-P151 HydrophobicContact CB-CG 4.12Å; V105-P151 HydrophobicContact CG2-CG 3.64Å; E149-P151 WeakPolarHBondContact O-CD 3.23Å; E149-P151 VanDerWaalsContact O-N 3.12Å; P151-N153 PolarHBondContact O-N 3.45Å; P151-N153 VanDerWaalsContact O-N 3.12Å | ||
| 152 | V | 51 | Low | 62.8 | Low | 78 Ų | 78 | 83.5 Ų | 83.5 | 47% | 0.473 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -21.7 | -173.9 | 177.2 | 0 | 0 | 0 | 0 | 112.2 | S150 | S150-V152 VanDerWaalsContact C-N 3.34Å; S150-V152 WeakPolarHBondContact O-CG2 3.39Å; S150-V152 PolarHBondContact O-N 3.16Å |
| 153 | N | 39.3 | Very low | 61.1 | Low | 146 Ų | 146 | 85.3 Ų | 85.3 | 78% | 0.781 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -131.9 | 33.2 | -174 | -70.9 | -20.6 | 0 | 0 | 0 | 114.5 | P151 N155 | P151-N153 PolarHBondContact O-N 3.45Å; P151-N153 VanDerWaalsContact O-N 3.12Å; N153-N155 PolarHBondContact O-N 3.45Å |
| 154 | S | 43.1 | Very low | 60.2 | Low | 82 Ų | 82 | 87.6 Ų | 87.6 | 57% | 0.573 | 49% | 0.487 | S | S | * | . | trans | -71.6 | 84.5 | 159.5 | -65.6 | 0 | 0 | 0 | 0 | 107.9 | K156 | S154-K156 PolarHBondContact O-N 2.94Š| ||
| 155 | N | 38.5 | Very low | 60.1 | Low | 139 Ų | 139 | 91.1 Ų | 91.1 | 74% | 0.743 | 51% | 0.506 | S | S | * | . | trans | -34.2 | 126.8 | 146.1 | -87.6 | -18.6 | 0 | 0 | 0 | 106.3 | N153 T157 | N153-N155 PolarHBondContact O-N 3.45Å; N155-T157 PolarHBondContact O-N 3.46Å | ||
| 156 | K | 40.8 | Very low | 60.1 | Low | 198 Ų | 198 | 93.6 Ų | 93.6 | 86% | 0.861 | 52% | 0.522 | S | S | * | . | trans | -48.8 | 84.5 | 175.1 | -64.5 | 172.7 | 179.2 | 176.9 | 0 | 108.6 | S154 N158 | S154-K156 PolarHBondContact O-N 2.94Å; K156-N158 PolarHBondContact O-N 3.44Å; K156-N158 VanDerWaalsContact O-N 3.13Å | ||
| 157 | T | 43.2 | Very low | 60.4 | Low | 101 Ų | 101 | 97.5 Ų | 97.5 | 62% | 0.62 | 55% | 0.546 | S | S | * | . | trans | -74.7 | 112.1 | 175.1 | 43.1 | 0 | 0 | 0 | 0 | 103.1 | N155 H159 | N155-T157 PolarHBondContact O-N 3.46Å; T157-H159 PolarHBondContact O-N 2.85Å | ||
| 158 | N | 40.8 | Very low | 60.8 | Low | 157 Ų | 157 | 99.3 Ų | 99.3 | 84% | 0.84 | 55% | 0.554 | S | S | * | * | trans | -63.3 | 58.5 | -178.1 | -64.7 | -45.5 | 0 | 0 | 0 | 111.1 | K156 P160 | K156-N158 PolarHBondContact O-N 3.44Å; K156-N158 VanDerWaalsContact O-N 3.13Å; N158-P160 WeakPolarHBondContact O-CD 3.48Å | ||
| 159 | H | 49.5 | Very low | 61.3 | Low | 165 Ų | 165 | 98.5 Ų | 98.5 | 76% | 0.764 | 55% | 0.549 | S | S | * | . | trans | -71.7 | 119.3 | 167 | -78.9 | -64.8 | 0 | 0 | 0 | 107.6 | T157 | T157-H159 PolarHBondContact O-N 2.85Š| ||
| 160 | P | 41 | Very low | 62.2 | Low | 98 Ų | 98 | 99.4 Ų | 99.4 | 64% | 0.636 | 56% | 0.556 | S | S | * | * | trans | -64.1 | 161.2 | -172.2 | 26.5 | -34.1 | 0 | 0 | 0 | 111.8 | N158 I162 | N158-P160 WeakPolarHBondContact O-CD 3.48Å; P160-I162 PolarHBondContact O-N 2.87Å | ||
| 161 | P | 44.7 | Very low | 63.6 | Low | 119 Ų | 119 | 103.9 Ų | 103.9 | 77% | 0.773 | 57% | 0.571 | S | S | * | * | trans | -78.8 | 84.3 | -160.6 | 33.8 | -33.9 | 0 | 0 | 0 | 110.2 | A163 | P161-A163 VanDerWaalsContact C-N 3.28Å; P161-A163 PolarHBondContact O-N 3.42Å | ||
| 162 | I | 55.7 | Low | 65.4 | Low | 140 Ų | 140 | 101.9 Ų | 101.9 | 72% | 0.718 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -69.1 | 98.8 | 159.8 | -58.7 | 173.8 | 0 | 0 | 0 | 105.4 | P160 Y164 | P160-I162 PolarHBondContact O-N 2.87Å; I162-Y164 VanDerWaalsContact C-N 3.28Å; I162-Y164 PolarHBondContact O-N 3.2Å |
| 163 | A | 57.7 | Low | 67.6 | Low | 80 Ų | 80 | 98.1 Ų | 98.1 | 66% | 0.661 | 54% | 0.535 | S | S | * | . | trans | 23.3 | 64.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | N101 P161 N165 | N101-A163 PolarHBondContact OD1-O 2.91Å; P161-A163 VanDerWaalsContact C-N 3.28Å; P161-A163 PolarHBondContact O-N 3.42Å; A163-N165 PolarHBondContact O-N 3.4Å | ||
| 164 | Y | 74.3 | Confident | 70.4 | Confident | 118 Ų | 118 | 93.4 Ų | 93.4 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | trans | -71.6 | 99.7 | -177.3 | -149.2 | -104.4 | 0 | 0 | 0 | 107.5 | D103 I162 P166 | D103-Y164 VanDerWaalsContact CA-OH 3.24Å; D103-Y164 WeakPolarHBondContact CA-OH 3.35Å; D103-Y164 VanDerWaalsContact CB-OH 3.25Å; D103-Y164 WeakPolarHBondContact CB-OH 3.38Å; D103-Y164 PolarHBondContact N-OH 2.91Å; I162-Y164 VanDerWaalsContact C-N 3.28Å; I162-Y164 PolarHBondContact O-N 3.2Å; Y164-P166 VanDerWaalsContact C-CD 3.44Å; Y164-P166 HydrophobicContact CD1-CG 3.66Å; Y164-P166 HydrophobicContact CE1-CG 3.95Å; Y164-P166 WeakPolarHBondContact O-CD 3.32Å | ||
| 165 | N | 89.6 | Confident | 73 | Confident | 74 Ų | 74 | 91.1 Ų | 91.1 | 40% | 0.396 | 50% | 0.495 | S | S | . | . | trans | -110.6 | 83.4 | 174.6 | -173 | -17.6 | 0 | 0 | 0 | 108.7 | N101 A163 P167 L168 G169 | N101-N165 PolarHBondContact OD1-N 2.91Å; A163-N165 PolarHBondContact O-N 3.4Å; N165-P167 VanDerWaalsContact C-N 3.34Å; N165-P167 VanDerWaalsContact OD1-CD 3.28Å; N165-P167 WeakPolarHBondContact OD1-CD 3.41Å; N165-L168 HydrophobicContact CB-CB 3.92Å; N165-L168 HydrophobicContact CB-CD2 4.48Å; N165-L168 WeakPolarHBondContact O-CB 3.47Å; N165-L168 PolarHBondContact O-N 3.08Å; N165-L168 PolarHBondContact OD1-N 3.38Å; N165-G169 PolarHBondContact O-N 3.49Å | ||
| 166 | P | 91.3 | Very high | 75.9 | Confident | 57 Ų | 57 | 84.5 Ų | 84.5 | 37% | 0.37 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -55.2 | -40 | -177.8 | -22.2 | 29.3 | 0 | 0 | 0 | 114.2 | L102 Y164 L168 G169 L170 | L102-P166 HydrophobicContact CD2-CB 4.09Å; Y164-P166 VanDerWaalsContact C-CD 3.44Å; Y164-P166 HydrophobicContact CD1-CG 3.66Å; Y164-P166 HydrophobicContact CE1-CG 3.95Å; Y164-P166 WeakPolarHBondContact O-CD 3.32Å; P166-L168 PolarHBondContact O-N 3.45Å; P166-G169 PolarHBondContact O-N 3.49Å; P166-L170 VanDerWaalsContact O-CB 3.28Å; P166-L170 WeakPolarHBondContact O-CB 3.32Å; P166-L170 PolarHBondContact O-N 3.39Å |
| 167 | P | 93.9 | Very high | 78.6 | Confident | 93 Ų | 93 | 75.1 Ų | 75.1 | 60% | 0.604 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -57 | -45 | 173.4 | -27.1 | 34.2 | 0 | 0 | 0 | 113.6 | N165 F171 | N165-P167 VanDerWaalsContact C-N 3.34Å; N165-P167 VanDerWaalsContact OD1-CD 3.28Å; N165-P167 WeakPolarHBondContact OD1-CD 3.41Å; P167-F171 WeakPolarHBondContact O-CB 3.44Å; P167-F171 PolarHBondContact O-N 2.76Å |
| 168 | L | 94.7 | Very high | 81.2 | Confident | 74 Ų | 74 | 73.6 Ų | 73.6 | 39% | 0.387 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 176.1 | 176.2 | 65.2 | 0 | 0 | 0 | 111.1 | N165 P166 L170 F171 C172 | N165-L168 HydrophobicContact CB-CB 3.92Å; N165-L168 HydrophobicContact CB-CD2 4.48Å; N165-L168 WeakPolarHBondContact O-CB 3.47Å; N165-L168 PolarHBondContact O-N 3.08Å; N165-L168 PolarHBondContact OD1-N 3.38Å; P166-L168 PolarHBondContact O-N 3.45Å; L168-L170 VanDerWaalsContact C-N 3.34Å; L168-L170 PolarHBondContact O-N 3.36Å; L168-F171 PolarHBondContact O-N 2.81Å; L168-C172 WeakPolarHBondContact O-CB 3.47Å; L168-C172 PolarHBondContact O-N 3.42Å; L168-C172 PolarHBondContact O-SG 2.71Å; L168-C172 VanDerWaalsContact O-SG 3.34Å |
| 169 | G | 94.8 | Very high | 84 | Confident | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -61.5 | -41.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A98 L102 N165 P166 C172 A173 | A98-G169 WeakPolarHBondContact CB-O 3.42Å; L102-G169 VanDerWaalsContact CD1-C 3.46Å; N165-G169 PolarHBondContact O-N 3.49Å; P166-G169 PolarHBondContact O-N 3.49Å; G169-C172 PolarHBondContact O-N 2.93Å; G169-A173 WeakPolarHBondContact O-CB 3.23Å; G169-A173 PolarHBondContact O-N 3.37Å |
| 170 | L | 95.6 | Very high | 86.3 | Confident | 82 Ų | 82 | 60.6 Ų | 60.6 | 43% | 0.429 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65 | -45 | 175.9 | -177 | 64.4 | 0 | 0 | 0 | 111.2 | A110 P166 L168 C172 A173 V174 | A110-L170 HydrophobicContact CB-CD1 3.75Å; P166-L170 VanDerWaalsContact O-CB 3.28Å; P166-L170 WeakPolarHBondContact O-CB 3.32Å; P166-L170 PolarHBondContact O-N 3.39Å; L168-L170 VanDerWaalsContact C-N 3.34Å; L168-L170 PolarHBondContact O-N 3.36Å; L170-C172 VanDerWaalsContact C-N 3.34Å; L170-C172 PolarHBondContact O-N 3.04Å; L170-A173 PolarHBondContact O-N 2.75Å; L170-V174 HydrophobicContact CD1-CG2 4.45Å; L170-V174 WeakPolarHBondContact O-CG2 3.31Å; L170-V174 PolarHBondContact O-N 2.64Å |
| 171 | F | 97.4 | Very high | 89 | Confident | 131 Ų | 131 | 56 Ų | 56 | 58% | 0.575 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -56.9 | -47.6 | 174.2 | 174.7 | -100.4 | 0 | 0 | 0 | 111.5 | P167 L168 A173 V174 C175 | P167-F171 WeakPolarHBondContact O-CB 3.44Å; P167-F171 PolarHBondContact O-N 2.76Å; L168-F171 PolarHBondContact O-N 2.81Å; F171-A173 PolarHBondContact O-N 3.42Å; F171-V174 PolarHBondContact O-N 2.86Å; F171-C175 VanDerWaalsContact CZ-SG 3.6Å; F171-C175 WeakPolarHBondContact O-CB 3.26Å; F171-C175 PolarHBondContact O-N 3.33Å; F171-C175 PolarHBondContact O-SG 3.03Å; F171-C175 VanDerWaalsContact O-SG 3.35Å |
| 172 | C | 97.7 | Very high | 91.5 | Very high | 7 Ų | 7 | 52.4 Ų | 52.4 | 5% | 0.047 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -61.4 | -42.8 | 176.7 | -71.6 | 0 | 0 | 0 | 0 | 112.4 | L94 A98 L168 G169 L170 C175 A176 | L94-C172 HydrophobicContact CB-CB 4.43Å; L94-C172 HydrophobicContact CD2-CB 4.33Å; A98-C172 HydrophobicContact CB-CB 3.91Å; L168-C172 WeakPolarHBondContact O-CB 3.47Å; L168-C172 PolarHBondContact O-N 3.42Å; L168-C172 PolarHBondContact O-SG 2.71Å; L168-C172 VanDerWaalsContact O-SG 3.34Å; G169-C172 PolarHBondContact O-N 2.93Å; L170-C172 VanDerWaalsContact C-N 3.34Å; L170-C172 PolarHBondContact O-N 3.04Å; C172-C175 PolarHBondContact O-N 3.44Å; C172-A176 VanDerWaalsContact O-CB 3.22Å; C172-A176 WeakPolarHBondContact O-CB 3.29Å; C172-A176 PolarHBondContact O-N 3.25Å |
| 173 | A | 96.7 | Very high | 93.5 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.3 | -43.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A98 L102 A110 G169 L170 F171 A176 S177 | A98-A173 HydrophobicContact CB-CB 4Å; L102-A173 HydrophobicContact CD1-CB 4.31Å; A110-A173 HydrophobicContact CB-CB 3.73Å; G169-A173 WeakPolarHBondContact O-CB 3.23Å; G169-A173 PolarHBondContact O-N 3.37Å; L170-A173 PolarHBondContact O-N 2.75Å; F171-A173 PolarHBondContact O-N 3.42Å; A173-A176 PolarHBondContact O-N 2.87Å; A173-S177 WeakPolarHBondContact O-CB 3.27Å; A173-S177 PolarHBondContact O-N 3.44Å |
| 174 | V | 97.8 | Very high | 95.4 | Very high | 47 Ų | 47 | 42.2 Ų | 42.2 | 29% | 0.285 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -64.6 | -49.4 | 176.7 | 173.1 | 0 | 0 | 0 | 0 | 110.5 | L113 L170 F171 A176 S177 I178 | L113-V174 HydrophobicContact CD1-CG2 4Å; L170-V174 HydrophobicContact CD1-CG2 4.45Å; L170-V174 WeakPolarHBondContact O-CG2 3.31Å; L170-V174 PolarHBondContact O-N 2.64Å; F171-V174 PolarHBondContact O-N 2.86Å; V174-A176 VanDerWaalsContact C-N 3.33Å; V174-A176 PolarHBondContact O-N 3.21Å; V174-S177 WeakPolarHBondContact O-CB 3.41Å; V174-S177 PolarHBondContact O-N 2.96Å; V174-S177 VanDerWaalsContact O-N 3.09Å; V174-S177 PolarHBondContact O-OG 3.25Å; V174-I178 HydrophobicContact CG1-CD1 4.01Å; V174-I178 WeakPolarHBondContact O-CG1 3.29Å; V174-I178 PolarHBondContact O-N 2.92Å |
| 175 | C | 98.4 | Very high | 96.5 | Very high | 33 Ų | 33 | 36.6 Ų | 36.6 | 22% | 0.223 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.7 | -43.9 | 176.2 | -72.9 | 0 | 0 | 0 | 0 | 111.9 | L94 F171 C172 S177 I178 L179 | L94-C175 HydrophobicContact CD1-CB 3.78Å; F171-C175 VanDerWaalsContact CZ-SG 3.6Å; F171-C175 WeakPolarHBondContact O-CB 3.26Å; F171-C175 PolarHBondContact O-N 3.33Å; F171-C175 PolarHBondContact O-SG 3.03Å; F171-C175 VanDerWaalsContact O-SG 3.35Å; C172-C175 PolarHBondContact O-N 3.44Å; C175-S177 VanDerWaalsContact C-N 3.3Å; C175-S177 PolarHBondContact O-N 2.91Å; C175-I178 PolarHBondContact O-N 2.67Å; C175-L179 WeakPolarHBondContact O-CB 3.26Å; C175-L179 WeakPolarHBondContact O-CG 3.2Å; C175-L179 PolarHBondContact O-N 3.48Å |
| 176 | A | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61 | -39.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q91 L94 L95 Y111 C172 A173 V174 S180 | Q91-A176 HydrophobicContact CG-CB 4.14Å; Q91-A176 WeakPolarHBondContact CG-O 3.35Å; L94-A176 HydrophobicContact CB-CB 3.93Å; L95-A176 HydrophobicContact CD2-CB 3.59Å; L95-A176 HydrophobicContact CG-CB 3.92Å; Y111-A176 HydrophobicContact CE2-CB 4.45Å; C172-A176 VanDerWaalsContact O-CB 3.22Å; C172-A176 WeakPolarHBondContact O-CB 3.29Å; C172-A176 PolarHBondContact O-N 3.25Å; A173-A176 PolarHBondContact O-N 2.87Å; V174-A176 VanDerWaalsContact C-N 3.33Å; V174-A176 PolarHBondContact O-N 3.21Å; A176-S180 VanDerWaalsContact O-CB 3.25Å; A176-S180 WeakPolarHBondContact O-CB 3.49Å; A176-S180 PolarHBondContact O-N 3.32Å |
| 177 | S | 97.7 | Very high | 97.1 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.007 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.6 | -38.4 | 177.4 | 83.4 | 0 | 0 | 0 | 0 | 112.5 | T117 A173 V174 C175 G181 | T117-S177 PolarHBondContact OG1-O 3.23Å; A173-S177 WeakPolarHBondContact O-CB 3.27Å; A173-S177 PolarHBondContact O-N 3.44Å; V174-S177 WeakPolarHBondContact O-CB 3.41Å; V174-S177 PolarHBondContact O-N 2.96Å; V174-S177 VanDerWaalsContact O-N 3.09Å; V174-S177 PolarHBondContact O-OG 3.25Å; C175-S177 VanDerWaalsContact C-N 3.3Å; C175-S177 PolarHBondContact O-N 2.91Å; S177-G181 PolarHBondContact O-N 3.49Å; S177-G181 VanDerWaalsContact O-N 3.11Å |
| 178 | I | 98.5 | Very high | 97.2 | Very high | 69 Ų | 69 | 28.5 Ų | 28.5 | 35% | 0.354 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -67 | -50.4 | 176.2 | -66.2 | 167.7 | 0 | 0 | 0 | 110 | T117 F121 V174 C175 S180 G181 L182 | T117-I178 HydrophobicContact CG2-CB 4.41Å; T117-I178 HydrophobicContact CG2-CG1 3.82Å; F121-I178 HydrophobicContact CE2-CG2 3.88Å; F121-I178 WeakPolarHBondContact CE2-O 3.39Å; F121-I178 HydrophobicContact CZ-CG2 3.95Å; V174-I178 HydrophobicContact CG1-CD1 4.01Å; V174-I178 WeakPolarHBondContact O-CG1 3.29Å; V174-I178 PolarHBondContact O-N 2.92Å; C175-I178 PolarHBondContact O-N 2.67Å; I178-S180 VanDerWaalsContact C-N 3.29Å; I178-S180 PolarHBondContact O-N 3.17Å; I178-G181 PolarHBondContact O-N 3.25Å; I178-L182 PolarHBondContact O-N 3.32Å |
| 179 | L | 98.6 | Very high | 97.2 | Very high | 42 Ų | 42 | 26.9 Ų | 26.9 | 22% | 0.22 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | 177.5 | -70.2 | -176.6 | 0 | 0 | 0 | 112 | I87 I90 Q91 L94 C175 L182 A183 | I87-L179 HydrophobicContact CG2-CB 3.73Å; I87-L179 HydrophobicContact CG2-CD2 4.07Å; I87-L179 HydrophobicContact CG2-CG 4.35Å; I87-L179 WeakPolarHBondContact CG2-O 3.43Å; I90-L179 HydrophobicContact CB-CD1 4.35Å; I90-L179 HydrophobicContact CG2-CD1 3.72Å; Q91-L179 HydrophobicContact CB-CB 4.19Å; L94-L179 HydrophobicContact CD1-CD1 3.85Å; C175-L179 WeakPolarHBondContact O-CB 3.26Å; C175-L179 WeakPolarHBondContact O-CG 3.2Å; C175-L179 PolarHBondContact O-N 3.48Å; L179-L182 PolarHBondContact O-N 2.85Å; L179-A183 WeakPolarHBondContact O-CB 3.29Å; L179-A183 PolarHBondContact O-N 2.96Å |
| 180 | S | 97.4 | Very high | 97.2 | Very high | 8 Ų | 8 | 27.2 Ų | 27.2 | 6% | 0.056 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.2 | -49 | 174.3 | -169.6 | 0 | 0 | 0 | 0 | 112 | Q91 A176 I178 L182 A183 C184 | Q91-S180 VanDerWaalsContact CD-CB 3.49Å; Q91-S180 PolarHBondContact NE2-OG 2.86Å; Q91-S180 VanDerWaalsContact OE1-CA 3.23Å; A176-S180 VanDerWaalsContact O-CB 3.25Å; A176-S180 WeakPolarHBondContact O-CB 3.49Å; A176-S180 PolarHBondContact O-N 3.32Å; I178-S180 VanDerWaalsContact C-N 3.29Å; I178-S180 PolarHBondContact O-N 3.17Å; S180-L182 VanDerWaalsContact C-N 3.34Å; S180-L182 PolarHBondContact O-N 3.5Å; S180-A183 PolarHBondContact O-N 3.44Å; S180-C184 WeakPolarHBondContact O-CB 3.13Å; S180-C184 PolarHBondContact O-N 3.15Å; S180-C184 PolarHBondContact O-SG 2.97Å |
| 181 | G | 97.5 | Very high | 97.2 | Very high | 0 Ų | 0 | 23.5 Ų | 23.5 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -62.2 | -42.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T118 S177 I178 V185 | T118-G181 WeakPolarHBondContact OG1-CA 3.46Å; S177-G181 PolarHBondContact O-N 3.49Å; S177-G181 VanDerWaalsContact O-N 3.11Å; I178-G181 PolarHBondContact O-N 3.25Å; G181-V185 WeakPolarHBondContact O-CG2 3.41Å; G181-V185 PolarHBondContact O-N 3.43Å |
| 182 | L | 98.1 | Very high | 97 | Very high | 45 Ų | 45 | 20 Ų | 20 | 24% | 0.236 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.3 | -51.2 | 177 | -178.5 | 62.3 | 0 | 0 | 0 | 111.7 | I87 F121 I125 I178 L179 S180 C184 V185 F186 | I87-L182 HydrophobicContact CD1-CD2 4.09Å; I87-L182 HydrophobicContact CD1-CG 4.27Å; F121-L182 HydrophobicContact CD1-CD1 3.98Å; F121-L182 HydrophobicContact CD2-CB 4Å; F121-L182 HydrophobicContact CE1-CD1 4Å; F121-L182 HydrophobicContact CE2-CB 3.82Å; F121-L182 HydrophobicContact CG-CD1 4.28Å; F121-L182 HydrophobicContact CZ-CB 4.18Å; F121-L182 HydrophobicContact CZ-CD1 4.31Å; I125-L182 HydrophobicContact CD1-CD1 3.63Å; I178-L182 PolarHBondContact O-N 3.32Å; L179-L182 PolarHBondContact O-N 2.85Å; S180-L182 VanDerWaalsContact C-N 3.34Å; S180-L182 PolarHBondContact O-N 3.5Å; L182-C184 VanDerWaalsContact C-N 3.34Å; L182-C184 PolarHBondContact O-N 3.48Å; L182-V185 PolarHBondContact O-N 3.18Å; L182-F186 VanDerWaalsContact O-CB 3.3Å; L182-F186 WeakPolarHBondContact O-CB 3.39Å; L182-F186 PolarHBondContact O-N 3.37Å |
| 183 | A | 97.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.6 | -41.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112 | I87 Y88 L179 S180 F187 | I87-A183 HydrophobicContact CB-CB 4.06Å; I87-A183 HydrophobicContact CG2-CB 3.7Å; Y88-A183 HydrophobicContact CD1-CB 4.13Å; Y88-A183 HydrophobicContact CD2-CB 4.16Å; Y88-A183 HydrophobicContact CE1-CB 3.75Å; Y88-A183 HydrophobicContact CE2-CB 3.79Å; Y88-A183 HydrophobicContact CG-CB 4.3Å; L179-A183 WeakPolarHBondContact O-CB 3.29Å; L179-A183 PolarHBondContact O-N 2.96Å; S180-A183 PolarHBondContact O-N 3.44Å; A183-F187 WeakPolarHBondContact O-CB 3.34Å; A183-F187 PolarHBondContact O-N 3.47Å |
| 184 | C | 96.6 | Very high | 96.1 | Very high | 5 Ų | 5 | 26.9 Ų | 26.9 | 3% | 0.034 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -56.9 | -56.2 | 174.4 | -74.5 | 0 | 0 | 0 | 0 | 110.1 | Y88 T118 S180 L182 F186 F187 E188 N261 | Y88-C184 PolarHBondContact OH-N 2.99Å; Y88-C184 PolarHBondContact OH-SG 3Å; T118-C184 HydrophobicContact CG2-CB 4.34Å; S180-C184 WeakPolarHBondContact O-CB 3.13Å; S180-C184 PolarHBondContact O-N 3.15Å; S180-C184 PolarHBondContact O-SG 2.97Å; L182-C184 VanDerWaalsContact C-N 3.34Å; L182-C184 PolarHBondContact O-N 3.48Å; C184-F186 PolarHBondContact O-N 2.95Å; C184-F187 WeakPolarHBondContact O-CB 3.12Å; C184-F187 PolarHBondContact O-N 3.48Å; C184-E188 PolarHBondContact O-N 3.04Å; C184-N261 HydrophobicContact CB-CB 4.23Å; C184-N261 PolarHBondContact O-ND2 3.03Å |
| 185 | V | 97.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -66.5 | -37.9 | -175.3 | 175.8 | 0 | 0 | 0 | 0 | 112.1 | T118 F121 I125 L126 G181 L182 F187 E188 M189 | T118-V185 HydrophobicContact CG2-CG2 4.08Å; T118-V185 VanDerWaalsContact O-CG2 3.3Å; T118-V185 WeakPolarHBondContact O-CG2 3.4Å; F121-V185 HydrophobicContact CB-CB 4.02Å; F121-V185 HydrophobicContact CB-CG1 4.3Å; F121-V185 HydrophobicContact CB-CG2 3.82Å; I125-V185 HydrophobicContact CB-CG1 3.94Å; I125-V185 HydrophobicContact CD1-CG1 4.18Å; I125-V185 HydrophobicContact CG2-CG1 4.31Å; L126-V185 HydrophobicContact CD1-CG1 3.86Å; L126-V185 HydrophobicContact CG-CG1 3.8Å; G181-V185 WeakPolarHBondContact O-CG2 3.41Å; G181-V185 PolarHBondContact O-N 3.43Å; L182-V185 PolarHBondContact O-N 3.18Å; V185-F187 VanDerWaalsContact C-N 3.34Å; V185-E188 WeakPolarHBondContact O-CB 3.34Å; V185-E188 PolarHBondContact O-N 3.17Å; V185-M189 PolarHBondContact O-N 2.91Å |
| 186 | F | 96.8 | Very high | 95.1 | Very high | 31 Ų | 31 | 31.9 Ų | 31.9 | 14% | 0.136 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.9 | -42.4 | 174.7 | -162.8 | -84.6 | 0 | 0 | 0 | 111.4 | M80 I83 P84 L182 C184 E188 M189 L190 | M80-F186 HydrophobicContact CB-CE1 4.46Å; M80-F186 HydrophobicContact CB-CZ 4.49Å; M80-F186 WeakPolarHBondContact O-CE1 3.41Å; I83-F186 HydrophobicContact CB-CD1 4.45Å; I83-F186 HydrophobicContact CB-CE1 3.97Å; I83-F186 HydrophobicContact CB-CZ 4.26Å; I83-F186 HydrophobicContact CD1-CE1 4.12Å; I83-F186 HydrophobicContact CD1-CE2 4.41Å; I83-F186 HydrophobicContact CD1-CZ 3.66Å; I83-F186 HydrophobicContact CG2-CD1 4.34Å; I83-F186 HydrophobicContact CG2-CE1 4.15Å; I83-F186 HydrophobicContact CG2-CE2 4.46Å; I83-F186 HydrophobicContact CG2-CZ 4.23Å; P84-F186 HydrophobicContact CG-CD1 4.32Å; L182-F186 VanDerWaalsContact O-CB 3.3Å; L182-F186 WeakPolarHBondContact O-CB 3.39Å; L182-F186 PolarHBondContact O-N 3.37Å; C184-F186 PolarHBondContact O-N 2.95Å; F186-E188 VanDerWaalsContact C-N 3.32Å; F186-E188 PolarHBondContact O-N 2.81Å; F186-M189 HydrophobicContact CD2-CE 3.63Å; F186-M189 HydrophobicContact CE1-CE 4.35Å; F186-M189 HydrophobicContact CE2-CE 3.38Å; F186-M189 HydrophobicContact CG-CE 4.21Å; F186-M189 HydrophobicContact CZ-CE 3.77Å; F186-M189 WeakPolarHBondContact O-CB 3.22Å; F186-M189 PolarHBondContact O-N 3.46Å; F186-M189 VanDerWaalsContact O-N 3.14Å; F186-L190 HydrophobicContact CD1-CD1 3.71Å; F186-L190 HydrophobicContact CD1-CD2 4.49Å; F186-L190 HydrophobicContact CD1-CG 3.88Å; F186-L190 HydrophobicContact CE1-CD1 3.69Å; F186-L190 HydrophobicContact CE1-CD2 3.86Å; F186-L190 HydrophobicContact CE1-CG 3.75Å; F186-L190 WeakPolarHBondContact O-CG 3.28Å; F186-L190 PolarHBondContact O-N 3.37Å |
| 187 | F | 96.7 | Very high | 94.8 | Very high | 23 Ų | 23 | 33.8 Ų | 33.8 | 10% | 0.101 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.3 | -42.1 | 171.9 | 170.4 | -101.2 | 0 | 0 | 0 | 112.4 | A183 C184 V185 M189 L190 L191 L205 V252 A253 V256 | A183-F187 WeakPolarHBondContact O-CB 3.34Å; A183-F187 PolarHBondContact O-N 3.47Å; C184-F187 WeakPolarHBondContact O-CB 3.12Å; C184-F187 PolarHBondContact O-N 3.48Å; V185-F187 VanDerWaalsContact C-N 3.34Å; F187-M189 VanDerWaalsContact C-N 3.34Å; F187-M189 PolarHBondContact O-N 3.38Å; F187-L190 PolarHBondContact O-N 2.97Å; F187-L191 HydrophobicContact CD1-CD1 4.05Å; F187-L191 HydrophobicContact CD2-CD1 4.47Å; F187-L191 HydrophobicContact CE1-CD1 3.47Å; F187-L191 VanDerWaalsContact CE1-CD1 3.47Å; F187-L191 HydrophobicContact CE2-CD1 3.97Å; F187-L191 HydrophobicContact CE2-CG 4.4Å; F187-L191 HydrophobicContact CZ-CD1 3.44Å; F187-L191 VanDerWaalsContact CZ-CD1 3.44Å; F187-L191 HydrophobicContact CZ-CG 4.34Å; F187-L191 WeakPolarHBondContact O-CG 3.3Å; F187-L191 PolarHBondContact O-N 3.42Å; F187-L191 VanDerWaalsContact O-N 3.16Å; F187-L205 HydrophobicContact CD2-CD1 3.97Å; F187-L205 HydrophobicContact CD2-CD2 4Å; F187-L205 HydrophobicContact CE2-CD1 3.48Å; F187-L205 VanDerWaalsContact CE2-CD1 3.48Å; F187-L205 HydrophobicContact CE2-CD2 4.24Å; F187-L205 HydrophobicContact CE2-CG 4.47Å; F187-V252 HydrophobicContact CE1-CG1 4.2Å; F187-A253 HydrophobicContact CZ-CB 3.97Å; F187-V256 HydrophobicContact CD1-CB 4.34Å; F187-V256 HydrophobicContact CD1-CG1 3.96Å; F187-V256 HydrophobicContact CD1-CG2 4.25Å; F187-V256 HydrophobicContact CE1-CB 3.88Å; F187-V256 HydrophobicContact CE1-CG1 3.97Å; F187-V256 HydrophobicContact CE1-CG2 3.87Å |
| 188 | E | 96.8 | Very high | 94.6 | Very high | 1 Ų | 1 | 34.8 Ų | 34.8 | 1% | 0.005 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.9 | -41 | 173.4 | 176.5 | 170 | 174.3 | 0 | 0 | 112.6 | L126 K128 C184 V185 F186 L191 K192 V256 N260 N261 | L126-E188 HydrophobicContact CD1-CB 4.05Å; L126-E188 HydrophobicContact CD1-CG 3.55Å; K128-E188 IonicContact NZ-OE1 2.72Å; K128-E188 PolarHBondContact NZ-OE1 3.14Å; C184-E188 PolarHBondContact O-N 3.04Å; V185-E188 WeakPolarHBondContact O-CB 3.34Å; V185-E188 PolarHBondContact O-N 3.17Å; F186-E188 VanDerWaalsContact C-N 3.32Å; F186-E188 PolarHBondContact O-N 2.81Å; E188-L191 PolarHBondContact O-N 3.2Å; E188-K192 HydrophobicContact CG-CD 3.76Å; E188-K192 HydrophobicContact CG-CG 4.39Å; E188-K192 WeakPolarHBondContact O-CB 3.33Å; E188-K192 WeakPolarHBondContact O-CG 3.34Å; E188-K192 PolarHBondContact O-N 3.36Å; E188-K192 IonicContact OE1-NZ 2.74Å; E188-K192 PolarHBondContact OE1-NZ 3.28Å; E188-V256 HydrophobicContact CB-CG1 3.52Å; E188-V256 HydrophobicContact CG-CG1 3.84Å; E188-N260 WeakPolarHBondContact OE1-CB 3.45Å; E188-N261 VanDerWaalsContact CB-ND2 3.26Å; E188-N261 WeakPolarHBondContact CB-ND2 3.37Å; E188-N261 PolarHBondContact OE2-N 3.43Å |
| 189 | M | 95.8 | Very high | 94.4 | Very high | 40 Ų | 40 | 36.2 Ų | 36.2 | 20% | 0.197 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.5 | -47.5 | 176.6 | -170.2 | -178.1 | 66.3 | 0 | 0 | 111.1 | I125 L126 V185 F186 F187 L191 K192 N193 | I125-M189 HydrophobicContact CG2-SD 3.56Å; I125-M189 VanDerWaalsContact CG2-SD 3.56Å; L126-M189 HydrophobicContact CD2-CB 3.71Å; L126-M189 HydrophobicContact CD2-CG 3.97Å; V185-M189 PolarHBondContact O-N 2.91Å; F186-M189 HydrophobicContact CD2-CE 3.63Å; F186-M189 HydrophobicContact CE1-CE 4.35Å; F186-M189 HydrophobicContact CE2-CE 3.38Å; F186-M189 HydrophobicContact CG-CE 4.21Å; F186-M189 HydrophobicContact CZ-CE 3.77Å; F186-M189 WeakPolarHBondContact O-CB 3.22Å; F186-M189 PolarHBondContact O-N 3.46Å; F186-M189 VanDerWaalsContact O-N 3.14Å; F187-M189 VanDerWaalsContact C-N 3.34Å; F187-M189 PolarHBondContact O-N 3.38Å; M189-L191 VanDerWaalsContact C-N 3.31Å; M189-L191 PolarHBondContact O-N 3.07Å; M189-K192 PolarHBondContact O-N 2.84Å; M189-N193 VanDerWaalsContact CG-ND2 3.33Å; M189-N193 WeakPolarHBondContact CG-ND2 3.39Å; M189-N193 VanDerWaalsContact O-CB 3.31Å; M189-N193 WeakPolarHBondContact O-CB 3.39Å; M189-N193 PolarHBondContact O-N 2.62Å |
| 190 | L | 94.3 | Very high | 94.2 | Very high | 7 Ų | 7 | 34.5 Ų | 34.5 | 4% | 0.037 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.3 | -37.3 | 179.3 | -69.9 | 173.4 | 0 | 0 | 0 | 113.2 | M80 T81 P84 F186 F187 T194 R201 | M80-L190 HydrophobicContact CB-CD2 3.85Å; T81-L190 HydrophobicContact CG2-CD1 4.31Å; P84-L190 HydrophobicContact CG-CD1 3.94Å; F186-L190 HydrophobicContact CD1-CD1 3.71Å; F186-L190 HydrophobicContact CD1-CD2 4.49Å; F186-L190 HydrophobicContact CD1-CG 3.88Å; F186-L190 HydrophobicContact CE1-CD1 3.69Å; F186-L190 HydrophobicContact CE1-CD2 3.86Å; F186-L190 HydrophobicContact CE1-CG 3.75Å; F186-L190 WeakPolarHBondContact O-CG 3.28Å; F186-L190 PolarHBondContact O-N 3.37Å; F187-L190 PolarHBondContact O-N 2.97Å; L190-T194 VanDerWaalsContact O-CG2 3.23Å; L190-T194 WeakPolarHBondContact O-CG2 3.41Å; L190-R201 PolarHBondContact O-NE 3.09Å; L190-R201 PolarHBondContact O-NH2 3.35Å |
| 191 | L | 94.1 | Very high | 94.1 | Very high | 3 Ų | 3 | 34.3 Ų | 34.3 | 2% | 0.016 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -76 | -30 | 179.3 | -73 | 178.7 | 0 | 0 | 0 | 113.4 | F187 E188 M189 R201 L205 A253 V256 | F187-L191 HydrophobicContact CD1-CD1 4.05Å; F187-L191 HydrophobicContact CD2-CD1 4.47Å; F187-L191 HydrophobicContact CE1-CD1 3.47Å; F187-L191 VanDerWaalsContact CE1-CD1 3.47Å; F187-L191 HydrophobicContact CE2-CD1 3.97Å; F187-L191 HydrophobicContact CE2-CG 4.4Å; F187-L191 HydrophobicContact CZ-CD1 3.44Å; F187-L191 VanDerWaalsContact CZ-CD1 3.44Å; F187-L191 HydrophobicContact CZ-CG 4.34Å; F187-L191 WeakPolarHBondContact O-CG 3.3Å; F187-L191 PolarHBondContact O-N 3.42Å; F187-L191 VanDerWaalsContact O-N 3.16Å; E188-L191 PolarHBondContact O-N 3.2Å; M189-L191 VanDerWaalsContact C-N 3.31Å; M189-L191 PolarHBondContact O-N 3.07Å; L191-R201 HydrophobicContact CD2-CB 3.71Å; L191-R201 HydrophobicContact CD2-CG 4.12Å; L191-L205 HydrophobicContact CD2-CD1 4.4Å; L191-A253 HydrophobicContact CD1-CB 4.11Å; L191-V256 HydrophobicContact CD1-CB 4.17Å; L191-V256 HydrophobicContact CD1-CG1 4Å |
| 192 | K | 93.7 | Very high | 94 | Very high | 59 Ų | 59 | 34.9 Ų | 34.9 | 26% | 0.257 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -99.1 | -33.5 | -174.1 | -71.4 | -175.6 | 176.9 | 162.6 | 0 | 114.2 | E188 M189 T194 V256 K257 A259 | E188-K192 HydrophobicContact CG-CD 3.76Å; E188-K192 HydrophobicContact CG-CG 4.39Å; E188-K192 WeakPolarHBondContact O-CB 3.33Å; E188-K192 WeakPolarHBondContact O-CG 3.34Å; E188-K192 PolarHBondContact O-N 3.36Å; E188-K192 IonicContact OE1-NZ 2.74Å; E188-K192 PolarHBondContact OE1-NZ 3.28Å; M189-K192 PolarHBondContact O-N 2.84Å; K192-T194 PolarHBondContact O-N 3.3Å; K192-T194 VanDerWaalsContact O-N 3.14Å; K192-V256 WeakPolarHBondContact CE-O 3.4Å; K192-V256 PolarHBondContact NZ-O 3.34Å; K192-K257 WeakPolarHBondContact CE-O 3.28Å; K192-A259 PolarHBondContact NZ-O 3.18Å |
| 193 | N | 89.4 | Confident | 94 | Very high | 123 Ų | 123 | 33.3 Ų | 33.3 | 66% | 0.658 | 17% | 0.168 | S | C | * | . | S | Bend | trans | -86.9 | 31.8 | -178.6 | -67.7 | -1.4 | 0 | 0 | 0 | 112.2 | M189 | M189-N193 VanDerWaalsContact CG-ND2 3.33Å; M189-N193 WeakPolarHBondContact CG-ND2 3.39Å; M189-N193 VanDerWaalsContact O-CB 3.31Å; M189-N193 WeakPolarHBondContact O-CB 3.39Å; M189-N193 PolarHBondContact O-N 2.62Å |
| 194 | T | 86.6 | Confident | 93.9 | Very high | 27 Ų | 27 | 33.6 Ų | 33.6 | 17% | 0.166 | 17% | 0.169 | C | C | . | . | trans | -142.3 | 149.4 | -177.1 | -166.6 | 0 | 0 | 0 | 0 | 111.2 | L190 K192 K196 R201 | L190-T194 VanDerWaalsContact O-CG2 3.23Å; L190-T194 WeakPolarHBondContact O-CG2 3.41Å; K192-T194 PolarHBondContact O-N 3.3Å; K192-T194 VanDerWaalsContact O-N 3.14Å; T194-K196 VanDerWaalsContact C-N 3.29Å; T194-K196 HydrophobicContact CG2-CB 3.96Å; T194-K196 WeakPolarHBondContact OG1-CB 3.22Å; T194-K196 WeakPolarHBondContact OG1-CG 3.23Å; T194-K196 PolarHBondContact OG1-N 2.91Å; T194-R201 VanDerWaalsContact CB-NH2 3.3Å; T194-R201 HydrophobicContact CG2-CG 4.12Å; T194-R201 PolarHBondContact OG1-NH2 3.28Å | ||
| 195 | N | 84.8 | Confident | 93.8 | Very high | 176 Ų | 176 | 34.1 Ų | 34.1 | 94% | 0.941 | 17% | 0.172 | S | C | * | . | trans | -88.7 | 1.3 | 170.6 | -64.7 | -27.5 | 0 | 0 | 0 | 112.3 | ||||
| 196 | K | 89.7 | Confident | 93.8 | Very high | 10 Ų | 10 | 34.2 Ų | 34.2 | 4% | 0.043 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -65.2 | 145.9 | 176.1 | -69.8 | 177.8 | 177.5 | -179.5 | 0 | 111.2 | L70 D77 T194 H200 R201 E204 | L70-K196 HydrophobicContact CD2-CG 4.1Å; D77-K196 VanDerWaalsContact OD2-CE 3.23Å; D77-K196 WeakPolarHBondContact OD2-CE 3.47Å; D77-K196 IonicContact OD2-NZ 2.72Å; D77-K196 PolarHBondContact OD2-NZ 3.33Å; T194-K196 VanDerWaalsContact C-N 3.29Å; T194-K196 HydrophobicContact CG2-CB 3.96Å; T194-K196 WeakPolarHBondContact OG1-CB 3.22Å; T194-K196 WeakPolarHBondContact OG1-CG 3.23Å; T194-K196 PolarHBondContact OG1-N 2.91Å; K196-H200 HydrophobicContact CB-CB 4.26Å; K196-R201 HydrophobicContact CB-CG 4.05Å; K196-E204 IonicContact NZ-OE1 3.56Å; K196-E204 PolarHBondContact NZ-OE1 3.38Å; K196-E204 IonicContact NZ-OE2 3.66Å |
| 197 | S | 92.3 | Very high | 93.8 | Very high | 40 Ų | 40 | 37.3 Ų | 37.3 | 28% | 0.28 | 19% | 0.186 | S | C | . | . | trans | -67.7 | 160.8 | 172.8 | 81.1 | 0 | 0 | 0 | 0 | 110.6 | W199 H200 R201 | S197-W199 PolarHBondContact O-N 3.08Å; S197-H200 PolarHBondContact O-N 2.91Å; S197-H200 PolarHBondContact OG-N 2.94Å; S197-H200 PolarHBondContact OG-ND1 3.48Å; S197-R201 PolarHBondContact O-N 3.45Å; S197-R201 VanDerWaalsContact O-N 3.14Å | ||
| 198 | I | 93.1 | Very high | 93.8 | Very high | 22 Ų | 22 | 36.2 Ų | 36.2 | 11% | 0.113 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.2 | -41 | 177.8 | -60.5 | 175.3 | 0 | 0 | 0 | 110.1 | R201 N202 A253 L254 K257 Y258 | I198-R201 PolarHBondContact O-N 3.26Å; I198-N202 WeakPolarHBondContact CG2-ND2 3.48Å; I198-N202 WeakPolarHBondContact O-CB 3.4Å; I198-N202 PolarHBondContact O-N 3.45Å; I198-N202 PolarHBondContact O-ND2 3.44Å; I198-A253 HydrophobicContact CG2-CB 4.3Å; I198-L254 HydrophobicContact CD1-CG 4.33Å; I198-K257 HydrophobicContact CD1-CD 3.62Å; I198-K257 HydrophobicContact CG1-CD 3.34Å; I198-Y258 HydrophobicContact CD1-CE2 3.99Å |
| 199 | W | 95.3 | Very high | 93.8 | Very high | 98 Ų | 98 | 38 Ų | 38 | 37% | 0.371 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.1 | -44.4 | 179.1 | -52.8 | 115.3 | 0 | 0 | 0 | 112 | C54 V57 L58 S197 R201 N202 I203 L250 | C54-W199 HydrophobicContact CB-CE3 4.33Å; V57-W199 HydrophobicContact CB-CD2 4.29Å; V57-W199 HydrophobicContact CB-CE3 4.36Å; V57-W199 HydrophobicContact CG1-CD2 3.83Å; V57-W199 HydrophobicContact CG1-CE3 4.35Å; V57-W199 HydrophobicContact CG1-CG 4.05Å; V57-W199 HydrophobicContact CG1-CZ2 4.13Å; V57-W199 HydrophobicContact CG2-CE3 4.4Å; V57-W199 HydrophobicContact CG2-CH2 4.27Å; V57-W199 HydrophobicContact CG2-CZ3 4.2Å; L58-W199 HydrophobicContact CD1-CB 4.35Å; L58-W199 HydrophobicContact CD2-CB 3.75Å; L58-W199 HydrophobicContact CD2-CG 4.42Å; L58-W199 HydrophobicContact CG-CB 3.95Å; S197-W199 PolarHBondContact O-N 3.08Å; W199-R201 PolarHBondContact O-N 3.09Å; W199-N202 PolarHBondContact O-N 2.89Å; W199-I203 WeakPolarHBondContact O-CG1 3.41Å; W199-I203 PolarHBondContact O-N 2.84Å; W199-L250 HydrophobicContact CZ3-CD1 4.41Å |
| 200 | H | 94.6 | Very high | 93.9 | Very high | 7 Ų | 7 | 37.3 Ų | 37.3 | 3% | 0.032 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.4 | -47.6 | 176.2 | -72.2 | 41.3 | 0 | 0 | 0 | 111.3 | L58 C67 K196 S197 N202 I203 E204 | L58-H200 WeakPolarHBondContact CD1-ND1 3.14Å; L58-H200 VanDerWaalsContact CD2-CE1 3.47Å; L58-H200 WeakPolarHBondContact CD2-CE1 3.39Å; L58-H200 WeakPolarHBondContact CD2-ND1 3.47Å; C67-H200 VanDerWaalsContact CA-CD2 3.42Å; C67-H200 WeakPolarHBondContact CA-CD2 3.3Å; C67-H200 VanDerWaalsContact CA-NE2 3.26Å; C67-H200 WeakPolarHBondContact CA-NE2 3.33Å; C67-H200 VanDerWaalsContact CB-CD2 3.45Å; C67-H200 WeakPolarHBondContact CB-CD2 3.36Å; C67-H200 VanDerWaalsContact CB-NE2 3.29Å; C67-H200 WeakPolarHBondContact CB-NE2 3.49Å; C67-H200 PolarHBondContact N-NE2 2.99Å; C67-H200 PolarHBondContact SG-CD2 3.07Å; K196-H200 HydrophobicContact CB-CB 4.26Å; S197-H200 PolarHBondContact O-N 2.91Å; S197-H200 PolarHBondContact OG-N 2.94Å; S197-H200 PolarHBondContact OG-ND1 3.48Å; H200-N202 VanDerWaalsContact C-N 3.34Å; H200-N202 PolarHBondContact O-N 3.41Å; H200-I203 WeakPolarHBondContact O-CB 3.39Å; H200-I203 PolarHBondContact O-N 2.94Å; H200-E204 PolarHBondContact O-N 2.92Å |
| 201 | R | 94.5 | Very high | 94.1 | Very high | 4 Ų | 4 | 39.9 Ų | 39.9 | 2% | 0.015 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.7 | -40.4 | 177.9 | -76.7 | -56.1 | -155.6 | -165.6 | -4.3 | 112.5 | D77 L190 L191 T194 K196 S197 I198 W199 I203 E204 L205 | D77-R201 VanDerWaalsContact CG-NH1 3.29Å; D77-R201 VanDerWaalsContact CG-NH2 3.29Å; D77-R201 IonicContact OD1-CZ 3.51Å; D77-R201 IonicContact OD1-NH1 3.36Å; D77-R201 PolarHBondContact OD1-NH1 2.84Å; D77-R201 IonicContact OD1-NH2 2.75Å; D77-R201 PolarHBondContact OD1-NH2 3.05Å; D77-R201 IonicContact OD2-CZ 3.21Å; D77-R201 IonicContact OD2-NH1 2.71Å; D77-R201 PolarHBondContact OD2-NH1 3.19Å; D77-R201 IonicContact OD2-NH2 3.04Å; D77-R201 PolarHBondContact OD2-NH2 3.26Å; L190-R201 PolarHBondContact O-NE 3.09Å; L190-R201 PolarHBondContact O-NH2 3.35Å; L191-R201 HydrophobicContact CD2-CB 3.71Å; L191-R201 HydrophobicContact CD2-CG 4.12Å; T194-R201 VanDerWaalsContact CB-NH2 3.3Å; T194-R201 HydrophobicContact CG2-CG 4.12Å; T194-R201 PolarHBondContact OG1-NH2 3.28Å; K196-R201 HydrophobicContact CB-CG 4.05Å; S197-R201 PolarHBondContact O-N 3.45Å; S197-R201 VanDerWaalsContact O-N 3.14Å; I198-R201 PolarHBondContact O-N 3.26Å; W199-R201 PolarHBondContact O-N 3.09Å; R201-I203 VanDerWaalsContact C-N 3.31Å; R201-I203 PolarHBondContact O-N 2.84Å; R201-E204 VanDerWaalsContact CD-OE2 3.22Å; R201-E204 WeakPolarHBondContact CD-OE2 3.49Å; R201-E204 IonicContact CZ-OE2 3.7Å; R201-E204 IonicContact NE-OE2 3.88Å; R201-E204 IonicContact NH1-OE2 2.76Å; R201-E204 PolarHBondContact NH1-OE2 3.2Å; R201-E204 PolarHBondContact O-N 3.4Å; R201-L205 HydrophobicContact CB-CD1 4.45Å; R201-L205 WeakPolarHBondContact O-CB 3.45Å; R201-L205 WeakPolarHBondContact O-CD1 3.37Å; R201-L205 VanDerWaalsContact O-CG 3.28Å; R201-L205 WeakPolarHBondContact O-CG 3.42Å; R201-L205 PolarHBondContact O-N 3.37Å |
| 202 | N | 96 | Very high | 94.2 | Very high | 12 Ų | 12 | 41.6 Ų | 41.6 | 6% | 0.064 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -66.7 | -30.5 | 178.1 | -80.3 | -27.8 | 0 | 0 | 0 | 112.9 | C54 I198 W199 H200 A206 L250 A253 | C54-N202 VanDerWaalsContact SG-CB 3.54Å; I198-N202 WeakPolarHBondContact CG2-ND2 3.48Å; I198-N202 WeakPolarHBondContact O-CB 3.4Å; I198-N202 PolarHBondContact O-N 3.45Å; I198-N202 PolarHBondContact O-ND2 3.44Å; W199-N202 PolarHBondContact O-N 2.89Å; H200-N202 VanDerWaalsContact C-N 3.34Å; H200-N202 PolarHBondContact O-N 3.41Å; N202-A206 WeakPolarHBondContact O-CB 3.39Å; N202-A206 PolarHBondContact O-N 2.84Å; N202-L250 HydrophobicContact CB-CD2 4.05Å; N202-L250 WeakPolarHBondContact ND2-CD2 3.36Å; N202-A253 WeakPolarHBondContact OD1-CB 3.26Å |
| 203 | I | 96.9 | Very high | 94.3 | Very high | 12 Ų | 12 | 39.6 Ų | 39.6 | 6% | 0.062 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.6 | -50.6 | 169.8 | -71 | 173.5 | 0 | 0 | 0 | 110.2 | F51 C54 V55 L58 W199 H200 R201 L205 A206 F207 | F51-I203 HydrophobicContact CD2-CG2 4.02Å; F51-I203 HydrophobicContact CE2-CG2 3.55Å; F51-I203 HydrophobicContact CZ-CG2 4.3Å; C54-I203 HydrophobicContact CB-CD1 4.07Å; C54-I203 HydrophobicContact CB-CG1 3.45Å; C54-I203 VanDerWaalsContact CB-CG1 3.45Å; V55-I203 HydrophobicContact CG2-CD1 3.79Å; V55-I203 HydrophobicContact CG2-CG1 4.19Å; L58-I203 HydrophobicContact CD1-CD1 3.43Å; L58-I203 VanDerWaalsContact CD1-CD1 3.43Å; L58-I203 HydrophobicContact CG-CD1 4.42Å; W199-I203 WeakPolarHBondContact O-CG1 3.41Å; W199-I203 PolarHBondContact O-N 2.84Å; H200-I203 WeakPolarHBondContact O-CB 3.39Å; H200-I203 PolarHBondContact O-N 2.94Å; R201-I203 VanDerWaalsContact C-N 3.31Å; R201-I203 PolarHBondContact O-N 2.84Å; I203-L205 VanDerWaalsContact C-N 3.33Å; I203-L205 PolarHBondContact O-N 3.37Å; I203-A206 PolarHBondContact O-N 3.29Å; I203-F207 WeakPolarHBondContact O-CB 3.42Å; I203-F207 PolarHBondContact O-N 3.06Å |
| 204 | E | 95.9 | Very high | 94.6 | Very high | 5 Ų | 5 | 37.1 Ų | 37.1 | 2% | 0.023 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.3 | -39.8 | -179.6 | -64.3 | 169.5 | 171.4 | 0 | 0 | 112.2 | V78 T81 K196 H200 R201 A208 | V78-E204 HydrophobicContact CG1-CG 4.31Å; V78-E204 HydrophobicContact CG2-CG 4.34Å; T81-E204 HydrophobicContact CG2-CB 3.85Å; T81-E204 PolarHBondContact OG1-O 2.86Å; K196-E204 IonicContact NZ-OE1 3.56Å; K196-E204 PolarHBondContact NZ-OE1 3.38Å; K196-E204 IonicContact NZ-OE2 3.66Å; H200-E204 PolarHBondContact O-N 2.92Å; R201-E204 VanDerWaalsContact CD-OE2 3.22Å; R201-E204 WeakPolarHBondContact CD-OE2 3.49Å; R201-E204 IonicContact CZ-OE2 3.7Å; R201-E204 IonicContact NE-OE2 3.88Å; R201-E204 IonicContact NH1-OE2 2.76Å; R201-E204 PolarHBondContact NH1-OE2 3.2Å; R201-E204 PolarHBondContact O-N 3.4Å; E204-A208 WeakPolarHBondContact O-CB 3.42Å; E204-A208 PolarHBondContact O-N 2.87Å |
| 205 | L | 95.7 | Very high | 95 | Very high | 17 Ų | 17 | 38.9 Ų | 38.9 | 9% | 0.089 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -71.8 | -43.2 | 178.7 | -73.3 | 159 | 0 | 0 | 0 | 112.5 | T81 P84 F187 L191 R201 I203 A208 S209 | T81-L205 HydrophobicContact CG2-CD2 4.49Å; P84-L205 HydrophobicContact CG-CD2 4.33Å; F187-L205 HydrophobicContact CD2-CD1 3.97Å; F187-L205 HydrophobicContact CD2-CD2 4Å; F187-L205 HydrophobicContact CE2-CD1 3.48Å; F187-L205 VanDerWaalsContact CE2-CD1 3.48Å; F187-L205 HydrophobicContact CE2-CD2 4.24Å; F187-L205 HydrophobicContact CE2-CG 4.47Å; L191-L205 HydrophobicContact CD2-CD1 4.4Å; R201-L205 HydrophobicContact CB-CD1 4.45Å; R201-L205 WeakPolarHBondContact O-CB 3.45Å; R201-L205 WeakPolarHBondContact O-CD1 3.37Å; R201-L205 VanDerWaalsContact O-CG 3.28Å; R201-L205 WeakPolarHBondContact O-CG 3.42Å; R201-L205 PolarHBondContact O-N 3.37Å; I203-L205 VanDerWaalsContact C-N 3.33Å; I203-L205 PolarHBondContact O-N 3.37Å; L205-A208 PolarHBondContact O-N 3.18Å; L205-S209 WeakPolarHBondContact O-CB 3.34Å; L205-S209 PolarHBondContact O-N 3.35Å; L205-S209 PolarHBondContact O-OG 3.16Å |
| 206 | A | 97.6 | Very high | 95.4 | Very high | 2 Ų | 2 | 32 Ų | 32 | 2% | 0.017 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -66 | -42.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | K50 F51 N202 I203 S209 I210 | K50-A206 HydrophobicContact CB-CB 4.37Å; F51-A206 HydrophobicContact CB-CB 3.93Å; F51-A206 HydrophobicContact CD2-CB 4.42Å; N202-A206 WeakPolarHBondContact O-CB 3.39Å; N202-A206 PolarHBondContact O-N 2.84Å; I203-A206 PolarHBondContact O-N 3.29Å; A206-S209 PolarHBondContact O-N 3.23Å; A206-I210 VanDerWaalsContact O-CG1 3.26Å; A206-I210 WeakPolarHBondContact O-CG1 3.29Å; A206-I210 PolarHBondContact O-N 3.39Å |
| 207 | F | 96.6 | Very high | 95.6 | Very high | 96 Ų | 96 | 32 Ų | 32 | 42% | 0.421 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -58.4 | -50.5 | 174.5 | 179.6 | -104.3 | 0 | 0 | 0 | 111.8 | F51 F82 I203 S209 I210 V211 | F51-F207 HydrophobicContact CD2-CB 4.29Å; F51-F207 HydrophobicContact CE2-CB 4.11Å; F51-F207 HydrophobicContact CE2-CD2 4.47Å; F82-F207 HydrophobicContact CE2-CD1 4.32Å; F82-F207 HydrophobicContact CE2-CE1 4.45Å; F82-F207 AromaticContact CZ-CD1 3.97Å; F82-F207 HydrophobicContact CZ-CD1 3.97Å; F82-F207 AromaticContact CZ-CE1 3.88Å; F82-F207 HydrophobicContact CZ-CE1 3.88Å; I203-F207 WeakPolarHBondContact O-CB 3.42Å; I203-F207 PolarHBondContact O-N 3.06Å; F207-S209 VanDerWaalsContact C-N 3.28Å; F207-S209 PolarHBondContact O-N 3.23Å; F207-I210 PolarHBondContact O-N 3Å; F207-V211 HydrophobicContact CD1-CG2 4.22Å; F207-V211 HydrophobicContact CD2-CG2 4.18Å; F207-V211 HydrophobicContact CE1-CG2 3.84Å; F207-V211 HydrophobicContact CE2-CG2 3.79Å; F207-V211 HydrophobicContact CG-CG2 4.39Å; F207-V211 HydrophobicContact CZ-CG2 3.6Å; F207-V211 WeakPolarHBondContact O-CG2 3.27Å; F207-V211 PolarHBondContact O-N 3.43Å |
| 208 | A | 97.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.7 | -40.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F82 A85 E204 L205 V211 I212 | F82-A208 HydrophobicContact CB-CB 4.49Å; F82-A208 HydrophobicContact CD1-CB 3.95Å; F82-A208 HydrophobicContact CD2-CB 3.77Å; F82-A208 HydrophobicContact CE1-CB 4.06Å; F82-A208 HydrophobicContact CE2-CB 3.87Å; F82-A208 HydrophobicContact CG-CB 3.81Å; F82-A208 HydrophobicContact CZ-CB 4.02Å; A85-A208 HydrophobicContact CB-CB 4.29Å; E204-A208 WeakPolarHBondContact O-CB 3.42Å; E204-A208 PolarHBondContact O-N 2.87Å; L205-A208 PolarHBondContact O-N 3.18Å; A208-V211 PolarHBondContact O-N 3.21Å; A208-I212 WeakPolarHBondContact O-CB 3.15Å; A208-I212 WeakPolarHBondContact O-CG1 3.46Å; A208-I212 PolarHBondContact O-N 3Å |
| 209 | S | 96.5 | Very high | 95.7 | Very high | 38 Ų | 38 | 40.1 Ų | 40.1 | 27% | 0.266 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -65.8 | -37.2 | 178.2 | -57 | 0 | 0 | 0 | 0 | 112.5 | L205 A206 F207 G213 | L205-S209 WeakPolarHBondContact O-CB 3.34Å; L205-S209 PolarHBondContact O-N 3.35Å; L205-S209 PolarHBondContact O-OG 3.16Å; A206-S209 PolarHBondContact O-N 3.23Å; F207-S209 VanDerWaalsContact C-N 3.28Å; F207-S209 PolarHBondContact O-N 3.23Å; S209-G213 VanDerWaalsContact O-CA 3.25Å; S209-G213 WeakPolarHBondContact O-CA 3.37Å; S209-G213 PolarHBondContact O-N 3.45Å |
| 210 | I | 97.7 | Very high | 95.4 | Very high | 26 Ų | 26 | 38.8 Ų | 38.8 | 13% | 0.133 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -69.2 | -49.5 | 175.1 | -66.6 | 162.3 | 0 | 0 | 0 | 110.6 | E47 F51 A206 F207 I212 G213 I214 | E47-I210 HydrophobicContact CB-CD1 4.14Å; E47-I210 HydrophobicContact CB-CG1 3.6Å; F51-I210 HydrophobicContact CB-CD1 4.37Å; A206-I210 VanDerWaalsContact O-CG1 3.26Å; A206-I210 WeakPolarHBondContact O-CG1 3.29Å; A206-I210 PolarHBondContact O-N 3.39Å; F207-I210 PolarHBondContact O-N 3Å; I210-I212 VanDerWaalsContact C-N 3.29Å; I210-I212 PolarHBondContact O-N 3.31Å; I210-G213 PolarHBondContact O-N 2.75Å; I210-I214 HydrophobicContact CG2-CD1 3.62Å; I210-I214 HydrophobicContact CG2-CG1 4.24Å; I210-I214 WeakPolarHBondContact O-CG1 3.47Å; I210-I214 PolarHBondContact O-N 2.95Å |
| 211 | V | 97.5 | Very high | 95.2 | Very high | 61 Ų | 61 | 40.5 Ų | 40.5 | 37% | 0.37 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -62.2 | -37.1 | -176.8 | 171.8 | 0 | 0 | 0 | 0 | 111.8 | F82 F207 A208 P215 | F82-V211 HydrophobicContact CE1-CB 3.93Å; F82-V211 HydrophobicContact CE1-CG1 3.8Å; F82-V211 HydrophobicContact CZ-CB 4.38Å; F82-V211 HydrophobicContact CZ-CG1 4.41Å; F207-V211 HydrophobicContact CD1-CG2 4.22Å; F207-V211 HydrophobicContact CD2-CG2 4.18Å; F207-V211 HydrophobicContact CE1-CG2 3.84Å; F207-V211 HydrophobicContact CE2-CG2 3.79Å; F207-V211 HydrophobicContact CG-CG2 4.39Å; F207-V211 HydrophobicContact CZ-CG2 3.6Å; F207-V211 WeakPolarHBondContact O-CG2 3.27Å; F207-V211 PolarHBondContact O-N 3.43Å; A208-V211 PolarHBondContact O-N 3.21Å; V211-P215 WeakPolarHBondContact O-CD 3.32Å; V211-P215 VanDerWaalsContact O-CG 3.3Å; V211-P215 WeakPolarHBondContact O-CG 3.44Å |
| 212 | I | 96.7 | Very high | 95.1 | Very high | 39 Ų | 39 | 46.8 Ų | 46.8 | 20% | 0.2 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -81.6 | -37.9 | 174.5 | -62.4 | -60.2 | 0 | 0 | 0 | 111.1 | F82 A85 I86 V89 A208 I210 P215 V216 | F82-I212 HydrophobicContact CD1-CD1 4.07Å; F82-I212 HydrophobicContact CD1-CG1 3.92Å; F82-I212 HydrophobicContact CE1-CG1 4.39Å; A85-I212 HydrophobicContact CB-CG1 4.46Å; I86-I212 HydrophobicContact CD1-CD1 4.38Å; I86-I212 HydrophobicContact CG1-CD1 3.92Å; I86-I212 HydrophobicContact CG1-CG1 4.13Å; V89-I212 HydrophobicContact CB-CG2 4.43Å; V89-I212 HydrophobicContact CG2-CG2 3.73Å; A208-I212 WeakPolarHBondContact O-CB 3.15Å; A208-I212 WeakPolarHBondContact O-CG1 3.46Å; A208-I212 PolarHBondContact O-N 3Å; I210-I212 VanDerWaalsContact C-N 3.29Å; I210-I212 PolarHBondContact O-N 3.31Å; I212-P215 WeakPolarHBondContact O-CD 3.44Å; I212-V216 HydrophobicContact CG2-CG2 4.3Å; I212-V216 WeakPolarHBondContact O-CB 3.41Å; I212-V216 WeakPolarHBondContact O-CG2 3.31Å; I212-V216 PolarHBondContact O-N 3.48Å |
| 213 | G | 95 | Very high | 94.9 | Very high | 16 Ų | 16 | 52.3 Ų | 52.3 | 17% | 0.165 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.8 | -40.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | S209 I210 V216 Q217 | S209-G213 VanDerWaalsContact O-CA 3.25Å; S209-G213 WeakPolarHBondContact O-CA 3.37Å; S209-G213 PolarHBondContact O-N 3.45Å; I210-G213 PolarHBondContact O-N 2.75Å; G213-V216 PolarHBondContact O-N 2.78Å; G213-Q217 WeakPolarHBondContact O-CB 3.37Å; G213-Q217 PolarHBondContact O-N 2.93Å |
| 214 | I | 95.9 | Very high | 94.5 | Very high | 72 Ų | 72 | 54.9 Ų | 54.9 | 37% | 0.369 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.5 | -54.8 | -179.4 | -70.7 | 170.9 | 0 | 0 | 0 | 111.7 | I44 I210 V216 Q217 L218 | I44-I214 HydrophobicContact CD1-CG1 4.16Å; I44-I214 HydrophobicContact CG2-CG1 4.38Å; I210-I214 HydrophobicContact CG2-CD1 3.62Å; I210-I214 HydrophobicContact CG2-CG1 4.24Å; I210-I214 WeakPolarHBondContact O-CG1 3.47Å; I210-I214 PolarHBondContact O-N 2.95Å; I214-V216 PolarHBondContact O-N 3.23Å; I214-Q217 WeakPolarHBondContact O-CB 3.49Å; I214-Q217 PolarHBondContact O-N 2.84Å; I214-Q217 VanDerWaalsContact O-N 3.15Å; I214-L218 HydrophobicContact CG2-CD1 4.03Å; I214-L218 HydrophobicContact CG2-CG 4.36Å; I214-L218 WeakPolarHBondContact O-CG 3.28Å; I214-L218 PolarHBondContact O-N 3.46Å |
| 215 | P | 95.4 | Very high | 94.3 | Very high | 64 Ų | 64 | 55.6 Ų | 55.6 | 42% | 0.416 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -54.9 | -40.7 | 175.1 | -26.7 | 34.2 | 0 | 0 | 0 | 112.8 | V211 I212 Q217 L218 L219 | V211-P215 WeakPolarHBondContact O-CD 3.32Å; V211-P215 VanDerWaalsContact O-CG 3.3Å; V211-P215 WeakPolarHBondContact O-CG 3.44Å; I212-P215 WeakPolarHBondContact O-CD 3.44Å; P215-Q217 PolarHBondContact O-N 3.2Å; P215-L218 PolarHBondContact O-N 3.2Å; P215-L219 VanDerWaalsContact O-CG 3.29Å; P215-L219 WeakPolarHBondContact O-CG 3.25Å; P215-L219 PolarHBondContact O-N 3.28Å |
| 216 | V | 94 | Very high | 94.2 | Very high | 32 Ų | 32 | 58.6 Ų | 58.6 | 19% | 0.194 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.4 | -40 | 179.9 | 170.6 | 0 | 0 | 0 | 0 | 111.7 | V89 R93 I212 G213 I214 L219 T220 | V89-V216 HydrophobicContact CG1-CB 4.48Å; V89-V216 HydrophobicContact CG1-CG1 3.98Å; V89-V216 HydrophobicContact CG1-CG2 3.64Å; V89-V216 HydrophobicContact CG2-CG2 4.26Å; R93-V216 PolarHBondContact NH2-O 2.67Å; I212-V216 HydrophobicContact CG2-CG2 4.3Å; I212-V216 WeakPolarHBondContact O-CB 3.41Å; I212-V216 WeakPolarHBondContact O-CG2 3.31Å; I212-V216 PolarHBondContact O-N 3.48Å; G213-V216 PolarHBondContact O-N 2.78Å; I214-V216 PolarHBondContact O-N 3.23Å; V216-L219 PolarHBondContact O-N 3.03Å; V216-T220 PolarHBondContact O-N 3.22Å; V216-T220 PolarHBondContact O-OG1 3.02Å; V216-T220 VanDerWaalsContact O-OG1 3.08Å |
| 217 | Q | 94.1 | Very high | 93.9 | Very high | 8 Ų | 8 | 68.8 Ų | 68.8 | 4% | 0.037 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.5 | -44 | 173.4 | 171.9 | 177.4 | 61.6 | 0 | 0 | 111.6 | S40 S41 I44 G213 I214 P215 L219 T220 D221 I225 Y230 | S40-Q217 WeakPolarHBondContact OG-CG 3.22Å; S40-Q217 PolarHBondContact OG-NE2 3.37Å; S41-Q217 VanDerWaalsContact CA-NE2 3.33Å; S41-Q217 PolarHBondContact OG-NE2 2.73Å; I44-Q217 HydrophobicContact CD1-CB 3.84Å; I44-Q217 VanDerWaalsContact CD1-CD 3.44Å; I44-Q217 HydrophobicContact CD1-CG 4.24Å; G213-Q217 WeakPolarHBondContact O-CB 3.37Å; G213-Q217 PolarHBondContact O-N 2.93Å; I214-Q217 WeakPolarHBondContact O-CB 3.49Å; I214-Q217 PolarHBondContact O-N 2.84Å; I214-Q217 VanDerWaalsContact O-N 3.15Å; P215-Q217 PolarHBondContact O-N 3.2Å; Q217-L219 PolarHBondContact O-N 3.11Å; Q217-T220 PolarHBondContact O-N 3.27Å; Q217-D221 HydrophobicContact CG-CB 4.41Å; Q217-D221 PolarHBondContact O-N 3.41Å; Q217-I225 VanDerWaalsContact CD-CD1 3.48Å; Q217-I225 HydrophobicContact CG-CD1 3.45Å; Q217-I225 VanDerWaalsContact CG-CD1 3.45Å; Q217-Y230 VanDerWaalsContact OE1-CE2 3.29Å; Q217-Y230 PolarHBondContact OE1-OH 3.4Å |
| 218 | L | 93.8 | Very high | 93.6 | Very high | 84 Ų | 84 | 67.2 Ų | 67.2 | 44% | 0.44 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.4 | -29.5 | 176.3 | -67.6 | 174.4 | 0 | 0 | 0 | 111.9 | I214 P215 W222 | I214-L218 HydrophobicContact CG2-CD1 4.03Å; I214-L218 HydrophobicContact CG2-CG 4.36Å; I214-L218 WeakPolarHBondContact O-CG 3.28Å; I214-L218 PolarHBondContact O-N 3.46Å; P215-L218 PolarHBondContact O-N 3.2Å; L218-W222 HydrophobicContact CD2-CE3 3.51Å; L218-W222 HydrophobicContact CD2-CZ3 3.64Å; L218-W222 WeakPolarHBondContact O-CB 3.39Å |
| 219 | L | 92.8 | Very high | 93.4 | Very high | 150 Ų | 150 | 68.9 Ų | 68.9 | 79% | 0.785 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -82.1 | -27.4 | 177.7 | -68.5 | 173.6 | 0 | 0 | 0 | 113.6 | P215 V216 Q217 | P215-L219 VanDerWaalsContact O-CG 3.29Å; P215-L219 WeakPolarHBondContact O-CG 3.25Å; P215-L219 PolarHBondContact O-N 3.28Å; V216-L219 PolarHBondContact O-N 3.03Å; Q217-L219 PolarHBondContact O-N 3.11Å |
| 220 | T | 89.7 | Confident | 93.2 | Very high | 70 Ų | 70 | 70 Ų | 70 | 43% | 0.429 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -108.4 | -35 | -174.7 | 55.1 | 0 | 0 | 0 | 0 | 115.8 | R93 V216 Q217 | R93-T220 PolarHBondContact NH2-OG1 3.01Å; V216-T220 PolarHBondContact O-N 3.22Å; V216-T220 PolarHBondContact O-OG1 3.02Å; V216-T220 VanDerWaalsContact O-OG1 3.08Å; Q217-T220 PolarHBondContact O-N 3.27Å |
| 221 | D | 90.3 | Very high | 93 | Very high | 43 Ų | 43 | 74 Ų | 74 | 23% | 0.23 | 38% | 0.381 | C | S | . | . | S | Bend | trans | -117.5 | 8.4 | -169.4 | -55.8 | -44.1 | 0 | 0 | 0 | 112.6 | S40 Q217 N223 D224 I225 | S40-D221 WeakPolarHBondContact CB-OD2 3.48Å; S40-D221 PolarHBondContact OG-OD2 3.47Å; Q217-D221 HydrophobicContact CG-CB 4.41Å; Q217-D221 PolarHBondContact O-N 3.41Å; D221-N223 VanDerWaalsContact C-N 3.34Å; D221-N223 PolarHBondContact O-N 2.79Å; D221-D224 PolarHBondContact O-N 3.36Å; D221-D224 VanDerWaalsContact O-N 3.14Å; D221-I225 HydrophobicContact CB-CD1 3.91Å; D221-I225 HydrophobicContact CB-CG1 4.37Å; D221-I225 WeakPolarHBondContact O-CB 3.22Å; D221-I225 VanDerWaalsContact O-CG1 3.31Å; D221-I225 WeakPolarHBondContact O-CG1 3.36Å; D221-I225 PolarHBondContact O-N 2.76Å |
| 222 | W | 92.3 | Very high | 92.7 | Very high | 135 Ų | 135 | 73.3 Ų | 73.3 | 51% | 0.511 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -55.2 | -45.3 | -177 | 174.4 | -103.9 | 0 | 0 | 0 | 113.7 | L218 D224 I225 T226 | L218-W222 HydrophobicContact CD2-CE3 3.51Å; L218-W222 HydrophobicContact CD2-CZ3 3.64Å; L218-W222 WeakPolarHBondContact O-CB 3.39Å; W222-D224 VanDerWaalsContact C-N 3.3Å; W222-D224 PolarHBondContact O-N 2.97Å; W222-I225 PolarHBondContact O-N 2.87Å; W222-T226 HydrophobicContact CD2-CG2 3.67Å; W222-T226 HydrophobicContact CE3-CG2 3.98Å; W222-T226 HydrophobicContact CG-CG2 4.29Å; W222-T226 HydrophobicContact CH2-CG2 3.78Å; W222-T226 HydrophobicContact CZ2-CG2 3.44Å; W222-T226 VanDerWaalsContact CZ2-CG2 3.44Å; W222-T226 HydrophobicContact CZ3-CG2 4.04Å; W222-T226 WeakPolarHBondContact O-CB 3.17Å; W222-T226 WeakPolarHBondContact O-CG2 3.35Å; W222-T226 PolarHBondContact O-N 2.9Å; W222-T226 PolarHBondContact O-OG1 3.43Å |
| 223 | N | 92.3 | Very high | 92.3 | Very high | 129 Ų | 129 | 72.4 Ų | 72.4 | 69% | 0.69 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -64.6 | -36.7 | -179.4 | -67.3 | -23.4 | 0 | 0 | 0 | 112 | D221 T226 R227 | D221-N223 VanDerWaalsContact C-N 3.34Å; D221-N223 PolarHBondContact O-N 2.79Å; N223-T226 PolarHBondContact O-OG1 2.67Å; N223-R227 WeakPolarHBondContact O-CB 3.33Å; N223-R227 PolarHBondContact O-N 3.42Å |
| 224 | D | 88.2 | Confident | 92.2 | Very high | 65 Ų | 65 | 73 Ų | 73 | 35% | 0.348 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -70.5 | -46.4 | 177.4 | -177.1 | 56.2 | 0 | 0 | 0 | 110.8 | N38 D221 W222 T226 R227 N228 | N38-D224 PolarHBondContact ND2-OD2 2.91Å; D221-D224 PolarHBondContact O-N 3.36Å; D221-D224 VanDerWaalsContact O-N 3.14Å; W222-D224 VanDerWaalsContact C-N 3.3Å; W222-D224 PolarHBondContact O-N 2.97Å; D224-T226 PolarHBondContact O-N 3.11Å; D224-R227 PolarHBondContact O-N 2.62Å; D224-N228 WeakPolarHBondContact O-CB 3.26Å; D224-N228 PolarHBondContact O-N 2.7Å; D224-N228 PolarHBondContact OD1-ND2 3.01Å |
| 225 | I | 92.1 | Very high | 92.1 | Very high | 21 Ų | 21 | 71.5 Ų | 71.5 | 11% | 0.108 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.3 | -41.3 | -179.7 | -68.8 | 167 | 0 | 0 | 0 | 112.1 | Q217 D221 W222 G229 Y230 | Q217-I225 VanDerWaalsContact CD-CD1 3.48Å; Q217-I225 HydrophobicContact CG-CD1 3.45Å; Q217-I225 VanDerWaalsContact CG-CD1 3.45Å; D221-I225 HydrophobicContact CB-CD1 3.91Å; D221-I225 HydrophobicContact CB-CG1 4.37Å; D221-I225 WeakPolarHBondContact O-CB 3.22Å; D221-I225 VanDerWaalsContact O-CG1 3.31Å; D221-I225 WeakPolarHBondContact O-CG1 3.36Å; D221-I225 PolarHBondContact O-N 2.76Å; W222-I225 PolarHBondContact O-N 2.87Å; I225-G229 CarbonylContact O-C 3.33Å; I225-G229 WeakPolarHBondContact O-CA 3.04Å; I225-G229 PolarHBondContact O-N 2.96Å; I225-Y230 HydrophobicContact CD1-CD2 4.43Å; I225-Y230 HydrophobicContact CG2-CD2 3.91Å |
| 226 | T | 92.8 | Very high | 92 | Very high | 79 Ų | 79 | 77 Ų | 77 | 49% | 0.485 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -71.5 | -33.3 | 179.2 | 48 | 0 | 0 | 0 | 0 | 112.5 | W222 N223 D224 | W222-T226 HydrophobicContact CD2-CG2 3.67Å; W222-T226 HydrophobicContact CE3-CG2 3.98Å; W222-T226 HydrophobicContact CG-CG2 4.29Å; W222-T226 HydrophobicContact CH2-CG2 3.78Å; W222-T226 HydrophobicContact CZ2-CG2 3.44Å; W222-T226 VanDerWaalsContact CZ2-CG2 3.44Å; W222-T226 HydrophobicContact CZ3-CG2 4.04Å; W222-T226 WeakPolarHBondContact O-CB 3.17Å; W222-T226 WeakPolarHBondContact O-CG2 3.35Å; W222-T226 PolarHBondContact O-N 2.9Å; W222-T226 PolarHBondContact O-OG1 3.43Å; N223-T226 PolarHBondContact O-OG1 2.67Å; D224-T226 PolarHBondContact O-N 3.11Å |
| 227 | R | 91.9 | Very high | 92 | Very high | 216 Ų | 216 | 76.9 Ų | 76.9 | 82% | 0.815 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -78.6 | -45.1 | 179.6 | -174.6 | 177.6 | 178.6 | 177.2 | -0.5 | 112.8 | N223 D224 | N223-R227 WeakPolarHBondContact O-CB 3.33Å; N223-R227 PolarHBondContact O-N 3.42Å; D224-R227 PolarHBondContact O-N 2.62Å |
| 228 | N | 90.1 | Very high | 92 | Very high | 64 Ų | 64 | 76.7 Ų | 76.7 | 34% | 0.342 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -101.7 | -19.2 | -170.2 | -62.3 | -31.2 | 0 | 0 | 0 | 112.8 | D224 H232 | D224-N228 WeakPolarHBondContact O-CB 3.26Å; D224-N228 PolarHBondContact O-N 2.7Å; D224-N228 PolarHBondContact OD1-ND2 3.01Å; N228-H232 HydrophobicContact CB-CB 3.81Å; N228-H232 WeakPolarHBondContact O-CB 3.45Å |
| 229 | G | 91.8 | Very high | 92.1 | Very high | 34 Ų | 34 | 78.1 Ų | 78.1 | 35% | 0.351 | 37% | 0.374 | S | S | . | . | trans | 95.4 | 153.4 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | I225 F231 H232 | I225-G229 CarbonylContact O-C 3.33Å; I225-G229 WeakPolarHBondContact O-CA 3.04Å; I225-G229 PolarHBondContact O-N 2.96Å; G229-F231 VanDerWaalsContact C-N 3.29Å; G229-F231 PolarHBondContact O-N 2.7Å; G229-H232 WeakPolarHBondContact O-CB 3.31Å; G229-H232 PolarHBondContact O-N 3.38Å | ||
| 230 | Y | 92.9 | Very high | 92.3 | Very high | 63 Ų | 63 | 74 Ų | 74 | 25% | 0.247 | 35% | 0.352 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -36.1 | -176.4 | -167.9 | -92.4 | 0 | 0 | 0 | 113.8 | S41 M45 Q217 I225 | S41-Y230 PolarHBondContact OG-O 2.72Å; M45-Y230 HydrophobicContact CE-CE1 4.45Å; Q217-Y230 VanDerWaalsContact OE1-CE2 3.29Å; Q217-Y230 PolarHBondContact OE1-OH 3.4Å; I225-Y230 HydrophobicContact CD1-CD2 4.43Å; I225-Y230 HydrophobicContact CG2-CD2 3.91Å |
| 231 | F | 93.9 | Very high | 92.6 | Very high | 109 Ų | 109 | 70.7 Ų | 70.7 | 48% | 0.478 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.5 | 21 | -178 | -63.3 | -70.4 | 0 | 0 | 0 | 112.9 | M45 G229 G233 F234 W239 | M45-F231 HydrophobicContact CE-CE1 3.48Å; M45-F231 VanDerWaalsContact CE-CE1 3.48Å; M45-F231 HydrophobicContact CE-CZ 3.65Å; G229-F231 VanDerWaalsContact C-N 3.29Å; G229-F231 PolarHBondContact O-N 2.7Å; F231-G233 PolarHBondContact O-N 3.39Å; F231-F234 VanDerWaalsContact C-CD2 3.46Å; F231-F234 HydrophobicContact CB-CB 4.28Å; F231-F234 HydrophobicContact CB-CD2 4.35Å; F231-F234 HydrophobicContact CB-CG 4.25Å; F231-F234 AromaticContact CD1-CD1 3.77Å; F231-F234 HydrophobicContact CD1-CD1 3.77Å; F231-F234 AromaticContact CD1-CE1 3.94Å; F231-F234 HydrophobicContact CD1-CE1 3.94Å; F231-F234 HydrophobicContact CD1-CG 4.08Å; F231-F234 HydrophobicContact CD1-CZ 4.41Å; F231-F234 HydrophobicContact CE1-CD1 4.49Å; F231-F234 HydrophobicContact CE1-CE1 4.39Å; F231-F234 WeakPolarHBondContact O-CB 3.29Å; F231-F234 WeakPolarHBondContact O-CD2 3.32Å; F231-F234 PolarHBondContact O-N 3.4Å; F231-F234 VanDerWaalsContact O-N 3.08Å; F231-W239 HydrophobicContact CD1-CZ2 4.4Å; F231-W239 HydrophobicContact CE1-CH2 4.2Å; F231-W239 HydrophobicContact CE1-CZ2 4.33Å |
| 232 | H | 90.5 | Very high | 92.9 | Very high | 46 Ų | 46 | 68.7 Ų | 68.7 | 21% | 0.213 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.3 | 130.1 | 176.5 | -174.4 | 72.1 | 0 | 0 | 0 | 111.4 | E35 F37 N228 G229 F234 | E35-H232 IonicContact OE1-CE1 3.45Å; E35-H232 IonicContact OE2-CE1 2.7Å; E35-H232 PolarHBondContact OE2-CE1 2.99Å; E35-H232 IonicContact OE2-ND1 3.1Å; E35-H232 PolarHBondContact OE2-ND1 3.17Å; E35-H232 IonicContact OE2-NE2 3.95Å; F37-H232 WeakPolarHBondContact CA-O 3.37Å; N228-H232 HydrophobicContact CB-CB 3.81Å; N228-H232 WeakPolarHBondContact O-CB 3.45Å; G229-H232 WeakPolarHBondContact O-CB 3.31Å; G229-H232 PolarHBondContact O-N 3.38Å; H232-F234 VanDerWaalsContact C-N 3.26Å; H232-F234 WeakPolarHBondContact O-CD2 3.4Å; H232-F234 PolarHBondContact O-N 3.45Å |
| 233 | G | 89 | Confident | 93.2 | Very high | 20 Ų | 20 | 68.1 Ų | 68.1 | 21% | 0.206 | 32% | 0.322 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 72.7 | 5.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | F231 D235 | F231-G233 PolarHBondContact O-N 3.39Å; G233-D235 PolarHBondContact O-N 3.2Å; G233-D235 VanDerWaalsContact O-N 3.11Å |
| 234 | F | 93.2 | Very high | 93.5 | Very high | 29 Ų | 29 | 62.6 Ų | 62.6 | 13% | 0.127 | 29% | 0.293 | C | S | . | . | trans | -80.2 | 93.3 | 179 | -78 | -126.4 | 0 | 0 | 0 | 111 | F37 F231 H232 V238 W239 I242 | F37-F234 HydrophobicContact CB-CD2 4.01Å; F37-F234 HydrophobicContact CB-CE2 3.99Å; F231-F234 VanDerWaalsContact C-CD2 3.46Å; F231-F234 HydrophobicContact CB-CB 4.28Å; F231-F234 HydrophobicContact CB-CD2 4.35Å; F231-F234 HydrophobicContact CB-CG 4.25Å; F231-F234 AromaticContact CD1-CD1 3.77Å; F231-F234 HydrophobicContact CD1-CD1 3.77Å; F231-F234 AromaticContact CD1-CE1 3.94Å; F231-F234 HydrophobicContact CD1-CE1 3.94Å; F231-F234 HydrophobicContact CD1-CG 4.08Å; F231-F234 HydrophobicContact CD1-CZ 4.41Å; F231-F234 HydrophobicContact CE1-CD1 4.49Å; F231-F234 HydrophobicContact CE1-CE1 4.39Å; F231-F234 WeakPolarHBondContact O-CB 3.29Å; F231-F234 WeakPolarHBondContact O-CD2 3.32Å; F231-F234 PolarHBondContact O-N 3.4Å; F231-F234 VanDerWaalsContact O-N 3.08Å; H232-F234 VanDerWaalsContact C-N 3.26Å; H232-F234 WeakPolarHBondContact O-CD2 3.4Å; H232-F234 PolarHBondContact O-N 3.45Å; F234-V238 HydrophobicContact CD1-CG1 3.96Å; F234-V238 HydrophobicContact CD2-CG1 4.49Å; F234-V238 HydrophobicContact CE1-CG1 4.3Å; F234-V238 HydrophobicContact CG-CG1 4.08Å; F234-W239 HydrophobicContact CD1-CZ2 4.19Å; F234-I242 HydrophobicContact CD1-CD1 3.91Å; F234-I242 HydrophobicContact CE1-CD1 3.57Å | ||
| 235 | D | 92.7 | Very high | 93.9 | Very high | 41 Ų | 41 | 61.8 Ų | 61.8 | 22% | 0.219 | 29% | 0.287 | C | S | . | . | trans | -94.2 | 178.3 | 167.9 | 73.9 | 3.2 | 0 | 0 | 0 | 112.2 | R32 G233 F237 V238 W239 | R32-D235 IonicContact CZ-OD2 2.67Å; R32-D235 IonicContact NH1-OD1 3.54Å; R32-D235 IonicContact NH1-OD2 2.67Å; R32-D235 PolarHBondContact NH1-OD2 2.79Å; R32-D235 IonicContact NH2-OD2 2.7Å; R32-D235 PolarHBondContact NH2-OD2 2.88Å; G233-D235 PolarHBondContact O-N 3.2Å; G233-D235 VanDerWaalsContact O-N 3.11Å; D235-F237 PolarHBondContact O-N 3.13Å; D235-F237 VanDerWaalsContact O-N 3.14Å; D235-F237 WeakPolarHBondContact OD1-CA 3.35Å; D235-F237 WeakPolarHBondContact OD1-CB 3.39Å; D235-F237 PolarHBondContact OD1-N 2.87Å; D235-V238 PolarHBondContact O-N 3.1Å; D235-V238 VanDerWaalsContact O-N 3.13Å; D235-V238 WeakPolarHBondContact OD1-CG2 3.35Å; D235-V238 PolarHBondContact OD1-N 3.39Å; D235-W239 PolarHBondContact O-N 3.46Å | ||
| 236 | W | 93.9 | Very high | 94.2 | Very high | 180 Ų | 180 | 61 Ų | 61 | 68% | 0.682 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -56.3 | -29.9 | 178.5 | 72.6 | -84.9 | 0 | 0 | 0 | 113 | W239 I240 | W236-W239 PolarHBondContact O-N 2.97Å; W236-I240 HydrophobicContact CE3-CD1 3.52Å; W236-I240 HydrophobicContact CE3-CG1 4.42Å; W236-I240 HydrophobicContact CH2-CD1 4.38Å; W236-I240 HydrophobicContact CZ3-CD1 3.27Å; W236-I240 PolarHBondContact O-N 3.38Å |
| 237 | F | 94 | Very high | 94.5 | Very high | 28 Ų | 28 | 61.1 Ų | 61.1 | 12% | 0.123 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -75.9 | -37.2 | 179.9 | -168.9 | -101.4 | 0 | 0 | 0 | 111.5 | C25 H28 A29 D235 W239 I240 V241 | C25-F237 HydrophobicContact CB-CE1 4.28Å; C25-F237 HydrophobicContact CB-CZ 3.92Å; C25-F237 WeakPolarHBondContact O-CE1 3.41Å; H28-F237 HydrophobicContact CB-CE1 4.45Å; H28-F237 AromaticContact CD2-CE1 3.78Å; H28-F237 AromaticContact CD2-CZ 3.78Å; A29-F237 HydrophobicContact CB-CD1 4.02Å; A29-F237 HydrophobicContact CB-CE1 3.92Å; D235-F237 PolarHBondContact O-N 3.13Å; D235-F237 VanDerWaalsContact O-N 3.14Å; D235-F237 WeakPolarHBondContact OD1-CA 3.35Å; D235-F237 WeakPolarHBondContact OD1-CB 3.39Å; D235-F237 PolarHBondContact OD1-N 2.87Å; F237-W239 VanDerWaalsContact C-N 3.25Å; F237-W239 PolarHBondContact O-N 3.37Å; F237-I240 WeakPolarHBondContact O-CB 3.27Å; F237-I240 PolarHBondContact O-N 2.9Å; F237-I240 VanDerWaalsContact O-N 3.1Å; F237-V241 HydrophobicContact CD1-CG2 4.35Å; F237-V241 HydrophobicContact CE1-CG2 4.22Å; F237-V241 WeakPolarHBondContact O-CG2 3.37Å; F237-V241 PolarHBondContact O-N 3.27Å |
| 238 | V | 94 | Very high | 94.7 | Very high | 5 Ų | 5 | 51 Ų | 51 | 3% | 0.03 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.1 | -37.3 | 170.3 | 177.3 | 0 | 0 | 0 | 0 | 110.9 | F37 F234 D235 I240 V241 I242 | F37-V238 HydrophobicContact CB-CG1 4.32Å; F37-V238 HydrophobicContact CB-CG2 4.3Å; F37-V238 HydrophobicContact CD1-CG1 4.33Å; F37-V238 HydrophobicContact CD1-CG2 3.63Å; F37-V238 HydrophobicContact CD2-CG1 4.39Å; F37-V238 HydrophobicContact CE1-CG2 4.23Å; F37-V238 HydrophobicContact CG-CG1 4.09Å; F37-V238 HydrophobicContact CG-CG2 4.1Å; F234-V238 HydrophobicContact CD1-CG1 3.96Å; F234-V238 HydrophobicContact CD2-CG1 4.49Å; F234-V238 HydrophobicContact CE1-CG1 4.3Å; F234-V238 HydrophobicContact CG-CG1 4.08Å; D235-V238 PolarHBondContact O-N 3.1Å; D235-V238 VanDerWaalsContact O-N 3.13Å; D235-V238 WeakPolarHBondContact OD1-CG2 3.35Å; D235-V238 PolarHBondContact OD1-N 3.39Å; V238-I240 VanDerWaalsContact C-N 3.34Å; V238-I240 PolarHBondContact O-N 3.46Å; V238-V241 WeakPolarHBondContact O-CB 3.45Å; V238-V241 PolarHBondContact O-N 2.71Å; V238-V241 VanDerWaalsContact O-N 3.17Å; V238-I242 HydrophobicContact CG1-CD1 4.03Å; V238-I242 HydrophobicContact CG1-CG1 4.47Å; V238-I242 VanDerWaalsContact O-CG1 3.31Å; V238-I242 WeakPolarHBondContact O-CG1 3.47Å; V238-I242 PolarHBondContact O-N 2.91Å |
| 239 | W | 96.1 | Very high | 95 | Very high | 113 Ų | 113 | 49 Ų | 49 | 43% | 0.428 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.8 | -36.2 | 173.2 | -71.3 | 107.6 | 0 | 0 | 0 | 113.3 | M45 F231 F234 D235 W236 F237 I242 F243 | M45-W239 HydrophobicContact CE-CH2 4.39Å; M45-W239 HydrophobicContact CG-CH2 3.92Å; M45-W239 HydrophobicContact CG-CZ3 3.54Å; M45-W239 HydrophobicContact SD-CH2 4.17Å; M45-W239 HydrophobicContact SD-CZ3 4.1Å; F231-W239 HydrophobicContact CD1-CZ2 4.4Å; F231-W239 HydrophobicContact CE1-CH2 4.2Å; F231-W239 HydrophobicContact CE1-CZ2 4.33Å; F234-W239 HydrophobicContact CD1-CZ2 4.19Å; D235-W239 PolarHBondContact O-N 3.46Å; W236-W239 PolarHBondContact O-N 2.97Å; F237-W239 VanDerWaalsContact C-N 3.25Å; F237-W239 PolarHBondContact O-N 3.37Å; W239-I242 HydrophobicContact CD2-CD1 4.27Å; W239-I242 HydrophobicContact CE3-CD1 3.82Å; W239-I242 HydrophobicContact CZ3-CD1 4.09Å; W239-I242 PolarHBondContact O-N 2.88Å; W239-F243 PolarHBondContact O-N 2.87Å |
| 240 | I | 96.3 | Very high | 95.3 | Very high | 65 Ų | 65 | 48.4 Ų | 48.4 | 33% | 0.333 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.4 | -43.4 | 171.3 | -68.3 | 174.4 | 0 | 0 | 0 | 110.8 | W236 F237 V238 I242 F243 L244 | W236-I240 HydrophobicContact CE3-CD1 3.52Å; W236-I240 HydrophobicContact CE3-CG1 4.42Å; W236-I240 HydrophobicContact CH2-CD1 4.38Å; W236-I240 HydrophobicContact CZ3-CD1 3.27Å; W236-I240 PolarHBondContact O-N 3.38Å; F237-I240 WeakPolarHBondContact O-CB 3.27Å; F237-I240 PolarHBondContact O-N 2.9Å; F237-I240 VanDerWaalsContact O-N 3.1Å; V238-I240 VanDerWaalsContact C-N 3.34Å; V238-I240 PolarHBondContact O-N 3.46Å; I240-I242 VanDerWaalsContact C-N 3.35Å; I240-I242 PolarHBondContact O-N 3.27Å; I240-F243 WeakPolarHBondContact O-CB 3.37Å; I240-F243 PolarHBondContact O-N 2.88Å; I240-L244 HydrophobicContact CG2-CD1 3.96Å; I240-L244 HydrophobicContact CG2-CG 4.33Å; I240-L244 WeakPolarHBondContact O-CB 3.48Å; I240-L244 WeakPolarHBondContact O-CG 3.26Å; I240-L244 PolarHBondContact O-N 3.5Å |
| 241 | V | 96.2 | Very high | 95.5 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.1 | -43.4 | 176.4 | 170.2 | 0 | 0 | 0 | 0 | 111.4 | Y22 C25 M26 A29 M42 F237 V238 F243 L244 H245 | Y22-V241 HydrophobicContact CE2-CG1 3.95Å; C25-V241 HydrophobicContact CB-CG2 3.97Å; M26-V241 HydrophobicContact CG-CG1 3.95Å; M26-V241 HydrophobicContact SD-CG1 3.24Å; M26-V241 WeakPolarHBondContact SD-CG1 3.44Å; A29-V241 HydrophobicContact CB-CG2 4.31Å; M42-V241 HydrophobicContact SD-CG1 3.78Å; F237-V241 HydrophobicContact CD1-CG2 4.35Å; F237-V241 HydrophobicContact CE1-CG2 4.22Å; F237-V241 WeakPolarHBondContact O-CG2 3.37Å; F237-V241 PolarHBondContact O-N 3.27Å; V238-V241 WeakPolarHBondContact O-CB 3.45Å; V238-V241 PolarHBondContact O-N 2.71Å; V238-V241 VanDerWaalsContact O-N 3.17Å; V241-F243 VanDerWaalsContact C-N 3.34Å; V241-F243 PolarHBondContact O-N 2.9Å; V241-L244 PolarHBondContact O-N 3.24Å; V241-H245 WeakPolarHBondContact O-CB 3.42Å; V241-H245 PolarHBondContact O-N 3.45Å |
| 242 | I | 97.8 | Very high | 95.6 | Very high | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.5 | -46.1 | 175.1 | -71.5 | 163.9 | 0 | 0 | 0 | 110.5 | M42 M45 L49 F234 V238 W239 I240 H245 A246 | M42-I242 HydrophobicContact CB-CG1 4.48Å; M42-I242 HydrophobicContact CG-CD1 4.33Å; M42-I242 HydrophobicContact CG-CG1 3.56Å; M45-I242 HydrophobicContact CB-CD1 4.19Å; M45-I242 HydrophobicContact CB-CG2 4.31Å; M45-I242 HydrophobicContact CG-CD1 4.07Å; M45-I242 HydrophobicContact CG-CG2 4.07Å; L49-I242 HydrophobicContact CD2-CG2 4.26Å; F234-I242 HydrophobicContact CD1-CD1 3.91Å; F234-I242 HydrophobicContact CE1-CD1 3.57Å; V238-I242 HydrophobicContact CG1-CD1 4.03Å; V238-I242 HydrophobicContact CG1-CG1 4.47Å; V238-I242 VanDerWaalsContact O-CG1 3.31Å; V238-I242 WeakPolarHBondContact O-CG1 3.47Å; V238-I242 PolarHBondContact O-N 2.91Å; W239-I242 HydrophobicContact CD2-CD1 4.27Å; W239-I242 HydrophobicContact CE3-CD1 3.82Å; W239-I242 HydrophobicContact CZ3-CD1 4.09Å; W239-I242 PolarHBondContact O-N 2.88Å; I240-I242 VanDerWaalsContact C-N 3.35Å; I240-I242 PolarHBondContact O-N 3.27Å; I242-H245 PolarHBondContact O-N 3.34Å; I242-A246 WeakPolarHBondContact O-CB 3.36Å; I242-A246 PolarHBondContact O-N 3.23Å |
| 243 | F | 98 | Very high | 95.9 | Very high | 122 Ų | 122 | 40.5 Ų | 40.5 | 54% | 0.535 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -60.6 | -47.8 | 176.5 | 174.7 | -95.2 | 0 | 0 | 0 | 111.8 | L49 W239 I240 V241 H245 A246 F247 | L49-F243 HydrophobicContact CD2-CB 4.35Å; L49-F243 HydrophobicContact CD2-CD2 4.26Å; W239-F243 PolarHBondContact O-N 2.87Å; I240-F243 WeakPolarHBondContact O-CB 3.37Å; I240-F243 PolarHBondContact O-N 2.88Å; V241-F243 VanDerWaalsContact C-N 3.34Å; V241-F243 PolarHBondContact O-N 2.9Å; F243-H245 VanDerWaalsContact C-N 3.33Å; F243-H245 PolarHBondContact O-N 3.05Å; F243-A246 PolarHBondContact O-N 3.44Å; F243-F247 VanDerWaalsContact O-CB 3.31Å; F243-F247 WeakPolarHBondContact O-CB 3.48Å; F243-F247 PolarHBondContact O-N 2.94Å |
| 244 | L | 97.8 | Very high | 96.2 | Very high | 13 Ų | 13 | 41.5 Ų | 41.5 | 7% | 0.068 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.2 | -39.5 | 178 | -72.4 | 172.6 | 0 | 0 | 0 | 112.2 | Q18 L21 Y22 C25 I240 V241 G248 | Q18-L244 PolarHBondContact NE2-O 2.93Å; L21-L244 HydrophobicContact CD2-CD1 4.12Å; L21-L244 HydrophobicContact CD2-CD2 3.66Å; L21-L244 HydrophobicContact CG-CD1 3.86Å; L21-L244 HydrophobicContact CG-CD2 4.18Å; Y22-L244 HydrophobicContact CD2-CB 4.13Å; C25-L244 HydrophobicContact CB-CD1 4.18Å; I240-L244 HydrophobicContact CG2-CD1 3.96Å; I240-L244 HydrophobicContact CG2-CG 4.33Å; I240-L244 WeakPolarHBondContact O-CB 3.48Å; I240-L244 WeakPolarHBondContact O-CG 3.26Å; I240-L244 PolarHBondContact O-N 3.5Å; V241-L244 PolarHBondContact O-N 3.24Å; L244-G248 PolarHBondContact O-N 2.94Å |
| 245 | H | 97.7 | Very high | 96.3 | Very high | 48 Ų | 48 | 40.1 Ų | 40.1 | 22% | 0.222 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.9 | -46 | 176.8 | -171 | -104.9 | 0 | 0 | 0 | 111.4 | Y22 M42 S46 V241 I242 F243 G248 G249 | Y22-H245 HydrophobicContact CD2-CB 4.24Å; Y22-H245 HydrophobicContact CE2-CB 3.69Å; Y22-H245 AromaticContact CE2-CD2 3.79Å; Y22-H245 AromaticContact CZ-CD2 3.47Å; Y22-H245 VanDerWaalsContact CZ-CD2 3.47Å; Y22-H245 PolarHBondContact OH-CD2 3.44Å; Y22-H245 VanDerWaalsContact OH-CD2 3.31Å; M42-H245 HydrophobicContact CE-CB 4.01Å; S46-H245 WeakPolarHBondContact CB-ND1 3.24Å; S46-H245 PolarHBondContact OG-CE1 3.14Å; S46-H245 PolarHBondContact OG-ND1 3.11Å; V241-H245 WeakPolarHBondContact O-CB 3.42Å; V241-H245 PolarHBondContact O-N 3.45Å; I242-H245 PolarHBondContact O-N 3.34Å; F243-H245 VanDerWaalsContact C-N 3.33Å; F243-H245 PolarHBondContact O-N 3.05Å; H245-G248 PolarHBondContact O-N 2.69Å; H245-G249 PolarHBondContact O-N 3.47Å |
| 246 | A | 98.4 | Very high | 96.5 | Very high | 4 Ų | 4 | 38.2 Ų | 38.2 | 3% | 0.033 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.9 | -48.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | S46 L49 K50 I242 F243 G248 G249 L250 | S46-A246 WeakPolarHBondContact O-CB 3.37Å; L49-A246 HydrophobicContact CB-CB 4.13Å; L49-A246 HydrophobicContact CD2-CB 3.83Å; L49-A246 HydrophobicContact CG-CB 4.07Å; K50-A246 WeakPolarHBondContact CD-O 3.48Å; K50-A246 HydrophobicContact CG-CB 3.73Å; K50-A246 VanDerWaalsContact CG-O 3.3Å; K50-A246 WeakPolarHBondContact CG-O 3.27Å; I242-A246 WeakPolarHBondContact O-CB 3.36Å; I242-A246 PolarHBondContact O-N 3.23Å; F243-A246 PolarHBondContact O-N 3.44Å; A246-G248 PolarHBondContact O-N 2.98Å; A246-G249 PolarHBondContact O-N 3.37Å; A246-L250 PolarHBondContact O-N 2.9Å; A246-L250 VanDerWaalsContact O-N 3.14Å |
| 247 | F | 97.9 | Very high | 96.5 | Very high | 82 Ų | 82 | 32.5 Ų | 32.5 | 36% | 0.36 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -61.4 | -43.4 | 177.6 | -178.4 | -125 | 0 | 0 | 0 | 111.9 | I14 Q18 F243 G249 L250 L251 | I14-F247 HydrophobicContact CG2-CE1 4.47Å; I14-F247 HydrophobicContact CG2-CZ 4.39Å; Q18-F247 HydrophobicContact CB-CD1 4.45Å; Q18-F247 HydrophobicContact CB-CE1 4.44Å; Q18-F247 HydrophobicContact CG-CD1 3.75Å; Q18-F247 HydrophobicContact CG-CE1 4.22Å; F243-F247 VanDerWaalsContact O-CB 3.31Å; F243-F247 WeakPolarHBondContact O-CB 3.48Å; F243-F247 PolarHBondContact O-N 2.94Å; F247-G249 VanDerWaalsContact C-N 3.34Å; F247-G249 PolarHBondContact O-N 2.81Å; F247-L250 PolarHBondContact O-N 3.29Å; F247-L251 HydrophobicContact CD1-CD1 3.87Å; F247-L251 HydrophobicContact CD2-CG 4.48Å; F247-L251 HydrophobicContact CE1-CD1 3.5Å; F247-L251 HydrophobicContact CE1-CG 4.23Å; F247-L251 HydrophobicContact CE2-CD1 4.3Å; F247-L251 HydrophobicContact CE2-CD2 4.36Å; F247-L251 HydrophobicContact CE2-CG 4.14Å; F247-L251 HydrophobicContact CG-CD1 4.41Å; F247-L251 HydrophobicContact CZ-CD1 3.74Å; F247-L251 HydrophobicContact CZ-CD2 4.13Å; F247-L251 HydrophobicContact CZ-CG 4.01Å; F247-L251 WeakPolarHBondContact O-CG 3.48Å; F247-L251 PolarHBondContact O-N 3.3Å |
| 248 | G | 97.6 | Very high | 96.4 | Very high | 5 Ų | 5 | 35.4 Ų | 35.4 | 5% | 0.052 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -57.7 | -43.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L244 H245 A246 L250 L251 V252 | L244-G248 PolarHBondContact O-N 2.94Å; H245-G248 PolarHBondContact O-N 2.69Å; A246-G248 PolarHBondContact O-N 2.98Å; G248-L250 VanDerWaalsContact C-N 3.33Å; G248-L250 PolarHBondContact O-N 2.91Å; G248-L251 PolarHBondContact O-N 3.45Å; G248-V252 WeakPolarHBondContact O-CG2 3.49Å; G248-V252 PolarHBondContact O-N 2.69Å |
| 249 | G | 96.4 | Very high | 96.4 | Very high | 22 Ų | 22 | 35.7 Ų | 35.7 | 23% | 0.227 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.2 | -40.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | H245 A246 F247 V252 A253 | H245-G249 PolarHBondContact O-N 3.47Å; A246-G249 PolarHBondContact O-N 3.37Å; F247-G249 VanDerWaalsContact C-N 3.34Å; F247-G249 PolarHBondContact O-N 2.81Å; G249-V252 PolarHBondContact O-N 2.6Å; G249-A253 PolarHBondContact O-N 3.45Å |
| 250 | L | 97.1 | Very high | 96.2 | Very high | 21 Ų | 21 | 31.8 Ų | 31.8 | 11% | 0.11 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -68.2 | -40.2 | 175.4 | -62.5 | 175.6 | 0 | 0 | 0 | 112 | K50 T53 C54 W199 N202 A246 F247 G248 A253 L254 | K50-L250 HydrophobicContact CB-CD2 4.38Å; K50-L250 HydrophobicContact CD-CD2 4.34Å; K50-L250 HydrophobicContact CD-CG 4.33Å; K50-L250 HydrophobicContact CG-CD2 4.18Å; K50-L250 HydrophobicContact CG-CG 4.08Å; T53-L250 HydrophobicContact CG2-CD1 4.13Å; C54-L250 VanDerWaalsContact SG-CD2 3.57Å; W199-L250 HydrophobicContact CZ3-CD1 4.41Å; N202-L250 HydrophobicContact CB-CD2 4.05Å; N202-L250 WeakPolarHBondContact ND2-CD2 3.36Å; A246-L250 PolarHBondContact O-N 2.9Å; A246-L250 VanDerWaalsContact O-N 3.14Å; F247-L250 PolarHBondContact O-N 3.29Å; G248-L250 VanDerWaalsContact C-N 3.33Å; G248-L250 PolarHBondContact O-N 2.91Å; L250-A253 PolarHBondContact O-N 3.33Å; L250-L254 PolarHBondContact O-N 2.89Å; L250-L254 VanDerWaalsContact O-N 3.16Å |
| 251 | L | 96.4 | Very high | 96 | Very high | 13 Ų | 13 | 28.8 Ų | 28.8 | 7% | 0.068 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.2 | -39.3 | 175.1 | -74.5 | 172.7 | 0 | 0 | 0 | 112.2 | I14 L15 Q18 F247 G248 A253 L254 V255 | I14-L251 HydrophobicContact CB-CD2 4.38Å; I14-L251 HydrophobicContact CG2-CD1 3.68Å; I14-L251 HydrophobicContact CG2-CD2 3.75Å; I14-L251 HydrophobicContact CG2-CG 4.39Å; L15-L251 HydrophobicContact CD1-CB 4.1Å; Q18-L251 HydrophobicContact CB-CD1 3.7Å; Q18-L251 HydrophobicContact CG-CD1 3.83Å; F247-L251 HydrophobicContact CD1-CD1 3.87Å; F247-L251 HydrophobicContact CD2-CG 4.48Å; F247-L251 HydrophobicContact CE1-CD1 3.5Å; F247-L251 HydrophobicContact CE1-CG 4.23Å; F247-L251 HydrophobicContact CE2-CD1 4.3Å; F247-L251 HydrophobicContact CE2-CD2 4.36Å; F247-L251 HydrophobicContact CE2-CG 4.14Å; F247-L251 HydrophobicContact CG-CD1 4.41Å; F247-L251 HydrophobicContact CZ-CD1 3.74Å; F247-L251 HydrophobicContact CZ-CD2 4.13Å; F247-L251 HydrophobicContact CZ-CG 4.01Å; F247-L251 WeakPolarHBondContact O-CG 3.48Å; F247-L251 PolarHBondContact O-N 3.3Å; G248-L251 PolarHBondContact O-N 3.45Å; L251-A253 VanDerWaalsContact C-N 3.32Å; L251-A253 PolarHBondContact O-N 3.34Å; L251-L254 WeakPolarHBondContact O-CB 3.02Å; L251-L254 PolarHBondContact O-N 3.35Å; L251-L254 VanDerWaalsContact O-N 3.11Å; L251-V255 WeakPolarHBondContact O-CG2 3.36Å; L251-V255 PolarHBondContact O-N 3.32Å |
| 252 | V | 96.7 | Very high | 95.9 | Very high | 38 Ų | 38 | 29.1 Ų | 29.1 | 23% | 0.23 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -58.6 | -45.1 | 175.5 | 167.5 | 0 | 0 | 0 | 0 | 110.4 | L15 F187 G248 G249 L254 V255 V256 K264 | L15-V252 HydrophobicContact CD1-CG2 3.89Å; F187-V252 HydrophobicContact CE1-CG1 4.2Å; G248-V252 WeakPolarHBondContact O-CG2 3.49Å; G248-V252 PolarHBondContact O-N 2.69Å; G249-V252 PolarHBondContact O-N 2.6Å; V252-L254 VanDerWaalsContact C-N 3.29Å; V252-L254 PolarHBondContact O-N 3.13Å; V252-V255 PolarHBondContact O-N 2.81Å; V252-V256 HydrophobicContact CG1-CG2 4.3Å; V252-V256 WeakPolarHBondContact O-CB 3.49Å; V252-V256 VanDerWaalsContact O-CG2 3.26Å; V252-V256 WeakPolarHBondContact O-CG2 3.31Å; V252-V256 PolarHBondContact O-N 3.13Å; V252-K264 HydrophobicContact CG1-CG 4.41Å |
| 253 | A | 96.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.1 | -41.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | F187 L191 I198 N202 G249 L250 L251 K257 | F187-A253 HydrophobicContact CZ-CB 3.97Å; L191-A253 HydrophobicContact CD1-CB 4.11Å; I198-A253 HydrophobicContact CG2-CB 4.3Å; N202-A253 WeakPolarHBondContact OD1-CB 3.26Å; G249-A253 PolarHBondContact O-N 3.45Å; L250-A253 PolarHBondContact O-N 3.33Å; L251-A253 VanDerWaalsContact C-N 3.32Å; L251-A253 PolarHBondContact O-N 3.34Å; A253-K257 WeakPolarHBondContact O-CB 3.47Å; A253-K257 PolarHBondContact O-N 3.38Å |
| 254 | L | 95.2 | Very high | 95.5 | Very high | 42 Ų | 42 | 25.2 Ų | 25.2 | 22% | 0.22 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -66.1 | -49.2 | 178.6 | -164 | 155 | 0 | 0 | 0 | 111.4 | M7 I198 L250 L251 V252 V256 K257 Y258 | M7-L254 HydrophobicContact CE-CD1 4.4Å; M7-L254 HydrophobicContact CE-CD2 4.28Å; I198-L254 HydrophobicContact CD1-CG 4.33Å; L250-L254 PolarHBondContact O-N 2.89Å; L250-L254 VanDerWaalsContact O-N 3.16Å; L251-L254 WeakPolarHBondContact O-CB 3.02Å; L251-L254 PolarHBondContact O-N 3.35Å; L251-L254 VanDerWaalsContact O-N 3.11Å; V252-L254 VanDerWaalsContact C-N 3.29Å; V252-L254 PolarHBondContact O-N 3.13Å; L254-V256 VanDerWaalsContact C-N 3.35Å; L254-V256 PolarHBondContact O-N 3.26Å; L254-K257 PolarHBondContact O-N 3.13Å; L254-Y258 HydrophobicContact CD2-CD2 3.65Å; L254-Y258 HydrophobicContact CD2-CE2 4.06Å; L254-Y258 HydrophobicContact CG-CD2 3.93Å; L254-Y258 HydrophobicContact CG-CE2 3.98Å; L254-Y258 VanDerWaalsContact O-CD2 3.29Å; L254-Y258 WeakPolarHBondContact O-CD2 3.21Å; L254-Y258 PolarHBondContact O-N 3.39Å |
| 255 | V | 96.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58.9 | -46.7 | 176.1 | 171.7 | 0 | 0 | 0 | 0 | 110.5 | S11 L12 L15 L251 V252 K257 Y258 A259 K264 | S11-V255 VanDerWaalsContact C-CG2 3.46Å; S11-V255 VanDerWaalsContact O-CG2 3.31Å; S11-V255 WeakPolarHBondContact O-CG2 3.41Å; L12-V255 HydrophobicContact CD2-CG1 3.51Å; L12-V255 HydrophobicContact CG-CG1 4.12Å; L15-V255 HydrophobicContact CB-CG2 3.93Å; L15-V255 HydrophobicContact CD2-CB 4.18Å; L15-V255 HydrophobicContact CD2-CG1 4.19Å; L15-V255 HydrophobicContact CD2-CG2 3.8Å; L15-V255 HydrophobicContact CG-CG2 4.43Å; L251-V255 WeakPolarHBondContact O-CG2 3.36Å; L251-V255 PolarHBondContact O-N 3.32Å; V252-V255 PolarHBondContact O-N 2.81Å; V255-K257 VanDerWaalsContact C-N 3.31Å; V255-K257 PolarHBondContact O-N 3.44Å; V255-Y258 PolarHBondContact O-N 3.41Å; V255-A259 HydrophobicContact CG1-CB 4.24Å; V255-A259 VanDerWaalsContact O-CA 3.29Å; V255-A259 WeakPolarHBondContact O-CA 3.29Å; V255-A259 WeakPolarHBondContact O-CB 3.3Å; V255-A259 PolarHBondContact O-N 2.93Å; V255-K264 HydrophobicContact CG1-CB 3.85Å; V255-K264 HydrophobicContact CG1-CG 4.45Å |
| 256 | V | 95.9 | Very high | 95.1 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.3 | -40 | 179.9 | 170.6 | 0 | 0 | 0 | 0 | 111 | F187 E188 L191 K192 V252 L254 N261 K264 | F187-V256 HydrophobicContact CD1-CB 4.34Å; F187-V256 HydrophobicContact CD1-CG1 3.96Å; F187-V256 HydrophobicContact CD1-CG2 4.25Å; F187-V256 HydrophobicContact CE1-CB 3.88Å; F187-V256 HydrophobicContact CE1-CG1 3.97Å; F187-V256 HydrophobicContact CE1-CG2 3.87Å; E188-V256 HydrophobicContact CB-CG1 3.52Å; E188-V256 HydrophobicContact CG-CG1 3.84Å; L191-V256 HydrophobicContact CD1-CB 4.17Å; L191-V256 HydrophobicContact CD1-CG1 4Å; K192-V256 WeakPolarHBondContact CE-O 3.4Å; K192-V256 PolarHBondContact NZ-O 3.34Å; V252-V256 HydrophobicContact CG1-CG2 4.3Å; V252-V256 WeakPolarHBondContact O-CB 3.49Å; V252-V256 VanDerWaalsContact O-CG2 3.26Å; V252-V256 WeakPolarHBondContact O-CG2 3.31Å; V252-V256 PolarHBondContact O-N 3.13Å; L254-V256 VanDerWaalsContact C-N 3.35Å; L254-V256 PolarHBondContact O-N 3.26Å; V256-N261 VanDerWaalsContact CG2-OD1 3.24Å; V256-N261 WeakPolarHBondContact CG2-OD1 3.38Å; V256-K264 HydrophobicContact CG2-CB 4.31Å; V256-K264 HydrophobicContact CG2-CG 4.31Å |
| 257 | K | 94.1 | Very high | 94.9 | Very high | 61 Ų | 61 | 23.6 Ų | 23.6 | 27% | 0.265 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -64.4 | -45.1 | 177.4 | -174.3 | 169.9 | -178.6 | 167.3 | 0 | 113.1 | K192 I198 A253 L254 V255 | K192-K257 WeakPolarHBondContact CE-O 3.28Å; I198-K257 HydrophobicContact CD1-CD 3.62Å; I198-K257 HydrophobicContact CG1-CD 3.34Å; A253-K257 WeakPolarHBondContact O-CB 3.47Å; A253-K257 PolarHBondContact O-N 3.38Å; L254-K257 PolarHBondContact O-N 3.13Å; V255-K257 VanDerWaalsContact C-N 3.31Å; V255-K257 PolarHBondContact O-N 3.44Å |
| 258 | Y | 92.7 | Very high | 94.6 | Very high | 89 Ų | 89 | 21.3 Ų | 21.3 | 35% | 0.349 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -91.1 | -23.2 | -176.1 | -70.1 | -74.1 | 0 | 0 | 0 | 114.4 | M7 I198 L254 V255 | M7-Y258 HydrophobicContact CB-CD1 3.94Å; M7-Y258 HydrophobicContact CB-CD2 4.25Å; M7-Y258 HydrophobicContact CB-CE1 4.18Å; M7-Y258 HydrophobicContact CB-CE2 4.49Å; M7-Y258 HydrophobicContact CB-CG 3.98Å; M7-Y258 HydrophobicContact CE-CD2 4.48Å; M7-Y258 HydrophobicContact CE-CE2 3.92Å; M7-Y258 HydrophobicContact CG-CE1 4.47Å; I198-Y258 HydrophobicContact CD1-CE2 3.99Å; L254-Y258 HydrophobicContact CD2-CD2 3.65Å; L254-Y258 HydrophobicContact CD2-CE2 4.06Å; L254-Y258 HydrophobicContact CG-CD2 3.93Å; L254-Y258 HydrophobicContact CG-CE2 3.98Å; L254-Y258 VanDerWaalsContact O-CD2 3.29Å; L254-Y258 WeakPolarHBondContact O-CD2 3.21Å; L254-Y258 PolarHBondContact O-N 3.39Å; V255-Y258 PolarHBondContact O-N 3.41Å |
| 259 | A | 92.8 | Very high | 94.3 | Very high | 11 Ų | 11 | 21.6 Ų | 21.6 | 9% | 0.091 | 12% | 0.117 | C | C | . | . | S | Bend | trans | -110.9 | -112.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | K8 L12 K192 V255 L263 | K8-A259 HydrophobicContact CG-CB 3.79Å; L12-A259 HydrophobicContact CD1-CB 4.36Å; K192-A259 PolarHBondContact NZ-O 3.18Å; V255-A259 HydrophobicContact CG1-CB 4.24Å; V255-A259 VanDerWaalsContact O-CA 3.29Å; V255-A259 WeakPolarHBondContact O-CA 3.29Å; V255-A259 WeakPolarHBondContact O-CB 3.3Å; V255-A259 PolarHBondContact O-N 2.93Å; A259-L263 HydrophobicContact CB-CB 4.18Å; A259-L263 HydrophobicContact CB-CD2 4.16Å |
| 260 | N | 92.9 | Very high | 94.1 | Very high | 30 Ų | 30 | 22.5 Ų | 22.5 | 16% | 0.16 | 12% | 0.118 | C | C | . | . | trans | -170.6 | 172.1 | 173.3 | 53.1 | 37.8 | 0 | 0 | 0 | 108.4 | E188 I262 L263 K264 | E188-N260 WeakPolarHBondContact OE1-CB 3.45Å; N260-I262 VanDerWaalsContact C-N 3.26Å; N260-I262 PolarHBondContact O-N 3.42Å; N260-I262 PolarHBondContact OD1-N 3.21Å; N260-L263 WeakPolarHBondContact OD1-CB 3.48Å; N260-L263 WeakPolarHBondContact OD1-CD1 3.34Å; N260-L263 PolarHBondContact OD1-N 2.82Å; N260-K264 PolarHBondContact O-N 3.33Å | ||
| 261 | N | 92.9 | Very high | 93.8 | Very high | 3 Ų | 3 | 21.6 Ų | 21.6 | 2% | 0.016 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -66 | -27.1 | 178.4 | -90.7 | -62.8 | 0 | 0 | 0 | 114.5 | T118 C184 E188 V256 K264 S265 | T118-N261 HydrophobicContact CG2-CB 4.07Å; C184-N261 HydrophobicContact CB-CB 4.23Å; C184-N261 PolarHBondContact O-ND2 3.03Å; E188-N261 VanDerWaalsContact CB-ND2 3.26Å; E188-N261 WeakPolarHBondContact CB-ND2 3.37Å; E188-N261 PolarHBondContact OE2-N 3.43Å; V256-N261 VanDerWaalsContact CG2-OD1 3.24Å; V256-N261 WeakPolarHBondContact CG2-OD1 3.38Å; N261-K264 WeakPolarHBondContact O-CE 3.41Å; N261-K264 PolarHBondContact O-N 3.01Å; N261-K264 WeakPolarHBondContact OD1-CE 3.25Å; N261-S265 PolarHBondContact O-N 3.37Å; N261-S265 PolarHBondContact O-OG 3.21Å; N261-S265 VanDerWaalsContact O-OG 3.13Å |
| 262 | I | 93.5 | Very high | 93.4 | Very high | 6 Ų | 6 | 23.2 Ų | 23.2 | 3% | 0.031 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -66.9 | -51.6 | 179.9 | -58.3 | 171 | 0 | 0 | 0 | 109.4 | T118 A119 V130 L138 N260 K264 S265 F266 Y305 | T118-I262 HydrophobicContact CG2-CG1 4.2Å; A119-I262 HydrophobicContact CB-CD1 4.23Å; V130-I262 HydrophobicContact CG2-CD1 4.49Å; L138-I262 HydrophobicContact CD2-CG2 3.95Å; N260-I262 VanDerWaalsContact C-N 3.26Å; N260-I262 PolarHBondContact O-N 3.42Å; N260-I262 PolarHBondContact OD1-N 3.21Å; I262-K264 VanDerWaalsContact C-N 3.28Å; I262-K264 PolarHBondContact O-N 2.88Å; I262-S265 WeakPolarHBondContact O-CA 3.24Å; I262-S265 WeakPolarHBondContact O-CB 3.28Å; I262-S265 PolarHBondContact O-N 3.45Å; I262-F266 HydrophobicContact CG2-CD2 4.03Å; I262-F266 HydrophobicContact CG2-CE2 3.86Å; I262-F266 WeakPolarHBondContact O-CD2 3.49Å; I262-F266 PolarHBondContact O-N 2.99Å; I262-Y305 VanDerWaalsContact CD1-OH 3.31Å; I262-Y305 WeakPolarHBondContact CD1-OH 3.42Å; I262-Y305 HydrophobicContact CG2-CD2 4.43Å; I262-Y305 HydrophobicContact CG2-CE1 4.09Å; I262-Y305 HydrophobicContact CG2-CE2 3.6Å; I262-Y305 VanDerWaalsContact CG2-CZ 3.42Å; I262-Y305 WeakPolarHBondContact CG2-OH 3.35Å |
| 263 | L | 92.6 | Very high | 93 | Very high | 13 Ų | 13 | 22 Ų | 22 | 7% | 0.068 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -61 | -35.8 | 175.7 | -94.1 | 65.9 | 0 | 0 | 0 | 112.4 | L12 A259 N260 S265 F266 A267 Y305 | L12-L263 HydrophobicContact CD1-CB 4.47Å; L12-L263 HydrophobicContact CD1-CD2 3.96Å; L12-L263 HydrophobicContact CD2-CB 4.14Å; A259-L263 HydrophobicContact CB-CB 4.18Å; A259-L263 HydrophobicContact CB-CD2 4.16Å; N260-L263 WeakPolarHBondContact OD1-CB 3.48Å; N260-L263 WeakPolarHBondContact OD1-CD1 3.34Å; N260-L263 PolarHBondContact OD1-N 2.82Å; L263-S265 VanDerWaalsContact C-N 3.31Å; L263-S265 PolarHBondContact O-N 3.42Å; L263-F266 WeakPolarHBondContact O-CB 3.36Å; L263-F266 PolarHBondContact O-N 3.36Å; L263-A267 PolarHBondContact O-N 3.24Å; L263-Y305 HydrophobicContact CD1-CD1 3.55Å; L263-Y305 HydrophobicContact CD1-CE1 3.23Å |
| 264 | K | 94.5 | Very high | 92.6 | Very high | 28 Ų | 28 | 25 Ų | 25 | 12% | 0.122 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -58.6 | -43.9 | 171.5 | 173.8 | -79.8 | -39.1 | -174.6 | 0 | 111.1 | L15 V252 V255 V256 N260 N261 I262 A267 C268 | L15-K264 HydrophobicContact CD2-CG 4.08Å; V252-K264 HydrophobicContact CG1-CG 4.41Å; V255-K264 HydrophobicContact CG1-CB 3.85Å; V255-K264 HydrophobicContact CG1-CG 4.45Å; V256-K264 HydrophobicContact CG2-CB 4.31Å; V256-K264 HydrophobicContact CG2-CG 4.31Å; N260-K264 PolarHBondContact O-N 3.33Å; N261-K264 WeakPolarHBondContact O-CE 3.41Å; N261-K264 PolarHBondContact O-N 3.01Å; N261-K264 WeakPolarHBondContact OD1-CE 3.25Å; I262-K264 VanDerWaalsContact C-N 3.28Å; I262-K264 PolarHBondContact O-N 2.88Å; K264-A267 PolarHBondContact O-N 3.07Å; K264-C268 PolarHBondContact O-N 2.92Å; K264-C268 PolarHBondContact O-SG 3.03Å |
| 265 | S | 93.3 | Very high | 92.2 | Very high | 12 Ų | 12 | 23.3 Ų | 23.3 | 8% | 0.084 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64.1 | -39.8 | 176.4 | -61.9 | 0 | 0 | 0 | 0 | 112.2 | N261 I262 L263 C268 C269 | N261-S265 PolarHBondContact O-N 3.37Å; N261-S265 PolarHBondContact O-OG 3.21Å; N261-S265 VanDerWaalsContact O-OG 3.13Å; I262-S265 WeakPolarHBondContact O-CA 3.24Å; I262-S265 WeakPolarHBondContact O-CB 3.28Å; I262-S265 PolarHBondContact O-N 3.45Å; L263-S265 VanDerWaalsContact C-N 3.31Å; L263-S265 PolarHBondContact O-N 3.42Å; S265-C268 PolarHBondContact O-N 3.21Å; S265-C269 PolarHBondContact O-N 3.43Å; S265-C269 PolarHBondContact O-SG 3.37Å |
| 266 | F | 93.1 | Very high | 91.5 | Very high | 11 Ų | 11 | 25.1 Ų | 25.1 | 5% | 0.048 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -59.6 | -47.4 | 172 | -86.1 | -90 | 0 | 0 | 0 | 112.3 | A137 L138 L141 I262 L263 C268 C269 V270 S301 S302 Y305 | A137-F266 HydrophobicContact CB-CZ 4.47Å; L138-F266 HydrophobicContact CD2-CE2 3.79Å; L138-F266 HydrophobicContact CD2-CZ 4.23Å; L141-F266 HydrophobicContact CB-CE1 4.08Å; L141-F266 HydrophobicContact CB-CZ 4.13Å; L141-F266 HydrophobicContact CD1-CD1 3.9Å; L141-F266 HydrophobicContact CD1-CE1 3.92Å; L141-F266 HydrophobicContact CD2-CD1 3.86Å; L141-F266 HydrophobicContact CD2-CD2 3.94Å; L141-F266 HydrophobicContact CD2-CE1 3.75Å; L141-F266 HydrophobicContact CD2-CE2 3.8Å; L141-F266 HydrophobicContact CD2-CG 3.97Å; L141-F266 HydrophobicContact CD2-CZ 3.71Å; L141-F266 HydrophobicContact CG-CD1 4.4Å; L141-F266 HydrophobicContact CG-CE1 4.13Å; L141-F266 HydrophobicContact CG-CZ 4.38Å; I262-F266 HydrophobicContact CG2-CD2 4.03Å; I262-F266 HydrophobicContact CG2-CE2 3.86Å; I262-F266 WeakPolarHBondContact O-CD2 3.49Å; I262-F266 PolarHBondContact O-N 2.99Å; L263-F266 WeakPolarHBondContact O-CB 3.36Å; L263-F266 PolarHBondContact O-N 3.36Å; F266-C268 VanDerWaalsContact C-N 3.31Å; F266-C268 PolarHBondContact O-N 2.79Å; F266-C269 WeakPolarHBondContact O-CB 3.42Å; F266-C269 PolarHBondContact O-N 3.22Å; F266-V270 WeakPolarHBondContact O-CG2 3.28Å; F266-V270 PolarHBondContact O-N 3.45Å; F266-S301 VanDerWaalsContact CE1-OG 3.22Å; F266-S301 WeakPolarHBondContact CE1-OG 3.31Å; F266-S302 WeakPolarHBondContact CD1-OG 3.33Å; F266-Y305 HydrophobicContact CD2-CG 4.4Å; F266-Y305 HydrophobicContact CE2-CD1 4.3Å; F266-Y305 AromaticContact CE2-CD2 3.55Å; F266-Y305 HydrophobicContact CE2-CD2 3.55Å; F266-Y305 HydrophobicContact CE2-CE2 4.09Å; F266-Y305 AromaticContact CE2-CG 3.67Å; F266-Y305 HydrophobicContact CE2-CG 3.67Å; F266-Y305 AromaticContact CZ-CD2 3.72Å; F266-Y305 HydrophobicContact CZ-CD2 3.72Å; F266-Y305 AromaticContact CZ-CG 3.79Å; F266-Y305 HydrophobicContact CZ-CG 3.79Å |
| 267 | A | 93.9 | Very high | 90.9 | Very high | 8 Ų | 8 | 26.9 Ų | 26.9 | 7% | 0.066 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -58.9 | -41.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L12 L15 V16 L263 K264 C269 V270 S271 | L12-A267 HydrophobicContact CD2-CB 3.87Å; L15-A267 HydrophobicContact CD2-CB 4.25Å; V16-A267 HydrophobicContact CG2-CB 3.82Å; L263-A267 PolarHBondContact O-N 3.24Å; K264-A267 PolarHBondContact O-N 3.07Å; A267-C269 VanDerWaalsContact C-N 3.34Å; A267-C269 PolarHBondContact O-N 3.01Å; A267-V270 PolarHBondContact O-N 3.12Å; A267-S271 PolarHBondContact O-N 3.48Å; A267-S271 PolarHBondContact O-OG 2.89Å |
| 268 | C | 92.4 | Very high | 90.5 | Very high | 35 Ų | 35 | 28 Ų | 28 | 24% | 0.236 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.8 | -40.5 | 173.3 | -67.2 | 0 | 0 | 0 | 0 | 112.3 | N19 K264 S265 F266 S271 I272 | N19-C268 PolarHBondContact ND2-SG 3.34Å; N19-C268 VanDerWaalsContact ND2-SG 3.43Å; K264-C268 PolarHBondContact O-N 2.92Å; K264-C268 PolarHBondContact O-SG 3.03Å; S265-C268 PolarHBondContact O-N 3.21Å; F266-C268 VanDerWaalsContact C-N 3.31Å; F266-C268 PolarHBondContact O-N 2.79Å; C268-S271 WeakPolarHBondContact CA-OG 3.4Å; C268-S271 PolarHBondContact O-N 2.99Å; C268-S271 PolarHBondContact O-OG 3.14Å; C268-I272 WeakPolarHBondContact O-CG1 3.42Å; C268-I272 PolarHBondContact O-N 3.49Å; C268-I272 VanDerWaalsContact O-N 3.1Å |
| 269 | C | 91.8 | Very high | 89.8 | Confident | 10 Ų | 10 | 23.8 Ų | 23.8 | 7% | 0.068 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -66.2 | -40.8 | 178.5 | -60.9 | 0 | 0 | 0 | 0 | 111.5 | L141 V145 S265 F266 A267 S271 I272 I273 V298 | L141-C269 HydrophobicContact CD1-CB 3.88Å; V145-C269 HydrophobicContact CG2-CB 3.86Å; V145-C269 VanDerWaalsContact CG2-SG 3.54Å; S265-C269 PolarHBondContact O-N 3.43Å; S265-C269 PolarHBondContact O-SG 3.37Å; F266-C269 WeakPolarHBondContact O-CB 3.42Å; F266-C269 PolarHBondContact O-N 3.22Å; A267-C269 VanDerWaalsContact C-N 3.34Å; A267-C269 PolarHBondContact O-N 3.01Å; C269-S271 VanDerWaalsContact C-N 3.34Å; C269-S271 PolarHBondContact O-N 3.49Å; C269-I272 PolarHBondContact O-N 3.48Å; C269-I273 PolarHBondContact O-N 3.44Å; C269-V298 HydrophobicContact CB-CG1 4.06Å |
| 270 | V | 91.4 | Very high | 89 | Confident | 42 Ų | 42 | 24.5 Ų | 24.5 | 26% | 0.255 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -62.1 | -40.9 | 173.4 | 175.7 | 0 | 0 | 0 | 0 | 111.1 | V16 F266 A267 I272 I273 L274 V298 | V16-V270 HydrophobicContact CG1-CG1 4.03Å; V16-V270 HydrophobicContact CG2-CG1 4.47Å; F266-V270 WeakPolarHBondContact O-CG2 3.28Å; F266-V270 PolarHBondContact O-N 3.45Å; A267-V270 PolarHBondContact O-N 3.12Å; V270-I272 VanDerWaalsContact C-N 3.3Å; V270-I272 PolarHBondContact O-N 3.26Å; V270-I273 PolarHBondContact O-N 2.96Å; V270-L274 HydrophobicContact CG1-CD1 4.16Å; V270-L274 HydrophobicContact CG1-CG 4.44Å; V270-L274 WeakPolarHBondContact O-CG 3.39Å; V270-L274 PolarHBondContact O-N 3.2Å; V270-V298 HydrophobicContact CG2-CG1 4.45Å |
| 271 | S | 91.8 | Very high | 88.4 | Confident | 2 Ų | 2 | 28.4 Ų | 28.4 | 1% | 0.014 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.4 | -32.9 | 177.2 | 59.6 | 0 | 0 | 0 | 0 | 113.7 | V16 N19 A267 C268 C269 L274 S275 | V16-S271 WeakPolarHBondContact O-CB 3.36Å; N19-S271 VanDerWaalsContact CB-OG 3.28Å; N19-S271 WeakPolarHBondContact CB-OG 3.48Å; A267-S271 PolarHBondContact O-N 3.48Å; A267-S271 PolarHBondContact O-OG 2.89Å; C268-S271 WeakPolarHBondContact CA-OG 3.4Å; C268-S271 PolarHBondContact O-N 2.99Å; C268-S271 PolarHBondContact O-OG 3.14Å; C269-S271 VanDerWaalsContact C-N 3.34Å; C269-S271 PolarHBondContact O-N 3.49Å; S271-L274 PolarHBondContact O-N 2.92Å; S271-S275 WeakPolarHBondContact O-CB 3.44Å; S271-S275 PolarHBondContact O-N 2.72Å |
| 272 | I | 87.3 | Confident | 87.7 | Confident | 46 Ų | 46 | 34.8 Ų | 34.8 | 24% | 0.236 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.6 | -47 | 175.9 | -69 | 163.3 | 0 | 0 | 0 | 110.1 | I23 E149 C268 C269 V270 L274 S275 C276 | I23-I272 HydrophobicContact CD1-CG1 4.1Å; E149-I272 HydrophobicContact CG-CG2 4.36Å; E149-I272 WeakPolarHBondContact OE1-CD1 3.32Å; C268-I272 WeakPolarHBondContact O-CG1 3.42Å; C268-I272 PolarHBondContact O-N 3.49Å; C268-I272 VanDerWaalsContact O-N 3.1Å; C269-I272 PolarHBondContact O-N 3.48Å; V270-I272 VanDerWaalsContact C-N 3.3Å; V270-I272 PolarHBondContact O-N 3.26Å; I272-L274 PolarHBondContact O-N 3.31Å; I272-S275 WeakPolarHBondContact O-CB 3.43Å; I272-S275 PolarHBondContact O-N 2.94Å; I272-S275 VanDerWaalsContact O-N 3.12Å; I272-C276 PolarHBondContact O-N 2.99Å; I272-C276 PolarHBondContact O-SG 2.93Å; I272-C276 VanDerWaalsContact O-SG 3.4Å |
| 273 | I | 87.6 | Confident | 86.8 | Confident | 13 Ų | 13 | 40 Ų | 40 | 7% | 0.067 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.2 | -47.7 | 175.8 | -71.6 | 165.6 | 0 | 0 | 0 | 111.3 | V148 C269 V270 S275 C276 A277 F291 T295 V298 | V148-I273 HydrophobicContact CG1-CG1 4.48Å; V148-I273 HydrophobicContact CG2-CG1 4.34Å; C269-I273 PolarHBondContact O-N 3.44Å; V270-I273 PolarHBondContact O-N 2.96Å; I273-S275 VanDerWaalsContact C-N 3.25Å; I273-S275 PolarHBondContact O-N 3.37Å; I273-C276 PolarHBondContact O-N 3.09Å; I273-A277 WeakPolarHBondContact O-CB 3.45Å; I273-A277 PolarHBondContact O-N 3.05Å; I273-F291 HydrophobicContact CG2-CZ 4.3Å; I273-T295 HydrophobicContact CD1-CG2 4.33Å; I273-T295 HydrophobicContact CG2-CG2 3.43Å; I273-T295 VanDerWaalsContact CG2-CG2 3.43Å; I273-V298 HydrophobicContact CD1-CB 3.4Å; I273-V298 VanDerWaalsContact CD1-CB 3.4Å; I273-V298 HydrophobicContact CD1-CG1 3.44Å; I273-V298 VanDerWaalsContact CD1-CG1 3.44Å; I273-V298 HydrophobicContact CD1-CG2 3.82Å |
| 274 | L | 89 | Confident | 85.6 | Confident | 64 Ų | 64 | 42.2 Ų | 42.2 | 34% | 0.335 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.1 | -35.7 | 178.1 | -69.2 | 174.7 | 0 | 0 | 0 | 111.6 | V16 L20 V270 S271 I272 A277 F278 | V16-L274 HydrophobicContact CG1-CD1 3.48Å; V16-L274 VanDerWaalsContact CG1-CD1 3.48Å; L20-L274 HydrophobicContact CD1-CB 3.96Å; L20-L274 HydrophobicContact CD2-CB 4.09Å; V270-L274 HydrophobicContact CG1-CD1 4.16Å; V270-L274 HydrophobicContact CG1-CG 4.44Å; V270-L274 WeakPolarHBondContact O-CG 3.39Å; V270-L274 PolarHBondContact O-N 3.2Å; S271-L274 PolarHBondContact O-N 2.92Å; I272-L274 PolarHBondContact O-N 3.31Å; L274-A277 PolarHBondContact O-N 3.24Å; L274-F278 VanDerWaalsContact O-CB 3.3Å; L274-F278 WeakPolarHBondContact O-CB 3.33Å; L274-F278 PolarHBondContact O-N 2.78Å |
| 275 | S | 86.6 | Confident | 84.4 | Confident | 6 Ų | 6 | 44.3 Ų | 44.3 | 4% | 0.042 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -67.9 | -40.3 | 177.4 | -175.3 | 0 | 0 | 0 | 0 | 111.9 | L20 I23 L24 S271 I272 I273 S279 | L20-S275 VanDerWaalsContact CD1-N 3.27Å; I23-S275 VanDerWaalsContact CG2-OG 3.28Å; I23-S275 WeakPolarHBondContact CG2-OG 3.31Å; L24-S275 VanDerWaalsContact CD2-OG 3.31Å; L24-S275 WeakPolarHBondContact CD2-OG 3.31Å; S271-S275 WeakPolarHBondContact O-CB 3.44Å; S271-S275 PolarHBondContact O-N 2.72Å; I272-S275 WeakPolarHBondContact O-CB 3.43Å; I272-S275 PolarHBondContact O-N 2.94Å; I272-S275 VanDerWaalsContact O-N 3.12Å; I273-S275 VanDerWaalsContact C-N 3.25Å; I273-S275 PolarHBondContact O-N 3.37Å; S275-S279 WeakPolarHBondContact O-CB 3.41Å; S275-S279 PolarHBondContact O-N 3.46Å; S275-S279 PolarHBondContact O-OG 2.92Å |
| 276 | C | 81.7 | Confident | 83.1 | Confident | 38 Ų | 38 | 52.9 Ų | 52.9 | 26% | 0.257 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -65.5 | -45.5 | 172.6 | -68.3 | 0 | 0 | 0 | 0 | 111.8 | I272 I273 F278 S279 V280 F291 | I272-C276 PolarHBondContact O-N 2.99Å; I272-C276 PolarHBondContact O-SG 2.93Å; I272-C276 VanDerWaalsContact O-SG 3.4Å; I273-C276 PolarHBondContact O-N 3.09Å; C276-F278 VanDerWaalsContact C-N 3.33Å; C276-F278 PolarHBondContact O-N 3.11Å; C276-S279 WeakPolarHBondContact O-CB 3.5Å; C276-S279 PolarHBondContact O-N 3.36Å; C276-S279 VanDerWaalsContact O-N 3.11Å; C276-V280 WeakPolarHBondContact O-CG2 3.36Å; C276-V280 PolarHBondContact O-N 3.24Å; C276-F291 HydrophobicContact CB-CD2 4.09Å; C276-F291 HydrophobicContact CB-CE1 4.48Å; C276-F291 HydrophobicContact CB-CE2 3.11Å; C276-F291 HydrophobicContact CB-CZ 3.35Å |
| 277 | A | 83.5 | Confident | 81.8 | Confident | 37 Ų | 37 | 56.3 Ų | 56.3 | 31% | 0.306 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.3 | -42.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | I273 L274 S279 V280 V281 | I273-A277 WeakPolarHBondContact O-CB 3.45Å; I273-A277 PolarHBondContact O-N 3.05Å; L274-A277 PolarHBondContact O-N 3.24Å; A277-S279 VanDerWaalsContact C-N 3.35Å; A277-S279 PolarHBondContact O-N 2.92Å; A277-V280 PolarHBondContact O-N 2.97Å; A277-V281 WeakPolarHBondContact O-CG2 3.33Å; A277-V281 PolarHBondContact O-N 3.47Å |
| 278 | F | 84.9 | Confident | 81 | Confident | 83 Ų | 83 | 57.7 Ų | 57.7 | 36% | 0.364 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.4 | -46.2 | 172.4 | -174.3 | -81.8 | 0 | 0 | 0 | 111.3 | L24 L274 C276 V280 V281 F282 | L24-F278 HydrophobicContact CD1-CB 4.12Å; L24-F278 HydrophobicContact CD1-CD1 3.48Å; L24-F278 VanDerWaalsContact CD1-CD1 3.48Å; L24-F278 HydrophobicContact CD1-CD2 4.07Å; L24-F278 HydrophobicContact CD1-CE1 3.85Å; L24-F278 HydrophobicContact CD1-CE2 4.38Å; L24-F278 HydrophobicContact CD1-CG 3.61Å; L24-F278 HydrophobicContact CD1-CZ 4.29Å; L24-F278 HydrophobicContact CD2-CB 4.38Å; L24-F278 HydrophobicContact CD2-CD1 3.64Å; L24-F278 HydrophobicContact CD2-CE1 4.33Å; L24-F278 HydrophobicContact CD2-CG 4.26Å; L24-F278 HydrophobicContact CG-CD1 4.21Å; L274-F278 VanDerWaalsContact O-CB 3.3Å; L274-F278 WeakPolarHBondContact O-CB 3.33Å; L274-F278 PolarHBondContact O-N 2.78Å; C276-F278 VanDerWaalsContact C-N 3.33Å; C276-F278 PolarHBondContact O-N 3.11Å; F278-V280 VanDerWaalsContact C-N 3.28Å; F278-V280 PolarHBondContact O-N 3.36Å; F278-V281 PolarHBondContact O-N 3.25Å; F278-F282 HydrophobicContact CB-CD2 4.49Å; F278-F282 HydrophobicContact CD1-CB 4.35Å; F278-F282 AromaticContact CD1-CD2 3.9Å; F278-F282 HydrophobicContact CD1-CD2 3.9Å; F278-F282 HydrophobicContact CD1-CG 4.41Å; F278-F282 AromaticContact CD2-CD2 3.41Å; F278-F282 HydrophobicContact CD2-CD2 3.41Å; F278-F282 VanDerWaalsContact CD2-CD2 3.41Å; F278-F282 AromaticContact CD2-CE2 3.41Å; F278-F282 HydrophobicContact CD2-CE2 3.41Å; F278-F282 VanDerWaalsContact CD2-CE2 3.41Å; F278-F282 HydrophobicContact CD2-CG 4.43Å; F278-F282 HydrophobicContact CD2-CZ 4.42Å; F278-F282 HydrophobicContact CE1-CB 4.01Å; F278-F282 AromaticContact CE1-CD2 3.86Å; F278-F282 HydrophobicContact CE1-CD2 3.86Å; F278-F282 HydrophobicContact CE1-CG 4.03Å; F278-F282 AromaticContact CE2-CD2 3.37Å; F278-F282 HydrophobicContact CE2-CD2 3.37Å; F278-F282 AromaticContact CE2-CE2 3.31Å; F278-F282 HydrophobicContact CE2-CE2 3.31Å; F278-F282 HydrophobicContact CE2-CG 4.06Å; F278-F282 AromaticContact CE2-CZ 3.94Å; F278-F282 HydrophobicContact CE2-CZ 3.94Å; F278-F282 AromaticContact CG-CD2 3.68Å; F278-F282 HydrophobicContact CG-CD2 3.68Å; F278-F282 HydrophobicContact CG-CE2 4.14Å; F278-F282 HydrophobicContact CZ-CB 4.29Å; F278-F282 HydrophobicContact CZ-CD1 4.38Å; F278-F282 AromaticContact CZ-CD2 3.6Å; F278-F282 HydrophobicContact CZ-CD2 3.6Å; F278-F282 AromaticContact CZ-CE2 3.97Å; F278-F282 HydrophobicContact CZ-CE2 3.97Å; F278-F282 AromaticContact CZ-CG 3.84Å; F278-F282 HydrophobicContact CZ-CG 3.84Å; F278-F282 HydrophobicContact CZ-CZ 4.49Å; F278-F282 WeakPolarHBondContact O-CB 3.25Å; F278-F282 WeakPolarHBondContact O-CD2 3.33Å; F278-F282 PolarHBondContact O-N 3.1Å |
| 279 | S | 78.6 | Confident | 80.4 | Confident | 1 Ų | 1 | 62.4 Ų | 62.4 | 1% | 0.007 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.5 | -34.7 | 178.7 | -56.9 | 0 | 0 | 0 | 0 | 112.3 | R27 S275 C276 A277 L283 | R27-S279 PolarHBondContact NH1-OG 3.28Å; S275-S279 WeakPolarHBondContact O-CB 3.41Å; S275-S279 PolarHBondContact O-N 3.46Å; S275-S279 PolarHBondContact O-OG 2.92Å; C276-S279 WeakPolarHBondContact O-CB 3.5Å; C276-S279 PolarHBondContact O-N 3.36Å; C276-S279 VanDerWaalsContact O-N 3.11Å; A277-S279 VanDerWaalsContact C-N 3.35Å; A277-S279 PolarHBondContact O-N 2.92Å; S279-L283 WeakPolarHBondContact O-CA 3.45Å; S279-L283 WeakPolarHBondContact O-CB 3.48Å; S279-L283 PolarHBondContact O-N 2.94Å |
| 280 | V | 76.6 | Confident | 80 | Confident | 27 Ų | 27 | 64.4 Ų | 64.4 | 16% | 0.164 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -66.7 | -52.6 | 174.3 | 164.1 | 0 | 0 | 0 | 0 | 111 | C276 A277 F278 G284 M285 L287 | C276-V280 WeakPolarHBondContact O-CG2 3.36Å; C276-V280 PolarHBondContact O-N 3.24Å; A277-V280 PolarHBondContact O-N 2.97Å; F278-V280 VanDerWaalsContact C-N 3.28Å; F278-V280 PolarHBondContact O-N 3.36Å; V280-G284 WeakPolarHBondContact O-CA 3.34Å; V280-G284 PolarHBondContact O-N 2.99Å; V280-M285 WeakPolarHBondContact CG1-O 3.49Å; V280-M285 HydrophobicContact CG2-CB 4.41Å; V280-M285 PolarHBondContact O-N 3.44Å; V280-L287 HydrophobicContact CB-CG 4.36Å; V280-L287 HydrophobicContact CG1-CD1 3.76Å; V280-L287 HydrophobicContact CG1-CD2 4.35Å; V280-L287 HydrophobicContact CG1-CG 3.66Å; V280-L287 HydrophobicContact CG2-CD2 3.97Å; V280-L287 HydrophobicContact CG2-CG 3.9Å |
| 281 | V | 79.3 | Confident | 79.6 | Confident | 111 Ų | 111 | 63.6 Ų | 63.6 | 67% | 0.673 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -68.1 | -42.5 | -173.3 | 173.3 | 0 | 0 | 0 | 0 | 111.8 | A277 F278 | A277-V281 WeakPolarHBondContact O-CG2 3.33Å; A277-V281 PolarHBondContact O-N 3.47Å; F278-V281 PolarHBondContact O-N 3.25Å |
| 282 | F | 79.1 | Confident | 79.2 | Confident | 138 Ų | 138 | 67.2 Ų | 67.2 | 61% | 0.605 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -95.8 | -27.8 | -172.8 | -68.9 | -85.6 | 0 | 0 | 0 | 114 | F278 | F278-F282 HydrophobicContact CB-CD2 4.49Å; F278-F282 HydrophobicContact CD1-CB 4.35Å; F278-F282 AromaticContact CD1-CD2 3.9Å; F278-F282 HydrophobicContact CD1-CD2 3.9Å; F278-F282 HydrophobicContact CD1-CG 4.41Å; F278-F282 AromaticContact CD2-CD2 3.41Å; F278-F282 HydrophobicContact CD2-CD2 3.41Å; F278-F282 VanDerWaalsContact CD2-CD2 3.41Å; F278-F282 AromaticContact CD2-CE2 3.41Å; F278-F282 HydrophobicContact CD2-CE2 3.41Å; F278-F282 VanDerWaalsContact CD2-CE2 3.41Å; F278-F282 HydrophobicContact CD2-CG 4.43Å; F278-F282 HydrophobicContact CD2-CZ 4.42Å; F278-F282 HydrophobicContact CE1-CB 4.01Å; F278-F282 AromaticContact CE1-CD2 3.86Å; F278-F282 HydrophobicContact CE1-CD2 3.86Å; F278-F282 HydrophobicContact CE1-CG 4.03Å; F278-F282 AromaticContact CE2-CD2 3.37Å; F278-F282 HydrophobicContact CE2-CD2 3.37Å; F278-F282 AromaticContact CE2-CE2 3.31Å; F278-F282 HydrophobicContact CE2-CE2 3.31Å; F278-F282 HydrophobicContact CE2-CG 4.06Å; F278-F282 AromaticContact CE2-CZ 3.94Å; F278-F282 HydrophobicContact CE2-CZ 3.94Å; F278-F282 AromaticContact CG-CD2 3.68Å; F278-F282 HydrophobicContact CG-CD2 3.68Å; F278-F282 HydrophobicContact CG-CE2 4.14Å; F278-F282 HydrophobicContact CZ-CB 4.29Å; F278-F282 HydrophobicContact CZ-CD1 4.38Å; F278-F282 AromaticContact CZ-CD2 3.6Å; F278-F282 HydrophobicContact CZ-CD2 3.6Å; F278-F282 AromaticContact CZ-CE2 3.97Å; F278-F282 HydrophobicContact CZ-CE2 3.97Å; F278-F282 AromaticContact CZ-CG 3.84Å; F278-F282 HydrophobicContact CZ-CG 3.84Å; F278-F282 HydrophobicContact CZ-CZ 4.49Å; F278-F282 WeakPolarHBondContact O-CB 3.25Å; F278-F282 WeakPolarHBondContact O-CD2 3.33Å; F278-F282 PolarHBondContact O-N 3.1Å |
| 283 | L | 73.8 | Confident | 79.3 | Confident | 116 Ų | 116 | 70.9 Ų | 70.9 | 61% | 0.607 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -103.8 | 1.7 | 178.6 | -49.5 | 169.7 | 0 | 0 | 0 | 112.9 | S279 M285 | S279-L283 WeakPolarHBondContact O-CA 3.45Å; S279-L283 WeakPolarHBondContact O-CB 3.48Å; S279-L283 PolarHBondContact O-N 2.94Å; L283-M285 VanDerWaalsContact C-N 3.28Å; L283-M285 HydrophobicContact CB-CG 4.36Å; L283-M285 PolarHBondContact O-N 2.59Å |
| 284 | G | 67.2 | Low | 79.4 | Confident | 59 Ų | 59 | 70.3 Ų | 70.3 | 61% | 0.608 | 38% | 0.383 | S | S | * | . | trans | 67.3 | 23.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | V280 | V280-G284 WeakPolarHBondContact O-CA 3.34Å; V280-G284 PolarHBondContact O-N 2.99Å | ||
| 285 | M | 68.7 | Low | 79.3 | Confident | 72 Ų | 72 | 68.1 Ų | 68.1 | 36% | 0.355 | 37% | 0.372 | S | S | . | . | P | Polyproline II helix | trans | -72.2 | 141.8 | 176.6 | -57.3 | -167.7 | -41.5 | 0 | 0 | 110.8 | V280 L283 | V280-M285 WeakPolarHBondContact CG1-O 3.49Å; V280-M285 HydrophobicContact CG2-CB 4.41Å; V280-M285 PolarHBondContact O-N 3.44Å; L283-M285 VanDerWaalsContact C-N 3.28Å; L283-M285 HydrophobicContact CB-CG 4.36Å; L283-M285 PolarHBondContact O-N 2.59Å |
| 286 | H | 65.9 | Low | 79.5 | Confident | 191 Ų | 191 | 72.7 Ų | 72.7 | 88% | 0.884 | 40% | 0.395 | S | S | * | . | P | Polyproline II helix | trans | -72.6 | 134.1 | 175.9 | -66.5 | -77.8 | 0 | 0 | 0 | 112.2 | S288 | H286-S288 PolarHBondContact O-N 2.83Š|
| 287 | L | 67.6 | Low | 80.1 | Confident | 83 Ų | 83 | 72 Ų | 72 | 44% | 0.435 | 39% | 0.389 | S | S | . | . | P | Polyproline II helix | trans | -70.9 | 122.3 | 171.5 | -80.8 | 153.2 | 0 | 0 | 0 | 110.1 | V280 F291 I292 | V280-L287 HydrophobicContact CB-CG 4.36Å; V280-L287 HydrophobicContact CG1-CD1 3.76Å; V280-L287 HydrophobicContact CG1-CD2 4.35Å; V280-L287 HydrophobicContact CG1-CG 3.66Å; V280-L287 HydrophobicContact CG2-CD2 3.97Å; V280-L287 HydrophobicContact CG2-CG 3.9Å; L287-F291 HydrophobicContact CD2-CD1 3.2Å; L287-F291 HydrophobicContact CD2-CE1 3.57Å; L287-F291 HydrophobicContact CD2-CG 4.19Å; L287-I292 HydrophobicContact CB-CD1 4.29Å; L287-I292 HydrophobicContact CB-CG1 4.47Å; L287-I292 HydrophobicContact CD2-CG1 4.17Å |
| 288 | S | 76.2 | Confident | 80.5 | Confident | 37 Ų | 37 | 70.3 Ų | 70.3 | 26% | 0.259 | 38% | 0.375 | S | S | . | . | P | Polyproline II helix | trans | -73.4 | 142.2 | 163.6 | 171.6 | 0 | 0 | 0 | 0 | 109.9 | H286 S290 F291 I292 | H286-S288 PolarHBondContact O-N 2.83Å; S288-S290 PolarHBondContact O-N 2.92Å; S288-S290 PolarHBondContact OG-N 3.15Å; S288-F291 WeakPolarHBondContact O-CB 3.34Å; S288-F291 PolarHBondContact O-N 2.93Å; S288-I292 PolarHBondContact O-N 3.45Å |
| 289 | N | 80.5 | Confident | 80.8 | Confident | 134 Ų | 134 | 70 Ų | 70 | 72% | 0.717 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -55.8 | -33.8 | 172.4 | -69.1 | -9.2 | 0 | 0 | 0 | 111.8 | F291 I292 F293 | N289-F291 VanDerWaalsContact C-N 3.29Å; N289-F291 PolarHBondContact O-N 3.33Å; N289-I292 PolarHBondContact O-N 3.5Å; N289-F293 WeakPolarHBondContact O-CB 3.48Å; N289-F293 PolarHBondContact O-N 3.34Å |
| 290 | S | 82.7 | Confident | 81.5 | Confident | 52 Ų | 52 | 73.9 Ų | 73.9 | 36% | 0.364 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.4 | -35.8 | 175.4 | -54 | 0 | 0 | 0 | 0 | 112.4 | S288 G294 | S288-S290 PolarHBondContact O-N 2.92Å; S288-S290 PolarHBondContact OG-N 3.15Å; S290-G294 PolarHBondContact O-N 2.85Å |
| 291 | F | 82.2 | Confident | 82.4 | Confident | 26 Ų | 26 | 72.6 Ų | 72.6 | 11% | 0.114 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -67.7 | -44.6 | 177.9 | 175.7 | -89.9 | 0 | 0 | 0 | 111.6 | V148 I273 C276 L287 S288 N289 T295 | V148-F291 HydrophobicContact CB-CD2 4.37Å; V148-F291 HydrophobicContact CG1-CD2 3.77Å; V148-F291 HydrophobicContact CG1-CE2 3.71Å; V148-F291 HydrophobicContact CG2-CD2 4.22Å; V148-F291 HydrophobicContact CG2-CE2 4.4Å; I273-F291 HydrophobicContact CG2-CZ 4.3Å; C276-F291 HydrophobicContact CB-CD2 4.09Å; C276-F291 HydrophobicContact CB-CE1 4.48Å; C276-F291 HydrophobicContact CB-CE2 3.11Å; C276-F291 HydrophobicContact CB-CZ 3.35Å; L287-F291 HydrophobicContact CD2-CD1 3.2Å; L287-F291 HydrophobicContact CD2-CE1 3.57Å; L287-F291 HydrophobicContact CD2-CG 4.19Å; S288-F291 WeakPolarHBondContact O-CB 3.34Å; S288-F291 PolarHBondContact O-N 2.93Å; N289-F291 VanDerWaalsContact C-N 3.29Å; N289-F291 PolarHBondContact O-N 3.33Å; F291-T295 WeakPolarHBondContact CE1-OG1 3.22Å; F291-T295 WeakPolarHBondContact CZ-OG1 3.49Å; F291-T295 WeakPolarHBondContact O-CB 3.1Å; F291-T295 PolarHBondContact O-N 3.34Å; F291-T295 PolarHBondContact O-OG1 3.25Å |
| 292 | I | 84.5 | Confident | 82.8 | Confident | 78 Ų | 78 | 68.3 Ų | 68.3 | 40% | 0.4 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.8 | -48.1 | 177.9 | -63.1 | 170.6 | 0 | 0 | 0 | 109.6 | L287 S288 N289 T295 L296 | L287-I292 HydrophobicContact CB-CD1 4.29Å; L287-I292 HydrophobicContact CB-CG1 4.47Å; L287-I292 HydrophobicContact CD2-CG1 4.17Å; S288-I292 PolarHBondContact O-N 3.45Å; N289-I292 PolarHBondContact O-N 3.5Å; I292-T295 WeakPolarHBondContact O-CB 3.28Å; I292-T295 PolarHBondContact O-N 2.93Å; I292-L296 HydrophobicContact CG2-CD1 4.34Å; I292-L296 WeakPolarHBondContact O-CG 3.45Å; I292-L296 PolarHBondContact O-N 3.19Å |
| 293 | F | 89.1 | Confident | 83.4 | Confident | 123 Ų | 123 | 66.6 Ų | 66.6 | 54% | 0.539 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.4 | -49.2 | 179.1 | -176.2 | -109.2 | 0 | 0 | 0 | 112.2 | N289 T295 L296 I297 | N289-F293 WeakPolarHBondContact O-CB 3.48Å; N289-F293 PolarHBondContact O-N 3.34Å; F293-T295 VanDerWaalsContact C-N 3.3Å; F293-T295 PolarHBondContact O-N 3.34Å; F293-L296 PolarHBondContact O-N 3.47Å; F293-I297 HydrophobicContact CD1-CD1 3.69Å; F293-I297 HydrophobicContact CE1-CD1 3.29Å; F293-I297 HydrophobicContact CE1-CG1 4.42Å; F293-I297 HydrophobicContact CE2-CD1 4.3Å; F293-I297 HydrophobicContact CG-CD1 4.37Å; F293-I297 HydrophobicContact CZ-CD1 3.64Å; F293-I297 HydrophobicContact CZ-CG1 4.45Å; F293-I297 WeakPolarHBondContact O-CG1 3.43Å; F293-I297 PolarHBondContact O-N 3.38Å; F293-I297 VanDerWaalsContact O-N 3.11Å |
| 294 | G | 89.7 | Confident | 84.3 | Confident | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -62.1 | -38 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | T147 S290 I297 V298 | T147-G294 WeakPolarHBondContact OG1-CA 3.37Å; S290-G294 PolarHBondContact O-N 2.85Å; G294-I297 PolarHBondContact O-N 2.75Å; G294-V298 WeakPolarHBondContact O-CG2 3.1Å; G294-V298 PolarHBondContact O-N 3.08Å |
| 295 | T | 87.6 | Confident | 85.4 | Confident | 19 Ų | 19 | 60.1 Ų | 60.1 | 12% | 0.117 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.2 | -48.3 | 175.2 | -67.4 | 0 | 0 | 0 | 0 | 111.9 | I273 F291 I292 F293 I297 V298 I299 | I273-T295 HydrophobicContact CD1-CG2 4.33Å; I273-T295 HydrophobicContact CG2-CG2 3.43Å; I273-T295 VanDerWaalsContact CG2-CG2 3.43Å; F291-T295 WeakPolarHBondContact CE1-OG1 3.22Å; F291-T295 WeakPolarHBondContact CZ-OG1 3.49Å; F291-T295 WeakPolarHBondContact O-CB 3.1Å; F291-T295 PolarHBondContact O-N 3.34Å; F291-T295 PolarHBondContact O-OG1 3.25Å; I292-T295 WeakPolarHBondContact O-CB 3.28Å; I292-T295 PolarHBondContact O-N 2.93Å; F293-T295 VanDerWaalsContact C-N 3.3Å; F293-T295 PolarHBondContact O-N 3.34Å; T295-I297 VanDerWaalsContact C-N 3.29Å; T295-I297 PolarHBondContact O-N 3.45Å; T295-V298 PolarHBondContact O-N 3.26Å; T295-I299 HydrophobicContact CG2-CD1 3.87Å; T295-I299 WeakPolarHBondContact O-CG1 3.42Å; T295-I299 PolarHBondContact O-N 3.35Å |
| 296 | L | 90.7 | Very high | 86.3 | Confident | 101 Ų | 101 | 59.7 Ų | 59.7 | 53% | 0.529 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59 | -42.7 | 177.4 | -71 | 171.2 | 0 | 0 | 0 | 111.2 | I292 F293 I299 V300 | I292-L296 HydrophobicContact CG2-CD1 4.34Å; I292-L296 WeakPolarHBondContact O-CG 3.45Å; I292-L296 PolarHBondContact O-N 3.19Å; F293-L296 PolarHBondContact O-N 3.47Å; L296-I299 PolarHBondContact O-N 3.37Å; L296-V300 WeakPolarHBondContact O-CB 3.44Å; L296-V300 VanDerWaalsContact O-CG2 3.3Å; L296-V300 WeakPolarHBondContact O-CG2 3.38Å; L296-V300 PolarHBondContact O-N 3.02Å |
| 297 | I | 94 | Very high | 87.3 | Confident | 24 Ų | 24 | 54.1 Ų | 54.1 | 12% | 0.123 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -61.8 | -45.3 | 177.5 | -67.8 | 171 | 0 | 0 | 0 | 111.5 | L140 I143 F293 G294 T295 I299 V300 S301 | L140-I297 HydrophobicContact CB-CG2 3.95Å; L140-I297 HydrophobicContact CD2-CG2 4.29Å; L140-I297 WeakPolarHBondContact O-CG2 3.44Å; I143-I297 HydrophobicContact CG2-CD1 4.12Å; F293-I297 HydrophobicContact CD1-CD1 3.69Å; F293-I297 HydrophobicContact CE1-CD1 3.29Å; F293-I297 HydrophobicContact CE1-CG1 4.42Å; F293-I297 HydrophobicContact CE2-CD1 4.3Å; F293-I297 HydrophobicContact CG-CD1 4.37Å; F293-I297 HydrophobicContact CZ-CD1 3.64Å; F293-I297 HydrophobicContact CZ-CG1 4.45Å; F293-I297 WeakPolarHBondContact O-CG1 3.43Å; F293-I297 PolarHBondContact O-N 3.38Å; F293-I297 VanDerWaalsContact O-N 3.11Å; G294-I297 PolarHBondContact O-N 2.75Å; T295-I297 VanDerWaalsContact C-N 3.29Å; T295-I297 PolarHBondContact O-N 3.45Å; I297-I299 VanDerWaalsContact C-N 3.33Å; I297-I299 PolarHBondContact O-N 3.34Å; I297-V300 PolarHBondContact O-N 3.35Å; I297-S301 WeakPolarHBondContact O-CB 3.36Å; I297-S301 PolarHBondContact O-N 3.2Å |
| 298 | V | 92.3 | Very high | 88.2 | Confident | 1 Ų | 1 | 55.9 Ų | 55.9 | 1% | 0.006 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.9 | -39.5 | 179.2 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | L141 V145 C269 V270 I273 G294 T295 S301 S302 | L141-V298 HydrophobicContact CD1-CB 4.41Å; L141-V298 HydrophobicContact CD1-CG1 3.81Å; L141-V298 HydrophobicContact CD1-CG2 4.19Å; V145-V298 HydrophobicContact CG2-CG2 4.06Å; C269-V298 HydrophobicContact CB-CG1 4.06Å; V270-V298 HydrophobicContact CG2-CG1 4.45Å; I273-V298 HydrophobicContact CD1-CB 3.4Å; I273-V298 VanDerWaalsContact CD1-CB 3.4Å; I273-V298 HydrophobicContact CD1-CG1 3.44Å; I273-V298 VanDerWaalsContact CD1-CG1 3.44Å; I273-V298 HydrophobicContact CD1-CG2 3.82Å; G294-V298 WeakPolarHBondContact O-CG2 3.1Å; G294-V298 PolarHBondContact O-N 3.08Å; T295-V298 PolarHBondContact O-N 3.26Å; V298-S301 PolarHBondContact O-N 3.31Å; V298-S302 WeakPolarHBondContact O-CB 2.95Å; V298-S302 PolarHBondContact O-N 3.31Å; V298-S302 PolarHBondContact O-OG 2.88Å |
| 299 | I | 89.8 | Confident | 88.4 | Confident | 78 Ų | 78 | 58.2 Ų | 58.2 | 40% | 0.4 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.5 | -51.3 | 176.5 | -67.1 | 168 | 0 | 0 | 0 | 110.3 | T295 L296 I297 S301 S302 I303 | T295-I299 HydrophobicContact CG2-CD1 3.87Å; T295-I299 WeakPolarHBondContact O-CG1 3.42Å; T295-I299 PolarHBondContact O-N 3.35Å; L296-I299 PolarHBondContact O-N 3.37Å; I297-I299 VanDerWaalsContact C-N 3.33Å; I297-I299 PolarHBondContact O-N 3.34Å; I299-S301 VanDerWaalsContact C-N 3.31Å; I299-S301 PolarHBondContact O-N 2.92Å; I299-S302 WeakPolarHBondContact O-CB 3.3Å; I299-S302 PolarHBondContact O-N 2.97Å; I299-S302 VanDerWaalsContact O-N 3.16Å; I299-I303 HydrophobicContact CG2-CD1 3.94Å; I299-I303 WeakPolarHBondContact O-CG1 3.4Å; I299-I303 PolarHBondContact O-N 2.85Å |
| 300 | V | 93.6 | Very high | 88.4 | Confident | 82 Ų | 82 | 53.5 Ų | 53.5 | 50% | 0.497 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -58.2 | -45.3 | 178.1 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | L296 I297 S302 I303 L304 | L296-V300 WeakPolarHBondContact O-CB 3.44Å; L296-V300 VanDerWaalsContact O-CG2 3.3Å; L296-V300 WeakPolarHBondContact O-CG2 3.38Å; L296-V300 PolarHBondContact O-N 3.02Å; I297-V300 PolarHBondContact O-N 3.35Å; V300-S302 PolarHBondContact O-N 3.08Å; V300-I303 PolarHBondContact O-N 3.23Å; V300-L304 VanDerWaalsContact O-CB 3.28Å; V300-L304 WeakPolarHBondContact O-CB 3.35Å; V300-L304 PolarHBondContact O-N 2.77Å |
| 301 | S | 95.3 | Very high | 87.7 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 176.5 | 175.3 | 0 | 0 | 0 | 0 | 112.4 | A137 L141 F266 I297 V298 I299 I303 L304 Y305 | A137-S301 PolarHBondContact O-OG 2.84Å; L141-S301 WeakPolarHBondContact CB-OG 3.29Å; L141-S301 PolarHBondContact N-OG 3.28Å; F266-S301 VanDerWaalsContact CE1-OG 3.22Å; F266-S301 WeakPolarHBondContact CE1-OG 3.31Å; I297-S301 WeakPolarHBondContact O-CB 3.36Å; I297-S301 PolarHBondContact O-N 3.2Å; V298-S301 PolarHBondContact O-N 3.31Å; I299-S301 VanDerWaalsContact C-N 3.31Å; I299-S301 PolarHBondContact O-N 2.92Å; S301-I303 PolarHBondContact O-N 3.14Å; S301-L304 PolarHBondContact O-N 3.38Å; S301-Y305 WeakPolarHBondContact O-CB 3.44Å; S301-Y305 PolarHBondContact O-N 3.38Å |
| 302 | S | 89.3 | Confident | 86.8 | Confident | 21 Ų | 21 | 66 Ų | 66 | 15% | 0.147 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 179.4 | -58.8 | 0 | 0 | 0 | 0 | 112.4 | F266 V298 I299 V300 S306 | F266-S302 WeakPolarHBondContact CD1-OG 3.33Å; V298-S302 WeakPolarHBondContact O-CB 2.95Å; V298-S302 PolarHBondContact O-N 3.31Å; V298-S302 PolarHBondContact O-OG 2.88Å; I299-S302 WeakPolarHBondContact O-CB 3.3Å; I299-S302 PolarHBondContact O-N 2.97Å; I299-S302 VanDerWaalsContact O-N 3.16Å; V300-S302 PolarHBondContact O-N 3.08Å; S302-S306 WeakPolarHBondContact O-CB 3.48Å; S302-S306 PolarHBondContact O-N 3.37Å; S302-S306 PolarHBondContact O-OG 3.01Å |
| 303 | I | 90.1 | Very high | 85.3 | Confident | 102 Ų | 102 | 68.7 Ų | 68.7 | 52% | 0.523 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -65.7 | -48.7 | 175.8 | -64.4 | 167.2 | 0 | 0 | 0 | 109.5 | I299 V300 S301 Y305 S306 S307 | I299-I303 HydrophobicContact CG2-CD1 3.94Å; I299-I303 WeakPolarHBondContact O-CG1 3.4Å; I299-I303 PolarHBondContact O-N 2.85Å; V300-I303 PolarHBondContact O-N 3.23Å; S301-I303 PolarHBondContact O-N 3.14Å; I303-Y305 PolarHBondContact O-N 2.89Å; I303-S306 PolarHBondContact O-N 3.31Å; I303-S306 VanDerWaalsContact O-N 3.15Å; I303-S307 WeakPolarHBondContact O-CB 3.09Å; I303-S307 PolarHBondContact O-N 2.9Å; I303-S307 PolarHBondContact O-OG 3.45Å; I303-S307 VanDerWaalsContact O-OG 3.1Å |
| 304 | L | 92.6 | Very high | 83.1 | Confident | 31 Ų | 31 | 67.6 Ų | 67.6 | 16% | 0.162 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -59.8 | -45.1 | -178.8 | -175.6 | 71 | 0 | 0 | 0 | 112.2 | F136 A137 L140 V300 S301 S306 S307 Y308 | F136-L304 HydrophobicContact CD1-CD2 3.53Å; F136-L304 HydrophobicContact CE1-CD2 4.1Å; F136-L304 HydrophobicContact CG-CD2 4.47Å; A137-L304 HydrophobicContact CB-CB 4.14Å; A137-L304 HydrophobicContact CB-CD2 3.86Å; A137-L304 HydrophobicContact CB-CG 4.1Å; L140-L304 HydrophobicContact CD1-CD2 4.23Å; V300-L304 VanDerWaalsContact O-CB 3.28Å; V300-L304 WeakPolarHBondContact O-CB 3.35Å; V300-L304 PolarHBondContact O-N 2.77Å; S301-L304 PolarHBondContact O-N 3.38Å; L304-S306 VanDerWaalsContact C-N 3.26Å; L304-S306 PolarHBondContact O-N 2.9Å; L304-S307 PolarHBondContact O-N 3.49Å; L304-Y308 HydrophobicContact CD1-CD2 3.63Å; L304-Y308 HydrophobicContact CD1-CE2 3.6Å; L304-Y308 HydrophobicContact CG-CD2 4.42Å; L304-Y308 WeakPolarHBondContact O-CD2 3.35Å; L304-Y308 PolarHBondContact O-N 2.89Å |
| 305 | Y | 91.3 | Very high | 80.6 | Confident | 7 Ų | 7 | 82.4 Ų | 82.4 | 3% | 0.027 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -61.5 | -37.6 | 178.5 | -167.8 | -79.7 | 0 | 0 | 0 | 112 | Q134 A137 L138 I262 L263 F266 S301 I303 | Q134-Y305 HydrophobicContact CB-CD2 3.74Å; Q134-Y305 HydrophobicContact CB-CE2 3.56Å; Q134-Y305 HydrophobicContact CG-CD1 4.3Å; Q134-Y305 HydrophobicContact CG-CD2 3.71Å; Q134-Y305 HydrophobicContact CG-CE1 4.25Å; Q134-Y305 HydrophobicContact CG-CE2 3.7Å; Q134-Y305 HydrophobicContact CG-CG 4.02Å; Q134-Y305 PolarHBondContact NE2-O 3.46Å; A137-Y305 HydrophobicContact CB-CD2 4.12Å; A137-Y305 HydrophobicContact CB-CG 4.47Å; L138-Y305 HydrophobicContact CD1-CE2 4.42Å; L138-Y305 HydrophobicContact CD2-CE2 4.37Å; L138-Y305 HydrophobicContact CG-CD2 4.37Å; L138-Y305 HydrophobicContact CG-CE2 4.16Å; I262-Y305 VanDerWaalsContact CD1-OH 3.31Å; I262-Y305 WeakPolarHBondContact CD1-OH 3.42Å; I262-Y305 HydrophobicContact CG2-CD2 4.43Å; I262-Y305 HydrophobicContact CG2-CE1 4.09Å; I262-Y305 HydrophobicContact CG2-CE2 3.6Å; I262-Y305 VanDerWaalsContact CG2-CZ 3.42Å; I262-Y305 WeakPolarHBondContact CG2-OH 3.35Å; L263-Y305 HydrophobicContact CD1-CD1 3.55Å; L263-Y305 HydrophobicContact CD1-CE1 3.23Å; F266-Y305 HydrophobicContact CD2-CG 4.4Å; F266-Y305 HydrophobicContact CE2-CD1 4.3Å; F266-Y305 AromaticContact CE2-CD2 3.55Å; F266-Y305 HydrophobicContact CE2-CD2 3.55Å; F266-Y305 HydrophobicContact CE2-CE2 4.09Å; F266-Y305 AromaticContact CE2-CG 3.67Å; F266-Y305 HydrophobicContact CE2-CG 3.67Å; F266-Y305 AromaticContact CZ-CD2 3.72Å; F266-Y305 HydrophobicContact CZ-CD2 3.72Å; F266-Y305 AromaticContact CZ-CG 3.79Å; F266-Y305 HydrophobicContact CZ-CG 3.79Å; S301-Y305 WeakPolarHBondContact O-CB 3.44Å; S301-Y305 PolarHBondContact O-N 3.38Å; I303-Y305 PolarHBondContact O-N 2.89Å |
| 306 | S | 86.5 | Confident | 80.2 | Confident | 63 Ų | 63 | 85.6 Ų | 85.6 | 44% | 0.441 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -76.3 | -33.8 | -177.7 | -59.1 | 0 | 0 | 0 | 0 | 113 | S302 I303 L304 | S302-S306 WeakPolarHBondContact O-CB 3.48Å; S302-S306 PolarHBondContact O-N 3.37Å; S302-S306 PolarHBondContact O-OG 3.01Å; I303-S306 PolarHBondContact O-N 3.31Å; I303-S306 VanDerWaalsContact O-N 3.15Å; L304-S306 VanDerWaalsContact C-N 3.26Å; L304-S306 PolarHBondContact O-N 2.9Å |
| 307 | S | 87.4 | Confident | 79.7 | Confident | 74 Ų | 74 | 84.8 Ų | 84.8 | 52% | 0.517 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -78.7 | -22.2 | -177.3 | -64.4 | 0 | 0 | 0 | 0 | 114.5 | I303 L304 P309 | I303-S307 WeakPolarHBondContact O-CB 3.09Å; I303-S307 PolarHBondContact O-N 2.9Å; I303-S307 PolarHBondContact O-OG 3.45Å; I303-S307 VanDerWaalsContact O-OG 3.1Å; L304-S307 PolarHBondContact O-N 3.49Å; S307-P309 VanDerWaalsContact O-CD 3.25Å; S307-P309 WeakPolarHBondContact O-CD 3.15Å |
| 308 | Y | 87.4 | Confident | 78.9 | Confident | 120 Ų | 120 | 88.2 Ų | 88.2 | 47% | 0.471 | 46% | 0.461 | S | S | . | . | trans | -121.7 | 62.8 | -174.6 | -63.8 | -85.4 | 0 | 0 | 0 | 113.1 | S131 M133 Q134 L304 | S131-Y308 PolarHBondContact OG-O 3.27Å; M133-Y308 HydrophobicContact CB-CD2 4.26Å; M133-Y308 HydrophobicContact CB-CG 3.88Å; M133-Y308 HydrophobicContact CG-CD1 4.2Å; M133-Y308 HydrophobicContact CG-CD2 4.48Å; M133-Y308 HydrophobicContact CG-CG 4.04Å; Q134-Y308 WeakPolarHBondContact CG-O 3.19Å; L304-Y308 HydrophobicContact CD1-CD2 3.63Å; L304-Y308 HydrophobicContact CD1-CE2 3.6Å; L304-Y308 HydrophobicContact CG-CD2 4.42Å; L304-Y308 WeakPolarHBondContact O-CD2 3.35Å; L304-Y308 PolarHBondContact O-N 2.89Å | ||
| 309 | P | 80.5 | Confident | 78.1 | Confident | 87 Ų | 87 | 93.3 Ų | 93.3 | 57% | 0.565 | 49% | 0.488 | S | S | * | . | trans | -58 | 150.6 | 172.7 | 27.4 | -33.8 | 0 | 0 | 0 | 110.8 | S307 K311 | S307-P309 VanDerWaalsContact O-CD 3.25Å; S307-P309 WeakPolarHBondContact O-CD 3.15Å; P309-K311 PolarHBondContact O-N 3.41Å | ||
| 310 | P | 79.3 | Confident | 77.4 | Confident | 35 Ų | 35 | 94.3 Ų | 94.3 | 23% | 0.227 | 49% | 0.493 | C | S | . | . | trans | -58.7 | 138.1 | 177.1 | 30 | -37.8 | 0 | 0 | 0 | 109.4 | P129 I312 | P129-P310 HydrophobicContact CB-CB 4.19Å; P129-P310 HydrophobicContact CG-CB 3.95Å; P129-P310 HydrophobicContact CG-CG 4.19Å; P129-P310 VanDerWaalsContact O-CG 3.27Å; P129-P310 WeakPolarHBondContact O-CG 3.37Å; P310-I312 PolarHBondContact O-N 3.22Å | ||
| 311 | K | 68.3 | Low | 76.3 | Confident | 186 Ų | 186 | 95.1 Ų | 95.1 | 81% | 0.809 | 49% | 0.493 | S | S | * | . | trans | -61.2 | 115.6 | 166.9 | -66.4 | -174.1 | -179.4 | -176.3 | 0 | 106.3 | P309 N313 | P309-K311 PolarHBondContact O-N 3.41Å; K311-N313 PolarHBondContact O-N 3.29Å | ||
| 312 | I | 63 | Low | 74.9 | Confident | 155 Ų | 155 | 101.9 Ų | 101.9 | 80% | 0.795 | 53% | 0.528 | S | S | * | . | trans | -66.3 | 98.4 | 167.3 | -58.4 | 171.8 | 0 | 0 | 0 | 103.6 | P310 A314 | P310-I312 PolarHBondContact O-N 3.22Å; I312-A314 PolarHBondContact O-N 2.71Å | ||
| 313 | N | 53 | Low | 73.8 | Confident | 134 Ų | 134 | 108.1 Ų | 108.1 | 72% | 0.717 | 56% | 0.558 | S | S | * | * | trans | -62.3 | 102.4 | 165.2 | -74.5 | -9.5 | 0 | 0 | 0 | 104.5 | K311 R315 | K311-N313 PolarHBondContact O-N 3.29Å; N313-R315 PolarHBondContact O-N 2.86Å | ||
| 314 | A | 44.4 | Very low | 72.5 | Confident | 99 Ų | 99 | 108.6 Ų | 108.6 | 82% | 0.818 | 56% | 0.561 | S | S | * | * | trans | -58.5 | 96.8 | 161.1 | 0 | 0 | 0 | 0 | 0 | 105.7 | I312 | I312-A314 PolarHBondContact O-N 2.71Š| ||
| 315 | R | 35.7 | Very low | 70.6 | Confident | 312 Ų | 312 | 115.6 Ų | 115.6 | 100% | 1.177 | 60% | 0.597 | S | S | * | * | trans | -105.6 | 0 | 155.8 | -91.1 | -169.4 | 175.4 | -172.5 | -1.2 | 106.3 | N313 | N313-R315 PolarHBondContact O-N 2.86Š|
Retrieved 315 of 315 residues in 278.7 ms
(Link to these results)