| 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 | 51.3 | Low | 82.1 | Confident | 191 Ų | 191 | 91.1 Ų | 91.1 | 94% | 0.941 | 47% | 0.471 | S | S | * | . | 0 | -41.7 | 0 | -72.1 | -178.2 | -156.9 | 0 | 0 | 114.8 | R5 | M1-R5 PolarHBondContact O-N 3.2Š| |||
| 2 | A | 59.8 | Low | 83.1 | Confident | 67 Ų | 67 | 86.9 Ų | 86.9 | 55% | 0.554 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -64.9 | -42.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A4 R5 L6 | A2-A4 PolarHBondContact O-N 2.93Å; A2-R5 PolarHBondContact O-N 2.81Å; A2-L6 WeakPolarHBondContact O-CG 3.32Å; A2-L6 PolarHBondContact O-N 3.29Å |
| 3 | S | 74.3 | Confident | 84.1 | Confident | 83 Ų | 83 | 85 Ų | 85 | 58% | 0.58 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -61.7 | -42.7 | 177.4 | -179.3 | 0 | 0 | 0 | 0 | 112.9 | R5 L6 K7 | S3-R5 PolarHBondContact O-N 3.38Å; S3-L6 PolarHBondContact O-N 3.23Å; S3-K7 WeakPolarHBondContact O-CB 3.26Å; S3-K7 PolarHBondContact O-N 3.08Å |
| 4 | A | 81.8 | Confident | 84.8 | Confident | 47 Ų | 47 | 79 Ų | 79 | 39% | 0.388 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.7 | -39.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A2 K7 Y8 | A2-A4 PolarHBondContact O-N 2.93Å; A4-K7 WeakPolarHBondContact O-CB 3.41Å; A4-K7 PolarHBondContact O-N 3.22Å; A4-Y8 WeakPolarHBondContact O-CD2 3.37Å; A4-Y8 PolarHBondContact O-N 2.99Å; A4-Y8 VanDerWaalsContact O-N 3.14Å |
| 5 | R | 88.4 | Confident | 85.5 | Confident | 176 Ų | 176 | 75.5 Ų | 75.5 | 66% | 0.664 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -62.8 | -45.5 | 175 | -77.2 | -174.7 | -99.8 | -178.9 | -8.3 | 111.9 | M1 A2 S3 K7 Y8 L9 | M1-R5 PolarHBondContact O-N 3.2Å; A2-R5 PolarHBondContact O-N 2.81Å; S3-R5 PolarHBondContact O-N 3.38Å; R5-K7 VanDerWaalsContact C-N 3.33Å; R5-K7 PolarHBondContact O-N 3.1Å; R5-Y8 PolarHBondContact O-N 2.97Å; R5-L9 VanDerWaalsContact O-CB 3.22Å; R5-L9 WeakPolarHBondContact O-CB 3.39Å; R5-L9 PolarHBondContact O-N 3.28Å |
| 6 | L | 88.6 | Confident | 86.1 | Confident | 75 Ų | 75 | 80 Ų | 80 | 39% | 0.393 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.4 | -38.9 | 177.2 | -69.6 | 173.3 | 0 | 0 | 0 | 112.3 | A2 S3 S10 Y267 | A2-L6 WeakPolarHBondContact O-CG 3.32Å; A2-L6 PolarHBondContact O-N 3.29Å; S3-L6 PolarHBondContact O-N 3.23Å; L6-S10 VanDerWaalsContact O-CB 3.26Å; L6-S10 WeakPolarHBondContact O-CB 3.42Å; L6-S10 PolarHBondContact O-N 3.45Å; L6-S10 PolarHBondContact O-OG 3.3Å; L6-Y267 HydrophobicContact CB-CD1 4.22Å; L6-Y267 HydrophobicContact CB-CG 4.22Å; L6-Y267 HydrophobicContact CD1-CD1 4.3Å; L6-Y267 HydrophobicContact CD1-CE1 4.01Å |
| 7 | K | 89.9 | Confident | 86.7 | Confident | 59 Ų | 59 | 75.7 Ų | 75.7 | 26% | 0.257 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -55.8 | -59 | 173.7 | 178.9 | -174.1 | 177.4 | -176.5 | 0 | 111.3 | S3 A4 R5 L9 S10 L11 A268 L272 | S3-K7 WeakPolarHBondContact O-CB 3.26Å; S3-K7 PolarHBondContact O-N 3.08Å; A4-K7 WeakPolarHBondContact O-CB 3.41Å; A4-K7 PolarHBondContact O-N 3.22Å; R5-K7 VanDerWaalsContact C-N 3.33Å; R5-K7 PolarHBondContact O-N 3.1Å; K7-L9 PolarHBondContact O-N 3.43Å; K7-S10 PolarHBondContact O-N 3.4Å; K7-S10 PolarHBondContact O-OG 2.8Å; K7-L11 HydrophobicContact CG-CD1 4.29Å; K7-L11 WeakPolarHBondContact O-CG 3.24Å; K7-L11 PolarHBondContact O-N 3.36Å; K7-L11 VanDerWaalsContact O-N 3.1Å; K7-A268 HydrophobicContact CG-CB 3.84Å; K7-L272 HydrophobicContact CD-CD1 4.47Å |
| 8 | Y | 90.4 | Very high | 87.1 | Confident | 156 Ų | 156 | 72.8 Ų | 72.8 | 61% | 0.612 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -67.2 | -36.6 | -177.6 | -66.4 | -62.8 | 0 | 0 | 0 | 113 | A4 R5 L11 G12 | A4-Y8 WeakPolarHBondContact O-CD2 3.37Å; A4-Y8 PolarHBondContact O-N 2.99Å; A4-Y8 VanDerWaalsContact O-N 3.14Å; R5-Y8 PolarHBondContact O-N 2.97Å; Y8-L11 PolarHBondContact O-N 2.82Å; Y8-G12 PolarHBondContact O-N 3.29Å |
| 9 | L | 93.4 | Very high | 87.4 | Confident | 115 Ų | 115 | 69.3 Ų | 69.3 | 60% | 0.602 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -60.3 | -47.3 | 173.7 | -177.9 | 68 | 0 | 0 | 0 | 111.1 | R5 K7 L11 G12 V13 | R5-L9 VanDerWaalsContact O-CB 3.22Å; R5-L9 WeakPolarHBondContact O-CB 3.39Å; R5-L9 PolarHBondContact O-N 3.28Å; K7-L9 PolarHBondContact O-N 3.43Å; L9-L11 VanDerWaalsContact C-N 3.32Å; L9-L11 PolarHBondContact O-N 3.1Å; L9-G12 PolarHBondContact O-N 2.9Å; L9-V13 HydrophobicContact CD1-CG2 4.46Å; L9-V13 VanDerWaalsContact O-CG2 3.3Å; L9-V13 WeakPolarHBondContact O-CG2 3.13Å; L9-V13 PolarHBondContact O-N 2.91Å |
| 10 | S | 92.4 | Very high | 87.6 | Confident | 11 Ų | 11 | 67.3 Ų | 67.3 | 8% | 0.077 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.7 | -38.1 | 179.9 | 72.3 | 0 | 0 | 0 | 0 | 112.4 | L6 K7 L14 V264 | L6-S10 VanDerWaalsContact O-CB 3.26Å; L6-S10 WeakPolarHBondContact O-CB 3.42Å; L6-S10 PolarHBondContact O-N 3.45Å; L6-S10 PolarHBondContact O-OG 3.3Å; K7-S10 PolarHBondContact O-N 3.4Å; K7-S10 PolarHBondContact O-OG 2.8Å; S10-L14 WeakPolarHBondContact O-CB 3.34Å; S10-L14 PolarHBondContact O-N 3.27Å; S10-V264 WeakPolarHBondContact O-CG2 3.45Å |
| 11 | L | 93 | Very high | 87.8 | Confident | 22 Ų | 22 | 65.2 Ų | 65.2 | 12% | 0.115 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -67.9 | -43.1 | 175.2 | -68.4 | 168 | 0 | 0 | 0 | 111.7 | K7 Y8 L9 L14 V15 V264 A268 L272 A276 | K7-L11 HydrophobicContact CG-CD1 4.29Å; K7-L11 WeakPolarHBondContact O-CG 3.24Å; K7-L11 PolarHBondContact O-N 3.36Å; K7-L11 VanDerWaalsContact O-N 3.1Å; Y8-L11 PolarHBondContact O-N 2.82Å; L9-L11 VanDerWaalsContact C-N 3.32Å; L9-L11 PolarHBondContact O-N 3.1Å; L11-L14 WeakPolarHBondContact O-CB 3.18Å; L11-L14 PolarHBondContact O-N 3.23Å; L11-V15 WeakPolarHBondContact O-CG2 3.13Å; L11-V15 PolarHBondContact O-N 2.63Å; L11-V264 HydrophobicContact CD2-CG1 3.74Å; L11-A268 HydrophobicContact CD1-CB 4.36Å; L11-A268 HydrophobicContact CD2-CB 4.23Å; L11-A268 HydrophobicContact CG-CB 4.3Å; L11-L272 HydrophobicContact CD1-CB 4.33Å; L11-L272 HydrophobicContact CD1-CD1 4.46Å; L11-L272 HydrophobicContact CD2-CB 4.01Å; L11-A276 HydrophobicContact CD2-CB 3.91Å |
| 12 | G | 94.1 | Very high | 89.6 | Confident | 41 Ų | 41 | 58.9 Ų | 58.9 | 42% | 0.423 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.1 | -44.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y8 L9 L14 V15 F16 | Y8-G12 PolarHBondContact O-N 3.29Å; L9-G12 PolarHBondContact O-N 2.9Å; G12-L14 VanDerWaalsContact C-N 3.31Å; G12-L14 PolarHBondContact O-N 2.89Å; G12-V15 PolarHBondContact O-N 2.8Å; G12-F16 PolarHBondContact O-N 2.91Å |
| 13 | V | 95.3 | Very high | 90.9 | Very high | 62 Ų | 62 | 57.1 Ų | 57.1 | 38% | 0.376 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -62.3 | -39 | 174.5 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | L9 F16 Q17 V260 | L9-V13 HydrophobicContact CD1-CG2 4.46Å; L9-V13 VanDerWaalsContact O-CG2 3.3Å; L9-V13 WeakPolarHBondContact O-CG2 3.13Å; L9-V13 PolarHBondContact O-N 2.91Å; V13-F16 PolarHBondContact O-N 3.43Å; V13-Q17 WeakPolarHBondContact O-CB 3.38Å; V13-Q17 PolarHBondContact O-N 2.96Å; V13-V260 HydrophobicContact CB-CG1 4.45Å; V13-V260 HydrophobicContact CG1-CG1 3.97Å; V13-V260 HydrophobicContact CG1-CG2 3.77Å |
| 14 | L | 94.7 | Very high | 91.6 | Very high | 1 Ų | 1 | 54.7 Ų | 54.7 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.7 | -44.7 | 175.5 | 179.8 | 65 | 0 | 0 | 0 | 112.2 | S10 L11 G12 Q17 T18 V260 I261 V264 K273 A276 | S10-L14 WeakPolarHBondContact O-CB 3.34Å; S10-L14 PolarHBondContact O-N 3.27Å; L11-L14 WeakPolarHBondContact O-CB 3.18Å; L11-L14 PolarHBondContact O-N 3.23Å; G12-L14 VanDerWaalsContact C-N 3.31Å; G12-L14 PolarHBondContact O-N 2.89Å; L14-Q17 PolarHBondContact O-N 3.19Å; L14-T18 VanDerWaalsContact O-CB 3.24Å; L14-T18 WeakPolarHBondContact O-CB 3.3Å; L14-T18 PolarHBondContact O-N 3.41Å; L14-T18 PolarHBondContact O-OG1 2.8Å; L14-V260 HydrophobicContact CB-CG1 3.78Å; L14-V260 HydrophobicContact CD1-CG1 4.02Å; L14-I261 HydrophobicContact CD1-CG1 3.86Å; L14-V264 HydrophobicContact CB-CG2 3.8Å; L14-V264 HydrophobicContact CD2-CB 4.33Å; L14-V264 HydrophobicContact CD2-CG1 4.09Å; L14-V264 HydrophobicContact CD2-CG2 3.77Å; L14-V264 HydrophobicContact CG-CG2 4.27Å; L14-K273 HydrophobicContact CD2-CB 4.46Å; L14-K273 HydrophobicContact CD2-CG 3.77Å; L14-A276 HydrophobicContact CD2-CB 3.84Å; L14-A276 HydrophobicContact CG-CB 4.41Å |
| 15 | V | 95.4 | Very high | 91.7 | Very high | 27 Ų | 27 | 55.2 Ų | 55.2 | 16% | 0.164 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.2 | -50 | 176.5 | 173.5 | 0 | 0 | 0 | 0 | 110 | L11 G12 T18 T19 A276 L279 L283 | L11-V15 WeakPolarHBondContact O-CG2 3.13Å; L11-V15 PolarHBondContact O-N 2.63Å; G12-V15 PolarHBondContact O-N 2.8Å; V15-T18 PolarHBondContact O-N 3.44Å; V15-T19 VanDerWaalsContact O-CB 3.27Å; V15-T19 WeakPolarHBondContact O-CB 3.15Å; V15-T19 PolarHBondContact O-N 2.94Å; V15-T19 PolarHBondContact O-OG1 3.06Å; V15-A276 HydrophobicContact CG2-CB 3.93Å; V15-A276 WeakPolarHBondContact CG2-O 3.31Å; V15-L279 HydrophobicContact CG2-CB 4.43Å; V15-L283 HydrophobicContact CG1-CD2 3.98Å |
| 16 | F | 95.3 | Very high | 91.3 | Very high | 147 Ų | 147 | 50.7 Ų | 50.7 | 65% | 0.645 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -62.2 | -47.9 | -179.8 | 178.3 | -98.8 | 0 | 0 | 0 | 112.4 | G12 V13 T19 S20 | G12-F16 PolarHBondContact O-N 2.91Å; V13-F16 PolarHBondContact O-N 3.43Å; F16-T19 PolarHBondContact O-N 2.72Å; F16-S20 WeakPolarHBondContact O-CB 3.44Å; F16-S20 PolarHBondContact O-N 3.02Å; F16-S20 PolarHBondContact O-OG 3.4Å |
| 17 | Q | 96.1 | Very high | 91 | Very high | 7 Ų | 7 | 53 Ų | 53 | 3% | 0.033 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.4 | -46.4 | 179.5 | 178.5 | -76.3 | -38.5 | 0 | 0 | 111.3 | V13 L14 S20 L21 L253 L256 | V13-Q17 WeakPolarHBondContact O-CB 3.38Å; V13-Q17 PolarHBondContact O-N 2.96Å; L14-Q17 PolarHBondContact O-N 3.19Å; Q17-S20 PolarHBondContact O-N 3.25Å; Q17-L21 WeakPolarHBondContact O-CB 3.46Å; Q17-L21 PolarHBondContact O-N 3.49Å; Q17-L253 PolarHBondContact NE2-O 3.48Å; Q17-L256 HydrophobicContact CB-CD2 4.24Å; Q17-L256 HydrophobicContact CG-CD2 3.49Å; Q17-L256 VanDerWaalsContact CG-CD2 3.49Å |
| 18 | T | 92.9 | Very high | 90.7 | Very high | 23 Ų | 23 | 50.8 Ų | 50.8 | 14% | 0.141 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.8 | -42.9 | -178 | -55.5 | 0 | 0 | 0 | 0 | 110.3 | L14 V15 L21 V22 S280 | L14-T18 VanDerWaalsContact O-CB 3.24Å; L14-T18 WeakPolarHBondContact O-CB 3.3Å; L14-T18 PolarHBondContact O-N 3.41Å; L14-T18 PolarHBondContact O-OG1 2.8Å; V15-T18 PolarHBondContact O-N 3.44Å; T18-L21 PolarHBondContact O-N 2.97Å; T18-V22 HydrophobicContact CG2-CG2 4.47Å; T18-V22 VanDerWaalsContact O-CG2 3.31Å; T18-V22 WeakPolarHBondContact O-CG2 3.1Å; T18-V22 PolarHBondContact O-N 3.43Å; T18-S280 VanDerWaalsContact CG2-OG 3.22Å; T18-S280 WeakPolarHBondContact CG2-OG 3.18Å |
| 19 | T | 92.6 | Very high | 89.8 | Confident | 6 Ų | 6 | 50.8 Ų | 50.8 | 4% | 0.037 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.7 | -49.2 | 175.3 | -57.2 | 0 | 0 | 0 | 0 | 111 | V15 F16 L21 V22 L23 S280 L283 I287 | V15-T19 VanDerWaalsContact O-CB 3.27Å; V15-T19 WeakPolarHBondContact O-CB 3.15Å; V15-T19 PolarHBondContact O-N 2.94Å; V15-T19 PolarHBondContact O-OG1 3.06Å; F16-T19 PolarHBondContact O-N 2.72Å; T19-L21 PolarHBondContact O-N 2.91Å; T19-V22 PolarHBondContact O-N 3.38Å; T19-L23 HydrophobicContact CG2-CD1 3.94Å; T19-L23 VanDerWaalsContact O-CG 3.31Å; T19-L23 WeakPolarHBondContact O-CG 3.41Å; T19-L23 PolarHBondContact O-N 3.5Å; T19-S280 PolarHBondContact OG1-O 3.42Å; T19-L283 HydrophobicContact CG2-CB 4.47Å; T19-L283 HydrophobicContact CG2-CD2 4.21Å; T19-L283 HydrophobicContact CG2-CG 4.09Å; T19-I287 HydrophobicContact CG2-CD1 3.74Å |
| 20 | S | 92.9 | Very high | 88.8 | Confident | 29 Ų | 29 | 49.3 Ų | 49.3 | 20% | 0.203 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 179 | -58.2 | 0 | 0 | 0 | 0 | 111.9 | F16 Q17 T24 | F16-S20 WeakPolarHBondContact O-CB 3.44Å; F16-S20 PolarHBondContact O-N 3.02Å; F16-S20 PolarHBondContact O-OG 3.4Å; Q17-S20 PolarHBondContact O-N 3.25Å; S20-T24 VanDerWaalsContact O-CB 3.3Å; S20-T24 WeakPolarHBondContact O-CB 3.34Å; S20-T24 PolarHBondContact O-N 3.36Å; S20-T24 PolarHBondContact O-OG1 2.89Å |
| 21 | L | 92.1 | Very high | 87.7 | Confident | 25 Ų | 25 | 52.1 Ų | 52.1 | 13% | 0.131 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.9 | -46 | 177.6 | 176.5 | 63.7 | 0 | 0 | 0 | 111.7 | Q17 T18 T19 T24 M25 V250 L253 Q254 | Q17-L21 WeakPolarHBondContact O-CB 3.46Å; Q17-L21 PolarHBondContact O-N 3.49Å; T18-L21 PolarHBondContact O-N 2.97Å; T19-L21 PolarHBondContact O-N 2.91Å; L21-T24 PolarHBondContact O-N 3.24Å; L21-M25 HydrophobicContact CD1-CG 4.04Å; L21-M25 HydrophobicContact CG-CE 4.21Å; L21-M25 VanDerWaalsContact O-CB 3.32Å; L21-M25 WeakPolarHBondContact O-CB 2.94Å; L21-M25 WeakPolarHBondContact O-CG 3.41Å; L21-M25 PolarHBondContact O-N 2.83Å; L21-V250 HydrophobicContact CD1-CG1 4.26Å; L21-L253 HydrophobicContact CB-CB 4.41Å; L21-L253 HydrophobicContact CD1-CB 3.84Å; L21-Q254 HydrophobicContact CD1-CB 4.37Å |
| 22 | V | 87.8 | Confident | 86 | Confident | 58 Ų | 58 | 60.2 Ų | 60.2 | 35% | 0.352 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.6 | -48.2 | 179.5 | 169 | 0 | 0 | 0 | 0 | 111 | T18 T19 M25 R26 | T18-V22 HydrophobicContact CG2-CG2 4.47Å; T18-V22 VanDerWaalsContact O-CG2 3.31Å; T18-V22 WeakPolarHBondContact O-CG2 3.1Å; T18-V22 PolarHBondContact O-N 3.43Å; T19-V22 PolarHBondContact O-N 3.38Å; V22-M25 PolarHBondContact O-N 3.36Å; V22-R26 WeakPolarHBondContact O-CB 3.45Å; V22-R26 PolarHBondContact O-N 2.9Å |
| 23 | L | 87.4 | Confident | 84.4 | Confident | 30 Ų | 30 | 61.2 Ų | 61.2 | 16% | 0.157 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 179 | -67.6 | 170.8 | 0 | 0 | 0 | 111.6 | T19 R26 Y27 I287 S288 L292 | T19-L23 HydrophobicContact CG2-CD1 3.94Å; T19-L23 VanDerWaalsContact O-CG 3.31Å; T19-L23 WeakPolarHBondContact O-CG 3.41Å; T19-L23 PolarHBondContact O-N 3.5Å; L23-R26 PolarHBondContact O-N 3.47Å; L23-Y27 WeakPolarHBondContact O-CB 3.43Å; L23-Y27 PolarHBondContact O-N 3.44Å; L23-I287 HydrophobicContact CD1-CB 4.08Å; L23-I287 HydrophobicContact CD1-CD1 4.22Å; L23-I287 HydrophobicContact CD1-CG2 3.39Å; L23-I287 HydrophobicContact CD2-CG2 4.09Å; L23-I287 HydrophobicContact CG-CG2 4.4Å; L23-S288 WeakPolarHBondContact CD2-OG 3.48Å; L23-L292 HydrophobicContact CD2-CD1 4.15Å |
| 24 | T | 88.4 | Confident | 82.6 | Confident | 32 Ų | 32 | 68.1 Ų | 68.1 | 20% | 0.196 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.3 | -39.9 | 179 | -50.5 | 0 | 0 | 0 | 0 | 111.4 | S20 L21 Y27 S28 I246 T249 V250 L253 | S20-T24 VanDerWaalsContact O-CB 3.3Å; S20-T24 WeakPolarHBondContact O-CB 3.34Å; S20-T24 PolarHBondContact O-N 3.36Å; S20-T24 PolarHBondContact O-OG1 2.89Å; L21-T24 PolarHBondContact O-N 3.24Å; T24-Y27 PolarHBondContact O-N 3.13Å; T24-S28 WeakPolarHBondContact O-CB 3.36Å; T24-S28 PolarHBondContact O-N 3.46Å; T24-I246 HydrophobicContact CG2-CG2 4.21Å; T24-T249 HydrophobicContact CG2-CG2 4.26Å; T24-V250 HydrophobicContact CG2-CG2 3.75Å; T24-L253 HydrophobicContact CG2-CD1 4.24Å |
| 25 | M | 85.1 | Confident | 81.2 | Confident | 58 Ų | 58 | 70.7 Ų | 70.7 | 29% | 0.286 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 174.2 | -81.8 | -150.1 | -69.8 | 0 | 0 | 112.2 | L21 V22 S28 R29 V250 | L21-M25 HydrophobicContact CD1-CG 4.04Å; L21-M25 HydrophobicContact CG-CE 4.21Å; L21-M25 VanDerWaalsContact O-CB 3.32Å; L21-M25 WeakPolarHBondContact O-CB 2.94Å; L21-M25 WeakPolarHBondContact O-CG 3.41Å; L21-M25 PolarHBondContact O-N 2.83Å; V22-M25 PolarHBondContact O-N 3.36Å; M25-S28 PolarHBondContact O-N 3.44Å; M25-R29 WeakPolarHBondContact O-CG 3.35Å; M25-R29 PolarHBondContact O-N 2.96Å; M25-V250 HydrophobicContact CG-CG1 3.6Å; M25-V250 HydrophobicContact CG-CG2 4.18Å; M25-V250 HydrophobicContact SD-CG1 4.19Å |
| 26 | R | 79.6 | Confident | 80 | Confident | 81 Ų | 81 | 72.9 Ų | 72.9 | 31% | 0.306 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.1 | -51.9 | 175.5 | -173.3 | 177.7 | 179.3 | 175.5 | 0.1 | 110.1 | V22 L23 S28 R29 T30 S288 D294 | V22-R26 WeakPolarHBondContact O-CB 3.45Å; V22-R26 PolarHBondContact O-N 2.9Å; L23-R26 PolarHBondContact O-N 3.47Å; R26-S28 VanDerWaalsContact C-N 3.32Å; R26-S28 PolarHBondContact O-N 3.18Å; R26-R29 PolarHBondContact O-N 3.15Å; R26-T30 PolarHBondContact O-N 3.41Å; R26-T30 PolarHBondContact O-OG1 3.34Å; R26-S288 PolarHBondContact NH1-OG 2.92Å; R26-D294 PolarHBondContact NH2-O 3.04Å |
| 27 | Y | 82.7 | Confident | 79.3 | Confident | 122 Ų | 122 | 75.6 Ų | 75.6 | 48% | 0.478 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -57.2 | -43.2 | 176.9 | -176.4 | -107.7 | 0 | 0 | 0 | 112.7 | L23 T24 R29 T30 L31 I246 | L23-Y27 WeakPolarHBondContact O-CB 3.43Å; L23-Y27 PolarHBondContact O-N 3.44Å; T24-Y27 PolarHBondContact O-N 3.13Å; Y27-R29 PolarHBondContact O-N 3.32Å; Y27-T30 WeakPolarHBondContact CA-OG1 3.39Å; Y27-T30 PolarHBondContact O-N 2.99Å; Y27-T30 PolarHBondContact O-OG1 3.38Å; Y27-L31 HydrophobicContact CD1-CD1 3.86Å; Y27-L31 HydrophobicContact CD2-CD1 3.96Å; Y27-L31 HydrophobicContact CE1-CD1 3.38Å; Y27-L31 HydrophobicContact CE2-CD1 3.49Å; Y27-L31 VanDerWaalsContact CE2-CD1 3.49Å; Y27-L31 HydrophobicContact CG-CD1 4.13Å; Y27-L31 PolarHBondContact O-N 3.47Å; Y27-L31 VanDerWaalsContact O-N 3.08Å; Y27-I246 HydrophobicContact CD1-CD1 4.04Å; Y27-I246 HydrophobicContact CD1-CG2 4.27Å; Y27-I246 HydrophobicContact CE1-CD1 3.61Å; Y27-I246 HydrophobicContact CE1-CG1 4.42Å |
| 28 | S | 82.3 | Confident | 78.8 | Confident | 14 Ų | 14 | 77 Ų | 77 | 10% | 0.098 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -60.6 | -30.1 | 176.5 | 176.3 | 0 | 0 | 0 | 0 | 113.4 | T24 M25 R26 Y38 | T24-S28 WeakPolarHBondContact O-CB 3.36Å; T24-S28 PolarHBondContact O-N 3.46Å; M25-S28 PolarHBondContact O-N 3.44Å; R26-S28 VanDerWaalsContact C-N 3.32Å; R26-S28 PolarHBondContact O-N 3.18Å; S28-Y38 VanDerWaalsContact OG-CE1 3.28Å; S28-Y38 WeakPolarHBondContact OG-CE1 3.38Å |
| 29 | R | 71.6 | Confident | 78.5 | Confident | 156 Ų | 156 | 76.5 Ų | 76.5 | 59% | 0.589 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -91.4 | -23.3 | -178.7 | -71.9 | 179.7 | 178.4 | -166.6 | 0.5 | 113.5 | M25 R26 Y27 | M25-R29 WeakPolarHBondContact O-CG 3.35Å; M25-R29 PolarHBondContact O-N 2.96Å; R26-R29 PolarHBondContact O-N 3.15Å; Y27-R29 PolarHBondContact O-N 3.32Å |
| 30 | T | 73.1 | Confident | 78.2 | Confident | 84 Ų | 84 | 78.1 Ų | 78.1 | 52% | 0.515 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -86.1 | -24.9 | 176.5 | 53.4 | 0 | 0 | 0 | 0 | 112.4 | R26 Y27 Q32 | R26-T30 PolarHBondContact O-N 3.41Å; R26-T30 PolarHBondContact O-OG1 3.34Å; Y27-T30 WeakPolarHBondContact CA-OG1 3.39Å; Y27-T30 PolarHBondContact O-N 2.99Å; Y27-T30 PolarHBondContact O-OG1 3.38Å; T30-Q32 PolarHBondContact O-N 3.38Å; T30-Q32 VanDerWaalsContact O-N 3.14Å |
| 31 | L | 69.6 | Low | 78 | Confident | 69 Ų | 69 | 77.8 Ų | 77.8 | 36% | 0.361 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -62.7 | 115.5 | 170.1 | -110.9 | 100 | 0 | 0 | 0 | 110.7 | Y27 A33 I246 | Y27-L31 HydrophobicContact CD1-CD1 3.86Å; Y27-L31 HydrophobicContact CD2-CD1 3.96Å; Y27-L31 HydrophobicContact CE1-CD1 3.38Å; Y27-L31 HydrophobicContact CE2-CD1 3.49Å; Y27-L31 VanDerWaalsContact CE2-CD1 3.49Å; Y27-L31 HydrophobicContact CG-CD1 4.13Å; Y27-L31 PolarHBondContact O-N 3.47Å; Y27-L31 VanDerWaalsContact O-N 3.08Å; L31-A33 PolarHBondContact O-N 3.13Å; L31-A33 VanDerWaalsContact O-N 3.1Å; L31-I246 HydrophobicContact CD1-CD1 4.12Å; L31-I246 HydrophobicContact CD2-CD1 3.98Å |
| 32 | Q | 57.4 | Low | 78 | Confident | 193 Ų | 193 | 76.6 Ų | 76.6 | 90% | 0.902 | 39% | 0.392 | S | S | * | . | trans | -72.7 | 96.4 | 164.3 | -70.1 | -178.7 | -15.1 | 0 | 0 | 108 | T30 | T30-Q32 PolarHBondContact O-N 3.38Å; T30-Q32 VanDerWaalsContact O-N 3.14Å | ||
| 33 | A | 60.8 | Low | 78.1 | Confident | 61 Ų | 61 | 74 Ų | 74 | 50% | 0.504 | 38% | 0.376 | S | S | . | . | trans | -89.2 | 137.9 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | L31 G35 | L31-A33 PolarHBondContact O-N 3.13Å; L31-A33 VanDerWaalsContact O-N 3.1Å; A33-G35 PolarHBondContact O-N 3.49Å | ||
| 34 | E | 56.1 | Low | 78.3 | Confident | 207 Ų | 207 | 75.1 Ų | 75.1 | 97% | 0.967 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -65.2 | 114.5 | 170.7 | -67.6 | -175.6 | 165.3 | 0 | 0 | 109.2 | ||
| 35 | G | 65.8 | Low | 78.5 | Confident | 56 Ų | 56 | 73.7 Ų | 73.7 | 58% | 0.577 | 38% | 0.376 | S | S | * | . | S | Bend | trans | 128.7 | 178.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | A33 | A33-G35 PolarHBondContact O-N 3.49Š|
| 36 | P | 71 | Confident | 79 | Confident | 73 Ų | 73 | 71.7 Ų | 71.7 | 47% | 0.474 | 37% | 0.366 | S | S | . | . | P | Polyproline II helix | trans | -65.4 | 139.6 | 177.6 | 27.3 | -33.4 | 0 | 0 | 0 | 110.7 | Q241 G242 | P36-Q241 HydrophobicContact CG-CB 4.35Å; P36-G242 VanDerWaalsContact O-CA 3.3Å; P36-G242 WeakPolarHBondContact O-CA 3.5Å |
| 37 | R | 80 | Confident | 79.7 | Confident | 204 Ų | 204 | 67.9 Ų | 67.9 | 77% | 0.77 | 35% | 0.352 | S | S | * | . | P | Polyproline II helix | trans | -62.9 | 147.8 | 174.4 | -70.3 | -178.9 | 173.9 | 170 | -2.2 | 110.6 | Q241 | R37-Q241 PolarHBondContact O-NE2 3.4Š|
| 38 | Y | 85.9 | Confident | 80.2 | Confident | 35 Ų | 35 | 63.5 Ų | 63.5 | 14% | 0.137 | 34% | 0.336 | C | S | . | . | P | Polyproline II helix | trans | -62.3 | 146.6 | 173.5 | 73.3 | -90 | 0 | 0 | 0 | 111.1 | S28 A43 Q241 T247 | S28-Y38 VanDerWaalsContact OG-CE1 3.28Å; S28-Y38 WeakPolarHBondContact OG-CE1 3.38Å; Y38-A43 HydrophobicContact CD2-CB 4.26Å; Y38-A43 HydrophobicContact CE2-CB 4.3Å; Y38-Q241 VanDerWaalsContact CA-O 3.3Å; Y38-Q241 WeakPolarHBondContact CA-O 3.34Å; Y38-T247 HydrophobicContact CD1-CG2 3.91Å; Y38-T247 HydrophobicContact CD2-CG2 3.84Å; Y38-T247 HydrophobicContact CE1-CG2 4.45Å; Y38-T247 HydrophobicContact CE2-CG2 4.39Å; Y38-T247 HydrophobicContact CG-CG2 3.58Å |
| 39 | L | 87.1 | Confident | 80.9 | Confident | 13 Ų | 13 | 65.5 Ų | 65.5 | 7% | 0.068 | 35% | 0.348 | C | S | . | . | P | Polyproline II helix | trans | -80.3 | 125.6 | 177.8 | -59.1 | 171.8 | 0 | 0 | 0 | 109.1 | S41 S42 A43 D230 R233 V234 Q241 | L39-S41 PolarHBondContact O-N 2.94Å; L39-S42 PolarHBondContact O-N 2.94Å; L39-S42 PolarHBondContact O-OG 3.46Å; L39-A43 PolarHBondContact O-N 3.26Å; L39-A43 VanDerWaalsContact O-N 3.12Å; L39-D230 HydrophobicContact CD1-CB 4.2Å; L39-D230 HydrophobicContact CD2-CB 4.42Å; L39-R233 HydrophobicContact CD1-CB 4.29Å; L39-R233 HydrophobicContact CD2-CB 4.3Å; L39-V234 HydrophobicContact CD1-CG2 3.61Å; L39-Q241 HydrophobicContact CD1-CG 4.12Å; L39-Q241 HydrophobicContact CG-CG 3.98Å |
| 40 | A | 85.9 | Confident | 82.1 | Confident | 41 Ų | 41 | 61.3 Ų | 61.3 | 34% | 0.339 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.3 | -33.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | A43 V44 | A40-A43 PolarHBondContact O-N 2.87Å; A40-V44 VanDerWaalsContact O-CG2 3.27Å; A40-V44 WeakPolarHBondContact O-CG2 3.2Å; A40-V44 PolarHBondContact O-N 3.01Å; A40-V44 VanDerWaalsContact O-N 3.08Å |
| 41 | S | 88.5 | Confident | 83.1 | Confident | 22 Ų | 22 | 58.4 Ų | 58.4 | 15% | 0.154 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 176.4 | 54.2 | 0 | 0 | 0 | 0 | 112.2 | L39 V44 V45 D230 | L39-S41 PolarHBondContact O-N 2.94Å; S41-V44 PolarHBondContact O-N 2.97Å; S41-V45 WeakPolarHBondContact O-CG2 3.35Å; S41-V45 PolarHBondContact O-N 3.26Å; S41-V45 VanDerWaalsContact O-N 3.15Å; S41-D230 WeakPolarHBondContact CB-OD2 3.39Å; S41-D230 PolarHBondContact OG-OD2 3Å |
| 42 | S | 91.4 | Very high | 84.3 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 174.8 | 72.4 | 0 | 0 | 0 | 0 | 111.7 | L39 V44 V45 V46 M226 M239 Y243 | L39-S42 PolarHBondContact O-N 2.94Å; L39-S42 PolarHBondContact O-OG 3.46Å; S42-V44 VanDerWaalsContact C-N 3.31Å; S42-V44 PolarHBondContact O-N 3.34Å; S42-V45 PolarHBondContact O-N 3.37Å; S42-V46 VanDerWaalsContact O-CG2 3.27Å; S42-V46 WeakPolarHBondContact O-CG2 3.38Å; S42-V46 PolarHBondContact O-N 2.79Å; S42-M226 VanDerWaalsContact CA-SD 3.6Å; S42-M239 VanDerWaalsContact CB-O 3.24Å; S42-M239 WeakPolarHBondContact CB-O 3.31Å; S42-M239 PolarHBondContact OG-O 2.89Å; S42-Y243 PolarHBondContact O-OH 3Å; S42-Y243 WeakPolarHBondContact OG-CE2 3.43Å; S42-Y243 PolarHBondContact OG-OH 3.33Å |
| 43 | A | 90.9 | Very high | 86.2 | Confident | 3 Ų | 3 | 52.5 Ų | 52.5 | 3% | 0.025 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60 | -41 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y38 L39 A40 A47 Y243 V251 | Y38-A43 HydrophobicContact CD2-CB 4.26Å; Y38-A43 HydrophobicContact CE2-CB 4.3Å; L39-A43 PolarHBondContact O-N 3.26Å; L39-A43 VanDerWaalsContact O-N 3.12Å; A40-A43 PolarHBondContact O-N 2.87Å; A43-A47 VanDerWaalsContact O-CB 3.29Å; A43-A47 WeakPolarHBondContact O-CB 3.33Å; A43-A47 PolarHBondContact O-N 2.92Å; A43-Y243 VanDerWaalsContact CA-OH 3.23Å; A43-Y243 WeakPolarHBondContact CA-OH 3.39Å; A43-Y243 PolarHBondContact N-OH 2.95Å; A43-V251 HydrophobicContact CB-CG2 3.85Å |
| 44 | V | 90.3 | Very high | 87.9 | Confident | 54 Ų | 54 | 51.3 Ų | 51.3 | 33% | 0.327 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63 | -47 | 175 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | A40 S41 S42 V46 A47 E48 | A40-V44 VanDerWaalsContact O-CG2 3.27Å; A40-V44 WeakPolarHBondContact O-CG2 3.2Å; A40-V44 PolarHBondContact O-N 3.01Å; A40-V44 VanDerWaalsContact O-N 3.08Å; S41-V44 PolarHBondContact O-N 2.97Å; S42-V44 VanDerWaalsContact C-N 3.31Å; S42-V44 PolarHBondContact O-N 3.34Å; V44-V46 PolarHBondContact O-N 3.21Å; V44-A47 PolarHBondContact O-N 3.47Å; V44-E48 PolarHBondContact O-N 3.28Å |
| 45 | V | 93.9 | Very high | 89.7 | Confident | 2 Ų | 2 | 41.5 Ų | 41.5 | 1% | 0.012 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.9 | -45.9 | 179.3 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | S41 S42 A47 E48 V49 F219 G222 M226 M239 | S41-V45 WeakPolarHBondContact O-CG2 3.35Å; S41-V45 PolarHBondContact O-N 3.26Å; S41-V45 VanDerWaalsContact O-N 3.15Å; S42-V45 PolarHBondContact O-N 3.37Å; V45-A47 VanDerWaalsContact C-N 3.33Å; V45-A47 PolarHBondContact O-N 3.35Å; V45-E48 PolarHBondContact O-N 3.45Å; V45-V49 WeakPolarHBondContact O-CG2 3.16Å; V45-V49 PolarHBondContact O-N 3.46Å; V45-V49 VanDerWaalsContact O-N 3.11Å; V45-F219 HydrophobicContact CG1-CD2 3.81Å; V45-F219 HydrophobicContact CG1-CE2 3.6Å; V45-G222 WeakPolarHBondContact CG2-O 3.44Å; V45-M226 HydrophobicContact CG2-CB 4.29Å; V45-M226 HydrophobicContact CG2-SD 4.31Å; V45-M239 HydrophobicContact CB-CE 3.85Å; V45-M239 HydrophobicContact CG1-CE 3.7Å |
| 46 | V | 95 | Very high | 91 | Very high | 15 Ų | 15 | 40.7 Ų | 40.7 | 9% | 0.091 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.9 | -38.9 | 177.8 | -177.7 | 0 | 0 | 0 | 0 | 110.8 | S42 V44 E48 V49 M50 M239 F240 W248 V251 | S42-V46 VanDerWaalsContact O-CG2 3.27Å; S42-V46 WeakPolarHBondContact O-CG2 3.38Å; S42-V46 PolarHBondContact O-N 2.79Å; V44-V46 PolarHBondContact O-N 3.21Å; V46-E48 VanDerWaalsContact C-N 3.32Å; V46-E48 PolarHBondContact O-N 3.37Å; V46-V49 PolarHBondContact O-N 2.96Å; V46-M50 HydrophobicContact CG1-CG 4.42Å; V46-M50 HydrophobicContact CG1-SD 4.47Å; V46-M50 WeakPolarHBondContact O-CG 3.44Å; V46-M50 PolarHBondContact O-N 3.29Å; V46-M239 HydrophobicContact CG2-CE 3.7Å; V46-F240 HydrophobicContact CG2-CE1 3.63Å; V46-F240 HydrophobicContact CG2-CZ 4.31Å; V46-W248 HydrophobicContact CG1-CH2 4.18Å; V46-W248 HydrophobicContact CG1-CZ3 3.81Å; V46-V251 HydrophobicContact CB-CG1 3.94Å; V46-V251 HydrophobicContact CG1-CG1 3.68Å |
| 47 | A | 93.9 | Very high | 92.1 | Very high | 1 Ų | 1 | 41.7 Ų | 41.7 | 1% | 0.008 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.7 | -37.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | A43 V44 V45 K51 V251 Q254 A255 | A43-A47 VanDerWaalsContact O-CB 3.29Å; A43-A47 WeakPolarHBondContact O-CB 3.33Å; A43-A47 PolarHBondContact O-N 2.92Å; V44-A47 PolarHBondContact O-N 3.47Å; V45-A47 VanDerWaalsContact C-N 3.33Å; V45-A47 PolarHBondContact O-N 3.35Å; A47-K51 WeakPolarHBondContact O-CB 3.2Å; A47-K51 PolarHBondContact O-N 3.37Å; A47-V251 HydrophobicContact CB-CG1 4.12Å; A47-Q254 HydrophobicContact CB-CB 4.12Å; A47-Q254 HydrophobicContact CB-CG 3.94Å; A47-A255 HydrophobicContact CB-CB 4.46Å; A47-A255 WeakPolarHBondContact O-CB 3.48Å |
| 48 | E | 94.4 | Very high | 92.7 | Very high | 30 Ų | 30 | 34.6 Ų | 34.6 | 14% | 0.14 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.3 | -43.7 | 172.9 | -68 | -53.4 | 143.5 | 0 | 0 | 111.7 | V44 V45 V46 K51 I52 F219 | V44-E48 PolarHBondContact O-N 3.28Å; V45-E48 PolarHBondContact O-N 3.45Å; V46-E48 VanDerWaalsContact C-N 3.32Å; V46-E48 PolarHBondContact O-N 3.37Å; E48-K51 WeakPolarHBondContact O-CB 3.42Å; E48-K51 PolarHBondContact O-N 2.9Å; E48-K51 IonicContact OE1-NZ 3.57Å; E48-K51 PolarHBondContact OE1-NZ 3.25Å; E48-K51 WeakPolarHBondContact OE2-CE 3.46Å; E48-K51 IonicContact OE2-NZ 2.73Å; E48-K51 PolarHBondContact OE2-NZ 3.34Å; E48-I52 VanDerWaalsContact O-CG1 3.29Å; E48-I52 WeakPolarHBondContact O-CG1 3.19Å; E48-I52 PolarHBondContact O-N 3.28Å; E48-F219 HydrophobicContact CB-CB 4.29Å |
| 49 | V | 96.1 | Very high | 93.1 | Very high | 57 Ų | 57 | 32.9 Ų | 32.9 | 35% | 0.345 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -60.1 | -49.5 | 175.8 | 176 | 0 | 0 | 0 | 0 | 110.9 | V45 V46 K51 I52 L53 F219 | V45-V49 WeakPolarHBondContact O-CG2 3.16Å; V45-V49 PolarHBondContact O-N 3.46Å; V45-V49 VanDerWaalsContact O-N 3.11Å; V46-V49 PolarHBondContact O-N 2.96Å; V49-K51 VanDerWaalsContact C-N 3.27Å; V49-K51 PolarHBondContact O-N 3.49Å; V49-I52 PolarHBondContact O-N 3.48Å; V49-L53 HydrophobicContact CG1-CD1 4.07Å; V49-L53 HydrophobicContact CG1-CG 4.45Å; V49-L53 WeakPolarHBondContact O-CG 3.21Å; V49-L53 PolarHBondContact O-N 3.01Å; V49-F219 HydrophobicContact CG2-CD2 3.56Å; V49-F219 HydrophobicContact CG2-CE2 3.55Å |
| 50 | M | 96.4 | Very high | 93.3 | Very high | 68 Ų | 68 | 34 Ų | 34 | 34% | 0.335 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -60.2 | -38.6 | 177.9 | -71.8 | -172.1 | 77.9 | 0 | 0 | 112 | V46 L53 A54 W248 V251 A252 A255 | V46-M50 HydrophobicContact CG1-CG 4.42Å; V46-M50 HydrophobicContact CG1-SD 4.47Å; V46-M50 WeakPolarHBondContact O-CG 3.44Å; V46-M50 PolarHBondContact O-N 3.29Å; M50-L53 PolarHBondContact O-N 3.14Å; M50-A54 VanDerWaalsContact O-CB 3.31Å; M50-A54 WeakPolarHBondContact O-CB 3.45Å; M50-A54 PolarHBondContact O-N 3.46Å; M50-W248 HydrophobicContact SD-CZ3 4.45Å; M50-V251 HydrophobicContact SD-CG1 3.75Å; M50-A252 HydrophobicContact CE-CB 4.26Å; M50-A255 HydrophobicContact CB-CB 3.86Å |
| 51 | K | 95.1 | Very high | 93.6 | Very high | 23 Ų | 23 | 38.3 Ų | 38.3 | 10% | 0.1 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.8 | -44 | 177.5 | -170.3 | -166.6 | -50.6 | 165.9 | 0 | 111.7 | A47 E48 V49 A54 C55 A255 L259 | A47-K51 WeakPolarHBondContact O-CB 3.2Å; A47-K51 PolarHBondContact O-N 3.37Å; E48-K51 WeakPolarHBondContact O-CB 3.42Å; E48-K51 PolarHBondContact O-N 2.9Å; E48-K51 IonicContact OE1-NZ 3.57Å; E48-K51 PolarHBondContact OE1-NZ 3.25Å; E48-K51 WeakPolarHBondContact OE2-CE 3.46Å; E48-K51 IonicContact OE2-NZ 2.73Å; E48-K51 PolarHBondContact OE2-NZ 3.34Å; V49-K51 VanDerWaalsContact C-N 3.27Å; V49-K51 PolarHBondContact O-N 3.49Å; K51-A54 PolarHBondContact O-N 3.43Å; K51-C55 PolarHBondContact O-N 2.81Å; K51-C55 PolarHBondContact O-SG 3.37Å; K51-C55 VanDerWaalsContact O-SG 3.38Å; K51-A255 HydrophobicContact CB-CB 4.32Å; K51-L259 HydrophobicContact CG-CD2 3.71Å; K51-L259 HydrophobicContact CG-CG 4.26Å |
| 52 | I | 95.4 | Very high | 93.6 | Very high | 32 Ų | 32 | 41.6 Ų | 41.6 | 16% | 0.164 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.3 | -49 | 175.2 | -67.1 | 164.1 | 0 | 0 | 0 | 109.9 | E48 V49 A54 C55 V56 I212 F219 | E48-I52 VanDerWaalsContact O-CG1 3.29Å; E48-I52 WeakPolarHBondContact O-CG1 3.19Å; E48-I52 PolarHBondContact O-N 3.28Å; V49-I52 PolarHBondContact O-N 3.48Å; I52-A54 PolarHBondContact O-N 2.89Å; I52-C55 PolarHBondContact O-N 3.05Å; I52-V56 HydrophobicContact CG2-CG2 4.44Å; I52-V56 WeakPolarHBondContact O-CG2 3.22Å; I52-V56 PolarHBondContact O-N 2.84Å; I52-I212 HydrophobicContact CG2-CG2 4.37Å; I52-F219 HydrophobicContact CD1-CB 4.35Å |
| 53 | L | 96.3 | Very high | 93.5 | Very high | 106 Ų | 106 | 44.7 Ų | 44.7 | 56% | 0.555 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -58.3 | -47.2 | 178.3 | -69.2 | 174.2 | 0 | 0 | 0 | 111.5 | V49 M50 C55 V56 V57 | V49-L53 HydrophobicContact CG1-CD1 4.07Å; V49-L53 HydrophobicContact CG1-CG 4.45Å; V49-L53 WeakPolarHBondContact O-CG 3.21Å; V49-L53 PolarHBondContact O-N 3.01Å; M50-L53 PolarHBondContact O-N 3.14Å; L53-C55 VanDerWaalsContact C-N 3.33Å; L53-C55 PolarHBondContact O-N 2.9Å; L53-V56 PolarHBondContact O-N 3.47Å; L53-V57 WeakPolarHBondContact O-CG2 3.48Å; L53-V57 PolarHBondContact O-N 2.94Å |
| 54 | A | 95.6 | Very high | 93.4 | Very high | 36 Ų | 36 | 49.5 Ų | 49.5 | 30% | 0.298 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.2 | -42.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | M50 K51 I52 V57 L58 L259 | M50-A54 VanDerWaalsContact O-CB 3.31Å; M50-A54 WeakPolarHBondContact O-CB 3.45Å; M50-A54 PolarHBondContact O-N 3.46Å; K51-A54 PolarHBondContact O-N 3.43Å; I52-A54 PolarHBondContact O-N 2.89Å; A54-V57 PolarHBondContact O-N 2.8Å; A54-L58 VanDerWaalsContact O-CG 3.31Å; A54-L58 WeakPolarHBondContact O-CG 3.49Å; A54-L58 PolarHBondContact O-N 2.76Å; A54-L259 HydrophobicContact CB-CD1 3.83Å |
| 55 | C | 94.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.5 | -39.3 | 174.9 | -72.4 | 0 | 0 | 0 | 0 | 112.7 | K51 I52 L53 V57 L58 V59 W208 N211 I212 L259 | K51-C55 PolarHBondContact O-N 2.81Å; K51-C55 PolarHBondContact O-SG 3.37Å; K51-C55 VanDerWaalsContact O-SG 3.38Å; I52-C55 PolarHBondContact O-N 3.05Å; L53-C55 VanDerWaalsContact C-N 3.33Å; L53-C55 PolarHBondContact O-N 2.9Å; C55-V57 VanDerWaalsContact C-N 3.32Å; C55-V57 PolarHBondContact O-N 3.24Å; C55-L58 PolarHBondContact O-N 3.49Å; C55-V59 WeakPolarHBondContact O-CG2 3.46Å; C55-V59 PolarHBondContact O-N 3.44Å; C55-W208 HydrophobicContact CB-CB 4.23Å; C55-N211 PolarHBondContact SG-ND2 3.32Å; C55-I212 HydrophobicContact CB-CD1 3.93Å; C55-I212 HydrophobicContact CB-CG1 3.43Å; C55-I212 VanDerWaalsContact CB-CG1 3.43Å; C55-L259 WeakPolarHBondContact SG-CD2 3.35Å |
| 56 | V | 94.3 | Very high | 93.1 | Very high | 39 Ų | 39 | 56.4 Ų | 56.4 | 24% | 0.236 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.2 | -43.1 | 175.1 | 171.2 | 0 | 0 | 0 | 0 | 110.6 | I52 L53 L58 V59 F60 L70 I212 | I52-V56 HydrophobicContact CG2-CG2 4.44Å; I52-V56 WeakPolarHBondContact O-CG2 3.22Å; I52-V56 PolarHBondContact O-N 2.84Å; L53-V56 PolarHBondContact O-N 3.47Å; V56-L58 VanDerWaalsContact C-N 3.35Å; V56-L58 PolarHBondContact O-N 3.21Å; V56-V59 PolarHBondContact O-N 3.21Å; V56-F60 WeakPolarHBondContact O-CB 3.49Å; V56-F60 PolarHBondContact O-N 3.36Å; V56-L70 HydrophobicContact CG1-CD1 4.46Å; V56-L70 HydrophobicContact CG1-CD2 4.15Å; V56-I212 HydrophobicContact CG2-CD1 3.77Å; V56-I212 HydrophobicContact CG2-CG1 4.3Å |
| 57 | V | 93.8 | Very high | 92.8 | Very high | 94 Ų | 94 | 61.8 Ų | 61.8 | 57% | 0.57 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -62.7 | -40.4 | 174.8 | 176.7 | 0 | 0 | 0 | 0 | 111.7 | L53 A54 C55 F60 K61 | L53-V57 WeakPolarHBondContact O-CG2 3.48Å; L53-V57 PolarHBondContact O-N 2.94Å; A54-V57 PolarHBondContact O-N 2.8Å; C55-V57 VanDerWaalsContact C-N 3.32Å; C55-V57 PolarHBondContact O-N 3.24Å; V57-F60 WeakPolarHBondContact O-CB 3.31Å; V57-F60 PolarHBondContact O-N 3.48Å; V57-K61 PolarHBondContact O-N 3.18Å |
| 58 | L | 93 | Very high | 92.6 | Very high | 55 Ų | 55 | 72.4 Ų | 72.4 | 29% | 0.288 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.8 | -41.6 | 177.1 | -70.7 | 171.7 | 0 | 0 | 0 | 112.2 | A54 C55 V56 F60 K61 E62 W208 | A54-L58 VanDerWaalsContact O-CG 3.31Å; A54-L58 WeakPolarHBondContact O-CG 3.49Å; A54-L58 PolarHBondContact O-N 2.76Å; C55-L58 PolarHBondContact O-N 3.49Å; V56-L58 VanDerWaalsContact C-N 3.35Å; V56-L58 PolarHBondContact O-N 3.21Å; L58-F60 VanDerWaalsContact C-N 3.33Å; L58-K61 PolarHBondContact O-N 3.37Å; L58-E62 WeakPolarHBondContact O-CG 3.35Å; L58-E62 PolarHBondContact O-N 2.88Å; L58-W208 HydrophobicContact CB-CD2 4.13Å; L58-W208 HydrophobicContact CB-CG 4Å; L58-W208 HydrophobicContact CD1-CD2 3.73Å; L58-W208 HydrophobicContact CD1-CE3 3.63Å; L58-W208 HydrophobicContact CD1-CG 4.44Å; L58-W208 HydrophobicContact CD1-CH2 3.89Å; L58-W208 HydrophobicContact CD1-CZ2 4Å; L58-W208 HydrophobicContact CD1-CZ3 3.71Å |
| 59 | V | 92.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 173.3 | 175.9 | 0 | 0 | 0 | 0 | 110.5 | C55 V56 K61 E62 H63 L70 W208 I209 I212 | C55-V59 WeakPolarHBondContact O-CG2 3.46Å; C55-V59 PolarHBondContact O-N 3.44Å; V56-V59 PolarHBondContact O-N 3.21Å; V59-K61 VanDerWaalsContact C-N 3.28Å; V59-K61 PolarHBondContact O-N 3.48Å; V59-E62 PolarHBondContact O-N 2.89Å; V59-H63 PolarHBondContact O-CD2 3.31Å; V59-H63 VanDerWaalsContact O-CD2 3.25Å; V59-H63 PolarHBondContact O-N 2.88Å; V59-H63 VanDerWaalsContact O-N 3.12Å; V59-L70 HydrophobicContact CB-CD1 4.01Å; V59-L70 HydrophobicContact CG1-CD1 3.6Å; V59-W208 HydrophobicContact CG2-CB 3.65Å; V59-I209 HydrophobicContact CG2-CG1 3.9Å; V59-I212 HydrophobicContact CG2-CD1 4.18Å |
| 60 | F | 92.4 | Very high | 91.9 | Very high | 37 Ų | 37 | 70.4 Ų | 70.4 | 16% | 0.162 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -59.4 | -40.7 | 176.4 | -174.9 | -126.6 | 0 | 0 | 0 | 112.1 | V56 V57 L58 H63 Y65 M67 L70 | V56-F60 WeakPolarHBondContact O-CB 3.49Å; V56-F60 PolarHBondContact O-N 3.36Å; V57-F60 WeakPolarHBondContact O-CB 3.31Å; V57-F60 PolarHBondContact O-N 3.48Å; L58-F60 VanDerWaalsContact C-N 3.33Å; F60-H63 CarbonylContact O-C 3.39Å; F60-H63 PolarHBondContact O-N 3.43Å; F60-Y65 AromaticContact CD1-CD1 3.7Å; F60-Y65 HydrophobicContact CD1-CD1 3.7Å; F60-Y65 HydrophobicContact CD1-CE1 4.46Å; F60-Y65 AromaticContact CE1-CD1 3.51Å; F60-Y65 HydrophobicContact CE1-CD1 3.51Å; F60-Y65 HydrophobicContact CE1-CG 4.2Å; F60-Y65 VanDerWaalsContact CE2-CA 3.46Å; F60-Y65 WeakPolarHBondContact CE2-O 3.37Å; F60-Y65 VanDerWaalsContact CZ-C 3.43Å; F60-Y65 VanDerWaalsContact CZ-CA 3.46Å; F60-Y65 HydrophobicContact CZ-CD1 4.23Å; F60-Y65 HydrophobicContact CZ-CG 4.49Å; F60-Y65 WeakPolarHBondContact CZ-O 3.46Å; F60-Y65 WeakPolarHBondContact O-CA 3.13Å; F60-Y65 PolarHBondContact O-N 2.97Å; F60-M67 HydrophobicContact CD2-SD 4.08Å; F60-M67 HydrophobicContact CE1-CE 3.94Å; F60-M67 HydrophobicContact CE2-CE 3.74Å; F60-M67 HydrophobicContact CE2-CG 3.79Å; F60-M67 HydrophobicContact CE2-SD 3.43Å; F60-M67 WeakPolarHBondContact CE2-SD 3.16Å; F60-M67 HydrophobicContact CZ-CE 3.42Å; F60-M67 VanDerWaalsContact CZ-CE 3.42Å; F60-M67 HydrophobicContact CZ-CG 4.09Å; F60-M67 HydrophobicContact CZ-SD 3.8Å; F60-L70 HydrophobicContact CB-CD1 4.31Å; F60-L70 HydrophobicContact CB-CD2 4.07Å; F60-L70 HydrophobicContact CD2-CB 4.14Å; F60-L70 HydrophobicContact CD2-CD2 3.84Å; F60-L70 HydrophobicContact CD2-CG 4.5Å; F60-L70 HydrophobicContact CG-CD2 4.23Å |
| 61 | K | 91.5 | Very high | 91.5 | Very high | 130 Ų | 130 | 71.7 Ų | 71.7 | 57% | 0.565 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -68.5 | -40.2 | 174.3 | -174.8 | 178 | 177.9 | 179 | 0 | 112.7 | V57 L58 V59 H63 S64 Y65 | V57-K61 PolarHBondContact O-N 3.18Å; L58-K61 PolarHBondContact O-N 3.37Å; V59-K61 VanDerWaalsContact C-N 3.28Å; V59-K61 PolarHBondContact O-N 3.48Å; K61-H63 PolarHBondContact O-N 3.12Å; K61-S64 PolarHBondContact O-N 3.25Å; K61-Y65 HydrophobicContact CB-CE1 4.43Å |
| 62 | E | 89.4 | Confident | 91.3 | Very high | 91 Ų | 91 | 73.8 Ų | 73.8 | 43% | 0.425 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.9 | -29.2 | 176 | -78.7 | -175 | 167 | 0 | 0 | 112.3 | L58 V59 S206 W208 | L58-E62 WeakPolarHBondContact O-CG 3.35Å; L58-E62 PolarHBondContact O-N 2.88Å; V59-E62 PolarHBondContact O-N 2.89Å; E62-S206 PolarHBondContact OE2-OG 3.19Å; E62-W208 PolarHBondContact OE1-NE1 3.4Å |
| 63 | H | 89.1 | Confident | 90.9 | Very high | 65 Ų | 65 | 73.6 Ų | 73.6 | 30% | 0.301 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.6 | 35 | 179.2 | -65.3 | -68.5 | 0 | 0 | 0 | 113.7 | V59 F60 K61 Y65 S66 A69 I73 | V59-H63 PolarHBondContact O-CD2 3.31Å; V59-H63 VanDerWaalsContact O-CD2 3.25Å; V59-H63 PolarHBondContact O-N 2.88Å; V59-H63 VanDerWaalsContact O-N 3.12Å; F60-H63 CarbonylContact O-C 3.39Å; F60-H63 PolarHBondContact O-N 3.43Å; K61-H63 PolarHBondContact O-N 3.12Å; H63-Y65 VanDerWaalsContact C-N 3.26Å; H63-Y65 PolarHBondContact O-N 3.18Å; H63-S66 WeakPolarHBondContact O-CB 3.42Å; H63-S66 PolarHBondContact O-N 3.27Å; H63-S66 VanDerWaalsContact O-N 3.14Å; H63-A69 HydrophobicContact CB-CB 4.13Å; H63-I73 VanDerWaalsContact CD2-CD1 3.46Å; H63-I73 WeakPolarHBondContact CD2-CD1 3.49Å; H63-I73 WeakPolarHBondContact CE1-CD1 3.33Å; H63-I73 WeakPolarHBondContact ND1-CD1 3.23Å; H63-I73 WeakPolarHBondContact NE2-CD1 3.27Å |
| 64 | S | 88.4 | Confident | 90.6 | Very high | 104 Ų | 104 | 70.1 Ų | 70.1 | 73% | 0.727 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55 | 36.4 | 171.6 | -55.4 | 0 | 0 | 0 | 0 | 114.3 | K61 S66 | K61-S64 PolarHBondContact O-N 3.25Å; S64-S66 PolarHBondContact O-N 3Å |
| 65 | Y | 88.7 | Confident | 90.3 | Very high | 150 Ų | 150 | 75 Ų | 75 | 59% | 0.588 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.6 | 26.3 | 179.6 | -52 | -82.7 | 0 | 0 | 0 | 114.4 | F60 K61 H63 | F60-Y65 AromaticContact CD1-CD1 3.7Å; F60-Y65 HydrophobicContact CD1-CD1 3.7Å; F60-Y65 HydrophobicContact CD1-CE1 4.46Å; F60-Y65 AromaticContact CE1-CD1 3.51Å; F60-Y65 HydrophobicContact CE1-CD1 3.51Å; F60-Y65 HydrophobicContact CE1-CG 4.2Å; F60-Y65 VanDerWaalsContact CE2-CA 3.46Å; F60-Y65 WeakPolarHBondContact CE2-O 3.37Å; F60-Y65 VanDerWaalsContact CZ-C 3.43Å; F60-Y65 VanDerWaalsContact CZ-CA 3.46Å; F60-Y65 HydrophobicContact CZ-CD1 4.23Å; F60-Y65 HydrophobicContact CZ-CG 4.49Å; F60-Y65 WeakPolarHBondContact CZ-O 3.46Å; F60-Y65 WeakPolarHBondContact O-CA 3.13Å; F60-Y65 PolarHBondContact O-N 2.97Å; K61-Y65 HydrophobicContact CB-CE1 4.43Å; H63-Y65 VanDerWaalsContact C-N 3.26Å; H63-Y65 PolarHBondContact O-N 3.18Å |
| 66 | S | 90.3 | Very high | 90 | Very high | 51 Ų | 51 | 79.8 Ų | 79.8 | 36% | 0.357 | 40% | 0.395 | S | S | . | . | trans | -86.6 | 111 | 175.1 | 177.6 | 0 | 0 | 0 | 0 | 112 | H63 S64 R68 A69 L70 | H63-S66 WeakPolarHBondContact O-CB 3.42Å; H63-S66 PolarHBondContact O-N 3.27Å; H63-S66 VanDerWaalsContact O-N 3.14Å; S64-S66 PolarHBondContact O-N 3Å; S66-R68 VanDerWaalsContact C-N 3.31Å; S66-R68 PolarHBondContact O-N 3.24Å; S66-A69 PolarHBondContact O-N 3.25Å; S66-A69 PolarHBondContact OG-N 3.2Å; S66-L70 PolarHBondContact O-N 3.4Å | ||
| 67 | M | 87.8 | Confident | 89.6 | Confident | 128 Ų | 128 | 79.1 Ų | 79.1 | 63% | 0.631 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -65 | -34.3 | 179.5 | -73.5 | -64.1 | -175.7 | 0 | 0 | 112.6 | F60 L70 N71 | F60-M67 HydrophobicContact CD2-SD 4.08Å; F60-M67 HydrophobicContact CE1-CE 3.94Å; F60-M67 HydrophobicContact CE2-CE 3.74Å; F60-M67 HydrophobicContact CE2-CG 3.79Å; F60-M67 HydrophobicContact CE2-SD 3.43Å; F60-M67 WeakPolarHBondContact CE2-SD 3.16Å; F60-M67 HydrophobicContact CZ-CE 3.42Å; F60-M67 VanDerWaalsContact CZ-CE 3.42Å; F60-M67 HydrophobicContact CZ-CG 4.09Å; F60-M67 HydrophobicContact CZ-SD 3.8Å; M67-L70 PolarHBondContact O-N 2.88Å; M67-L70 HydrophobicContact SD-CD2 4.31Å; M67-N71 PolarHBondContact O-N 3.44Å |
| 68 | R | 88.7 | Confident | 89.3 | Confident | 224 Ų | 224 | 76 Ų | 76 | 85% | 0.845 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -65.9 | -42.8 | 175.6 | -69.2 | -176.8 | -173.3 | 166 | 2.4 | 111 | S66 S72 | S66-R68 VanDerWaalsContact C-N 3.31Å; S66-R68 PolarHBondContact O-N 3.24Å; R68-S72 VanDerWaalsContact O-CB 3.24Å; R68-S72 WeakPolarHBondContact O-CB 3.39Å; R68-S72 PolarHBondContact O-N 3.06Å |
| 69 | A | 87.2 | Confident | 88.9 | Confident | 29 Ų | 29 | 79.1 Ų | 79.1 | 24% | 0.24 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.8 | -44.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | H63 S66 S72 I73 | H63-A69 HydrophobicContact CB-CB 4.13Å; S66-A69 PolarHBondContact O-N 3.25Å; S66-A69 PolarHBondContact OG-N 3.2Å; A69-S72 PolarHBondContact O-N 3.26Å; A69-I73 WeakPolarHBondContact O-CB 3.45Å; A69-I73 WeakPolarHBondContact O-CG1 3.49Å; A69-I73 PolarHBondContact O-N 2.83Å |
| 70 | L | 88.5 | Confident | 88.5 | Confident | 17 Ų | 17 | 85.6 Ų | 85.6 | 9% | 0.089 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -57.1 | -53.5 | 176.8 | 179 | 67.9 | 0 | 0 | 0 | 112 | V56 V59 F60 S66 M67 S72 I73 L74 | V56-L70 HydrophobicContact CG1-CD1 4.46Å; V56-L70 HydrophobicContact CG1-CD2 4.15Å; V59-L70 HydrophobicContact CB-CD1 4.01Å; V59-L70 HydrophobicContact CG1-CD1 3.6Å; F60-L70 HydrophobicContact CB-CD1 4.31Å; F60-L70 HydrophobicContact CB-CD2 4.07Å; F60-L70 HydrophobicContact CD2-CB 4.14Å; F60-L70 HydrophobicContact CD2-CD2 3.84Å; F60-L70 HydrophobicContact CD2-CG 4.5Å; F60-L70 HydrophobicContact CG-CD2 4.23Å; S66-L70 PolarHBondContact O-N 3.4Å; M67-L70 PolarHBondContact O-N 2.88Å; M67-L70 HydrophobicContact SD-CD2 4.31Å; L70-S72 VanDerWaalsContact C-N 3.33Å; L70-S72 PolarHBondContact O-N 3.46Å; L70-I73 PolarHBondContact O-N 2.84Å; L70-L74 HydrophobicContact CD1-CD1 3.88Å; L70-L74 HydrophobicContact CD1-CG 4.08Å; L70-L74 HydrophobicContact CG-CD1 3.93Å; L70-L74 HydrophobicContact CG-CG 4.42Å; L70-L74 WeakPolarHBondContact O-CB 3.33Å; L70-L74 WeakPolarHBondContact O-CG 3.24Å; L70-L74 PolarHBondContact O-N 3.23Å |
| 71 | N | 89.4 | Confident | 88.3 | Confident | 94 Ų | 94 | 87 Ų | 87 | 50% | 0.503 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -64.3 | -39.3 | -178.6 | -172.5 | 33.3 | 0 | 0 | 0 | 111.7 | M67 R75 | M67-N71 PolarHBondContact O-N 3.44Å; N71-R75 WeakPolarHBondContact O-CB 3.43Å; N71-R75 PolarHBondContact O-N 3.27Å |
| 72 | S | 89.3 | Confident | 88 | Confident | 67 Ų | 67 | 84.6 Ų | 84.6 | 47% | 0.469 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.5 | -48.6 | 175.1 | -173.9 | 0 | 0 | 0 | 0 | 111.4 | R68 A69 L70 R75 Q76 | R68-S72 VanDerWaalsContact O-CB 3.24Å; R68-S72 WeakPolarHBondContact O-CB 3.39Å; R68-S72 PolarHBondContact O-N 3.06Å; A69-S72 PolarHBondContact O-N 3.26Å; L70-S72 VanDerWaalsContact C-N 3.33Å; L70-S72 PolarHBondContact O-N 3.46Å; S72-R75 PolarHBondContact O-N 3.11Å; S72-Q76 WeakPolarHBondContact O-CB 3.45Å; S72-Q76 PolarHBondContact O-N 3.27Å |
| 73 | I | 88.9 | Confident | 87.9 | Confident | 29 Ų | 29 | 85.1 Ų | 85.1 | 15% | 0.149 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -70.4 | -43.9 | -176.6 | -68.5 | 170.1 | 0 | 0 | 0 | 111.5 | H63 A69 L70 R75 Q76 E77 I209 | H63-I73 VanDerWaalsContact CD2-CD1 3.46Å; H63-I73 WeakPolarHBondContact CD2-CD1 3.49Å; H63-I73 WeakPolarHBondContact CE1-CD1 3.33Å; H63-I73 WeakPolarHBondContact ND1-CD1 3.23Å; H63-I73 WeakPolarHBondContact NE2-CD1 3.27Å; A69-I73 WeakPolarHBondContact O-CB 3.45Å; A69-I73 WeakPolarHBondContact O-CG1 3.49Å; A69-I73 PolarHBondContact O-N 2.83Å; L70-I73 PolarHBondContact O-N 2.84Å; I73-R75 VanDerWaalsContact C-N 3.32Å; I73-R75 PolarHBondContact O-N 2.74Å; I73-Q76 PolarHBondContact O-N 3.41Å; I73-E77 HydrophobicContact CG2-CG 4.14Å; I73-E77 VanDerWaalsContact O-CB 3.3Å; I73-E77 WeakPolarHBondContact O-CB 3.45Å; I73-E77 WeakPolarHBondContact O-CG 3.41Å; I73-E77 PolarHBondContact O-N 2.9Å; I73-I209 HydrophobicContact CG2-CD1 3.52Å |
| 74 | L | 88.5 | Confident | 87.7 | Confident | 32 Ų | 32 | 85 Ų | 85 | 17% | 0.168 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -60.1 | -45.3 | 175.2 | -69.9 | 177.5 | 0 | 0 | 0 | 110.5 | L70 I78 I212 | L70-L74 HydrophobicContact CD1-CD1 3.88Å; L70-L74 HydrophobicContact CD1-CG 4.08Å; L70-L74 HydrophobicContact CG-CD1 3.93Å; L70-L74 HydrophobicContact CG-CG 4.42Å; L70-L74 WeakPolarHBondContact O-CB 3.33Å; L70-L74 WeakPolarHBondContact O-CG 3.24Å; L70-L74 PolarHBondContact O-N 3.23Å; L74-I78 HydrophobicContact CB-CD1 4.34Å; L74-I78 HydrophobicContact CD2-CD1 3.99Å; L74-I78 WeakPolarHBondContact O-CB 3.14Å; L74-I78 WeakPolarHBondContact O-CG1 3.31Å; L74-I78 PolarHBondContact O-N 3.01Å; L74-I212 HydrophobicContact CD2-CD1 3.9Å |
| 75 | R | 88.9 | Confident | 87.7 | Confident | 139 Ų | 139 | 80.7 Ų | 80.7 | 53% | 0.525 | 40% | 0.398 | S | S | . | . | I | π-helix | trans | -65.4 | -40.1 | 177.5 | -179.1 | 175 | -67.8 | -129.2 | 1.4 | 112.2 | N71 S72 I73 L79 H80 | N71-R75 WeakPolarHBondContact O-CB 3.43Å; N71-R75 PolarHBondContact O-N 3.27Å; S72-R75 PolarHBondContact O-N 3.11Å; I73-R75 VanDerWaalsContact C-N 3.32Å; I73-R75 PolarHBondContact O-N 2.74Å; R75-L79 HydrophobicContact CG-CD1 4.1Å; R75-L79 WeakPolarHBondContact O-CB 3.44Å; R75-L79 PolarHBondContact O-N 3.28Å; R75-L79 VanDerWaalsContact O-N 3.1Å; R75-H80 PolarHBondContact O-N 3.49Å; R75-H80 PolarHBondContact O-ND1 3.34Å |
| 76 | Q | 88.9 | Confident | 87.7 | Confident | 100 Ų | 100 | 78.7 Ų | 78.7 | 47% | 0.467 | 40% | 0.397 | S | S | . | . | I | π-helix | trans | -70.7 | -44.5 | -179.4 | -174.3 | 175.5 | 7.4 | 0 | 0 | 111.8 | S72 I73 H80 | S72-Q76 WeakPolarHBondContact O-CB 3.45Å; S72-Q76 PolarHBondContact O-N 3.27Å; I73-Q76 PolarHBondContact O-N 3.41Å; Q76-H80 WeakPolarHBondContact O-CB 3.43Å |
| 77 | E | 86.7 | Confident | 87.8 | Confident | 25 Ų | 25 | 80.9 Ų | 80.9 | 12% | 0.117 | 40% | 0.4 | C | S | . | . | I | π-helix | trans | -85.2 | -27.9 | -174.3 | -62.9 | -60.9 | 155.1 | 0 | 0 | 113 | I73 K81 Q205 I209 Q213 | I73-E77 HydrophobicContact CG2-CG 4.14Å; I73-E77 VanDerWaalsContact O-CB 3.3Å; I73-E77 WeakPolarHBondContact O-CB 3.45Å; I73-E77 WeakPolarHBondContact O-CG 3.41Å; I73-E77 PolarHBondContact O-N 2.9Å; E77-K81 VanDerWaalsContact CD-NZ 3.27Å; E77-K81 IonicContact OE1-NZ 3.6Å; E77-K81 PolarHBondContact OE1-NZ 2.81Å; E77-K81 WeakPolarHBondContact OE2-CD 3.28Å; E77-K81 IonicContact OE2-NZ 3.96Å; E77-K81 PolarHBondContact OE2-NZ 2.94Å; E77-Q205 WeakPolarHBondContact OE2-CG 3.14Å; E77-Q205 PolarHBondContact OE2-NE2 3.4Å; E77-I209 HydrophobicContact CB-CG2 3.73Å; E77-I209 HydrophobicContact CG-CD1 4.16Å; E77-I209 HydrophobicContact CG-CG2 4.39Å; E77-Q213 PolarHBondContact O-NE2 3.43Å |
| 78 | I | 86.3 | Confident | 87.9 | Confident | 30 Ų | 30 | 74.8 Ų | 74.8 | 15% | 0.154 | 37% | 0.37 | C | S | . | . | I | π-helix | trans | -91.3 | -55 | 178 | -60.4 | 170 | 0 | 0 | 0 | 111.2 | L74 T85 I212 Q213 M216 | L74-I78 HydrophobicContact CB-CD1 4.34Å; L74-I78 HydrophobicContact CD2-CD1 3.99Å; L74-I78 WeakPolarHBondContact O-CB 3.14Å; L74-I78 WeakPolarHBondContact O-CG1 3.31Å; L74-I78 PolarHBondContact O-N 3.01Å; I78-T85 PolarHBondContact O-OG1 2.91Å; I78-I212 HydrophobicContact CD1-CG2 3.92Å; I78-Q213 HydrophobicContact CG1-CG 4.25Å; I78-M216 HydrophobicContact CB-CE 4.49Å; I78-M216 HydrophobicContact CD1-CE 3.87Å; I78-M216 HydrophobicContact CD1-SD 4.4Å; I78-M216 HydrophobicContact CG1-CE 4.04Å; I78-M216 HydrophobicContact CG2-CE 3.66Å; I78-M216 HydrophobicContact CG2-SD 4.32Å |
| 79 | L | 84.6 | Confident | 88.1 | Confident | 119 Ų | 119 | 64.8 Ų | 64.8 | 62% | 0.623 | 34% | 0.335 | S | S | * | . | I | π-helix | trans | -86.4 | -37.2 | -170 | -63.9 | 170.2 | 0 | 0 | 0 | 113.1 | R75 | R75-L79 HydrophobicContact CG-CD1 4.1Å; R75-L79 WeakPolarHBondContact O-CB 3.44Å; R75-L79 PolarHBondContact O-N 3.28Å; R75-L79 VanDerWaalsContact O-N 3.1Å |
| 80 | H | 85.4 | Confident | 88.4 | Confident | 136 Ų | 136 | 67 Ų | 67 | 63% | 0.63 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -85.9 | -8.6 | -177.8 | -65.2 | 73.3 | 0 | 0 | 0 | 113.6 | R75 Q76 P82 | R75-H80 PolarHBondContact O-N 3.49Å; R75-H80 PolarHBondContact O-ND1 3.34Å; Q76-H80 WeakPolarHBondContact O-CB 3.43Å; H80-P82 WeakPolarHBondContact O-CD 3.36Å |
| 81 | K | 87.7 | Confident | 88.6 | Confident | 66 Ų | 66 | 66.1 Ų | 66.1 | 29% | 0.287 | 34% | 0.338 | S | S | . | . | trans | -121.5 | 60.7 | 174 | -63.6 | -178.8 | -174.4 | 166.5 | 0 | 111.6 | E77 V83 E84 T85 | E77-K81 VanDerWaalsContact CD-NZ 3.27Å; E77-K81 IonicContact OE1-NZ 3.6Å; E77-K81 PolarHBondContact OE1-NZ 2.81Å; E77-K81 WeakPolarHBondContact OE2-CD 3.28Å; E77-K81 IonicContact OE2-NZ 3.96Å; E77-K81 PolarHBondContact OE2-NZ 2.94Å; K81-V83 VanDerWaalsContact C-N 3.29Å; K81-V83 PolarHBondContact O-N 3.4Å; K81-E84 HydrophobicContact CB-CB 4.24Å; K81-E84 HydrophobicContact CB-CG 4.44Å; K81-E84 PolarHBondContact O-N 2.97Å; K81-T85 PolarHBondContact O-N 3.16Å; K81-T85 VanDerWaalsContact O-N 3.08Å; K81-T85 PolarHBondContact O-OG1 3.49Å | ||
| 82 | P | 86.1 | Confident | 88.6 | Confident | 81 Ų | 81 | 62 Ų | 62 | 53% | 0.526 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.2 | -34.9 | -173.5 | 26.4 | -34.8 | 0 | 0 | 0 | 112.4 | H80 T85 L86 | H80-P82 WeakPolarHBondContact O-CD 3.36Å; P82-T85 PolarHBondContact O-N 2.93Å; P82-L86 VanDerWaalsContact O-CB 3.26Å; P82-L86 WeakPolarHBondContact O-CB 3.3Å; P82-L86 PolarHBondContact O-N 3.46Å |
| 83 | V | 87 | Confident | 88.7 | Confident | 102 Ų | 102 | 59.9 Ų | 59.9 | 62% | 0.618 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -65.4 | -41.8 | 178.8 | -180 | 0 | 0 | 0 | 0 | 111.5 | K81 L86 K87 | K81-V83 VanDerWaalsContact C-N 3.29Å; K81-V83 PolarHBondContact O-N 3.4Å; V83-L86 PolarHBondContact O-N 3.31Å; V83-K87 WeakPolarHBondContact O-CG 3.46Å; V83-K87 PolarHBondContact O-N 3.27Å; V83-K87 VanDerWaalsContact O-N 3.1Å |
| 84 | E | 85.2 | Confident | 89 | Confident | 63 Ų | 63 | 60.1 Ų | 60.1 | 29% | 0.294 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -69.6 | -38 | 177.4 | -67.7 | -167.6 | -162.6 | 0 | 0 | 112.3 | K81 K87 Q205 R210 | K81-E84 HydrophobicContact CB-CB 4.24Å; K81-E84 HydrophobicContact CB-CG 4.44Å; K81-E84 PolarHBondContact O-N 2.97Å; E84-K87 PolarHBondContact O-N 3.47Å; E84-Q205 PolarHBondContact OE2-NE2 3.47Å; E84-R210 IonicContact OE2-CZ 2.8Å; E84-R210 IonicContact OE2-NH1 2.91Å; E84-R210 IonicContact OE2-NH2 3.62Å; E84-R210 PolarHBondContact OE2-NH2 3.19Å |
| 85 | T | 87.2 | Confident | 89.1 | Confident | 12 Ų | 12 | 61.4 Ų | 61.4 | 7% | 0.074 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.6 | -46.4 | 173.3 | -62 | 0 | 0 | 0 | 0 | 110.1 | I78 K81 P82 K87 L88 Q213 F217 | I78-T85 PolarHBondContact O-OG1 2.91Å; K81-T85 PolarHBondContact O-N 3.16Å; K81-T85 VanDerWaalsContact O-N 3.08Å; K81-T85 PolarHBondContact O-OG1 3.49Å; P82-T85 PolarHBondContact O-N 2.93Å; T85-K87 VanDerWaalsContact C-N 3.28Å; T85-K87 PolarHBondContact O-N 2.85Å; T85-L88 WeakPolarHBondContact O-CB 3.47Å; T85-L88 PolarHBondContact O-N 2.96Å; T85-Q213 HydrophobicContact CG2-CB 4.39Å; T85-Q213 HydrophobicContact CG2-CG 4.12Å; T85-Q213 PolarHBondContact OG1-NE2 2.88Å; T85-F217 HydrophobicContact CG2-CE2 3.68Å; T85-F217 HydrophobicContact CG2-CZ 3.95Å; T85-F217 WeakPolarHBondContact O-CE2 3.29Å |
| 86 | L | 89.3 | Confident | 89 | Confident | 109 Ų | 109 | 56.7 Ų | 56.7 | 57% | 0.571 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -63.6 | -30.2 | -179.7 | -170.9 | 64.4 | 0 | 0 | 0 | 113 | P82 V83 L88 A89 | P82-L86 VanDerWaalsContact O-CB 3.26Å; P82-L86 WeakPolarHBondContact O-CB 3.3Å; P82-L86 PolarHBondContact O-N 3.46Å; V83-L86 PolarHBondContact O-N 3.31Å; L86-L88 PolarHBondContact O-N 2.9Å; L86-A89 HydrophobicContact CD1-CB 4.07Å; L86-A89 WeakPolarHBondContact O-CB 3.43Å; L86-A89 PolarHBondContact O-N 3.46Å |
| 87 | K | 91.6 | Very high | 89 | Confident | 97 Ų | 97 | 56.4 Ų | 56.4 | 42% | 0.422 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -57 | -30.9 | 171.9 | -73.8 | 174.7 | -176.5 | 179 | 0 | 112.3 | V83 E84 T85 A89 I90 P91 Y195 I199 | V83-K87 WeakPolarHBondContact O-CG 3.46Å; V83-K87 PolarHBondContact O-N 3.27Å; V83-K87 VanDerWaalsContact O-N 3.1Å; E84-K87 PolarHBondContact O-N 3.47Å; T85-K87 VanDerWaalsContact C-N 3.28Å; T85-K87 PolarHBondContact O-N 2.85Å; K87-A89 VanDerWaalsContact C-N 3.33Å; K87-I90 WeakPolarHBondContact O-CB 3.37Å; K87-I90 PolarHBondContact O-N 3Å; K87-P91 WeakPolarHBondContact O-CD 3.38Å; K87-Y195 WeakPolarHBondContact O-CE1 3.33Å; K87-I199 HydrophobicContact CB-CD1 3.97Å |
| 88 | L | 90.9 | Very high | 89.3 | Confident | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -79.9 | -13.6 | 176.9 | -68.8 | 166.4 | 0 | 0 | 0 | 113.8 | T85 L86 I90 P91 S92 F196 I199 R210 Q213 L214 | T85-L88 WeakPolarHBondContact O-CB 3.47Å; T85-L88 PolarHBondContact O-N 2.96Å; L86-L88 PolarHBondContact O-N 2.9Å; L88-I90 PolarHBondContact O-N 3Å; L88-P91 HydrophobicContact CD2-CG 4.41Å; L88-P91 VanDerWaalsContact O-CD 3.31Å; L88-P91 WeakPolarHBondContact O-CD 3.5Å; L88-P91 WeakPolarHBondContact O-CG 3.31Å; L88-S92 WeakPolarHBondContact O-CB 3.47Å; L88-S92 PolarHBondContact O-N 3.36Å; L88-F196 HydrophobicContact CD2-CD2 3.67Å; L88-F196 HydrophobicContact CD2-CE2 3.77Å; L88-I199 HydrophobicContact CD2-CB 4.49Å; L88-I199 HydrophobicContact CD2-CD1 4.06Å; L88-I199 HydrophobicContact CD2-CG2 3.94Å; L88-I199 HydrophobicContact CG-CG2 4.41Å; L88-R210 HydrophobicContact CD1-CB 4.48Å; L88-R210 WeakPolarHBondContact CD1-O 3.25Å; L88-Q213 HydrophobicContact CD1-CB 3.29Å; L88-Q213 HydrophobicContact CD1-CG 4.21Å; L88-L214 HydrophobicContact CB-CD1 4.46Å; L88-L214 HydrophobicContact CD2-CD1 4.45Å; L88-L214 WeakPolarHBondContact O-CD1 3.37Å |
| 89 | A | 92.1 | Very high | 89.4 | Confident | 14 Ų | 14 | 58.2 Ų | 58.2 | 12% | 0.116 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.6 | -32 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L86 K87 S92 G93 F217 | L86-A89 HydrophobicContact CD1-CB 4.07Å; L86-A89 WeakPolarHBondContact O-CB 3.43Å; L86-A89 PolarHBondContact O-N 3.46Å; K87-A89 VanDerWaalsContact C-N 3.33Å; A89-S92 PolarHBondContact O-N 3.36Å; A89-G93 PolarHBondContact O-N 3.3Å; A89-F217 HydrophobicContact CB-CB 4.49Å; A89-F217 HydrophobicContact CB-CD1 3.62Å; A89-F217 HydrophobicContact CB-CD2 3.91Å; A89-F217 HydrophobicContact CB-CE1 3.7Å; A89-F217 HydrophobicContact CB-CE2 4.01Å; A89-F217 HydrophobicContact CB-CG 3.73Å; A89-F217 HydrophobicContact CB-CZ 3.9Å |
| 90 | I | 93.3 | Very high | 89.6 | Confident | 74 Ų | 74 | 54.5 Ų | 54.5 | 38% | 0.379 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.1 | -60.6 | 178.8 | -58.5 | 171.2 | 0 | 0 | 0 | 111.6 | K87 L88 S92 G93 I94 F191 Y195 | K87-I90 WeakPolarHBondContact O-CB 3.37Å; K87-I90 PolarHBondContact O-N 3Å; L88-I90 PolarHBondContact O-N 3Å; I90-S92 VanDerWaalsContact C-N 3.28Å; I90-S92 PolarHBondContact O-N 3.32Å; I90-G93 PolarHBondContact O-N 3.41Å; I90-I94 HydrophobicContact CG2-CD1 3.74Å; I90-I94 WeakPolarHBondContact O-CB 3.44Å; I90-I94 WeakPolarHBondContact O-CG1 3Å; I90-I94 PolarHBondContact O-N 3.45Å; I90-F191 HydrophobicContact CG2-CE1 4.37Å; I90-Y195 HydrophobicContact CB-CE1 4.15Å; I90-Y195 HydrophobicContact CD1-CE1 4.35Å; I90-Y195 HydrophobicContact CG2-CE1 4.32Å |
| 91 | P | 92.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.4 | -37 | 179.4 | 24.3 | -33.1 | 0 | 0 | 0 | 111.7 | K87 L88 I94 Y95 A192 Y195 F196 L214 | K87-P91 WeakPolarHBondContact O-CD 3.38Å; L88-P91 HydrophobicContact CD2-CG 4.41Å; L88-P91 VanDerWaalsContact O-CD 3.31Å; L88-P91 WeakPolarHBondContact O-CD 3.5Å; L88-P91 WeakPolarHBondContact O-CG 3.31Å; P91-I94 PolarHBondContact O-N 3.05Å; P91-Y95 HydrophobicContact CB-CE2 4.29Å; P91-Y95 WeakPolarHBondContact O-CD2 3.49Å; P91-Y95 PolarHBondContact O-N 3.39Å; P91-A192 HydrophobicContact CB-CB 4.26Å; P91-Y195 HydrophobicContact CB-CD1 4.42Å; P91-Y195 HydrophobicContact CG-CD1 4.15Å; P91-F196 HydrophobicContact CB-CB 4.29Å; P91-L214 HydrophobicContact CB-CD1 4.42Å; P91-L214 HydrophobicContact CG-CD1 3.92Å |
| 92 | S | 90.8 | Very high | 89.9 | Confident | 7 Ų | 7 | 47.2 Ų | 47.2 | 5% | 0.049 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.4 | -48.7 | 177.4 | -172.8 | 0 | 0 | 0 | 0 | 112.5 | L88 A89 I90 I94 Y95 T96 G218 F221 | L88-S92 WeakPolarHBondContact O-CB 3.47Å; L88-S92 PolarHBondContact O-N 3.36Å; A89-S92 PolarHBondContact O-N 3.36Å; I90-S92 VanDerWaalsContact C-N 3.28Å; I90-S92 PolarHBondContact O-N 3.32Å; S92-I94 VanDerWaalsContact C-N 3.34Å; S92-I94 PolarHBondContact O-N 2.78Å; S92-Y95 PolarHBondContact O-N 2.98Å; S92-T96 PolarHBondContact O-N 2.95Å; S92-T96 PolarHBondContact O-OG1 2.7Å; S92-G218 VanDerWaalsContact OG-CA 3.28Å; S92-G218 WeakPolarHBondContact OG-CA 3.31Å; S92-G218 PolarHBondContact OG-N 2.91Å; S92-F221 WeakPolarHBondContact OG-CD2 3.39Å |
| 93 | G | 91.6 | Very high | 89.9 | Confident | 23 Ų | 23 | 50.7 Ų | 50.7 | 24% | 0.237 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65 | -38.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | A89 I90 T96 L97 | A89-G93 PolarHBondContact O-N 3.3Å; I90-G93 PolarHBondContact O-N 3.41Å; G93-T96 PolarHBondContact O-N 3.06Å; G93-L97 WeakPolarHBondContact O-CB 3.38Å; G93-L97 PolarHBondContact O-N 3.46Å |
| 94 | I | 93.8 | Very high | 89.9 | Confident | 34 Ų | 34 | 48.6 Ų | 48.6 | 17% | 0.174 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.9 | -38.7 | 175.6 | -66.1 | 173.2 | 0 | 0 | 0 | 111.5 | I90 P91 S92 T96 L97 Q98 S188 F191 A192 | I90-I94 HydrophobicContact CG2-CD1 3.74Å; I90-I94 WeakPolarHBondContact O-CB 3.44Å; I90-I94 WeakPolarHBondContact O-CG1 3Å; I90-I94 PolarHBondContact O-N 3.45Å; P91-I94 PolarHBondContact O-N 3.05Å; S92-I94 VanDerWaalsContact C-N 3.34Å; S92-I94 PolarHBondContact O-N 2.78Å; I94-T96 VanDerWaalsContact C-N 3.34Å; I94-L97 PolarHBondContact O-N 3.15Å; I94-Q98 VanDerWaalsContact O-CB 3.26Å; I94-Q98 WeakPolarHBondContact O-CB 3.26Å; I94-Q98 PolarHBondContact O-N 2.94Å; I94-S188 VanDerWaalsContact CG2-O 3.3Å; I94-S188 WeakPolarHBondContact CG2-O 3.5Å; I94-F191 HydrophobicContact CD1-CD1 3.51Å; I94-F191 HydrophobicContact CD1-CE1 3.57Å; I94-A192 HydrophobicContact CB-CB 3.99Å; I94-A192 HydrophobicContact CG2-CB 3.71Å |
| 95 | Y | 90.4 | Very high | 90.1 | Very high | 59 Ų | 59 | 45.6 Ų | 45.6 | 23% | 0.231 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.8 | -39.4 | 173.5 | -73.1 | -49.5 | 0 | 0 | 0 | 112.1 | P91 S92 Q98 N99 A192 G193 | P91-Y95 HydrophobicContact CB-CE2 4.29Å; P91-Y95 WeakPolarHBondContact O-CD2 3.49Å; P91-Y95 PolarHBondContact O-N 3.39Å; S92-Y95 PolarHBondContact O-N 2.98Å; Y95-Q98 WeakPolarHBondContact O-CB 3.36Å; Y95-Q98 PolarHBondContact O-N 3.3Å; Y95-N99 PolarHBondContact O-N 3.02Å; Y95-N99 PolarHBondContact O-ND2 3.45Å; Y95-A192 HydrophobicContact CD1-CB 4.06Å; Y95-A192 HydrophobicContact CE1-CB 3.74Å; Y95-A192 HydrophobicContact CE2-CB 4.22Å; Y95-A192 HydrophobicContact CG-CB 4.44Å; Y95-G193 WeakPolarHBondContact OH-CA 3.33Å; Y95-G193 PolarHBondContact OH-N 3.18Å |
| 96 | T | 87.8 | Confident | 90 | Very high | 39 Ų | 39 | 48.8 Ų | 48.8 | 24% | 0.239 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64.3 | -46.7 | 174.5 | -58.1 | 0 | 0 | 0 | 0 | 111.5 | S92 G93 I94 Q98 N99 N100 F221 | S92-T96 PolarHBondContact O-N 2.95Å; S92-T96 PolarHBondContact O-OG1 2.7Å; G93-T96 PolarHBondContact O-N 3.06Å; I94-T96 VanDerWaalsContact C-N 3.34Å; T96-Q98 VanDerWaalsContact C-N 3.32Å; T96-Q98 PolarHBondContact O-N 2.89Å; T96-N99 PolarHBondContact O-N 2.71Å; T96-N100 PolarHBondContact O-N 2.73Å; T96-N100 PolarHBondContact O-ND2 3.06Å; T96-F221 HydrophobicContact CG2-CB 4.22Å; T96-F221 WeakPolarHBondContact OG1-CB 3.47Å |
| 97 | L | 88.3 | Confident | 89.8 | Confident | 94 Ų | 94 | 47.4 Ų | 47.4 | 49% | 0.492 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -59.1 | -45 | 175.2 | 178 | 63.4 | 0 | 0 | 0 | 111.2 | G93 I94 N99 N100 L101 | G93-L97 WeakPolarHBondContact O-CB 3.38Å; G93-L97 PolarHBondContact O-N 3.46Å; I94-L97 PolarHBondContact O-N 3.15Å; L97-N99 VanDerWaalsContact C-N 3.33Å; L97-N99 PolarHBondContact O-N 2.88Å; L97-N100 PolarHBondContact O-N 3.48Å; L97-L101 HydrophobicContact CD1-CD1 4.44Å; L97-L101 HydrophobicContact CD1-CG 4.34Å; L97-L101 HydrophobicContact CG-CD1 4.05Å; L97-L101 HydrophobicContact CG-CG 4.4Å; L97-L101 WeakPolarHBondContact O-CG 3.21Å; L97-L101 PolarHBondContact O-N 2.94Å |
| 98 | Q | 92.5 | Very high | 89.5 | Confident | 8 Ų | 8 | 44.6 Ų | 44.6 | 4% | 0.037 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -54.1 | -50.1 | 176 | 179.6 | -172.1 | -15.5 | 0 | 0 | 110.7 | I94 Y95 T96 N100 L101 L102 Y118 A185 S189 | I94-Q98 VanDerWaalsContact O-CB 3.26Å; I94-Q98 WeakPolarHBondContact O-CB 3.26Å; I94-Q98 PolarHBondContact O-N 2.94Å; Y95-Q98 WeakPolarHBondContact O-CB 3.36Å; Y95-Q98 PolarHBondContact O-N 3.3Å; T96-Q98 VanDerWaalsContact C-N 3.32Å; T96-Q98 PolarHBondContact O-N 2.89Å; Q98-N100 VanDerWaalsContact C-N 3.3Å; Q98-N100 PolarHBondContact O-N 3.42Å; Q98-L101 PolarHBondContact O-N 2.94Å; Q98-L102 HydrophobicContact CG-CD1 4.28Å; Q98-L102 HydrophobicContact CG-CG 4.47Å; Q98-L102 WeakPolarHBondContact O-CG 3.4Å; Q98-L102 PolarHBondContact O-N 3.24Å; Q98-Y118 PolarHBondContact NE2-OH 3.33Å; Q98-Y118 VanDerWaalsContact NE2-OH 3.1Å; Q98-A185 HydrophobicContact CG-CB 4.14Å; Q98-S189 PolarHBondContact NE2-OG 2.91Å; Q98-S189 VanDerWaalsContact OE1-CA 3.22Å; Q98-S189 PolarHBondContact OE1-OG 2.77Å |
| 99 | N | 88.8 | Confident | 89.3 | Confident | 86 Ų | 86 | 44.9 Ų | 44.9 | 46% | 0.46 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -57.9 | -43.6 | -179.6 | -71.8 | -26.1 | 0 | 0 | 0 | 111.7 | Y95 T96 L97 L102 Y103 | Y95-N99 PolarHBondContact O-N 3.02Å; Y95-N99 PolarHBondContact O-ND2 3.45Å; T96-N99 PolarHBondContact O-N 2.71Å; L97-N99 VanDerWaalsContact C-N 3.33Å; L97-N99 PolarHBondContact O-N 2.88Å; N99-L102 PolarHBondContact O-N 2.86Å; N99-Y103 WeakPolarHBondContact O-CD2 3.31Å; N99-Y103 PolarHBondContact O-N 2.94Å; N99-Y103 VanDerWaalsContact O-N 3.16Å |
| 100 | N | 88.6 | Confident | 89 | Confident | 41 Ų | 41 | 47.3 Ų | 47.3 | 22% | 0.219 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.3 | -42.3 | 176.9 | -69.5 | -52 | 0 | 0 | 0 | 112.5 | T96 L97 Q98 L102 Y103 V104 Y229 | T96-N100 PolarHBondContact O-N 2.73Å; T96-N100 PolarHBondContact O-ND2 3.06Å; L97-N100 PolarHBondContact O-N 3.48Å; Q98-N100 VanDerWaalsContact C-N 3.3Å; Q98-N100 PolarHBondContact O-N 3.42Å; N100-L102 VanDerWaalsContact C-N 3.27Å; N100-L102 PolarHBondContact O-N 3.44Å; N100-Y103 WeakPolarHBondContact O-CB 3.3Å; N100-Y103 PolarHBondContact O-N 3.49Å; N100-Y103 VanDerWaalsContact O-N 3.14Å; N100-V104 WeakPolarHBondContact O-CG2 3.44Å; N100-V104 PolarHBondContact O-N 3.24Å; N100-Y229 WeakPolarHBondContact OD1-CE2 3.46Å; N100-Y229 VanDerWaalsContact OD1-CZ 3.27Å; N100-Y229 PolarHBondContact OD1-OH 3.43Å |
| 101 | L | 90.9 | Very high | 88.4 | Confident | 33 Ų | 33 | 46.5 Ų | 46.5 | 17% | 0.173 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62 | -35.1 | 175.3 | -69.3 | 172.2 | 0 | 0 | 0 | 112.1 | L97 Q98 V104 A105 A181 V184 A185 | L97-L101 HydrophobicContact CD1-CD1 4.44Å; L97-L101 HydrophobicContact CD1-CG 4.34Å; L97-L101 HydrophobicContact CG-CD1 4.05Å; L97-L101 HydrophobicContact CG-CG 4.4Å; L97-L101 WeakPolarHBondContact O-CG 3.21Å; L97-L101 PolarHBondContact O-N 2.94Å; Q98-L101 PolarHBondContact O-N 2.94Å; L101-V104 PolarHBondContact O-N 3.27Å; L101-A105 VanDerWaalsContact O-CB 3.32Å; L101-A105 WeakPolarHBondContact O-CB 3.3Å; L101-A105 PolarHBondContact O-N 2.89Å; L101-A181 HydrophobicContact CD2-CB 4.39Å; L101-V184 HydrophobicContact CD1-CB 4.02Å; L101-V184 HydrophobicContact CD1-CG1 3.53Å; L101-A185 HydrophobicContact CB-CB 3.89Å; L101-A185 HydrophobicContact CD1-CB 4.4Å |
| 102 | L | 90.1 | Very high | 88 | Confident | 16 Ų | 16 | 47.4 Ų | 47.4 | 8% | 0.084 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.9 | -35.8 | 174.7 | -64.8 | 176.2 | 0 | 0 | 0 | 112.3 | Q98 N99 N100 A105 L106 Y114 Y118 A185 | Q98-L102 HydrophobicContact CG-CD1 4.28Å; Q98-L102 HydrophobicContact CG-CG 4.47Å; Q98-L102 WeakPolarHBondContact O-CG 3.4Å; Q98-L102 PolarHBondContact O-N 3.24Å; N99-L102 PolarHBondContact O-N 2.86Å; N100-L102 VanDerWaalsContact C-N 3.27Å; N100-L102 PolarHBondContact O-N 3.44Å; L102-A105 PolarHBondContact O-N 2.95Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 WeakPolarHBondContact O-CG 3.44Å; L102-L106 PolarHBondContact O-N 3.38Å; L102-Y114 HydrophobicContact CD2-CE2 3.97Å; L102-Y118 HydrophobicContact CD1-CE2 3.97Å; L102-Y118 HydrophobicContact CD2-CD2 3.61Å; L102-Y118 HydrophobicContact CD2-CE2 3.45Å; L102-Y118 VanDerWaalsContact CD2-CE2 3.45Å; L102-Y118 HydrophobicContact CD2-CG 4.38Å; L102-Y118 HydrophobicContact CG-CE2 4.32Å; L102-A185 HydrophobicContact CD2-CB 3.71Å; L102-A185 HydrophobicContact CG-CB 4.16Å |
| 103 | Y | 85.8 | Confident | 87.8 | Confident | 153 Ų | 153 | 49.2 Ų | 49.2 | 60% | 0.6 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -65.2 | -44.1 | 172.2 | -80.8 | -74.1 | 0 | 0 | 0 | 112.2 | N99 N100 A105 L106 S107 | N99-Y103 WeakPolarHBondContact O-CD2 3.31Å; N99-Y103 PolarHBondContact O-N 2.94Å; N99-Y103 VanDerWaalsContact O-N 3.16Å; N100-Y103 WeakPolarHBondContact O-CB 3.3Å; N100-Y103 PolarHBondContact O-N 3.49Å; N100-Y103 VanDerWaalsContact O-N 3.14Å; Y103-A105 VanDerWaalsContact C-N 3.31Å; Y103-A105 PolarHBondContact O-N 2.84Å; Y103-L106 PolarHBondContact O-N 3.15Å; Y103-S107 WeakPolarHBondContact O-CB 3.35Å; Y103-S107 PolarHBondContact O-N 2.96Å; Y103-S107 PolarHBondContact O-OG 3.22Å |
| 104 | V | 86.8 | Confident | 87.6 | Confident | 59 Ų | 59 | 49.1 Ų | 49.1 | 36% | 0.358 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -59.4 | -46.2 | 174.8 | 174.2 | 0 | 0 | 0 | 0 | 110 | N100 L101 S107 N108 V177 A181 | N100-V104 WeakPolarHBondContact O-CG2 3.44Å; N100-V104 PolarHBondContact O-N 3.24Å; L101-V104 PolarHBondContact O-N 3.27Å; V104-S107 PolarHBondContact O-N 2.87Å; V104-N108 WeakPolarHBondContact O-CB 3.21Å; V104-N108 PolarHBondContact O-N 3.12Å; V104-N108 VanDerWaalsContact O-N 3.17Å; V104-N108 PolarHBondContact O-ND2 3.24Å; V104-V177 HydrophobicContact CG1-CG1 4.12Å; V104-A181 HydrophobicContact CB-CB 4.31Å; V104-A181 HydrophobicContact CG1-CB 4.01Å |
| 105 | A | 89.3 | Confident | 87.2 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60 | -49.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L101 L102 Y103 S107 N108 L109 Y114 A181 V182 | L101-A105 VanDerWaalsContact O-CB 3.32Å; L101-A105 WeakPolarHBondContact O-CB 3.3Å; L101-A105 PolarHBondContact O-N 2.89Å; L102-A105 PolarHBondContact O-N 2.95Å; Y103-A105 VanDerWaalsContact C-N 3.31Å; Y103-A105 PolarHBondContact O-N 2.84Å; A105-S107 PolarHBondContact O-N 3.47Å; A105-N108 PolarHBondContact O-N 3.47Å; A105-N108 VanDerWaalsContact O-N 3.11Å; A105-L109 WeakPolarHBondContact O-CB 3.28Å; A105-L109 PolarHBondContact O-N 3.32Å; A105-Y114 HydrophobicContact CB-CD2 3.9Å; A105-Y114 HydrophobicContact CB-CE2 3.98Å; A105-A181 HydrophobicContact CB-CB 4.23Å; A105-V182 HydrophobicContact CB-CB 4.4Å; A105-V182 HydrophobicContact CB-CG2 3.2Å |
| 106 | L | 85 | Confident | 87.1 | Confident | 79 Ų | 79 | 49.6 Ų | 49.6 | 41% | 0.414 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61.4 | -31.5 | 178.2 | -77.8 | 169.1 | 0 | 0 | 0 | 112.9 | L102 Y103 N108 Y114 | L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 WeakPolarHBondContact O-CG 3.44Å; L102-L106 PolarHBondContact O-N 3.38Å; Y103-L106 PolarHBondContact O-N 3.15Å; L106-N108 VanDerWaalsContact C-N 3.33Å; L106-Y114 HydrophobicContact CD1-CE2 4.5Å; L106-Y114 HydrophobicContact CD2-CD1 3.53Å; L106-Y114 HydrophobicContact CD2-CD2 3.88Å; L106-Y114 HydrophobicContact CD2-CE1 3.6Å; L106-Y114 HydrophobicContact CD2-CE2 3.94Å; L106-Y114 HydrophobicContact CD2-CG 3.67Å; L106-Y114 HydrophobicContact CG-CD1 4.38Å; L106-Y114 HydrophobicContact CG-CD2 3.99Å; L106-Y114 HydrophobicContact CG-CE1 4.14Å; L106-Y114 HydrophobicContact CG-CE2 3.71Å; L106-Y114 HydrophobicContact CG-CG 4.31Å |
| 107 | S | 85.1 | Confident | 87.2 | Confident | 79 Ų | 79 | 48.8 Ų | 48.8 | 55% | 0.552 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -72.1 | -31 | 177.9 | -56.9 | 0 | 0 | 0 | 0 | 111.9 | Y103 V104 A105 R170 | Y103-S107 WeakPolarHBondContact O-CB 3.35Å; Y103-S107 PolarHBondContact O-N 2.96Å; Y103-S107 PolarHBondContact O-OG 3.22Å; V104-S107 PolarHBondContact O-N 2.87Å; A105-S107 PolarHBondContact O-N 3.47Å; S107-R170 PolarHBondContact O-NH2 3.11Å |
| 108 | N | 86.2 | Confident | 87.4 | Confident | 39 Ų | 39 | 45.9 Ų | 45.9 | 21% | 0.209 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -106.6 | -17 | -171.7 | -73.2 | -74.6 | 0 | 0 | 0 | 114.8 | V104 A105 L106 S174 | V104-N108 WeakPolarHBondContact O-CB 3.21Å; V104-N108 PolarHBondContact O-N 3.12Å; V104-N108 VanDerWaalsContact O-N 3.17Å; V104-N108 PolarHBondContact O-ND2 3.24Å; A105-N108 PolarHBondContact O-N 3.47Å; A105-N108 VanDerWaalsContact O-N 3.11Å; L106-N108 VanDerWaalsContact C-N 3.33Å; N108-S174 WeakPolarHBondContact CB-O 3.12Å |
| 109 | L | 85.6 | Confident | 87.4 | Confident | 5 Ų | 5 | 45.7 Ų | 45.7 | 3% | 0.026 | 25% | 0.25 | C | S | . | . | S | Bend | trans | -111.6 | 153.4 | 178.2 | -62.7 | 180 | 0 | 0 | 0 | 111.7 | A105 T113 R170 Q175 V179 V182 | A105-L109 WeakPolarHBondContact O-CB 3.28Å; A105-L109 PolarHBondContact O-N 3.32Å; L109-T113 HydrophobicContact CD1-CG2 4.39Å; L109-T113 HydrophobicContact CD2-CG2 4.27Å; L109-R170 PolarHBondContact O-NH1 3.13Å; L109-R170 PolarHBondContact O-NH2 3.09Å; L109-Q175 HydrophobicContact CD2-CG 3.96Å; L109-V179 HydrophobicContact CD1-CG2 4.46Å; L109-V179 HydrophobicContact CD2-CG2 3.81Å; L109-V182 HydrophobicContact CD1-CG2 3.58Å |
| 110 | D | 85.4 | Confident | 87.6 | Confident | 65 Ų | 65 | 44.1 Ų | 44.1 | 35% | 0.348 | 24% | 0.242 | S | C | . | . | trans | -71.3 | 161.4 | 165.4 | 67.2 | -76.8 | 0 | 0 | 0 | 109.9 | A112 T113 Y114 | D110-A112 VanDerWaalsContact C-N 3.3Å; D110-A112 PolarHBondContact O-N 3.25Å; D110-A112 WeakPolarHBondContact OD2-CB 3.44Å; D110-A112 PolarHBondContact OD2-N 3.34Å; D110-T113 VanDerWaalsContact CG-OG1 3.3Å; D110-T113 WeakPolarHBondContact OD1-CB 3.27Å; D110-T113 PolarHBondContact OD1-OG1 2.89Å; D110-T113 PolarHBondContact OD2-N 2.96Å; D110-T113 PolarHBondContact OD2-OG1 2.98Å; D110-Y114 VanDerWaalsContact O-CB 3.31Å; D110-Y114 WeakPolarHBondContact O-CB 3.21Å; D110-Y114 PolarHBondContact O-N 2.77Å | ||
| 111 | A | 81.3 | Confident | 87.8 | Confident | 57 Ų | 57 | 44.7 Ų | 44.7 | 47% | 0.471 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.9 | -36.8 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q115 P158 | A111-Q115 WeakPolarHBondContact O-CB 3.4Å; A111-Q115 WeakPolarHBondContact O-CG 3.44Å; A111-Q115 PolarHBondContact O-N 2.93Å; A111-P158 HydrophobicContact CB-CG 3.99Å |
| 112 | A | 83.7 | Confident | 87.8 | Confident | 19 Ų | 19 | 43.9 Ų | 43.9 | 16% | 0.157 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -68.7 | -52.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | D110 Y114 Q115 V116 W157 P158 | D110-A112 VanDerWaalsContact C-N 3.3Å; D110-A112 PolarHBondContact O-N 3.25Å; D110-A112 WeakPolarHBondContact OD2-CB 3.44Å; D110-A112 PolarHBondContact OD2-N 3.34Å; A112-Y114 VanDerWaalsContact C-N 3.31Å; A112-Y114 PolarHBondContact O-N 2.91Å; A112-Q115 PolarHBondContact O-N 3.45Å; A112-V116 WeakPolarHBondContact O-CG2 3.01Å; A112-V116 PolarHBondContact O-N 3.23Å; A112-W157 HydrophobicContact CB-CH2 4.37Å; A112-W157 HydrophobicContact CB-CZ2 4.3Å; A112-P158 HydrophobicContact CB-CG 3.88Å |
| 113 | T | 86.8 | Confident | 88 | Confident | 45 Ų | 45 | 44.8 Ų | 44.8 | 28% | 0.276 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -58.6 | -43.4 | 177.2 | -56.4 | 0 | 0 | 0 | 0 | 111.4 | L109 D110 T117 | L109-T113 HydrophobicContact CD1-CG2 4.39Å; L109-T113 HydrophobicContact CD2-CG2 4.27Å; D110-T113 VanDerWaalsContact CG-OG1 3.3Å; D110-T113 WeakPolarHBondContact OD1-CB 3.27Å; D110-T113 PolarHBondContact OD1-OG1 2.89Å; D110-T113 PolarHBondContact OD2-N 2.96Å; D110-T113 PolarHBondContact OD2-OG1 2.98Å; T113-T117 VanDerWaalsContact O-CB 3.23Å; T113-T117 WeakPolarHBondContact O-CB 3.4Å; T113-T117 PolarHBondContact O-N 2.91Å; T113-T117 PolarHBondContact O-OG1 2.88Å |
| 114 | Y | 88.3 | Confident | 88.4 | Confident | 22 Ų | 22 | 38.2 Ų | 38.2 | 9% | 0.086 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.5 | -50.5 | 175.6 | 171.6 | -93.9 | 0 | 0 | 0 | 112 | L102 A105 L106 D110 A112 V116 T117 Y118 V182 | L102-Y114 HydrophobicContact CD2-CE2 3.97Å; A105-Y114 HydrophobicContact CB-CD2 3.9Å; A105-Y114 HydrophobicContact CB-CE2 3.98Å; L106-Y114 HydrophobicContact CD1-CE2 4.5Å; L106-Y114 HydrophobicContact CD2-CD1 3.53Å; L106-Y114 HydrophobicContact CD2-CD2 3.88Å; L106-Y114 HydrophobicContact CD2-CE1 3.6Å; L106-Y114 HydrophobicContact CD2-CE2 3.94Å; L106-Y114 HydrophobicContact CD2-CG 3.67Å; L106-Y114 HydrophobicContact CG-CD1 4.38Å; L106-Y114 HydrophobicContact CG-CD2 3.99Å; L106-Y114 HydrophobicContact CG-CE1 4.14Å; L106-Y114 HydrophobicContact CG-CE2 3.71Å; L106-Y114 HydrophobicContact CG-CG 4.31Å; D110-Y114 VanDerWaalsContact O-CB 3.31Å; D110-Y114 WeakPolarHBondContact O-CB 3.21Å; D110-Y114 PolarHBondContact O-N 2.77Å; A112-Y114 VanDerWaalsContact C-N 3.31Å; A112-Y114 PolarHBondContact O-N 2.91Å; Y114-V116 PolarHBondContact O-N 3.25Å; Y114-T117 PolarHBondContact O-N 3.4Å; Y114-Y118 VanDerWaalsContact O-CB 3.26Å; Y114-Y118 WeakPolarHBondContact O-CB 3.48Å; Y114-Y118 PolarHBondContact O-N 3.42Å; Y114-V182 HydrophobicContact CD2-CG2 3.81Å; Y114-V182 HydrophobicContact CE2-CG2 4.23Å |
| 115 | Q | 84.5 | Confident | 88.8 | Confident | 54 Ų | 54 | 36.1 Ų | 36.1 | 25% | 0.252 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -64.9 | -42.2 | -174.2 | -72.1 | -71.5 | 44.9 | 0 | 0 | 112.3 | A111 A112 Q119 | A111-Q115 WeakPolarHBondContact O-CB 3.4Å; A111-Q115 WeakPolarHBondContact O-CG 3.44Å; A111-Q115 PolarHBondContact O-N 2.93Å; A112-Q115 PolarHBondContact O-N 3.45Å; Q115-Q119 WeakPolarHBondContact O-CG 3.49Å; Q115-Q119 PolarHBondContact O-NE2 3.38Å |
| 116 | V | 88.6 | Confident | 89 | Confident | 48 Ų | 48 | 36.1 Ų | 36.1 | 29% | 0.291 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -67 | -49.3 | 177.9 | 178.4 | 0 | 0 | 0 | 0 | 110.4 | A112 Y114 Y118 Q119 A153 W157 | A112-V116 WeakPolarHBondContact O-CG2 3.01Å; A112-V116 PolarHBondContact O-N 3.23Å; Y114-V116 PolarHBondContact O-N 3.25Å; V116-Y118 VanDerWaalsContact C-N 3.29Å; V116-Y118 PolarHBondContact O-N 3.18Å; V116-Q119 PolarHBondContact O-N 2.94Å; V116-A153 HydrophobicContact CG1-CB 4.46Å; V116-A153 HydrophobicContact CG2-CB 4.3Å; V116-W157 HydrophobicContact CG2-CE3 4Å; V116-W157 HydrophobicContact CG2-CZ3 3.6Å |
| 117 | T | 90.5 | Very high | 89.5 | Confident | 23 Ų | 23 | 37.1 Ų | 37.1 | 14% | 0.141 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.6 | -36.9 | -177.3 | -50.7 | 0 | 0 | 0 | 0 | 111.2 | T113 Y114 Q119 L120 V182 L183 | T113-T117 VanDerWaalsContact O-CB 3.23Å; T113-T117 WeakPolarHBondContact O-CB 3.4Å; T113-T117 PolarHBondContact O-N 2.91Å; T113-T117 PolarHBondContact O-OG1 2.88Å; Y114-T117 PolarHBondContact O-N 3.4Å; T117-Q119 PolarHBondContact O-N 3.32Å; T117-L120 WeakPolarHBondContact O-CB 3.4Å; T117-L120 WeakPolarHBondContact O-CD1 3.49Å; T117-L120 PolarHBondContact O-N 3.44Å; T117-L120 VanDerWaalsContact O-N 3.15Å; T117-V182 HydrophobicContact CG2-CB 3.97Å; T117-V182 HydrophobicContact CG2-CG1 3.6Å; T117-L183 HydrophobicContact CG2-CD2 4.14Å |
| 118 | Y | 91.2 | Very high | 90 | Very high | 33 Ų | 33 | 36 Ų | 36 | 13% | 0.129 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -66.3 | -22.4 | -178.9 | -172.8 | -131.1 | 0 | 0 | 0 | 113.5 | Q98 L102 Y114 V116 L120 K121 V182 C186 | Q98-Y118 PolarHBondContact NE2-OH 3.33Å; Q98-Y118 VanDerWaalsContact NE2-OH 3.1Å; L102-Y118 HydrophobicContact CD1-CE2 3.97Å; L102-Y118 HydrophobicContact CD2-CD2 3.61Å; L102-Y118 HydrophobicContact CD2-CE2 3.45Å; L102-Y118 VanDerWaalsContact CD2-CE2 3.45Å; L102-Y118 HydrophobicContact CD2-CG 4.38Å; L102-Y118 HydrophobicContact CG-CE2 4.32Å; Y114-Y118 VanDerWaalsContact O-CB 3.26Å; Y114-Y118 WeakPolarHBondContact O-CB 3.48Å; Y114-Y118 PolarHBondContact O-N 3.42Å; V116-Y118 VanDerWaalsContact C-N 3.29Å; V116-Y118 PolarHBondContact O-N 3.18Å; Y118-L120 PolarHBondContact O-N 2.98Å; Y118-K121 HydrophobicContact CD1-CD 4.32Å; Y118-K121 HydrophobicContact CD2-CD 4.41Å; Y118-K121 HydrophobicContact CE1-CD 3.97Å; Y118-K121 VanDerWaalsContact CE1-NZ 3.33Å; Y118-K121 HydrophobicContact CE2-CD 4Å; Y118-K121 WeakPolarHBondContact O-CB 3.39Å; Y118-K121 VanDerWaalsContact O-CG 3.25Å; Y118-K121 WeakPolarHBondContact O-CG 3.27Å; Y118-K121 PolarHBondContact O-N 2.95Å; Y118-V182 HydrophobicContact CD2-CG1 4.4Å; Y118-C186 PolarHBondContact O-SG 3.25Å; Y118-C186 VanDerWaalsContact O-SG 3.35Å |
| 119 | Q | 92.9 | Very high | 90.4 | Very high | 3 Ų | 3 | 34.1 Ų | 34.1 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70 | -13.4 | 176.3 | -52.8 | -45.3 | -25.4 | 0 | 0 | 113.9 | Q115 V116 T117 K121 I122 M149 V152 A153 | Q115-Q119 WeakPolarHBondContact O-CG 3.49Å; Q115-Q119 PolarHBondContact O-NE2 3.38Å; V116-Q119 PolarHBondContact O-N 2.94Å; T117-Q119 PolarHBondContact O-N 3.32Å; Q119-K121 PolarHBondContact O-N 3.29Å; Q119-I122 WeakPolarHBondContact O-CB 3.48Å; Q119-I122 PolarHBondContact O-N 3.25Å; Q119-M149 HydrophobicContact CB-CG 3.72Å; Q119-V152 VanDerWaalsContact CD-CG1 3.41Å; Q119-V152 HydrophobicContact CG-CB 4.36Å; Q119-V152 HydrophobicContact CG-CG1 4.1Å; Q119-A153 HydrophobicContact CG-CB 4.27Å |
| 120 | L | 92.4 | Very high | 90.8 | Very high | 54 Ų | 54 | 36.2 Ų | 36.2 | 28% | 0.283 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -57 | -18.5 | 169.6 | -88.2 | 73.4 | 0 | 0 | 0 | 112 | T117 Y118 I122 L123 T124 M149 L183 C186 | T117-L120 WeakPolarHBondContact O-CB 3.4Å; T117-L120 WeakPolarHBondContact O-CD1 3.49Å; T117-L120 PolarHBondContact O-N 3.44Å; T117-L120 VanDerWaalsContact O-N 3.15Å; Y118-L120 PolarHBondContact O-N 2.98Å; L120-I122 PolarHBondContact O-N 3.16Å; L120-I122 VanDerWaalsContact O-N 3.16Å; L120-L123 PolarHBondContact O-N 3.35Å; L120-L123 VanDerWaalsContact O-N 3.13Å; L120-T124 WeakPolarHBondContact O-CG2 3.26Å; L120-T124 PolarHBondContact O-N 2.83Å; L120-T124 PolarHBondContact O-OG1 2.79Å; L120-T124 VanDerWaalsContact O-OG1 3.09Å; L120-M149 HydrophobicContact CD1-CE 3.37Å; L120-M149 HydrophobicContact CD1-SD 4.35Å; L120-M149 HydrophobicContact CG-CE 4.19Å; L120-L183 HydrophobicContact CD2-CD2 3.73Å; L120-C186 HydrophobicContact CB-CB 4.34Å |
| 121 | K | 93 | Very high | 91.2 | Very high | 53 Ų | 53 | 37.2 Ų | 37.2 | 23% | 0.23 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -53.4 | -31.5 | 170.8 | 77.9 | -173.8 | 180 | -172.8 | 0 | 113 | Y118 Q119 T124 T125 C186 | Y118-K121 HydrophobicContact CD1-CD 4.32Å; Y118-K121 HydrophobicContact CD2-CD 4.41Å; Y118-K121 HydrophobicContact CE1-CD 3.97Å; Y118-K121 VanDerWaalsContact CE1-NZ 3.33Å; Y118-K121 HydrophobicContact CE2-CD 4Å; Y118-K121 WeakPolarHBondContact O-CB 3.39Å; Y118-K121 VanDerWaalsContact O-CG 3.25Å; Y118-K121 WeakPolarHBondContact O-CG 3.27Å; Y118-K121 PolarHBondContact O-N 2.95Å; Q119-K121 PolarHBondContact O-N 3.29Å; K121-T124 WeakPolarHBondContact CA-OG1 3.3Å; K121-T124 PolarHBondContact O-OG1 3.17Å; K121-T124 VanDerWaalsContact O-OG1 3.05Å; K121-T125 VanDerWaalsContact O-CB 3.24Å; K121-T125 WeakPolarHBondContact O-CB 3.26Å; K121-T125 PolarHBondContact O-N 3.34Å; K121-T125 PolarHBondContact O-OG1 3.2Å; K121-C186 HydrophobicContact CB-CB 4.3Å |
| 122 | I | 92.3 | Very high | 91.7 | Very high | 15 Ų | 15 | 36.1 Ų | 36.1 | 8% | 0.077 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.6 | -48.2 | 179 | -63.1 | 171.9 | 0 | 0 | 0 | 109.5 | Q119 L120 T125 A126 L145 L148 M149 V152 | Q119-I122 WeakPolarHBondContact O-CB 3.48Å; Q119-I122 PolarHBondContact O-N 3.25Å; L120-I122 PolarHBondContact O-N 3.16Å; L120-I122 VanDerWaalsContact O-N 3.16Å; I122-T125 PolarHBondContact O-N 3.28Å; I122-A126 PolarHBondContact O-N 2.86Å; I122-A126 VanDerWaalsContact O-N 3.09Å; I122-L145 HydrophobicContact CG2-CD2 3.98Å; I122-L148 HydrophobicContact CD1-CD2 4.16Å; I122-L148 HydrophobicContact CD1-CG 4.23Å; I122-L148 HydrophobicContact CG2-CD2 4.12Å; I122-M149 HydrophobicContact CD1-CB 4.49Å; I122-V152 HydrophobicContact CD1-CG2 4.47Å |
| 123 | L | 93.9 | Very high | 92.1 | Very high | 35 Ų | 35 | 37.4 Ų | 37.4 | 18% | 0.183 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.6 | -44.6 | 179.7 | -63.6 | -179.1 | 0 | 0 | 0 | 112.1 | L120 T125 A126 L127 L145 L146 M149 | L120-L123 PolarHBondContact O-N 3.35Å; L120-L123 VanDerWaalsContact O-N 3.13Å; L123-T125 VanDerWaalsContact C-N 3.31Å; L123-T125 PolarHBondContact O-N 2.65Å; L123-A126 WeakPolarHBondContact O-CB 3.46Å; L123-A126 PolarHBondContact O-N 3.28Å; L123-A126 VanDerWaalsContact O-N 3.12Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 3.43Å; L123-L145 HydrophobicContact CD2-CB 4.19Å; L123-L146 HydrophobicContact CD1-CD2 3.91Å; L123-L146 HydrophobicContact CD2-CD2 3.88Å; L123-L146 HydrophobicContact CD2-CG 4.42Å; L123-M149 HydrophobicContact CD1-SD 3.56Å; L123-M149 VanDerWaalsContact CD1-SD 3.56Å; L123-M149 HydrophobicContact CG-SD 3.95Å |
| 124 | T | 94.4 | Very high | 92.1 | Very high | 16 Ų | 16 | 38 Ų | 38 | 10% | 0.098 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.5 | -40.1 | 176.5 | 52.6 | 0 | 0 | 0 | 0 | 111.5 | L120 K121 A126 L127 F128 C186 | L120-T124 WeakPolarHBondContact O-CG2 3.26Å; L120-T124 PolarHBondContact O-N 2.83Å; L120-T124 PolarHBondContact O-OG1 2.79Å; L120-T124 VanDerWaalsContact O-OG1 3.09Å; K121-T124 WeakPolarHBondContact CA-OG1 3.3Å; K121-T124 PolarHBondContact O-OG1 3.17Å; K121-T124 VanDerWaalsContact O-OG1 3.05Å; T124-A126 VanDerWaalsContact C-N 3.34Å; T124-A126 PolarHBondContact O-N 2.9Å; T124-L127 PolarHBondContact O-N 3.37Å; T124-F128 WeakPolarHBondContact O-CD2 3.49Å; T124-F128 PolarHBondContact O-N 3.37Å; T124-C186 PolarHBondContact OG1-O 3.1Å; T124-C186 VanDerWaalsContact OG1-O 3.13Å |
| 125 | T | 94.3 | Very high | 92.1 | Very high | 14 Ų | 14 | 40 Ų | 40 | 9% | 0.086 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.6 | -45 | 172.4 | -62.4 | 0 | 0 | 0 | 0 | 111.6 | K121 I122 L123 S129 G190 V194 N270 I271 | K121-T125 VanDerWaalsContact O-CB 3.24Å; K121-T125 WeakPolarHBondContact O-CB 3.26Å; K121-T125 PolarHBondContact O-N 3.34Å; K121-T125 PolarHBondContact O-OG1 3.2Å; I122-T125 PolarHBondContact O-N 3.28Å; L123-T125 VanDerWaalsContact C-N 3.31Å; L123-T125 PolarHBondContact O-N 2.65Å; T125-S129 VanDerWaalsContact O-CB 3.26Å; T125-S129 WeakPolarHBondContact O-CB 3.38Å; T125-S129 PolarHBondContact O-N 3.04Å; T125-G190 WeakPolarHBondContact OG1-CA 3.14Å; T125-V194 HydrophobicContact CG2-CG2 4.08Å; T125-V194 WeakPolarHBondContact O-CG2 3.27Å; T125-N270 HydrophobicContact CG2-CB 4.07Å; T125-N270 WeakPolarHBondContact CG2-ND2 3.22Å; T125-I271 HydrophobicContact CG2-CG1 4.45Å |
| 126 | A | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.2 | -43.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | I122 L123 T124 S129 V130 L137 W142 L145 I271 | I122-A126 PolarHBondContact O-N 2.86Å; I122-A126 VanDerWaalsContact O-N 3.09Å; L123-A126 WeakPolarHBondContact O-CB 3.46Å; L123-A126 PolarHBondContact O-N 3.28Å; L123-A126 VanDerWaalsContact O-N 3.12Å; T124-A126 VanDerWaalsContact C-N 3.34Å; T124-A126 PolarHBondContact O-N 2.9Å; A126-S129 WeakPolarHBondContact O-CB 3.43Å; A126-S129 PolarHBondContact O-N 3.39Å; A126-S129 VanDerWaalsContact O-N 3.15Å; A126-V130 WeakPolarHBondContact O-CG2 3.44Å; A126-V130 PolarHBondContact O-N 3.47Å; A126-L137 HydrophobicContact CB-CD1 4.13Å; A126-W142 HydrophobicContact CB-CH2 4.18Å; A126-W142 HydrophobicContact CB-CZ3 4.07Å; A126-L145 HydrophobicContact CB-CD1 3.47Å; A126-L145 VanDerWaalsContact CB-CD1 3.47Å; A126-I271 HydrophobicContact CB-CD1 4.37Å |
| 127 | L | 95.3 | Very high | 92.3 | Very high | 100 Ų | 100 | 47.8 Ų | 47.8 | 52% | 0.524 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.2 | -48.3 | 176.2 | -73.2 | 168.5 | 0 | 0 | 0 | 111.7 | L123 T124 S129 V130 S131 W142 | L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 3.43Å; T124-L127 PolarHBondContact O-N 3.37Å; L127-S129 VanDerWaalsContact C-N 3.31Å; L127-S129 PolarHBondContact O-N 3.12Å; L127-V130 PolarHBondContact O-N 3.03Å; L127-S131 PolarHBondContact O-N 3.14Å; L127-S131 PolarHBondContact O-OG 3.4Å; L127-W142 HydrophobicContact CD2-CH2 3.71Å; L127-W142 HydrophobicContact CD2-CZ3 4.39Å; L127-W142 HydrophobicContact CG-CH2 4.09Å |
| 128 | F | 96.1 | Very high | 92.3 | Very high | 55 Ų | 55 | 48.5 Ų | 48.5 | 24% | 0.241 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.8 | -34.6 | 175.1 | -74.5 | -60.2 | 0 | 0 | 0 | 112.1 | T124 V130 S131 M132 C187 F191 V194 | T124-F128 WeakPolarHBondContact O-CD2 3.49Å; T124-F128 PolarHBondContact O-N 3.37Å; F128-V130 VanDerWaalsContact C-N 3.32Å; F128-V130 PolarHBondContact O-N 2.95Å; F128-S131 WeakPolarHBondContact CA-OG 3.16Å; F128-S131 PolarHBondContact O-N 3.18Å; F128-S131 PolarHBondContact O-OG 3.02Å; F128-M132 HydrophobicContact CB-SD 3.94Å; F128-M132 HydrophobicContact CD1-CG 4.25Å; F128-M132 HydrophobicContact CD1-SD 3.68Å; F128-M132 HydrophobicContact CG-SD 4.11Å; F128-M132 VanDerWaalsContact O-CB 3.23Å; F128-M132 WeakPolarHBondContact O-CB 3.43Å; F128-M132 WeakPolarHBondContact O-CG 3.48Å; F128-M132 PolarHBondContact O-N 3.18Å; F128-C187 WeakPolarHBondContact CE2-O 3.49Å; F128-F191 HydrophobicContact CD1-CD2 4.19Å; F128-F191 HydrophobicContact CD2-CB 4.13Å; F128-F191 HydrophobicContact CE1-CB 4.4Å; F128-F191 AromaticContact CE1-CD2 3.97Å; F128-F191 HydrophobicContact CE1-CD2 3.97Å; F128-F191 HydrophobicContact CE2-CB 3.89Å; F128-F191 HydrophobicContact CZ-CB 4.04Å; F128-F191 HydrophobicContact CZ-CD2 4.35Å; F128-V194 HydrophobicContact CB-CB 3.99Å; F128-V194 HydrophobicContact CB-CG1 4.17Å; F128-V194 HydrophobicContact CB-CG2 3.88Å; F128-V194 WeakPolarHBondContact O-CG1 3.44Å |
| 129 | S | 93.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.4 | -38.9 | 175.9 | -160.1 | 0 | 0 | 0 | 0 | 111.7 | T125 A126 L127 L133 R135 | T125-S129 VanDerWaalsContact O-CB 3.26Å; T125-S129 WeakPolarHBondContact O-CB 3.38Å; T125-S129 PolarHBondContact O-N 3.04Å; A126-S129 WeakPolarHBondContact O-CB 3.43Å; A126-S129 PolarHBondContact O-N 3.39Å; A126-S129 VanDerWaalsContact O-N 3.15Å; L127-S129 VanDerWaalsContact C-N 3.31Å; L127-S129 PolarHBondContact O-N 3.12Å; S129-L133 WeakPolarHBondContact O-CB 3.49Å; S129-L133 PolarHBondContact O-N 3.48Å; S129-R135 PolarHBondContact O-N 3.46Å; S129-R135 VanDerWaalsContact OG-CD 3.27Å; S129-R135 WeakPolarHBondContact OG-CD 3.33Å; S129-R135 PolarHBondContact OG-NE 3.28Å |
| 130 | V | 94.1 | Very high | 92.1 | Very high | 50 Ų | 50 | 59.6 Ų | 59.6 | 30% | 0.303 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -69.3 | -46.8 | 173.4 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | A126 L127 F128 G134 R135 L137 W142 | A126-V130 WeakPolarHBondContact O-CG2 3.44Å; A126-V130 PolarHBondContact O-N 3.47Å; L127-V130 PolarHBondContact O-N 3.03Å; F128-V130 VanDerWaalsContact C-N 3.32Å; F128-V130 PolarHBondContact O-N 2.95Å; V130-G134 VanDerWaalsContact O-CA 3.27Å; V130-G134 WeakPolarHBondContact O-CA 3.48Å; V130-G134 PolarHBondContact O-N 3.5Å; V130-R135 WeakPolarHBondContact CG1-O 3.35Å; V130-L137 HydrophobicContact CG2-CB 4.39Å; V130-L137 HydrophobicContact CG2-CD1 3.7Å; V130-L137 HydrophobicContact CG2-CG 3.87Å; V130-W142 HydrophobicContact CG2-CZ2 4.02Å |
| 131 | S | 93.9 | Very high | 92.1 | Very high | 86 Ų | 86 | 59 Ų | 59 | 60% | 0.601 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -76.7 | -38.6 | -173.4 | 71 | 0 | 0 | 0 | 0 | 114.3 | L127 F128 | L127-S131 PolarHBondContact O-N 3.14Å; L127-S131 PolarHBondContact O-OG 3.4Å; F128-S131 WeakPolarHBondContact CA-OG 3.16Å; F128-S131 PolarHBondContact O-N 3.18Å; F128-S131 PolarHBondContact O-OG 3.02Å |
| 132 | M | 92.9 | Very high | 92.2 | Very high | 34 Ų | 34 | 60.4 Ų | 60.4 | 17% | 0.167 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -95.6 | -34.1 | -172.6 | -61.3 | 175 | 60.6 | 0 | 0 | 114.4 | F128 F191 V194 Y195 K198 | F128-M132 HydrophobicContact CB-SD 3.94Å; F128-M132 HydrophobicContact CD1-CG 4.25Å; F128-M132 HydrophobicContact CD1-SD 3.68Å; F128-M132 HydrophobicContact CG-SD 4.11Å; F128-M132 VanDerWaalsContact O-CB 3.23Å; F128-M132 WeakPolarHBondContact O-CB 3.43Å; F128-M132 WeakPolarHBondContact O-CG 3.48Å; F128-M132 PolarHBondContact O-N 3.18Å; M132-F191 HydrophobicContact CE-CD2 4.13Å; M132-F191 HydrophobicContact CE-CE2 3.82Å; M132-F191 HydrophobicContact CE-CZ 4.4Å; M132-F191 HydrophobicContact SD-CD2 3.75Å; M132-F191 HydrophobicContact SD-CE2 3.93Å; M132-V194 HydrophobicContact CB-CG1 3.93Å; M132-V194 HydrophobicContact CE-CG1 4.48Å; M132-V194 HydrophobicContact CG-CG1 4.49Å; M132-V194 HydrophobicContact SD-CB 4.41Å; M132-V194 HydrophobicContact SD-CG1 4.03Å; M132-Y195 HydrophobicContact CE-CD2 3.71Å; M132-Y195 HydrophobicContact CE-CG 4.27Å; M132-K198 PolarHBondContact O-NZ 3.46Å |
| 133 | L | 91.1 | Very high | 92.3 | Very high | 46 Ų | 46 | 63.6 Ų | 63.6 | 24% | 0.241 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -101.1 | -4.8 | 178.7 | -67.8 | 160.2 | 0 | 0 | 0 | 112.3 | S129 R135 V194 E197 K198 | S129-L133 WeakPolarHBondContact O-CB 3.49Å; S129-L133 PolarHBondContact O-N 3.48Å; L133-R135 VanDerWaalsContact C-N 3.29Å; L133-R135 HydrophobicContact CB-CG 4.13Å; L133-R135 PolarHBondContact O-N 3.06Å; L133-V194 HydrophobicContact CD1-CG1 3.68Å; L133-V194 HydrophobicContact CG-CG1 3.96Å; L133-E197 HydrophobicContact CD1-CB 4.37Å; L133-E197 HydrophobicContact CD1-CG 3.94Å; L133-E197 HydrophobicContact CD2-CG 4.46Å; L133-K198 HydrophobicContact CD2-CB 3.84Å; L133-K198 HydrophobicContact CD2-CG 4.19Å |
| 134 | G | 87.9 | Confident | 92.4 | Very high | 58 Ų | 58 | 61.9 Ų | 61.9 | 60% | 0.598 | 32% | 0.323 | S | S | * | . | trans | 68.2 | 24.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | V130 | V130-G134 VanDerWaalsContact O-CA 3.27Å; V130-G134 WeakPolarHBondContact O-CA 3.48Å; V130-G134 PolarHBondContact O-N 3.5Å | ||
| 135 | R | 87.9 | Confident | 92.4 | Very high | 63 Ų | 63 | 61.2 Ų | 61.2 | 24% | 0.238 | 32% | 0.318 | C | S | . | . | trans | -69.6 | 146.9 | 179.9 | -65.1 | -160.1 | -178.8 | -154.3 | -7.9 | 111.6 | S129 V130 L133 E197 D269 | S129-R135 PolarHBondContact O-N 3.46Å; S129-R135 VanDerWaalsContact OG-CD 3.27Å; S129-R135 WeakPolarHBondContact OG-CD 3.33Å; S129-R135 PolarHBondContact OG-NE 3.28Å; V130-R135 WeakPolarHBondContact CG1-O 3.35Å; L133-R135 VanDerWaalsContact C-N 3.29Å; L133-R135 HydrophobicContact CB-CG 4.13Å; L133-R135 PolarHBondContact O-N 3.06Å; R135-E197 IonicContact CZ-OE1 3.6Å; R135-E197 IonicContact NE-OE1 2.65Å; R135-E197 IonicContact NH2-OE1 2.77Å; R135-E197 PolarHBondContact NH2-OE1 3.2Å; R135-D269 IonicContact CZ-OD2 3.99Å; R135-D269 VanDerWaalsContact NH1-CB 3.34Å; R135-D269 IonicContact NH1-OD1 2.96Å; R135-D269 IonicContact NH1-OD2 3.81Å; R135-D269 PolarHBondContact NH1-OD2 3.45Å; R135-D269 IonicContact NH2-OD2 2.71Å | ||
| 136 | R | 88.1 | Confident | 92.4 | Very high | 240 Ų | 240 | 64.9 Ų | 64.9 | 91% | 0.906 | 34% | 0.337 | S | S | * | . | trans | -106.9 | 111.5 | 172.4 | -62.7 | -175.3 | -179.4 | -168.6 | -0.5 | 108.8 | ||||
| 137 | L | 88.8 | Confident | 92.5 | Very high | 25 Ų | 25 | 66.7 Ų | 66.7 | 13% | 0.131 | 35% | 0.347 | C | S | . | . | trans | -99.9 | 126 | 175.4 | -65.5 | 176.6 | 0 | 0 | 0 | 109.5 | A126 V130 Q141 W142 L145 I271 Y315 | A126-L137 HydrophobicContact CB-CD1 4.13Å; V130-L137 HydrophobicContact CG2-CB 4.39Å; V130-L137 HydrophobicContact CG2-CD1 3.7Å; V130-L137 HydrophobicContact CG2-CG 3.87Å; L137-Q141 VanDerWaalsContact CA-OE1 3.32Å; L137-Q141 HydrophobicContact CB-CB 4.37Å; L137-Q141 HydrophobicContact CD2-CB 4.28Å; L137-W142 HydrophobicContact CD1-CH2 4.46Å; L137-W142 HydrophobicContact CD1-CZ2 4.06Å; L137-W142 PolarHBondContact O-NE1 3.19Å; L137-L145 HydrophobicContact CD1-CD1 4.14Å; L137-I271 HydrophobicContact CD1-CD1 4.14Å; L137-I271 HydrophobicContact CD2-CD1 4.26Å; L137-Y315 HydrophobicContact CD2-CE2 4.34Å | ||
| 138 | G | 89.6 | Confident | 92.5 | Very high | 38 Ų | 38 | 62 Ų | 62 | 39% | 0.392 | 32% | 0.322 | S | S | . | . | trans | -73.5 | 167.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y140 Q141 W142 | G138-Y140 VanDerWaalsContact C-N 3.3Å; G138-Y140 PolarHBondContact O-N 3.28Å; G138-Q141 WeakPolarHBondContact O-CB 3.2Å; G138-Q141 PolarHBondContact O-N 3Å; G138-W142 PolarHBondContact O-N 3.35Å | ||
| 139 | V | 90.3 | Very high | 92.5 | Very high | 123 Ų | 123 | 61 Ų | 61 | 75% | 0.745 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -57.7 | -42.4 | 179.6 | -179.5 | 0 | 0 | 0 | 0 | 111.7 | Q141 W142 L143 | V139-Q141 VanDerWaalsContact C-N 3.31Å; V139-Q141 PolarHBondContact O-N 2.84Å; V139-W142 PolarHBondContact O-N 3.33Å; V139-L143 WeakPolarHBondContact O-CB 3.31Å; V139-L143 PolarHBondContact O-N 2.91Å |
| 140 | Y | 90.6 | Very high | 92.5 | Very high | 146 Ų | 146 | 63.2 Ų | 63.2 | 57% | 0.573 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -63.8 | -34.2 | 176.6 | -65.1 | -68.6 | 0 | 0 | 0 | 113.2 | G138 S144 L314 | G138-Y140 VanDerWaalsContact C-N 3.3Å; G138-Y140 PolarHBondContact O-N 3.28Å; Y140-S144 WeakPolarHBondContact O-CB 3.31Å; Y140-S144 PolarHBondContact O-N 2.91Å; Y140-S144 PolarHBondContact O-OG 3.05Å; Y140-L314 HydrophobicContact CD1-CD1 4.08Å |
| 141 | Q | 92.5 | Very high | 92.5 | Very high | 43 Ų | 43 | 60.8 Ų | 60.8 | 20% | 0.201 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -70.9 | -43 | 176 | -71 | 174.7 | -33.8 | 0 | 0 | 110.7 | L137 G138 V139 L143 S144 L145 Y315 | L137-Q141 VanDerWaalsContact CA-OE1 3.32Å; L137-Q141 HydrophobicContact CB-CB 4.37Å; L137-Q141 HydrophobicContact CD2-CB 4.28Å; G138-Q141 WeakPolarHBondContact O-CB 3.2Å; G138-Q141 PolarHBondContact O-N 3Å; V139-Q141 VanDerWaalsContact C-N 3.31Å; V139-Q141 PolarHBondContact O-N 2.84Å; Q141-L143 PolarHBondContact O-N 3.17Å; Q141-S144 WeakPolarHBondContact CA-OG 3.18Å; Q141-S144 PolarHBondContact O-N 3.25Å; Q141-S144 PolarHBondContact O-OG 2.91Å; Q141-L145 VanDerWaalsContact O-CG 3.31Å; Q141-L145 WeakPolarHBondContact O-CG 3.42Å; Q141-L145 PolarHBondContact O-N 3.26Å; Q141-Y315 HydrophobicContact CB-CD2 3.85Å; Q141-Y315 HydrophobicContact CB-CE2 3.83Å; Q141-Y315 HydrophobicContact CG-CD2 3.82Å; Q141-Y315 HydrophobicContact CG-CE2 3.88Å |
| 142 | W | 94.6 | Very high | 92.5 | Very high | 82 Ų | 82 | 56.8 Ų | 56.8 | 31% | 0.311 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.7 | -46.2 | 172.3 | -80.8 | 110.7 | 0 | 0 | 0 | 112.6 | A126 L127 V130 L137 G138 V139 S144 L145 L146 | A126-W142 HydrophobicContact CB-CH2 4.18Å; A126-W142 HydrophobicContact CB-CZ3 4.07Å; L127-W142 HydrophobicContact CD2-CH2 3.71Å; L127-W142 HydrophobicContact CD2-CZ3 4.39Å; L127-W142 HydrophobicContact CG-CH2 4.09Å; V130-W142 HydrophobicContact CG2-CZ2 4.02Å; L137-W142 HydrophobicContact CD1-CH2 4.46Å; L137-W142 HydrophobicContact CD1-CZ2 4.06Å; L137-W142 PolarHBondContact O-NE1 3.19Å; G138-W142 PolarHBondContact O-N 3.35Å; V139-W142 PolarHBondContact O-N 3.33Å; W142-S144 VanDerWaalsContact C-N 3.32Å; W142-S144 PolarHBondContact O-N 3.04Å; W142-L145 HydrophobicContact CE3-CD1 4.26Å; W142-L145 PolarHBondContact O-N 3.29Å; W142-L145 VanDerWaalsContact O-N 3.17Å; W142-L146 PolarHBondContact O-N 3.31Å; W142-L146 VanDerWaalsContact O-N 3.15Å |
| 143 | L | 94.7 | Very high | 92.4 | Very high | 81 Ų | 81 | 55.7 Ų | 55.7 | 42% | 0.424 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.1 | -44 | 176.5 | -176.7 | 61.8 | 0 | 0 | 0 | 111.1 | V139 Q141 L145 L146 I147 L314 | V139-L143 WeakPolarHBondContact O-CB 3.31Å; V139-L143 PolarHBondContact O-N 2.91Å; Q141-L143 PolarHBondContact O-N 3.17Å; L143-L145 VanDerWaalsContact C-N 3.27Å; L143-L145 PolarHBondContact O-N 3.37Å; L143-L146 PolarHBondContact O-N 3.29Å; L143-I147 HydrophobicContact CD1-CD1 4.33Å; L143-I147 HydrophobicContact CD1-CG1 4.48Å; L143-I147 HydrophobicContact CG-CD1 3.91Å; L143-I147 HydrophobicContact CG-CG1 4.47Å; L143-I147 VanDerWaalsContact O-CG1 3.3Å; L143-I147 WeakPolarHBondContact O-CG1 3.28Å; L143-I147 PolarHBondContact O-N 2.98Å; L143-L314 HydrophobicContact CD2-CD2 4.26Å; L143-L314 HydrophobicContact CG-CD2 4.29Å |
| 144 | S | 95.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.2 | -33.1 | 177.4 | 73.5 | 0 | 0 | 0 | 0 | 113 | Y140 Q141 W142 I147 L148 A311 Y315 | Y140-S144 WeakPolarHBondContact O-CB 3.31Å; Y140-S144 PolarHBondContact O-N 2.91Å; Y140-S144 PolarHBondContact O-OG 3.05Å; Q141-S144 WeakPolarHBondContact CA-OG 3.18Å; Q141-S144 PolarHBondContact O-N 3.25Å; Q141-S144 PolarHBondContact O-OG 2.91Å; W142-S144 VanDerWaalsContact C-N 3.32Å; W142-S144 PolarHBondContact O-N 3.04Å; S144-I147 PolarHBondContact O-N 2.97Å; S144-L148 VanDerWaalsContact O-CB 3.25Å; S144-L148 WeakPolarHBondContact O-CB 3.46Å; S144-L148 PolarHBondContact O-N 3.1Å; S144-A311 WeakPolarHBondContact CB-O 3.46Å; S144-A311 VanDerWaalsContact O-CB 3.31Å; S144-A311 WeakPolarHBondContact O-CB 3.31Å; S144-Y315 WeakPolarHBondContact OG-CB 3.36Å; S144-Y315 VanDerWaalsContact OG-CD2 3.3Å; S144-Y315 WeakPolarHBondContact OG-CD2 3.26Å |
| 145 | L | 94.9 | Very high | 92.5 | Very high | 1 Ų | 1 | 53.5 Ų | 53.5 | 1% | 0.005 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -70.2 | -37.5 | 176.3 | -67.4 | 167.5 | 0 | 0 | 0 | 112.1 | I122 L123 A126 L137 Q141 W142 L143 L148 M149 I271 F275 | I122-L145 HydrophobicContact CG2-CD2 3.98Å; L123-L145 HydrophobicContact CD2-CB 4.19Å; A126-L145 HydrophobicContact CB-CD1 3.47Å; A126-L145 VanDerWaalsContact CB-CD1 3.47Å; L137-L145 HydrophobicContact CD1-CD1 4.14Å; Q141-L145 VanDerWaalsContact O-CG 3.31Å; Q141-L145 WeakPolarHBondContact O-CG 3.42Å; Q141-L145 PolarHBondContact O-N 3.26Å; W142-L145 HydrophobicContact CE3-CD1 4.26Å; W142-L145 PolarHBondContact O-N 3.29Å; W142-L145 VanDerWaalsContact O-N 3.17Å; L143-L145 VanDerWaalsContact C-N 3.27Å; L143-L145 PolarHBondContact O-N 3.37Å; L145-L148 PolarHBondContact O-N 2.8Å; L145-M149 WeakPolarHBondContact O-CB 3.49Å; L145-M149 PolarHBondContact O-N 3.37Å; L145-I271 HydrophobicContact CD2-CG2 3.75Å; L145-F275 HydrophobicContact CD2-CE2 3.75Å; L145-F275 HydrophobicContact CD2-CZ 4.09Å |
| 146 | L | 95.5 | Very high | 92.4 | Very high | 91 Ų | 91 | 52.6 Ų | 52.6 | 48% | 0.476 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -65.9 | -44.9 | 173.5 | -68.6 | 170.3 | 0 | 0 | 0 | 111.2 | L123 W142 L143 L148 M149 A150 | L123-L146 HydrophobicContact CD1-CD2 3.91Å; L123-L146 HydrophobicContact CD2-CD2 3.88Å; L123-L146 HydrophobicContact CD2-CG 4.42Å; W142-L146 PolarHBondContact O-N 3.31Å; W142-L146 VanDerWaalsContact O-N 3.15Å; L143-L146 PolarHBondContact O-N 3.29Å; L146-L148 VanDerWaalsContact C-N 3.32Å; L146-L148 PolarHBondContact O-N 3.47Å; L146-M149 PolarHBondContact O-N 3.21Å; L146-A150 PolarHBondContact O-N 2.88Å |
| 147 | I | 95.9 | Very high | 92.3 | Very high | 39 Ų | 39 | 47 Ų | 47 | 20% | 0.2 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.6 | -41.6 | 175.5 | -63.5 | 168.9 | 0 | 0 | 0 | 110.3 | L143 S144 A150 G151 L307 A311 L314 | L143-I147 HydrophobicContact CD1-CD1 4.33Å; L143-I147 HydrophobicContact CD1-CG1 4.48Å; L143-I147 HydrophobicContact CG-CD1 3.91Å; L143-I147 HydrophobicContact CG-CG1 4.47Å; L143-I147 VanDerWaalsContact O-CG1 3.3Å; L143-I147 WeakPolarHBondContact O-CG1 3.28Å; L143-I147 PolarHBondContact O-N 2.98Å; S144-I147 PolarHBondContact O-N 2.97Å; I147-A150 PolarHBondContact O-N 3.5Å; I147-G151 PolarHBondContact O-N 2.94Å; I147-L307 HydrophobicContact CG2-CB 3.99Å; I147-L307 HydrophobicContact CG2-CD2 4.12Å; I147-L307 WeakPolarHBondContact CG2-O 3.47Å; I147-A311 HydrophobicContact CB-CB 4.07Å; I147-A311 HydrophobicContact CG2-CB 3.88Å; I147-L314 HydrophobicContact CD1-CD2 3.94Å |
| 148 | L | 95.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.7 | -47.6 | 176.3 | -175.8 | 69.8 | 0 | 0 | 0 | 111 | I122 S144 L145 L146 A150 G151 V152 F275 V308 A311 | I122-L148 HydrophobicContact CD1-CD2 4.16Å; I122-L148 HydrophobicContact CD1-CG 4.23Å; I122-L148 HydrophobicContact CG2-CD2 4.12Å; S144-L148 VanDerWaalsContact O-CB 3.25Å; S144-L148 WeakPolarHBondContact O-CB 3.46Å; S144-L148 PolarHBondContact O-N 3.1Å; L145-L148 PolarHBondContact O-N 2.8Å; L146-L148 VanDerWaalsContact C-N 3.32Å; L146-L148 PolarHBondContact O-N 3.47Å; L148-A150 PolarHBondContact O-N 3.23Å; L148-G151 PolarHBondContact O-N 2.7Å; L148-V152 HydrophobicContact CD1-CG2 4.34Å; L148-V152 HydrophobicContact CG-CG2 4.39Å; L148-V152 VanDerWaalsContact O-CG2 3.25Å; L148-V152 WeakPolarHBondContact O-CG2 3.33Å; L148-V152 PolarHBondContact O-N 3.02Å; L148-F275 HydrophobicContact CB-CE1 4.14Å; L148-F275 HydrophobicContact CB-CZ 4.41Å; L148-F275 HydrophobicContact CD1-CD1 3.76Å; L148-F275 HydrophobicContact CD1-CE1 3.91Å; L148-F275 HydrophobicContact CD2-CD1 3.71Å; L148-F275 HydrophobicContact CD2-CD2 3.98Å; L148-F275 HydrophobicContact CD2-CE1 3.7Å; L148-F275 HydrophobicContact CD2-CE2 3.97Å; L148-F275 HydrophobicContact CD2-CG 3.85Å; L148-F275 HydrophobicContact CD2-CZ 3.83Å; L148-F275 HydrophobicContact CG-CD1 4.27Å; L148-F275 HydrophobicContact CG-CE1 4.13Å; L148-V308 HydrophobicContact CD1-CB 4.36Å; L148-V308 HydrophobicContact CD1-CG1 3.86Å; L148-V308 HydrophobicContact CD1-CG2 4.28Å; L148-A311 HydrophobicContact CB-CB 3.91Å; L148-A311 HydrophobicContact CD1-CB 4.35Å |
| 149 | M | 94.6 | Very high | 90.2 | Very high | 35 Ų | 35 | 48.2 Ų | 48.2 | 17% | 0.172 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.9 | -48.7 | 177.8 | 178.3 | -174.4 | 152.8 | 0 | 0 | 111.3 | Q119 L120 I122 L123 L145 L146 V152 A153 | Q119-M149 HydrophobicContact CB-CG 3.72Å; L120-M149 HydrophobicContact CD1-CE 3.37Å; L120-M149 HydrophobicContact CD1-SD 4.35Å; L120-M149 HydrophobicContact CG-CE 4.19Å; I122-M149 HydrophobicContact CD1-CB 4.49Å; L123-M149 HydrophobicContact CD1-SD 3.56Å; L123-M149 VanDerWaalsContact CD1-SD 3.56Å; L123-M149 HydrophobicContact CG-SD 3.95Å; L145-M149 WeakPolarHBondContact O-CB 3.49Å; L145-M149 PolarHBondContact O-N 3.37Å; L146-M149 PolarHBondContact O-N 3.21Å; M149-V152 PolarHBondContact O-N 3.46Å; M149-A153 WeakPolarHBondContact O-CB 3.46Å; M149-A153 PolarHBondContact O-N 3.13Å |
| 150 | A | 94.2 | Very high | 88.3 | Confident | 46 Ų | 46 | 51.6 Ų | 51.6 | 38% | 0.38 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -61.3 | -46.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L146 I147 L148 V152 A153 L154 | L146-A150 PolarHBondContact O-N 2.88Å; I147-A150 PolarHBondContact O-N 3.5Å; L148-A150 PolarHBondContact O-N 3.23Å; A150-V152 PolarHBondContact O-N 2.98Å; A150-A153 PolarHBondContact O-N 3.05Å; A150-L154 WeakPolarHBondContact O-CG 3.28Å; A150-L154 PolarHBondContact O-N 3.09Å |
| 151 | G | 94.4 | Very high | 86 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.5 | -45.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | I147 L148 L154 V155 G304 | I147-G151 PolarHBondContact O-N 2.94Å; L148-G151 PolarHBondContact O-N 2.7Å; G151-L154 PolarHBondContact O-N 2.98Å; G151-V155 WeakPolarHBondContact O-CB 3.45Å; G151-V155 VanDerWaalsContact O-CG2 3.31Å; G151-V155 WeakPolarHBondContact O-CG2 3.29Å; G151-V155 PolarHBondContact O-N 2.69Å; G151-G304 WeakPolarHBondContact CA-O 3.42Å; G151-G304 WeakPolarHBondContact O-CA 3.32Å |
| 152 | V | 92.2 | Very high | 83.7 | Confident | 2 Ų | 2 | 52.2 Ų | 52.2 | 1% | 0.012 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -66.1 | -39.6 | 177.3 | 179.8 | 0 | 0 | 0 | 0 | 111.4 | Q119 I122 L148 M149 A150 L154 V155 Q156 S278 I281 V308 | Q119-V152 VanDerWaalsContact CD-CG1 3.41Å; Q119-V152 HydrophobicContact CG-CB 4.36Å; Q119-V152 HydrophobicContact CG-CG1 4.1Å; I122-V152 HydrophobicContact CD1-CG2 4.47Å; L148-V152 HydrophobicContact CD1-CG2 4.34Å; L148-V152 HydrophobicContact CG-CG2 4.39Å; L148-V152 VanDerWaalsContact O-CG2 3.25Å; L148-V152 WeakPolarHBondContact O-CG2 3.33Å; L148-V152 PolarHBondContact O-N 3.02Å; M149-V152 PolarHBondContact O-N 3.46Å; A150-V152 PolarHBondContact O-N 2.98Å; V152-L154 VanDerWaalsContact C-N 3.32Å; V152-L154 PolarHBondContact O-N 3.35Å; V152-V155 PolarHBondContact O-N 3.18Å; V152-Q156 HydrophobicContact CG1-CG 4.35Å; V152-Q156 WeakPolarHBondContact O-CB 3.32Å; V152-Q156 WeakPolarHBondContact O-CG 3.48Å; V152-Q156 PolarHBondContact O-N 2.99Å; V152-S278 WeakPolarHBondContact CG2-OG 3.27Å; V152-I281 HydrophobicContact CG1-CD1 4.41Å; V152-V308 HydrophobicContact CG2-CG2 4Å |
| 153 | A | 91.9 | Very high | 81 | Confident | 10 Ų | 10 | 53.3 Ų | 53.3 | 8% | 0.083 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | V116 Q119 M149 A150 W157 | V116-A153 HydrophobicContact CG1-CB 4.46Å; V116-A153 HydrophobicContact CG2-CB 4.3Å; Q119-A153 HydrophobicContact CG-CB 4.27Å; M149-A153 WeakPolarHBondContact O-CB 3.46Å; M149-A153 PolarHBondContact O-N 3.13Å; A150-A153 PolarHBondContact O-N 3.05Å; A153-W157 PolarHBondContact O-N 3.31Å; A153-W157 VanDerWaalsContact O-N 3.17Å |
| 154 | L | 91.3 | Very high | 78.5 | Confident | 46 Ų | 46 | 53 Ų | 53 | 24% | 0.241 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -69.8 | -42.1 | 175.5 | -65.9 | -179.4 | 0 | 0 | 0 | 112.5 | A150 G151 V152 Q156 W157 V300 L303 L307 | A150-L154 WeakPolarHBondContact O-CG 3.28Å; A150-L154 PolarHBondContact O-N 3.09Å; G151-L154 PolarHBondContact O-N 2.98Å; V152-L154 VanDerWaalsContact C-N 3.32Å; V152-L154 PolarHBondContact O-N 3.35Å; L154-Q156 PolarHBondContact O-N 3.12Å; L154-W157 VanDerWaalsContact O-CB 3.31Å; L154-W157 WeakPolarHBondContact O-CB 3.13Å; L154-W157 PolarHBondContact O-N 3.35Å; L154-V300 HydrophobicContact CB-CG1 4.02Å; L154-V300 HydrophobicContact CD2-CG1 3.84Å; L154-V300 HydrophobicContact CG-CG1 4.44Å; L154-L303 HydrophobicContact CD1-CD2 4.04Å; L154-L303 HydrophobicContact CD1-CG 4.08Å; L154-L307 HydrophobicContact CD1-CD1 3.83Å |
| 155 | V | 90.1 | Very high | 76 | Confident | 13 Ų | 13 | 58.3 Ų | 58.3 | 8% | 0.079 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.9 | -34.1 | 177 | 163.5 | 0 | 0 | 0 | 0 | 112.1 | G151 V152 I281 I282 F301 G304 A305 | G151-V155 WeakPolarHBondContact O-CB 3.45Å; G151-V155 VanDerWaalsContact O-CG2 3.31Å; G151-V155 WeakPolarHBondContact O-CG2 3.29Å; G151-V155 PolarHBondContact O-N 2.69Å; V152-V155 PolarHBondContact O-N 3.18Å; V155-I281 HydrophobicContact CG1-CG2 3.57Å; V155-I282 HydrophobicContact CG1-CG1 4.36Å; V155-I282 HydrophobicContact CG2-CG1 4.16Å; V155-F301 HydrophobicContact CB-CD2 4.29Å; V155-F301 HydrophobicContact CB-CE2 4.5Å; V155-F301 HydrophobicContact CG1-CD2 3.83Å; V155-F301 HydrophobicContact CG1-CE2 3.67Å; V155-F301 HydrophobicContact CG2-CD2 4.3Å; V155-F301 HydrophobicContact CG2-CE2 4.42Å; V155-G304 VanDerWaalsContact CG2-C 3.46Å; V155-A305 HydrophobicContact CG2-CB 4.45Å |
| 156 | Q | 86.5 | Confident | 73.5 | Confident | 43 Ų | 43 | 67.5 Ų | 67.5 | 20% | 0.201 | 40% | 0.402 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.6 | 9.4 | -179 | -63.3 | -174.4 | 2.3 | 0 | 0 | 113.3 | V152 L154 I281 | V152-Q156 HydrophobicContact CG1-CG 4.35Å; V152-Q156 WeakPolarHBondContact O-CB 3.32Å; V152-Q156 WeakPolarHBondContact O-CG 3.48Å; V152-Q156 PolarHBondContact O-N 2.99Å; L154-Q156 PolarHBondContact O-N 3.12Å; Q156-I281 HydrophobicContact CG-CG2 4.33Å |
| 157 | W | 84.6 | Confident | 71.3 | Confident | 123 Ų | 123 | 70.3 Ų | 70.3 | 47% | 0.466 | 41% | 0.411 | S | S | . | . | P | Polyproline II helix | trans | -61.6 | 130.3 | 179.4 | -166.5 | -90.7 | 0 | 0 | 0 | 109.8 | A112 V116 A153 L154 S159 V300 | A112-W157 HydrophobicContact CB-CH2 4.37Å; A112-W157 HydrophobicContact CB-CZ2 4.3Å; V116-W157 HydrophobicContact CG2-CE3 4Å; V116-W157 HydrophobicContact CG2-CZ3 3.6Å; A153-W157 PolarHBondContact O-N 3.31Å; A153-W157 VanDerWaalsContact O-N 3.17Å; L154-W157 VanDerWaalsContact O-CB 3.31Å; L154-W157 WeakPolarHBondContact O-CB 3.13Å; L154-W157 PolarHBondContact O-N 3.35Å; W157-S159 PolarHBondContact O-N 2.96Å; W157-S159 VanDerWaalsContact O-N 3.16Å; W157-V300 HydrophobicContact CB-CG1 4.35Å |
| 158 | P | 74.9 | Confident | 69.1 | Low | 47 Ų | 47 | 76.9 Ų | 76.9 | 31% | 0.305 | 44% | 0.441 | S | S | . | . | P | Polyproline II helix | trans | -62.2 | 118.6 | 176 | -19 | 31.4 | 0 | 0 | 0 | 110 | A111 A112 | A111-P158 HydrophobicContact CB-CG 3.99Å; A112-P158 HydrophobicContact CB-CG 3.88Å |
| 159 | S | 60.3 | Low | 67 | Low | 42 Ų | 42 | 82.1 Ų | 82.1 | 29% | 0.294 | 48% | 0.483 | S | S | . | . | P | Polyproline II helix | trans | -69.2 | 133.9 | 167.7 | -62.4 | 0 | 0 | 0 | 0 | 108.8 | W157 S161 | W157-S159 PolarHBondContact O-N 2.96Å; W157-S159 VanDerWaalsContact O-N 3.16Å; S159-S161 PolarHBondContact O-N 3.39Å |
| 160 | E | 50.7 | Low | 65.4 | Low | 193 Ų | 193 | 83.8 Ų | 83.8 | 90% | 0.902 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | 3.9 | -175.7 | -67.9 | -175.2 | 155.3 | 0 | 0 | 115.3 | A162 | E160-A162 PolarHBondContact O-N 3.45Š|
| 161 | S | 41.3 | Very low | 64.2 | Low | 120 Ų | 120 | 85.6 Ų | 85.6 | 84% | 0.839 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | 2.7 | -176.2 | -45.4 | 0 | 0 | 0 | 0 | 115.2 | S159 | S159-S161 PolarHBondContact O-N 3.39Š|
| 162 | A | 43.8 | Very low | 63.1 | Low | 82 Ų | 82 | 89.5 Ų | 89.5 | 68% | 0.678 | 53% | 0.53 | S | S | * | . | trans | -110.5 | 98.9 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | E160 A164 | E160-A162 PolarHBondContact O-N 3.45Å; A162-A164 PolarHBondContact O-N 2.74Å | ||
| 163 | A | 38.2 | Very low | 62.2 | Low | 106 Ų | 106 | 91.4 Ų | 91.4 | 88% | 0.876 | 55% | 0.55 | S | S | * | . | trans | -57.6 | 79.6 | 156.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 164 | A | 43.5 | Very low | 61.7 | Low | 74 Ų | 74 | 92.3 Ų | 92.3 | 61% | 0.612 | 56% | 0.556 | S | S | * | * | trans | -65.9 | 134.3 | 159.7 | 0 | 0 | 0 | 0 | 0 | 105.6 | A162 E166 | A162-A164 PolarHBondContact O-N 2.74Å; A164-E166 PolarHBondContact O-N 3.45Å | ||
| 165 | P | 42.6 | Very low | 61.4 | Low | 112 Ų | 112 | 94.5 Ų | 94.5 | 73% | 0.727 | 57% | 0.565 | S | S | * | * | trans | -52.7 | 135.7 | 171.6 | 24.2 | -31.3 | 0 | 0 | 0 | 107 | K167 | P165-K167 VanDerWaalsContact C-N 3.3Å; P165-K167 PolarHBondContact O-N 2.94Å | ||
| 166 | E | 40.5 | Very low | 61.4 | Low | 194 Ų | 194 | 100.8 Ų | 100.8 | 91% | 0.907 | 59% | 0.591 | S | S | * | * | trans | -43.4 | 99.9 | 171 | -71.6 | 177.4 | 149.7 | 0 | 0 | 107.7 | A164 E168 | A164-E166 PolarHBondContact O-N 3.45Å; E166-E168 PolarHBondContact O-N 3.12Å | ||
| 167 | K | 49.6 | Very low | 61.6 | Low | 150 Ų | 150 | 102.3 Ų | 102.3 | 65% | 0.652 | 60% | 0.603 | S | S | * | * | trans | -66.2 | 112.3 | 168.7 | -80.6 | -174.7 | 176.3 | -179.1 | 0 | 103.4 | P165 | P165-K167 VanDerWaalsContact C-N 3.3Å; P165-K167 PolarHBondContact O-N 2.94Å | ||
| 168 | E | 50.1 | Low | 61.9 | Low | 177 Ų | 177 | 96.4 Ų | 96.4 | 83% | 0.827 | 58% | 0.581 | S | S | * | * | trans | -26.8 | 136.3 | 177.2 | -71.3 | 176.4 | 144.3 | 0 | 0 | 111.5 | E166 R170 | E166-E168 PolarHBondContact O-N 3.12Å; E168-R170 VanDerWaalsContact C-N 3.33Å; E168-R170 WeakPolarHBondContact O-CA 3.43Å; E168-R170 PolarHBondContact O-N 3.41Å | ||
| 169 | A | 51.8 | Low | 62.7 | Low | 109 Ų | 109 | 96.4 Ų | 96.4 | 90% | 0.901 | 58% | 0.58 | S | S | * | * | trans | -39.9 | 96.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | S171 | A169-S171 PolarHBondContact O-N 3.47Š| ||
| 170 | R | 60.6 | Low | 64.3 | Low | 70 Ų | 70 | 97.1 Ų | 97.1 | 26% | 0.264 | 58% | 0.582 | S | S | . | * | trans | -62.8 | 124.1 | -173.2 | -80.2 | 179.1 | 169.9 | 156.8 | -20.8 | 107.2 | S107 L109 E168 A172 | S107-R170 PolarHBondContact O-NH2 3.11Å; L109-R170 PolarHBondContact O-NH1 3.13Å; L109-R170 PolarHBondContact O-NH2 3.09Å; E168-R170 VanDerWaalsContact C-N 3.33Å; E168-R170 WeakPolarHBondContact O-CA 3.43Å; E168-R170 PolarHBondContact O-N 3.41Å; R170-A172 PolarHBondContact O-N 3.49Å | ||
| 171 | S | 69.8 | Low | 66.4 | Low | 85 Ų | 85 | 88.2 Ų | 88.2 | 59% | 0.594 | 54% | 0.542 | S | S | * | . | trans | -49.2 | 139.4 | 177.3 | 164 | 0 | 0 | 0 | 0 | 110.4 | A169 G173 S174 Q175 | A169-S171 PolarHBondContact O-N 3.47Å; S171-G173 PolarHBondContact O-N 3.06Å; S171-G173 PolarHBondContact OG-N 3.33Å; S171-S174 PolarHBondContact N-OG 2.73Å; S171-S174 WeakPolarHBondContact O-CB 3.34Å; S171-S174 PolarHBondContact O-N 3Å; S171-S174 PolarHBondContact O-OG 2.75Å; S171-Q175 PolarHBondContact O-N 3.37Å | ||
| 172 | A | 70.3 | Confident | 68.9 | Low | 81 Ų | 81 | 82.5 Ų | 82.5 | 67% | 0.669 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -52.1 | -31.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | R170 Q175 F176 | R170-A172 PolarHBondContact O-N 3.49Å; A172-Q175 PolarHBondContact O-N 2.94Å; A172-F176 PolarHBondContact O-N 3.38Å |
| 173 | G | 73.8 | Confident | 71.3 | Confident | 42 Ų | 42 | 81.9 Ų | 81.9 | 43% | 0.433 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65 | -39.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | S171 V177 | S171-G173 PolarHBondContact O-N 3.06Å; S171-G173 PolarHBondContact OG-N 3.33Å; G173-V177 WeakPolarHBondContact O-CG2 3.36Å; G173-V177 PolarHBondContact O-N 3Å; G173-V177 VanDerWaalsContact O-N 3.17Å |
| 174 | S | 80.9 | Confident | 74 | Confident | 29 Ų | 29 | 80.2 Ų | 80.2 | 20% | 0.203 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -68.3 | -41.2 | 177.6 | 68.1 | 0 | 0 | 0 | 0 | 111.6 | N108 S171 F176 V177 G178 | N108-S174 WeakPolarHBondContact CB-O 3.12Å; S171-S174 PolarHBondContact N-OG 2.73Å; S171-S174 WeakPolarHBondContact O-CB 3.34Å; S171-S174 PolarHBondContact O-N 3Å; S171-S174 PolarHBondContact O-OG 2.75Å; S174-F176 PolarHBondContact O-N 3.4Å; S174-V177 PolarHBondContact O-N 3.09Å; S174-G178 PolarHBondContact O-N 2.96Å |
| 175 | Q | 85.4 | Confident | 76.4 | Confident | 93 Ų | 93 | 76.7 Ų | 76.7 | 44% | 0.435 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -65.4 | -40.7 | 177.2 | -173.1 | 176.1 | -14 | 0 | 0 | 111.7 | L109 S171 A172 G178 V179 | L109-Q175 HydrophobicContact CD2-CG 3.96Å; S171-Q175 PolarHBondContact O-N 3.37Å; A172-Q175 PolarHBondContact O-N 2.94Å; Q175-G178 PolarHBondContact O-N 2.96Å; Q175-V179 WeakPolarHBondContact O-CG2 3.22Å; Q175-V179 PolarHBondContact O-N 2.88Å |
| 176 | F | 90.1 | Very high | 78.8 | Confident | 145 Ų | 145 | 71.4 Ų | 71.4 | 64% | 0.636 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -59.1 | -48.1 | 175.2 | -179.3 | -101.4 | 0 | 0 | 0 | 111.8 | A172 S174 G178 V179 T180 | A172-F176 PolarHBondContact O-N 3.38Å; S174-F176 PolarHBondContact O-N 3.4Å; F176-G178 VanDerWaalsContact C-N 3.27Å; F176-G178 PolarHBondContact O-N 2.56Å; F176-V179 PolarHBondContact O-N 2.96Å; F176-T180 WeakPolarHBondContact O-CB 3.25Å; F176-T180 PolarHBondContact O-N 2.99Å; F176-T180 PolarHBondContact O-OG1 3.16Å |
| 177 | V | 91.4 | Very high | 81.4 | Confident | 74 Ų | 74 | 64.9 Ų | 64.9 | 45% | 0.448 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.7 | -43.2 | 175.1 | 172 | 0 | 0 | 0 | 0 | 111 | V104 G173 S174 A181 | V104-V177 HydrophobicContact CG1-CG1 4.12Å; G173-V177 WeakPolarHBondContact O-CG2 3.36Å; G173-V177 PolarHBondContact O-N 3Å; G173-V177 VanDerWaalsContact O-N 3.17Å; S174-V177 PolarHBondContact O-N 3.09Å; V177-A181 VanDerWaalsContact O-CB 3.27Å; V177-A181 WeakPolarHBondContact O-CB 3.24Å; V177-A181 PolarHBondContact O-N 3.33Å |
| 178 | G | 91.2 | Very high | 83.5 | Confident | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -60.7 | -49.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | S174 Q175 F176 A181 V182 | S174-G178 PolarHBondContact O-N 2.96Å; Q175-G178 PolarHBondContact O-N 2.96Å; F176-G178 VanDerWaalsContact C-N 3.27Å; F176-G178 PolarHBondContact O-N 2.56Å; G178-A181 PolarHBondContact O-N 3.12Å; G178-V182 PolarHBondContact O-N 3.4Å |
| 179 | V | 91.5 | Very high | 85.5 | Confident | 46 Ų | 46 | 51 Ų | 51 | 28% | 0.279 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.3 | -47 | 178.9 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | L109 Q175 F176 A181 V182 L183 | L109-V179 HydrophobicContact CD1-CG2 4.46Å; L109-V179 HydrophobicContact CD2-CG2 3.81Å; Q175-V179 WeakPolarHBondContact O-CG2 3.22Å; Q175-V179 PolarHBondContact O-N 2.88Å; F176-V179 PolarHBondContact O-N 2.96Å; V179-A181 VanDerWaalsContact C-N 3.29Å; V179-A181 PolarHBondContact O-N 3.07Å; V179-V182 PolarHBondContact O-N 3.38Å; V179-L183 HydrophobicContact CG1-CD1 3.92Å; V179-L183 HydrophobicContact CG1-CG 4.31Å; V179-L183 WeakPolarHBondContact O-CG 3.2Å; V179-L183 PolarHBondContact O-N 3.44Å |
| 180 | T | 93.7 | Very high | 87.5 | Confident | 57 Ų | 57 | 45.9 Ų | 45.9 | 35% | 0.35 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -58.9 | -42.2 | 176.7 | -55.9 | 0 | 0 | 0 | 0 | 111.1 | F176 L183 V184 | F176-T180 WeakPolarHBondContact O-CB 3.25Å; F176-T180 PolarHBondContact O-N 2.99Å; F176-T180 PolarHBondContact O-OG1 3.16Å; T180-L183 PolarHBondContact O-N 3.36Å; T180-V184 HydrophobicContact CG2-CG2 4.36Å; T180-V184 VanDerWaalsContact O-CG2 3.3Å; T180-V184 WeakPolarHBondContact O-CG2 3.49Å; T180-V184 PolarHBondContact O-N 3.38Å |
| 181 | A | 93.4 | Very high | 89.1 | Confident | 7 Ų | 7 | 45.6 Ų | 45.6 | 6% | 0.058 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L101 V104 A105 V177 G178 V179 A185 | L101-A181 HydrophobicContact CD2-CB 4.39Å; V104-A181 HydrophobicContact CB-CB 4.31Å; V104-A181 HydrophobicContact CG1-CB 4.01Å; A105-A181 HydrophobicContact CB-CB 4.23Å; V177-A181 VanDerWaalsContact O-CB 3.27Å; V177-A181 WeakPolarHBondContact O-CB 3.24Å; V177-A181 PolarHBondContact O-N 3.33Å; G178-A181 PolarHBondContact O-N 3.12Å; V179-A181 VanDerWaalsContact C-N 3.29Å; V179-A181 PolarHBondContact O-N 3.07Å; A181-A185 VanDerWaalsContact O-CB 3.28Å; A181-A185 WeakPolarHBondContact O-CB 3.23Å; A181-A185 PolarHBondContact O-N 2.78Å |
| 182 | V | 93.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.8 | -44.1 | 176 | -178.7 | 0 | 0 | 0 | 0 | 111.4 | A105 L109 Y114 T117 Y118 G178 V179 V184 A185 C186 | A105-V182 HydrophobicContact CB-CB 4.4Å; A105-V182 HydrophobicContact CB-CG2 3.2Å; L109-V182 HydrophobicContact CD1-CG2 3.58Å; Y114-V182 HydrophobicContact CD2-CG2 3.81Å; Y114-V182 HydrophobicContact CE2-CG2 4.23Å; T117-V182 HydrophobicContact CG2-CB 3.97Å; T117-V182 HydrophobicContact CG2-CG1 3.6Å; Y118-V182 HydrophobicContact CD2-CG1 4.4Å; G178-V182 PolarHBondContact O-N 3.4Å; V179-V182 PolarHBondContact O-N 3.38Å; V182-V184 PolarHBondContact O-N 3.38Å; V182-A185 CarbonylContact O-C 3.52Å; V182-A185 WeakPolarHBondContact O-CB 3.39Å; V182-A185 PolarHBondContact O-N 3.07Å; V182-A185 VanDerWaalsContact O-N 3.16Å; V182-C186 PolarHBondContact O-N 3.18Å; V182-C186 PolarHBondContact O-SG 3.21Å |
| 183 | L | 94.3 | Very high | 91.3 | Very high | 69 Ų | 69 | 37.7 Ų | 37.7 | 36% | 0.361 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -61.7 | -45.3 | -179.2 | -70.9 | 175.5 | 0 | 0 | 0 | 111.6 | T117 L120 V179 T180 A185 C186 C187 | T117-L183 HydrophobicContact CG2-CD2 4.14Å; L120-L183 HydrophobicContact CD2-CD2 3.73Å; V179-L183 HydrophobicContact CG1-CD1 3.92Å; V179-L183 HydrophobicContact CG1-CG 4.31Å; V179-L183 WeakPolarHBondContact O-CG 3.2Å; V179-L183 PolarHBondContact O-N 3.44Å; T180-L183 PolarHBondContact O-N 3.36Å; L183-A185 VanDerWaalsContact C-N 3.33Å; L183-A185 PolarHBondContact O-N 3.39Å; L183-C186 PolarHBondContact O-N 3.34Å; L183-C187 PolarHBondContact O-N 3.4Å; L183-C187 PolarHBondContact O-SG 2.84Å |
| 184 | V | 95.2 | Very high | 92.4 | Very high | 70 Ų | 70 | 35.7 Ų | 35.7 | 42% | 0.424 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -62.8 | -42 | 174.8 | 178.2 | 0 | 0 | 0 | 0 | 110.3 | L101 T180 V182 C186 C187 S188 | L101-V184 HydrophobicContact CD1-CB 4.02Å; L101-V184 HydrophobicContact CD1-CG1 3.53Å; T180-V184 HydrophobicContact CG2-CG2 4.36Å; T180-V184 VanDerWaalsContact O-CG2 3.3Å; T180-V184 WeakPolarHBondContact O-CG2 3.49Å; T180-V184 PolarHBondContact O-N 3.38Å; V182-V184 PolarHBondContact O-N 3.38Å; V184-C186 PolarHBondContact O-N 3.08Å; V184-C187 PolarHBondContact O-N 2.92Å; V184-S188 WeakPolarHBondContact O-CB 3.38Å; V184-S188 PolarHBondContact O-N 2.94Å; V184-S188 PolarHBondContact O-OG 3.35Å |
| 185 | A | 94 | Very high | 93 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.9 | -37.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q98 L101 L102 A181 V182 L183 S188 S189 | Q98-A185 HydrophobicContact CG-CB 4.14Å; L101-A185 HydrophobicContact CB-CB 3.89Å; L101-A185 HydrophobicContact CD1-CB 4.4Å; L102-A185 HydrophobicContact CD2-CB 3.71Å; L102-A185 HydrophobicContact CG-CB 4.16Å; A181-A185 VanDerWaalsContact O-CB 3.28Å; A181-A185 WeakPolarHBondContact O-CB 3.23Å; A181-A185 PolarHBondContact O-N 2.78Å; V182-A185 CarbonylContact O-C 3.52Å; V182-A185 WeakPolarHBondContact O-CB 3.39Å; V182-A185 PolarHBondContact O-N 3.07Å; V182-A185 VanDerWaalsContact O-N 3.16Å; L183-A185 VanDerWaalsContact C-N 3.33Å; L183-A185 PolarHBondContact O-N 3.39Å; A185-S188 WeakPolarHBondContact CA-OG 3.42Å; A185-S188 PolarHBondContact O-OG 2.85Å; A185-S189 VanDerWaalsContact O-CB 3.29Å; A185-S189 WeakPolarHBondContact O-CB 3.48Å; A185-S189 PolarHBondContact O-N 3.28Å |
| 186 | C | 93.6 | Very high | 93.4 | Very high | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.007 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.2 | -50.2 | 175.7 | -72 | 0 | 0 | 0 | 0 | 111 | Y118 L120 K121 T124 V182 L183 V184 S188 S189 G190 | Y118-C186 PolarHBondContact O-SG 3.25Å; Y118-C186 VanDerWaalsContact O-SG 3.35Å; L120-C186 HydrophobicContact CB-CB 4.34Å; K121-C186 HydrophobicContact CB-CB 4.3Å; T124-C186 PolarHBondContact OG1-O 3.1Å; T124-C186 VanDerWaalsContact OG1-O 3.13Å; V182-C186 PolarHBondContact O-N 3.18Å; V182-C186 PolarHBondContact O-SG 3.21Å; L183-C186 PolarHBondContact O-N 3.34Å; V184-C186 PolarHBondContact O-N 3.08Å; C186-S188 VanDerWaalsContact C-N 3.34Å; C186-S188 PolarHBondContact O-N 2.93Å; C186-S189 PolarHBondContact O-N 3.03Å; C186-G190 PolarHBondContact O-N 2.85Å |
| 187 | C | 94.8 | Very high | 93.6 | Very high | 58 Ų | 58 | 25.3 Ų | 25.3 | 39% | 0.392 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -60.3 | -44.3 | 177.5 | -71.5 | 0 | 0 | 0 | 0 | 111.6 | F128 L183 V184 S189 G190 F191 | F128-C187 WeakPolarHBondContact CE2-O 3.49Å; L183-C187 PolarHBondContact O-N 3.4Å; L183-C187 PolarHBondContact O-SG 2.84Å; V184-C187 PolarHBondContact O-N 2.92Å; C187-S189 VanDerWaalsContact C-N 3.34Å; C187-S189 PolarHBondContact O-N 3.4Å; C187-G190 PolarHBondContact O-N 2.83Å; C187-F191 WeakPolarHBondContact O-CB 3.07Å; C187-F191 PolarHBondContact O-N 3.45Å |
| 188 | S | 94.3 | Very high | 93.7 | Very high | 16 Ų | 16 | 24.7 Ų | 24.7 | 11% | 0.112 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.8 | -38.9 | 179.6 | 79.1 | 0 | 0 | 0 | 0 | 111.6 | I94 V184 A185 C186 A192 | I94-S188 VanDerWaalsContact CG2-O 3.3Å; I94-S188 WeakPolarHBondContact CG2-O 3.5Å; V184-S188 WeakPolarHBondContact O-CB 3.38Å; V184-S188 PolarHBondContact O-N 2.94Å; V184-S188 PolarHBondContact O-OG 3.35Å; A185-S188 WeakPolarHBondContact CA-OG 3.42Å; A185-S188 PolarHBondContact O-OG 2.85Å; C186-S188 VanDerWaalsContact C-N 3.34Å; C186-S188 PolarHBondContact O-N 2.93Å; S188-A192 VanDerWaalsContact O-CB 3.31Å; S188-A192 WeakPolarHBondContact O-CB 3.36Å; S188-A192 PolarHBondContact O-N 3.11Å |
| 189 | S | 92.3 | Very high | 93.7 | Very high | 20 Ų | 20 | 25.6 Ų | 25.6 | 14% | 0.14 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.2 | -48.2 | 175 | -158.2 | 0 | 0 | 0 | 0 | 112.8 | Q98 A185 C186 C187 G193 | Q98-S189 PolarHBondContact NE2-OG 2.91Å; Q98-S189 VanDerWaalsContact OE1-CA 3.22Å; Q98-S189 PolarHBondContact OE1-OG 2.77Å; A185-S189 VanDerWaalsContact O-CB 3.29Å; A185-S189 WeakPolarHBondContact O-CB 3.48Å; A185-S189 PolarHBondContact O-N 3.28Å; C186-S189 PolarHBondContact O-N 3.03Å; C187-S189 VanDerWaalsContact C-N 3.34Å; C187-S189 PolarHBondContact O-N 3.4Å; S189-G193 PolarHBondContact O-N 3.48Å |
| 190 | G | 92.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -60.7 | -46.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | T125 C186 C187 V194 | T125-G190 WeakPolarHBondContact OG1-CA 3.14Å; C186-G190 PolarHBondContact O-N 2.85Å; C187-G190 PolarHBondContact O-N 2.83Å; G190-V194 WeakPolarHBondContact O-CB 3.41Å; G190-V194 VanDerWaalsContact O-CG2 3.27Å; G190-V194 WeakPolarHBondContact O-CG2 3.29Å; G190-V194 PolarHBondContact O-N 3.26Å |
| 191 | F | 95.3 | Very high | 93.4 | Very high | 64 Ų | 64 | 25 Ų | 25 | 28% | 0.281 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -61.8 | -53.9 | 177.5 | 179 | -92.1 | 0 | 0 | 0 | 112 | I90 I94 F128 M132 C187 G193 V194 Y195 | I90-F191 HydrophobicContact CG2-CE1 4.37Å; I94-F191 HydrophobicContact CD1-CD1 3.51Å; I94-F191 HydrophobicContact CD1-CE1 3.57Å; F128-F191 HydrophobicContact CD1-CD2 4.19Å; F128-F191 HydrophobicContact CD2-CB 4.13Å; F128-F191 HydrophobicContact CE1-CB 4.4Å; F128-F191 AromaticContact CE1-CD2 3.97Å; F128-F191 HydrophobicContact CE1-CD2 3.97Å; F128-F191 HydrophobicContact CE2-CB 3.89Å; F128-F191 HydrophobicContact CZ-CB 4.04Å; F128-F191 HydrophobicContact CZ-CD2 4.35Å; M132-F191 HydrophobicContact CE-CD2 4.13Å; M132-F191 HydrophobicContact CE-CE2 3.82Å; M132-F191 HydrophobicContact CE-CZ 4.4Å; M132-F191 HydrophobicContact SD-CD2 3.75Å; M132-F191 HydrophobicContact SD-CE2 3.93Å; C187-F191 WeakPolarHBondContact O-CB 3.07Å; C187-F191 PolarHBondContact O-N 3.45Å; F191-G193 VanDerWaalsContact C-N 3.32Å; F191-G193 PolarHBondContact O-N 2.76Å; F191-V194 PolarHBondContact O-N 3.43Å; F191-Y195 HydrophobicContact CE1-CD2 4.46Å; F191-Y195 HydrophobicContact CE1-CG 4.38Å; F191-Y195 HydrophobicContact CZ-CD2 4.11Å; F191-Y195 HydrophobicContact CZ-CG 4.47Å; F191-Y195 WeakPolarHBondContact O-CB 3.44Å; F191-Y195 PolarHBondContact O-N 2.67Å |
| 192 | A | 94.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.1 | -40.9 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | P91 I94 Y95 S188 F196 | P91-A192 HydrophobicContact CB-CB 4.26Å; I94-A192 HydrophobicContact CB-CB 3.99Å; I94-A192 HydrophobicContact CG2-CB 3.71Å; Y95-A192 HydrophobicContact CD1-CB 4.06Å; Y95-A192 HydrophobicContact CE1-CB 3.74Å; Y95-A192 HydrophobicContact CE2-CB 4.22Å; Y95-A192 HydrophobicContact CG-CB 4.44Å; S188-A192 VanDerWaalsContact O-CB 3.31Å; S188-A192 WeakPolarHBondContact O-CB 3.36Å; S188-A192 PolarHBondContact O-N 3.11Å; A192-F196 VanDerWaalsContact O-CB 3.28Å; A192-F196 WeakPolarHBondContact O-CB 3.24Å; A192-F196 PolarHBondContact O-N 3.42Å |
| 193 | G | 92.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64 | -47 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | Y95 S189 F191 E197 N270 | Y95-G193 WeakPolarHBondContact OH-CA 3.33Å; Y95-G193 PolarHBondContact OH-N 3.18Å; S189-G193 PolarHBondContact O-N 3.48Å; F191-G193 VanDerWaalsContact C-N 3.32Å; F191-G193 PolarHBondContact O-N 2.76Å; G193-E197 PolarHBondContact O-N 3.26Å; G193-N270 WeakPolarHBondContact CA-ND2 3.23Å |
| 194 | V | 95.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -72.5 | -36.7 | 179.5 | 174.4 | 0 | 0 | 0 | 0 | 111.9 | T125 F128 M132 L133 G190 F191 E197 K198 | T125-V194 HydrophobicContact CG2-CG2 4.08Å; T125-V194 WeakPolarHBondContact O-CG2 3.27Å; F128-V194 HydrophobicContact CB-CB 3.99Å; F128-V194 HydrophobicContact CB-CG1 4.17Å; F128-V194 HydrophobicContact CB-CG2 3.88Å; F128-V194 WeakPolarHBondContact O-CG1 3.44Å; M132-V194 HydrophobicContact CB-CG1 3.93Å; M132-V194 HydrophobicContact CE-CG1 4.48Å; M132-V194 HydrophobicContact CG-CG1 4.49Å; M132-V194 HydrophobicContact SD-CB 4.41Å; M132-V194 HydrophobicContact SD-CG1 4.03Å; L133-V194 HydrophobicContact CD1-CG1 3.68Å; L133-V194 HydrophobicContact CG-CG1 3.96Å; G190-V194 WeakPolarHBondContact O-CB 3.41Å; G190-V194 VanDerWaalsContact O-CG2 3.27Å; G190-V194 WeakPolarHBondContact O-CG2 3.29Å; G190-V194 PolarHBondContact O-N 3.26Å; F191-V194 PolarHBondContact O-N 3.43Å; V194-E197 WeakPolarHBondContact O-CB 3.27Å; V194-E197 PolarHBondContact O-N 3.22Å; V194-K198 WeakPolarHBondContact O-CB 3.43Å; V194-K198 PolarHBondContact O-N 3.21Å |
| 195 | Y | 94.9 | Very high | 91.5 | Very high | 44 Ų | 44 | 37.5 Ų | 37.5 | 17% | 0.173 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.7 | -43.8 | 174.5 | -172.4 | -98.9 | 0 | 0 | 0 | 111.4 | K87 I90 P91 M132 F191 K198 I199 | K87-Y195 WeakPolarHBondContact O-CE1 3.33Å; I90-Y195 HydrophobicContact CB-CE1 4.15Å; I90-Y195 HydrophobicContact CD1-CE1 4.35Å; I90-Y195 HydrophobicContact CG2-CE1 4.32Å; P91-Y195 HydrophobicContact CB-CD1 4.42Å; P91-Y195 HydrophobicContact CG-CD1 4.15Å; M132-Y195 HydrophobicContact CE-CD2 3.71Å; M132-Y195 HydrophobicContact CE-CG 4.27Å; F191-Y195 HydrophobicContact CE1-CD2 4.46Å; F191-Y195 HydrophobicContact CE1-CG 4.38Å; F191-Y195 HydrophobicContact CZ-CD2 4.11Å; F191-Y195 HydrophobicContact CZ-CG 4.47Å; F191-Y195 WeakPolarHBondContact O-CB 3.44Å; F191-Y195 PolarHBondContact O-N 2.67Å; Y195-K198 WeakPolarHBondContact O-CB 3.43Å; Y195-K198 PolarHBondContact O-N 2.67Å; Y195-I199 HydrophobicContact CD1-CD1 3.69Å; Y195-I199 HydrophobicContact CD1-CG1 4.45Å; Y195-I199 HydrophobicContact CE1-CD1 3.2Å; Y195-I199 HydrophobicContact CE1-CG1 4.15Å; Y195-I199 PolarHBondContact O-N 3.03Å |
| 196 | F | 93.1 | Very high | 91.3 | Very high | 5 Ų | 5 | 38.7 Ų | 38.7 | 2% | 0.022 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -64.8 | -40.8 | 174.4 | -178.6 | -120.5 | 0 | 0 | 0 | 111.9 | L88 P91 A192 K198 I199 L200 L214 I265 | L88-F196 HydrophobicContact CD2-CD2 3.67Å; L88-F196 HydrophobicContact CD2-CE2 3.77Å; P91-F196 HydrophobicContact CB-CB 4.29Å; A192-F196 VanDerWaalsContact O-CB 3.28Å; A192-F196 WeakPolarHBondContact O-CB 3.24Å; A192-F196 PolarHBondContact O-N 3.42Å; F196-K198 VanDerWaalsContact C-N 3.3Å; F196-K198 PolarHBondContact O-N 3.15Å; F196-I199 PolarHBondContact O-N 2.95Å; F196-L200 HydrophobicContact CD1-CD1 3.8Å; F196-L200 HydrophobicContact CD1-CG 4.43Å; F196-L200 HydrophobicContact CD2-CD1 4.48Å; F196-L200 HydrophobicContact CD2-CG 4.27Å; F196-L200 HydrophobicContact CE1-CD1 3.3Å; F196-L200 HydrophobicContact CE1-CG 4.06Å; F196-L200 HydrophobicContact CE2-CD1 4.03Å; F196-L200 HydrophobicContact CE2-CD2 4.12Å; F196-L200 HydrophobicContact CE2-CG 3.86Å; F196-L200 HydrophobicContact CG-CD1 4.38Å; F196-L200 HydrophobicContact CZ-CD1 3.43Å; F196-L200 VanDerWaalsContact CZ-CD1 3.43Å; F196-L200 HydrophobicContact CZ-CD2 3.98Å; F196-L200 HydrophobicContact CZ-CG 3.76Å; F196-L200 WeakPolarHBondContact O-CB 3.2Å; F196-L200 WeakPolarHBondContact O-CG 3.47Å; F196-L200 PolarHBondContact O-N 3.29Å; F196-L214 HydrophobicContact CD2-CD1 4.49Å; F196-L214 HydrophobicContact CD2-CD2 4.18Å; F196-L214 HydrophobicContact CE1-CD2 4.18Å; F196-L214 HydrophobicContact CE2-CB 4.37Å; F196-L214 HydrophobicContact CE2-CD2 3.72Å; F196-L214 HydrophobicContact CE2-CG 4.44Å; F196-L214 HydrophobicContact CZ-CD2 3.71Å; F196-I265 HydrophobicContact CD1-CD1 3.79Å; F196-I265 HydrophobicContact CE1-CD1 4.08Å |
| 197 | E | 94.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -56.8 | -44.2 | 172.1 | -179.6 | 175.5 | 166 | 0 | 0 | 111.8 | L133 R135 G193 V194 L200 K201 I265 D269 N270 | L133-E197 HydrophobicContact CD1-CB 4.37Å; L133-E197 HydrophobicContact CD1-CG 3.94Å; L133-E197 HydrophobicContact CD2-CG 4.46Å; R135-E197 IonicContact CZ-OE1 3.6Å; R135-E197 IonicContact NE-OE1 2.65Å; R135-E197 IonicContact NH2-OE1 2.77Å; R135-E197 PolarHBondContact NH2-OE1 3.2Å; G193-E197 PolarHBondContact O-N 3.26Å; V194-E197 WeakPolarHBondContact O-CB 3.27Å; V194-E197 PolarHBondContact O-N 3.22Å; E197-L200 PolarHBondContact O-N 3.18Å; E197-K201 HydrophobicContact CG-CD 3.83Å; E197-K201 HydrophobicContact CG-CG 4.42Å; E197-K201 WeakPolarHBondContact O-CB 3.26Å; E197-K201 WeakPolarHBondContact O-CG 3.36Å; E197-K201 PolarHBondContact O-N 2.89Å; E197-K201 IonicContact OE1-NZ 2.8Å; E197-K201 PolarHBondContact OE1-NZ 3.32Å; E197-I265 HydrophobicContact CB-CG2 3.62Å; E197-I265 HydrophobicContact CG-CG2 3.82Å; E197-D269 WeakPolarHBondContact OE1-CB 3.36Å; E197-N270 WeakPolarHBondContact OE2-CB 3.34Å; E197-N270 PolarHBondContact OE2-N 3.34Å |
| 198 | K | 93.2 | Very high | 91 | Very high | 62 Ų | 62 | 38.2 Ų | 38.2 | 27% | 0.27 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -60.1 | -50.4 | 177.5 | -172.9 | 173.4 | -173.7 | 165.1 | 0 | 111.6 | M132 L133 V194 Y195 F196 L200 K201 E202 | M132-K198 PolarHBondContact O-NZ 3.46Å; L133-K198 HydrophobicContact CD2-CB 3.84Å; L133-K198 HydrophobicContact CD2-CG 4.19Å; V194-K198 WeakPolarHBondContact O-CB 3.43Å; V194-K198 PolarHBondContact O-N 3.21Å; Y195-K198 WeakPolarHBondContact O-CB 3.43Å; Y195-K198 PolarHBondContact O-N 2.67Å; F196-K198 VanDerWaalsContact C-N 3.3Å; F196-K198 PolarHBondContact O-N 3.15Å; K198-L200 VanDerWaalsContact C-N 3.31Å; K198-L200 PolarHBondContact O-N 3.44Å; K198-K201 PolarHBondContact O-N 2.9Å; K198-E202 VanDerWaalsContact CE-CD 3.46Å; K198-E202 WeakPolarHBondContact CE-OE1 3.33Å; K198-E202 WeakPolarHBondContact CE-OE2 3.23Å; K198-E202 VanDerWaalsContact CG-CD 3.41Å; K198-E202 HydrophobicContact CG-CG 4.17Å; K198-E202 WeakPolarHBondContact CG-OE1 3.23Å; K198-E202 WeakPolarHBondContact CG-OE2 3.32Å; K198-E202 IonicContact NZ-OE1 3.58Å; K198-E202 WeakPolarHBondContact O-CB 3.35Å; K198-E202 WeakPolarHBondContact O-CG 3.26Å; K198-E202 PolarHBondContact O-N 2.9Å |
| 199 | I | 91.7 | Very high | 90.9 | Very high | 18 Ų | 18 | 37.8 Ų | 37.8 | 9% | 0.092 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60 | -42.2 | 177.5 | -67.8 | 172.4 | 0 | 0 | 0 | 111.5 | K87 L88 Y195 F196 S203 | K87-I199 HydrophobicContact CB-CD1 3.97Å; L88-I199 HydrophobicContact CD2-CB 4.49Å; L88-I199 HydrophobicContact CD2-CD1 4.06Å; L88-I199 HydrophobicContact CD2-CG2 3.94Å; L88-I199 HydrophobicContact CG-CG2 4.41Å; Y195-I199 HydrophobicContact CD1-CD1 3.69Å; Y195-I199 HydrophobicContact CD1-CG1 4.45Å; Y195-I199 HydrophobicContact CE1-CD1 3.2Å; Y195-I199 HydrophobicContact CE1-CG1 4.15Å; Y195-I199 PolarHBondContact O-N 3.03Å; F196-I199 PolarHBondContact O-N 2.95Å; I199-S203 WeakPolarHBondContact O-CB 3.47Å; I199-S203 PolarHBondContact O-N 3.16Å |
| 200 | L | 89.4 | Confident | 90.9 | Very high | 9 Ų | 9 | 37.3 Ų | 37.3 | 5% | 0.047 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.7 | -37.3 | 179.9 | -79.2 | 179.6 | 0 | 0 | 0 | 112.8 | F196 E197 K198 V207 R210 I265 | F196-L200 HydrophobicContact CD1-CD1 3.8Å; F196-L200 HydrophobicContact CD1-CG 4.43Å; F196-L200 HydrophobicContact CD2-CD1 4.48Å; F196-L200 HydrophobicContact CD2-CG 4.27Å; F196-L200 HydrophobicContact CE1-CD1 3.3Å; F196-L200 HydrophobicContact CE1-CG 4.06Å; F196-L200 HydrophobicContact CE2-CD1 4.03Å; F196-L200 HydrophobicContact CE2-CD2 4.12Å; F196-L200 HydrophobicContact CE2-CG 3.86Å; F196-L200 HydrophobicContact CG-CD1 4.38Å; F196-L200 HydrophobicContact CZ-CD1 3.43Å; F196-L200 VanDerWaalsContact CZ-CD1 3.43Å; F196-L200 HydrophobicContact CZ-CD2 3.98Å; F196-L200 HydrophobicContact CZ-CG 3.76Å; F196-L200 WeakPolarHBondContact O-CB 3.2Å; F196-L200 WeakPolarHBondContact O-CG 3.47Å; F196-L200 PolarHBondContact O-N 3.29Å; E197-L200 PolarHBondContact O-N 3.18Å; K198-L200 VanDerWaalsContact C-N 3.31Å; K198-L200 PolarHBondContact O-N 3.44Å; L200-V207 HydrophobicContact CD2-CB 4.37Å; L200-V207 HydrophobicContact CD2-CG1 4.05Å; L200-V207 HydrophobicContact CD2-CG2 4.07Å; L200-R210 HydrophobicContact CD2-CB 3.52Å; L200-R210 HydrophobicContact CD2-CG 3.91Å; L200-I265 HydrophobicContact CD1-CB 4.1Å; L200-I265 HydrophobicContact CD1-CG2 3.66Å |
| 201 | K | 89.6 | Confident | 90.9 | Very high | 81 Ų | 81 | 37.6 Ų | 37.6 | 35% | 0.352 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -90 | -29.1 | -173.9 | -70.9 | -176.2 | 177.4 | 178.1 | 0 | 114.2 | E197 K198 S203 I265 A268 | E197-K201 HydrophobicContact CG-CD 3.83Å; E197-K201 HydrophobicContact CG-CG 4.42Å; E197-K201 WeakPolarHBondContact O-CB 3.26Å; E197-K201 WeakPolarHBondContact O-CG 3.36Å; E197-K201 PolarHBondContact O-N 2.89Å; E197-K201 IonicContact OE1-NZ 2.8Å; E197-K201 PolarHBondContact OE1-NZ 3.32Å; K198-K201 PolarHBondContact O-N 2.9Å; K201-S203 VanDerWaalsContact C-N 3.34Å; K201-I265 WeakPolarHBondContact CE-O 3.14Å; K201-A268 PolarHBondContact NZ-O 3.36Å |
| 202 | E | 87.5 | Confident | 90.8 | Very high | 138 Ų | 138 | 34.8 Ų | 34.8 | 65% | 0.645 | 16% | 0.16 | S | C | * | . | H | α-helix | trans | -81.9 | -15.7 | 178.4 | -68 | -178.7 | 166.7 | 0 | 0 | 112.8 | K198 | K198-E202 VanDerWaalsContact CE-CD 3.46Å; K198-E202 WeakPolarHBondContact CE-OE1 3.33Å; K198-E202 WeakPolarHBondContact CE-OE2 3.23Å; K198-E202 VanDerWaalsContact CG-CD 3.41Å; K198-E202 HydrophobicContact CG-CG 4.17Å; K198-E202 WeakPolarHBondContact CG-OE1 3.23Å; K198-E202 WeakPolarHBondContact CG-OE2 3.32Å; K198-E202 IonicContact NZ-OE1 3.58Å; K198-E202 WeakPolarHBondContact O-CB 3.35Å; K198-E202 WeakPolarHBondContact O-CG 3.26Å; K198-E202 PolarHBondContact O-N 2.9Å |
| 203 | S | 82.2 | Confident | 90.8 | Very high | 27 Ų | 27 | 34.8 Ų | 34.8 | 19% | 0.189 | 16% | 0.16 | C | C | . | . | trans | -98.8 | 139.3 | -177.8 | 169.5 | 0 | 0 | 0 | 0 | 112.2 | I199 K201 Q205 R210 | I199-S203 WeakPolarHBondContact O-CB 3.47Å; I199-S203 PolarHBondContact O-N 3.16Å; K201-S203 VanDerWaalsContact C-N 3.34Å; S203-Q205 VanDerWaalsContact C-N 3.29Å; S203-Q205 PolarHBondContact O-N 2.93Å; S203-Q205 WeakPolarHBondContact OG-CB 3.38Å; S203-Q205 PolarHBondContact OG-N 3.1Å; S203-Q205 VanDerWaalsContact OG-N 3.13Å; S203-R210 PolarHBondContact OG-NE 3.48Å; S203-R210 PolarHBondContact OG-NH2 3.15Å | ||
| 204 | K | 83.7 | Confident | 90.7 | Very high | 219 Ų | 219 | 35.9 Ų | 35.9 | 95% | 0.952 | 17% | 0.166 | S | C | * | . | trans | -77.3 | -11 | 171.2 | -67.2 | -175.4 | 180 | 179.2 | 0 | 114.1 | ||||
| 205 | Q | 83.9 | Confident | 90.6 | Very high | 26 Ų | 26 | 35.9 Ų | 35.9 | 12% | 0.121 | 17% | 0.166 | C | C | . | . | S | Bend | trans | -61.1 | 151.8 | -179.9 | -70.7 | 169.7 | 6.6 | 0 | 0 | 112.6 | E77 E84 S203 R210 | E77-Q205 WeakPolarHBondContact OE2-CG 3.14Å; E77-Q205 PolarHBondContact OE2-NE2 3.4Å; E84-Q205 PolarHBondContact OE2-NE2 3.47Å; S203-Q205 VanDerWaalsContact C-N 3.29Å; S203-Q205 PolarHBondContact O-N 2.93Å; S203-Q205 WeakPolarHBondContact OG-CB 3.38Å; S203-Q205 PolarHBondContact OG-N 3.1Å; S203-Q205 VanDerWaalsContact OG-N 3.13Å; Q205-R210 HydrophobicContact CB-CG 4.46Å; Q205-R210 VanDerWaalsContact CD-NH2 3.35Å; Q205-R210 VanDerWaalsContact OE1-NH1 3.09Å |
| 206 | S | 88.4 | Confident | 90.5 | Very high | 24 Ų | 24 | 36.6 Ų | 36.6 | 17% | 0.168 | 17% | 0.171 | C | C | . | . | trans | -59.5 | 139.8 | 173.5 | -179.3 | 0 | 0 | 0 | 0 | 110.7 | E62 W208 I209 R210 | E62-S206 PolarHBondContact OE2-OG 3.19Å; S206-W208 PolarHBondContact O-N 2.96Å; S206-W208 VanDerWaalsContact OG-CD1 3.29Å; S206-W208 PolarHBondContact OG-N 3.47Å; S206-I209 PolarHBondContact O-N 3.32Å; S206-I209 VanDerWaalsContact O-N 3.11Å; S206-R210 PolarHBondContact O-N 3.24Å | ||
| 207 | V | 91.2 | Very high | 90.6 | Very high | 4 Ų | 4 | 38.5 Ų | 38.5 | 2% | 0.024 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.7 | -29.2 | 179.1 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | L200 R210 N211 A262 K266 | L200-V207 HydrophobicContact CD2-CB 4.37Å; L200-V207 HydrophobicContact CD2-CG1 4.05Å; L200-V207 HydrophobicContact CD2-CG2 4.07Å; V207-R210 PolarHBondContact O-N 3.27Å; V207-N211 VanDerWaalsContact O-CB 3.31Å; V207-N211 WeakPolarHBondContact O-CB 3.28Å; V207-N211 PolarHBondContact O-N 3.44Å; V207-A262 HydrophobicContact CG1-CB 3.97Å; V207-K266 HydrophobicContact CB-CD 4.11Å; V207-K266 HydrophobicContact CG2-CB 4.05Å; V207-K266 HydrophobicContact CG2-CD 3.31Å; V207-K266 HydrophobicContact CG2-CG 3.63Å |
| 208 | W | 92.8 | Very high | 90.4 | Very high | 45 Ų | 45 | 39 Ų | 39 | 17% | 0.17 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -68.9 | -36.4 | 175.7 | -45.3 | 120.4 | 0 | 0 | 0 | 112 | C55 L58 V59 E62 S206 N211 I212 L259 | C55-W208 HydrophobicContact CB-CB 4.23Å; L58-W208 HydrophobicContact CB-CD2 4.13Å; L58-W208 HydrophobicContact CB-CG 4Å; L58-W208 HydrophobicContact CD1-CD2 3.73Å; L58-W208 HydrophobicContact CD1-CE3 3.63Å; L58-W208 HydrophobicContact CD1-CG 4.44Å; L58-W208 HydrophobicContact CD1-CH2 3.89Å; L58-W208 HydrophobicContact CD1-CZ2 4Å; L58-W208 HydrophobicContact CD1-CZ3 3.71Å; V59-W208 HydrophobicContact CG2-CB 3.65Å; E62-W208 PolarHBondContact OE1-NE1 3.4Å; S206-W208 PolarHBondContact O-N 2.96Å; S206-W208 VanDerWaalsContact OG-CD1 3.29Å; S206-W208 PolarHBondContact OG-N 3.47Å; W208-N211 CarbonylContact O-C 3.57Å; W208-N211 PolarHBondContact O-N 3.06Å; W208-I212 VanDerWaalsContact O-CG1 3.3Å; W208-I212 WeakPolarHBondContact O-CG1 3.44Å; W208-I212 PolarHBondContact O-N 3.17Å; W208-L259 HydrophobicContact CZ3-CB 4.37Å; W208-L259 HydrophobicContact CZ3-CD2 4.36Å |
| 209 | I | 91.9 | Very high | 90.5 | Very high | 7 Ų | 7 | 39.3 Ų | 39.3 | 4% | 0.036 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -65.6 | -45.8 | 175.2 | -62.8 | 173.5 | 0 | 0 | 0 | 110.2 | V59 I73 E77 S206 N211 I212 Q213 | V59-I209 HydrophobicContact CG2-CG1 3.9Å; I73-I209 HydrophobicContact CG2-CD1 3.52Å; E77-I209 HydrophobicContact CB-CG2 3.73Å; E77-I209 HydrophobicContact CG-CD1 4.16Å; E77-I209 HydrophobicContact CG-CG2 4.39Å; S206-I209 PolarHBondContact O-N 3.32Å; S206-I209 VanDerWaalsContact O-N 3.11Å; I209-N211 PolarHBondContact O-N 3.06Å; I209-I212 WeakPolarHBondContact O-CB 3.41Å; I209-I212 PolarHBondContact O-N 3.45Å; I209-I212 VanDerWaalsContact O-N 3.15Å; I209-Q213 WeakPolarHBondContact O-CG 3.47Å; I209-Q213 PolarHBondContact O-N 2.65Å |
| 210 | R | 91.5 | Very high | 90.6 | Very high | 11 Ų | 11 | 42.4 Ų | 42.4 | 4% | 0.042 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -59.2 | -36.5 | 174.1 | -70 | -70.6 | -172.7 | -151.7 | -2.9 | 111.7 | E84 L88 L200 S203 Q205 S206 V207 Q213 L214 | E84-R210 IonicContact OE2-CZ 2.8Å; E84-R210 IonicContact OE2-NH1 2.91Å; E84-R210 IonicContact OE2-NH2 3.62Å; E84-R210 PolarHBondContact OE2-NH2 3.19Å; L88-R210 HydrophobicContact CD1-CB 4.48Å; L88-R210 WeakPolarHBondContact CD1-O 3.25Å; L200-R210 HydrophobicContact CD2-CB 3.52Å; L200-R210 HydrophobicContact CD2-CG 3.91Å; S203-R210 PolarHBondContact OG-NE 3.48Å; S203-R210 PolarHBondContact OG-NH2 3.15Å; Q205-R210 HydrophobicContact CB-CG 4.46Å; Q205-R210 VanDerWaalsContact CD-NH2 3.35Å; Q205-R210 VanDerWaalsContact OE1-NH1 3.09Å; S206-R210 PolarHBondContact O-N 3.24Å; V207-R210 PolarHBondContact O-N 3.27Å; R210-Q213 VanDerWaalsContact NH1-OE1 3.07Å; R210-Q213 PolarHBondContact O-N 3.41Å; R210-L214 WeakPolarHBondContact O-CB 3.49Å; R210-L214 PolarHBondContact O-N 2.87Å |
| 211 | N | 92.4 | Very high | 90.8 | Very high | 6 Ų | 6 | 45 Ų | 45 | 3% | 0.032 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -75.7 | -29.4 | 177.8 | -154.5 | 47.4 | 0 | 0 | 0 | 113 | C55 V207 W208 I209 G215 L259 | C55-N211 PolarHBondContact SG-ND2 3.32Å; V207-N211 VanDerWaalsContact O-CB 3.31Å; V207-N211 WeakPolarHBondContact O-CB 3.28Å; V207-N211 PolarHBondContact O-N 3.44Å; W208-N211 CarbonylContact O-C 3.57Å; W208-N211 PolarHBondContact O-N 3.06Å; I209-N211 PolarHBondContact O-N 3.06Å; N211-G215 WeakPolarHBondContact O-CA 3.43Å; N211-G215 PolarHBondContact O-N 3.3Å; N211-L259 WeakPolarHBondContact ND2-CD2 3.33Å |
| 212 | I | 93.6 | Very high | 90.9 | Very high | 4 Ų | 4 | 41.9 Ų | 41.9 | 2% | 0.021 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.6 | -49.4 | 167.8 | -68.7 | 162.8 | 0 | 0 | 0 | 109.6 | I52 C55 V56 V59 L74 I78 W208 I209 L214 G215 M216 | I52-I212 HydrophobicContact CG2-CG2 4.37Å; C55-I212 HydrophobicContact CB-CD1 3.93Å; C55-I212 HydrophobicContact CB-CG1 3.43Å; C55-I212 VanDerWaalsContact CB-CG1 3.43Å; V56-I212 HydrophobicContact CG2-CD1 3.77Å; V56-I212 HydrophobicContact CG2-CG1 4.3Å; V59-I212 HydrophobicContact CG2-CD1 4.18Å; L74-I212 HydrophobicContact CD2-CD1 3.9Å; I78-I212 HydrophobicContact CD1-CG2 3.92Å; W208-I212 VanDerWaalsContact O-CG1 3.3Å; W208-I212 WeakPolarHBondContact O-CG1 3.44Å; W208-I212 PolarHBondContact O-N 3.17Å; I209-I212 WeakPolarHBondContact O-CB 3.41Å; I209-I212 PolarHBondContact O-N 3.45Å; I209-I212 VanDerWaalsContact O-N 3.15Å; I212-L214 PolarHBondContact O-N 3.29Å; I212-G215 PolarHBondContact O-N 3.49Å; I212-M216 HydrophobicContact CG2-CE 4.16Å; I212-M216 HydrophobicContact CG2-CG 4.44Å; I212-M216 HydrophobicContact CG2-SD 4.44Å; I212-M216 WeakPolarHBondContact O-CG 3.43Å; I212-M216 PolarHBondContact O-N 3.4Å |
| 213 | Q | 93.1 | Very high | 91.1 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57 | -49.2 | 177 | -71.5 | 168.8 | -15.2 | 0 | 0 | 111.8 | E77 I78 T85 L88 I209 R210 M216 F217 | E77-Q213 PolarHBondContact O-NE2 3.43Å; I78-Q213 HydrophobicContact CG1-CG 4.25Å; T85-Q213 HydrophobicContact CG2-CB 4.39Å; T85-Q213 HydrophobicContact CG2-CG 4.12Å; T85-Q213 PolarHBondContact OG1-NE2 2.88Å; L88-Q213 HydrophobicContact CD1-CB 3.29Å; L88-Q213 HydrophobicContact CD1-CG 4.21Å; I209-Q213 WeakPolarHBondContact O-CG 3.47Å; I209-Q213 PolarHBondContact O-N 2.65Å; R210-Q213 VanDerWaalsContact NH1-OE1 3.07Å; R210-Q213 PolarHBondContact O-N 3.41Å; Q213-M216 HydrophobicContact CB-CE 4.37Å; Q213-M216 HydrophobicContact CG-CE 4.22Å; Q213-M216 PolarHBondContact O-N 3.1Å; Q213-F217 WeakPolarHBondContact O-CD2 3.07Å; Q213-F217 PolarHBondContact O-N 3.01Å |
| 214 | L | 92 | Very high | 91.5 | Very high | 23 Ų | 23 | 44.2 Ų | 44.2 | 12% | 0.12 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62 | -43.9 | 175.6 | -174.3 | 72.8 | 0 | 0 | 0 | 111.8 | L88 P91 F196 R210 I212 M216 F217 G218 | L88-L214 HydrophobicContact CB-CD1 4.46Å; L88-L214 HydrophobicContact CD2-CD1 4.45Å; L88-L214 WeakPolarHBondContact O-CD1 3.37Å; P91-L214 HydrophobicContact CB-CD1 4.42Å; P91-L214 HydrophobicContact CG-CD1 3.92Å; F196-L214 HydrophobicContact CD2-CD1 4.49Å; F196-L214 HydrophobicContact CD2-CD2 4.18Å; F196-L214 HydrophobicContact CE1-CD2 4.18Å; F196-L214 HydrophobicContact CE2-CB 4.37Å; F196-L214 HydrophobicContact CE2-CD2 3.72Å; F196-L214 HydrophobicContact CE2-CG 4.44Å; F196-L214 HydrophobicContact CZ-CD2 3.71Å; R210-L214 WeakPolarHBondContact O-CB 3.49Å; R210-L214 PolarHBondContact O-N 2.87Å; I212-L214 PolarHBondContact O-N 3.29Å; L214-M216 PolarHBondContact O-N 3.25Å; L214-F217 PolarHBondContact O-N 3.2Å; L214-G218 PolarHBondContact O-N 3.39Å |
| 215 | G | 92.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.9 | -36.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113 | N211 I212 G218 F219 | N211-G215 WeakPolarHBondContact O-CA 3.43Å; N211-G215 PolarHBondContact O-N 3.3Å; I212-G215 PolarHBondContact O-N 3.49Å; G215-G218 CarbonylContact O-C 3.58Å; G215-G218 PolarHBondContact O-N 3.41Å; G215-F219 WeakPolarHBondContact O-CB 3.3Å; G215-F219 PolarHBondContact O-N 3.19Å |
| 216 | M | 93.5 | Very high | 92.1 | Very high | 59 Ų | 59 | 33.5 Ų | 33.5 | 29% | 0.291 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -60.6 | -46.9 | 175.7 | -75.6 | -175.1 | -64.8 | 0 | 0 | 111.7 | I78 I212 Q213 L214 F219 V220 | I78-M216 HydrophobicContact CB-CE 4.49Å; I78-M216 HydrophobicContact CD1-CE 3.87Å; I78-M216 HydrophobicContact CD1-SD 4.4Å; I78-M216 HydrophobicContact CG1-CE 4.04Å; I78-M216 HydrophobicContact CG2-CE 3.66Å; I78-M216 HydrophobicContact CG2-SD 4.32Å; I212-M216 HydrophobicContact CG2-CE 4.16Å; I212-M216 HydrophobicContact CG2-CG 4.44Å; I212-M216 HydrophobicContact CG2-SD 4.44Å; I212-M216 WeakPolarHBondContact O-CG 3.43Å; I212-M216 PolarHBondContact O-N 3.4Å; Q213-M216 HydrophobicContact CB-CE 4.37Å; Q213-M216 HydrophobicContact CG-CE 4.22Å; Q213-M216 PolarHBondContact O-N 3.1Å; L214-M216 PolarHBondContact O-N 3.25Å; M216-F219 PolarHBondContact O-N 3.21Å; M216-V220 WeakPolarHBondContact O-CG2 3.38Å; M216-V220 PolarHBondContact O-N 3.05Å; M216-V220 VanDerWaalsContact O-N 3.13Å |
| 217 | F | 93.8 | Very high | 92.2 | Very high | 45 Ų | 45 | 37.1 Ų | 37.1 | 20% | 0.197 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.3 | -38.2 | 174.7 | -66.2 | -68.5 | 0 | 0 | 0 | 111.8 | T85 A89 Q213 L214 F219 V220 F221 | T85-F217 HydrophobicContact CG2-CE2 3.68Å; T85-F217 HydrophobicContact CG2-CZ 3.95Å; T85-F217 WeakPolarHBondContact O-CE2 3.29Å; A89-F217 HydrophobicContact CB-CB 4.49Å; A89-F217 HydrophobicContact CB-CD1 3.62Å; A89-F217 HydrophobicContact CB-CD2 3.91Å; A89-F217 HydrophobicContact CB-CE1 3.7Å; A89-F217 HydrophobicContact CB-CE2 4.01Å; A89-F217 HydrophobicContact CB-CG 3.73Å; A89-F217 HydrophobicContact CB-CZ 3.9Å; Q213-F217 WeakPolarHBondContact O-CD2 3.07Å; Q213-F217 PolarHBondContact O-N 3.01Å; L214-F217 PolarHBondContact O-N 3.2Å; F217-F219 VanDerWaalsContact C-N 3.31Å; F217-F219 PolarHBondContact O-N 3.45Å; F217-V220 PolarHBondContact O-N 3.12Å; F217-F221 HydrophobicContact CB-CD2 4.36Å; F217-F221 HydrophobicContact CB-CE2 4.04Å; F217-F221 WeakPolarHBondContact O-CD2 3.46Å; F217-F221 WeakPolarHBondContact O-CG 3.45Å; F217-F221 PolarHBondContact O-N 3.27Å |
| 218 | G | 91.7 | Very high | 92.1 | Very high | 12 Ų | 12 | 40 Ų | 40 | 12% | 0.124 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.8 | -41.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | S92 L214 G215 G222 | S92-G218 VanDerWaalsContact OG-CA 3.28Å; S92-G218 WeakPolarHBondContact OG-CA 3.31Å; S92-G218 PolarHBondContact OG-N 2.91Å; L214-G218 PolarHBondContact O-N 3.39Å; G215-G218 CarbonylContact O-C 3.58Å; G215-G218 PolarHBondContact O-N 3.41Å; G218-G222 WeakPolarHBondContact O-CA 3.3Å; G218-G222 PolarHBondContact O-N 3.29Å |
| 219 | F | 94.2 | Very high | 91.7 | Very high | 68 Ų | 68 | 45 Ų | 45 | 30% | 0.298 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.1 | -48.2 | 174.4 | 171.7 | -101.2 | 0 | 0 | 0 | 111.4 | V45 E48 V49 I52 G215 M216 F217 G222 L223 | V45-F219 HydrophobicContact CG1-CD2 3.81Å; V45-F219 HydrophobicContact CG1-CE2 3.6Å; E48-F219 HydrophobicContact CB-CB 4.29Å; V49-F219 HydrophobicContact CG2-CD2 3.56Å; V49-F219 HydrophobicContact CG2-CE2 3.55Å; I52-F219 HydrophobicContact CD1-CB 4.35Å; G215-F219 WeakPolarHBondContact O-CB 3.3Å; G215-F219 PolarHBondContact O-N 3.19Å; M216-F219 PolarHBondContact O-N 3.21Å; F217-F219 VanDerWaalsContact C-N 3.31Å; F217-F219 PolarHBondContact O-N 3.45Å; F219-G222 PolarHBondContact O-N 2.93Å; F219-L223 HydrophobicContact CE1-CD2 4.37Å; F219-L223 HydrophobicContact CZ-CD2 4.25Å; F219-L223 VanDerWaalsContact O-CB 3.24Å; F219-L223 WeakPolarHBondContact O-CB 3.45Å; F219-L223 PolarHBondContact O-N 3.46Å |
| 220 | V | 94.8 | Very high | 91.6 | Very high | 82 Ų | 82 | 45.9 Ų | 45.9 | 50% | 0.497 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.4 | -49 | 179.5 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | M216 F217 L223 F224 | M216-V220 WeakPolarHBondContact O-CG2 3.38Å; M216-V220 PolarHBondContact O-N 3.05Å; M216-V220 VanDerWaalsContact O-N 3.13Å; F217-V220 PolarHBondContact O-N 3.12Å; V220-L223 PolarHBondContact O-N 3.4Å; V220-F224 PolarHBondContact O-N 2.91Å |
| 221 | F | 92.4 | Very high | 91.5 | Very high | 64 Ų | 64 | 46.6 Ų | 46.6 | 28% | 0.281 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -68 | -37 | 178.6 | -62.7 | -40.3 | 0 | 0 | 0 | 112.6 | S92 T96 F217 F224 G225 | S92-F221 WeakPolarHBondContact OG-CD2 3.39Å; T96-F221 HydrophobicContact CG2-CB 4.22Å; T96-F221 WeakPolarHBondContact OG1-CB 3.47Å; F217-F221 HydrophobicContact CB-CD2 4.36Å; F217-F221 HydrophobicContact CB-CE2 4.04Å; F217-F221 WeakPolarHBondContact O-CD2 3.46Å; F217-F221 WeakPolarHBondContact O-CG 3.45Å; F217-F221 PolarHBondContact O-N 3.27Å; F221-F224 PolarHBondContact O-N 3.43Å; F221-G225 PolarHBondContact O-N 2.69Å |
| 222 | G | 90.9 | Very high | 91.3 | Very high | 16 Ų | 16 | 53.1 Ų | 53.1 | 17% | 0.165 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | V45 G218 F219 G225 M226 | V45-G222 WeakPolarHBondContact CG2-O 3.44Å; G218-G222 WeakPolarHBondContact O-CA 3.3Å; G218-G222 PolarHBondContact O-N 3.29Å; F219-G222 PolarHBondContact O-N 2.93Å; G222-G225 PolarHBondContact O-N 2.88Å; G222-M226 WeakPolarHBondContact O-CB 3.43Å; G222-M226 PolarHBondContact O-N 3.02Å |
| 223 | L | 92.4 | Very high | 91 | Very high | 59 Ų | 59 | 59.5 Ų | 59.5 | 31% | 0.309 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.3 | -46.1 | 176.6 | -176.1 | 68.1 | 0 | 0 | 0 | 110.7 | F219 V220 G225 M226 L227 | F219-L223 HydrophobicContact CE1-CD2 4.37Å; F219-L223 HydrophobicContact CZ-CD2 4.25Å; F219-L223 VanDerWaalsContact O-CB 3.24Å; F219-L223 WeakPolarHBondContact O-CB 3.45Å; F219-L223 PolarHBondContact O-N 3.46Å; V220-L223 PolarHBondContact O-N 3.4Å; L223-G225 VanDerWaalsContact C-N 3.33Å; L223-G225 PolarHBondContact O-N 3.32Å; L223-M226 HydrophobicContact CD1-CE 3.8Å; L223-M226 PolarHBondContact O-N 2.85Å; L223-L227 HydrophobicContact CG-CD1 4.31Å; L223-L227 WeakPolarHBondContact O-CG 3.31Å; L223-L227 PolarHBondContact O-N 3.33Å |
| 224 | F | 91.9 | Very high | 90.9 | Very high | 154 Ų | 154 | 60.7 Ų | 60.7 | 68% | 0.675 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -58.7 | -45.5 | 174.2 | -179.4 | -97.6 | 0 | 0 | 0 | 111.6 | V220 F221 M226 L227 A228 | V220-F224 PolarHBondContact O-N 2.91Å; F221-F224 PolarHBondContact O-N 3.43Å; F224-M226 PolarHBondContact O-N 2.92Å; F224-L227 PolarHBondContact O-N 2.84Å; F224-A228 VanDerWaalsContact O-CB 3.31Å; F224-A228 WeakPolarHBondContact O-CB 3.36Å; F224-A228 PolarHBondContact O-N 3.49Å |
| 225 | G | 88.5 | Confident | 90.8 | Very high | 16 Ų | 16 | 69.5 Ų | 69.5 | 17% | 0.165 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.1 | -45.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | F221 G222 L223 L227 A228 Y229 | F221-G225 PolarHBondContact O-N 2.69Å; G222-G225 PolarHBondContact O-N 2.88Å; L223-G225 VanDerWaalsContact C-N 3.33Å; L223-G225 PolarHBondContact O-N 3.32Å; G225-L227 PolarHBondContact O-N 2.75Å; G225-A228 PolarHBondContact O-N 2.87Å; G225-Y229 VanDerWaalsContact O-CD2 3.22Å; G225-Y229 WeakPolarHBondContact O-CD2 3.42Å; G225-Y229 PolarHBondContact O-N 2.84Å |
| 226 | M | 90.5 | Very high | 90.6 | Very high | 5 Ų | 5 | 76.3 Ų | 76.3 | 3% | 0.025 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -60.8 | -44.3 | 177.2 | -176.2 | -174.9 | 79.5 | 0 | 0 | 111.7 | S42 V45 G222 L223 F224 D230 G231 V234 M239 | S42-M226 VanDerWaalsContact CA-SD 3.6Å; V45-M226 HydrophobicContact CG2-CB 4.29Å; V45-M226 HydrophobicContact CG2-SD 4.31Å; G222-M226 WeakPolarHBondContact O-CB 3.43Å; G222-M226 PolarHBondContact O-N 3.02Å; L223-M226 HydrophobicContact CD1-CE 3.8Å; L223-M226 PolarHBondContact O-N 2.85Å; F224-M226 PolarHBondContact O-N 2.92Å; M226-D230 CarbonylContact O-C 3.28Å; M226-D230 WeakPolarHBondContact O-CA 3.33Å; M226-D230 PolarHBondContact O-N 2.63Å; M226-G231 PolarHBondContact O-N 3.36Å; M226-V234 HydrophobicContact CE-CG2 4.46Å; M226-V234 HydrophobicContact CG-CG2 4.15Å; M226-V234 HydrophobicContact SD-CG2 4.36Å; M226-M239 HydrophobicContact CE-CE 4.2Å; M226-M239 HydrophobicContact CE-CG 4.15Å; M226-M239 HydrophobicContact CE-SD 4.03Å; M226-M239 HydrophobicContact SD-CE 3.83Å; M226-M239 HydrophobicContact SD-CG 3.94Å; M226-M239 HydrophobicContact SD-SD 4.23Å |
| 227 | L | 90.8 | Very high | 90.3 | Very high | 100 Ų | 100 | 76.8 Ų | 76.8 | 52% | 0.524 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -67.1 | -37 | 177.8 | -67.3 | 174.7 | 0 | 0 | 0 | 112.2 | L223 F224 G225 G231 | L223-L227 HydrophobicContact CG-CD1 4.31Å; L223-L227 WeakPolarHBondContact O-CG 3.31Å; L223-L227 PolarHBondContact O-N 3.33Å; F224-L227 PolarHBondContact O-N 2.84Å; G225-L227 PolarHBondContact O-N 2.75Å; L227-G231 VanDerWaalsContact O-CA 3.26Å; L227-G231 WeakPolarHBondContact O-CA 3.46Å; L227-G231 PolarHBondContact O-N 3.36Å |
| 228 | A | 89.2 | Confident | 90.1 | Very high | 65 Ų | 65 | 76.1 Ų | 76.1 | 54% | 0.537 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -72.1 | -40.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | F224 G225 | F224-A228 VanDerWaalsContact O-CB 3.31Å; F224-A228 WeakPolarHBondContact O-CB 3.36Å; F224-A228 PolarHBondContact O-N 3.49Å; G225-A228 PolarHBondContact O-N 2.87Å |
| 229 | Y | 85.2 | Confident | 90 | Very high | 149 Ų | 149 | 77.6 Ų | 77.6 | 58% | 0.584 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -96.3 | -35.1 | -174.5 | -70.1 | -70.1 | 0 | 0 | 0 | 114.2 | N100 G225 | N100-Y229 WeakPolarHBondContact OD1-CE2 3.46Å; N100-Y229 VanDerWaalsContact OD1-CZ 3.27Å; N100-Y229 PolarHBondContact OD1-OH 3.43Å; G225-Y229 VanDerWaalsContact O-CD2 3.22Å; G225-Y229 WeakPolarHBondContact O-CD2 3.42Å; G225-Y229 PolarHBondContact O-N 2.84Å |
| 230 | D | 87.9 | Confident | 89.9 | Confident | 26 Ų | 26 | 79.8 Ų | 79.8 | 14% | 0.139 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -122.7 | 13.3 | -173.9 | -68.2 | -56.9 | 0 | 0 | 0 | 112.7 | L39 S41 M226 E232 R233 V234 | L39-D230 HydrophobicContact CD1-CB 4.2Å; L39-D230 HydrophobicContact CD2-CB 4.42Å; S41-D230 WeakPolarHBondContact CB-OD2 3.39Å; S41-D230 PolarHBondContact OG-OD2 3Å; M226-D230 CarbonylContact O-C 3.28Å; M226-D230 WeakPolarHBondContact O-CA 3.33Å; M226-D230 PolarHBondContact O-N 2.63Å; D230-E232 VanDerWaalsContact C-N 3.32Å; D230-E232 PolarHBondContact O-N 3.11Å; D230-R233 PolarHBondContact O-N 2.95Å; D230-R233 VanDerWaalsContact O-N 3.12Å; D230-R233 IonicContact OD1-NH1 2.7Å; D230-R233 PolarHBondContact OD1-NH1 3.45Å; D230-V234 HydrophobicContact CB-CG2 4.39Å; D230-V234 VanDerWaalsContact O-CG2 3.3Å; D230-V234 WeakPolarHBondContact O-CG2 3.36Å; D230-V234 PolarHBondContact O-N 3.2Å |
| 231 | G | 89.3 | Confident | 89.6 | Confident | 25 Ų | 25 | 76.9 Ų | 76.9 | 26% | 0.258 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -55.2 | -40.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | M226 L227 V234 R235 | M226-G231 PolarHBondContact O-N 3.36Å; L227-G231 VanDerWaalsContact O-CA 3.26Å; L227-G231 WeakPolarHBondContact O-CA 3.46Å; L227-G231 PolarHBondContact O-N 3.36Å; G231-V234 PolarHBondContact O-N 3.06Å; G231-R235 WeakPolarHBondContact O-CB 3.22Å; G231-R235 PolarHBondContact O-N 3.04Å |
| 232 | E | 89.5 | Confident | 89.3 | Confident | 143 Ų | 143 | 75.5 Ų | 75.5 | 67% | 0.668 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -65.6 | -46.5 | 176.7 | -65 | -160.3 | 145.1 | 0 | 0 | 111.9 | D230 V234 R235 E236 | D230-E232 VanDerWaalsContact C-N 3.32Å; D230-E232 PolarHBondContact O-N 3.11Å; E232-V234 VanDerWaalsContact C-N 3.32Å; E232-V234 PolarHBondContact O-N 2.63Å; E232-R235 WeakPolarHBondContact O-CB 3.24Å; E232-R235 PolarHBondContact O-N 2.96Å; E232-E236 WeakPolarHBondContact O-CG 3.16Å; E232-E236 PolarHBondContact O-N 3.22Å |
| 233 | R | 86.8 | Confident | 89.3 | Confident | 139 Ų | 139 | 76.4 Ų | 76.4 | 53% | 0.525 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.3 | -42.1 | 177.2 | -63.1 | -176.8 | 178.3 | 109 | 7.9 | 111.6 | L39 D230 R235 E236 S237 Q241 | L39-R233 HydrophobicContact CD1-CB 4.29Å; L39-R233 HydrophobicContact CD2-CB 4.3Å; D230-R233 PolarHBondContact O-N 2.95Å; D230-R233 VanDerWaalsContact O-N 3.12Å; D230-R233 IonicContact OD1-NH1 2.7Å; D230-R233 PolarHBondContact OD1-NH1 3.45Å; R233-R235 VanDerWaalsContact C-N 3.29Å; R233-R235 PolarHBondContact O-N 3.28Å; R233-E236 PolarHBondContact O-N 2.96Å; R233-S237 PolarHBondContact O-N 3.44Å; R233-Q241 PolarHBondContact O-OE1 3.18Å |
| 234 | V | 90.9 | Very high | 89.1 | Confident | 25 Ų | 25 | 76.2 Ų | 76.2 | 15% | 0.152 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -63.3 | -35.9 | 175.3 | 173.1 | 0 | 0 | 0 | 0 | 111.2 | L39 M226 D230 G231 E232 G238 M239 | L39-V234 HydrophobicContact CD1-CG2 3.61Å; M226-V234 HydrophobicContact CE-CG2 4.46Å; M226-V234 HydrophobicContact CG-CG2 4.15Å; M226-V234 HydrophobicContact SD-CG2 4.36Å; D230-V234 HydrophobicContact CB-CG2 4.39Å; D230-V234 VanDerWaalsContact O-CG2 3.3Å; D230-V234 WeakPolarHBondContact O-CG2 3.36Å; D230-V234 PolarHBondContact O-N 3.2Å; G231-V234 PolarHBondContact O-N 3.06Å; E232-V234 VanDerWaalsContact C-N 3.32Å; E232-V234 PolarHBondContact O-N 2.63Å; V234-G238 CarbonylContact O-C 3.44Å; V234-G238 WeakPolarHBondContact O-CA 3.11Å; V234-G238 PolarHBondContact O-N 2.91Å; V234-M239 HydrophobicContact CG1-CB 4.25Å |
| 235 | R | 89.4 | Confident | 89 | Confident | 207 Ų | 207 | 74.6 Ų | 74.6 | 78% | 0.781 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -71.7 | -38.6 | 177.5 | -166.1 | 179.1 | 80.9 | -177.1 | 2.2 | 112.4 | G231 E232 R233 | G231-R235 WeakPolarHBondContact O-CB 3.22Å; G231-R235 PolarHBondContact O-N 3.04Å; E232-R235 WeakPolarHBondContact O-CB 3.24Å; E232-R235 PolarHBondContact O-N 2.96Å; R233-R235 VanDerWaalsContact C-N 3.29Å; R233-R235 PolarHBondContact O-N 3.28Å |
| 236 | E | 89.6 | Confident | 89 | Confident | 144 Ų | 144 | 75.4 Ų | 75.4 | 67% | 0.673 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -77.8 | -44.6 | -176.5 | -71.7 | 175.8 | 175.7 | 0 | 0 | 113.2 | E232 R233 | E232-E236 WeakPolarHBondContact O-CG 3.16Å; E232-E236 PolarHBondContact O-N 3.22Å; R233-E236 PolarHBondContact O-N 2.96Å |
| 237 | S | 86.7 | Confident | 89 | Confident | 69 Ų | 69 | 75.2 Ų | 75.2 | 48% | 0.483 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -120.9 | -0.4 | -169.8 | -72.9 | 0 | 0 | 0 | 0 | 113.6 | R233 | R233-S237 PolarHBondContact O-N 3.44Å |
| 238 | G | 89.9 | Confident | 89.1 | Confident | 31 Ų | 31 | 75.9 Ų | 75.9 | 32% | 0.32 | 38% | 0.384 | S | S | . | . | trans | 83.1 | 162.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | V234 F240 | V234-G238 CarbonylContact O-C 3.44Å; V234-G238 WeakPolarHBondContact O-CA 3.11Å; V234-G238 PolarHBondContact O-N 2.91Å; G238-F240 VanDerWaalsContact C-N 3.28Å; G238-F240 PolarHBondContact O-N 3.29Å | ||
| 239 | M | 89.9 | Confident | 89.3 | Confident | 43 Ų | 43 | 75.9 Ų | 75.9 | 21% | 0.212 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -30 | -179.7 | -178.1 | -178.4 | 177.5 | 0 | 0 | 113.4 | S42 V45 V46 M226 V234 | S42-M239 VanDerWaalsContact CB-O 3.24Å; S42-M239 WeakPolarHBondContact CB-O 3.31Å; S42-M239 PolarHBondContact OG-O 2.89Å; V45-M239 HydrophobicContact CB-CE 3.85Å; V45-M239 HydrophobicContact CG1-CE 3.7Å; V46-M239 HydrophobicContact CG2-CE 3.7Å; M226-M239 HydrophobicContact CE-CE 4.2Å; M226-M239 HydrophobicContact CE-CG 4.15Å; M226-M239 HydrophobicContact CE-SD 4.03Å; M226-M239 HydrophobicContact SD-CE 3.83Å; M226-M239 HydrophobicContact SD-CG 3.94Å; M226-M239 HydrophobicContact SD-SD 4.23Å; V234-M239 HydrophobicContact CG1-CB 4.25Å |
| 240 | F | 91.6 | Very high | 89.6 | Confident | 114 Ų | 114 | 68.9 Ų | 68.9 | 50% | 0.5 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.7 | 21.4 | -174 | -59.5 | -75.8 | 0 | 0 | 0 | 113.4 | V46 G238 G242 Y243 W248 | V46-F240 HydrophobicContact CG2-CE1 3.63Å; V46-F240 HydrophobicContact CG2-CZ 4.31Å; G238-F240 VanDerWaalsContact C-N 3.28Å; G238-F240 PolarHBondContact O-N 3.29Å; F240-G242 PolarHBondContact O-N 3.25Å; F240-Y243 HydrophobicContact CB-CD2 4.3Å; F240-Y243 HydrophobicContact CB-CG 4.33Å; F240-Y243 HydrophobicContact CD1-CD1 4.04Å; F240-Y243 AromaticContact CD1-CE1 3.87Å; F240-Y243 HydrophobicContact CD1-CE1 3.87Å; F240-Y243 HydrophobicContact CD1-CE2 4.41Å; F240-Y243 HydrophobicContact CD1-CG 4.36Å; F240-Y243 HydrophobicContact CE1-CE1 4.42Å; F240-Y243 WeakPolarHBondContact O-CB 3.44Å; F240-Y243 WeakPolarHBondContact O-CD2 3.49Å; F240-Y243 PolarHBondContact O-N 3.21Å; F240-W248 HydrophobicContact CD1-CZ2 4.49Å; F240-W248 HydrophobicContact CE1-CH2 4.34Å |
| 241 | Q | 88.4 | Confident | 89.9 | Confident | 21 Ų | 21 | 67.6 Ų | 67.6 | 10% | 0.098 | 34% | 0.343 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55 | 136.8 | 175.5 | 62.7 | 174.2 | 56.3 | 0 | 0 | 111.7 | P36 R37 Y38 L39 R233 Y243 | P36-Q241 HydrophobicContact CG-CB 4.35Å; R37-Q241 PolarHBondContact O-NE2 3.4Å; Y38-Q241 VanDerWaalsContact CA-O 3.3Å; Y38-Q241 WeakPolarHBondContact CA-O 3.34Å; L39-Q241 HydrophobicContact CD1-CG 4.12Å; L39-Q241 HydrophobicContact CG-CG 3.98Å; R233-Q241 PolarHBondContact O-OE1 3.18Å; Q241-Y243 WeakPolarHBondContact O-CD2 3.1Å; Q241-Y243 PolarHBondContact O-N 3.26Å; Q241-Y243 VanDerWaalsContact O-N 3.12Å |
| 242 | G | 86.6 | Confident | 90.2 | Very high | 35 Ų | 35 | 68.3 Ų | 68.3 | 36% | 0.361 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65 | 13.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | P36 F240 N244 T247 | P36-G242 VanDerWaalsContact O-CA 3.3Å; P36-G242 WeakPolarHBondContact O-CA 3.5Å; F240-G242 PolarHBondContact O-N 3.25Å; G242-N244 PolarHBondContact O-N 2.87Å; G242-T247 PolarHBondContact O-OG1 3.05Å |
| 243 | Y | 89.4 | Confident | 90.4 | Very high | 35 Ų | 35 | 63.2 Ų | 63.2 | 14% | 0.137 | 32% | 0.323 | C | S | . | . | trans | -74.4 | 119.5 | 173.9 | -85.7 | -126.1 | 0 | 0 | 0 | 109.9 | S42 A43 F240 Q241 T247 W248 V251 | S42-Y243 PolarHBondContact O-OH 3Å; S42-Y243 WeakPolarHBondContact OG-CE2 3.43Å; S42-Y243 PolarHBondContact OG-OH 3.33Å; A43-Y243 VanDerWaalsContact CA-OH 3.23Å; A43-Y243 WeakPolarHBondContact CA-OH 3.39Å; A43-Y243 PolarHBondContact N-OH 2.95Å; F240-Y243 HydrophobicContact CB-CD2 4.3Å; F240-Y243 HydrophobicContact CB-CG 4.33Å; F240-Y243 HydrophobicContact CD1-CD1 4.04Å; F240-Y243 AromaticContact CD1-CE1 3.87Å; F240-Y243 HydrophobicContact CD1-CE1 3.87Å; F240-Y243 HydrophobicContact CD1-CE2 4.41Å; F240-Y243 HydrophobicContact CD1-CG 4.36Å; F240-Y243 HydrophobicContact CE1-CE1 4.42Å; F240-Y243 WeakPolarHBondContact O-CB 3.44Å; F240-Y243 WeakPolarHBondContact O-CD2 3.49Å; F240-Y243 PolarHBondContact O-N 3.21Å; Q241-Y243 WeakPolarHBondContact O-CD2 3.1Å; Q241-Y243 PolarHBondContact O-N 3.26Å; Q241-Y243 VanDerWaalsContact O-N 3.12Å; Y243-T247 HydrophobicContact CD1-CG2 3.96Å; Y243-T247 HydrophobicContact CD2-CG2 4.03Å; Y243-T247 HydrophobicContact CE1-CG2 4.14Å; Y243-T247 HydrophobicContact CE2-CG2 4.19Å; Y243-T247 HydrophobicContact CG-CG2 3.92Å; Y243-W248 HydrophobicContact CD1-CD2 4.22Å; Y243-W248 AromaticContact CD1-CE2 3.81Å; Y243-W248 HydrophobicContact CD1-CZ2 4.03Å; Y243-W248 AromaticContact CD1-NE1 3.94Å; Y243-V251 HydrophobicContact CE1-CG2 4.25Å | ||
| 244 | N | 88.9 | Confident | 90.7 | Very high | 55 Ų | 55 | 59 Ų | 59 | 29% | 0.294 | 31% | 0.31 | S | S | . | . | trans | -122 | -177.9 | 170 | 64.8 | 25.9 | 0 | 0 | 0 | 109.8 | G242 I246 T247 W248 | G242-N244 PolarHBondContact O-N 2.87Å; N244-I246 PolarHBondContact O-N 3.22Å; N244-I246 WeakPolarHBondContact OD1-CA 3.38Å; N244-I246 WeakPolarHBondContact OD1-CB 3.3Å; N244-I246 PolarHBondContact OD1-N 3.5Å; N244-T247 PolarHBondContact O-N 3.48Å; N244-T247 VanDerWaalsContact O-N 3.14Å; N244-T247 PolarHBondContact OD1-N 3.47Å; N244-T247 PolarHBondContact OD1-OG1 2.91Å; N244-T247 VanDerWaalsContact OD1-OG1 3.14Å; N244-W248 PolarHBondContact O-N 3.37Å | ||
| 245 | T | 90.5 | Very high | 90.9 | Very high | 119 Ų | 119 | 58.2 Ų | 58.2 | 73% | 0.73 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -56.4 | -34.5 | 178.8 | -48.4 | 0 | 0 | 0 | 0 | 112.7 | T249 | T245-T249 WeakPolarHBondContact O-CB 3.22Å; T245-T249 PolarHBondContact O-N 3.01Å; T245-T249 PolarHBondContact O-OG1 3.49Å |
| 246 | I | 89.1 | Confident | 91.2 | Very high | 34 Ų | 34 | 52.5 Ų | 52.5 | 17% | 0.174 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -70.8 | -45.2 | 178.4 | -54.9 | 168.7 | 0 | 0 | 0 | 109.8 | T24 Y27 L31 N244 W248 T249 V250 | T24-I246 HydrophobicContact CG2-CG2 4.21Å; Y27-I246 HydrophobicContact CD1-CD1 4.04Å; Y27-I246 HydrophobicContact CD1-CG2 4.27Å; Y27-I246 HydrophobicContact CE1-CD1 3.61Å; Y27-I246 HydrophobicContact CE1-CG1 4.42Å; L31-I246 HydrophobicContact CD1-CD1 4.12Å; L31-I246 HydrophobicContact CD2-CD1 3.98Å; N244-I246 PolarHBondContact O-N 3.22Å; N244-I246 WeakPolarHBondContact OD1-CA 3.38Å; N244-I246 WeakPolarHBondContact OD1-CB 3.3Å; N244-I246 PolarHBondContact OD1-N 3.5Å; I246-W248 VanDerWaalsContact C-N 3.33Å; I246-W248 PolarHBondContact O-N 2.93Å; I246-T249 CarbonylContact O-C 3.59Å; I246-T249 WeakPolarHBondContact O-CA 3.4Å; I246-T249 WeakPolarHBondContact O-CB 3.34Å; I246-T249 PolarHBondContact O-N 3.24Å; I246-V250 WeakPolarHBondContact O-CG2 3.37Å; I246-V250 PolarHBondContact O-N 3.31Å |
| 247 | T | 89.7 | Confident | 91.3 | Very high | 1 Ų | 1 | 45.8 Ų | 45.8 | 1% | 0.006 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.5 | -44.6 | 175.8 | -50.4 | 0 | 0 | 0 | 0 | 110.9 | Y38 G242 Y243 N244 T249 V250 V251 | Y38-T247 HydrophobicContact CD1-CG2 3.91Å; Y38-T247 HydrophobicContact CD2-CG2 3.84Å; Y38-T247 HydrophobicContact CE1-CG2 4.45Å; Y38-T247 HydrophobicContact CE2-CG2 4.39Å; Y38-T247 HydrophobicContact CG-CG2 3.58Å; G242-T247 PolarHBondContact O-OG1 3.05Å; Y243-T247 HydrophobicContact CD1-CG2 3.96Å; Y243-T247 HydrophobicContact CD2-CG2 4.03Å; Y243-T247 HydrophobicContact CE1-CG2 4.14Å; Y243-T247 HydrophobicContact CE2-CG2 4.19Å; Y243-T247 HydrophobicContact CG-CG2 3.92Å; N244-T247 PolarHBondContact O-N 3.48Å; N244-T247 VanDerWaalsContact O-N 3.14Å; N244-T247 PolarHBondContact OD1-N 3.47Å; N244-T247 PolarHBondContact OD1-OG1 2.91Å; N244-T247 VanDerWaalsContact OD1-OG1 3.14Å; T247-T249 VanDerWaalsContact C-N 3.31Å; T247-T249 PolarHBondContact O-N 2.96Å; T247-V250 WeakPolarHBondContact O-CB 3.25Å; T247-V250 PolarHBondContact O-N 3.36Å; T247-V251 VanDerWaalsContact O-CG2 3.31Å; T247-V251 WeakPolarHBondContact O-CG2 3.38Å; T247-V251 PolarHBondContact O-N 2.97Å |
| 248 | W | 93.4 | Very high | 91.6 | Very high | 114 Ų | 114 | 43.2 Ų | 43.2 | 43% | 0.432 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.3 | -38.4 | 173.8 | -81.1 | 111.4 | 0 | 0 | 0 | 112.8 | V46 M50 F240 Y243 N244 I246 V251 A252 | V46-W248 HydrophobicContact CG1-CH2 4.18Å; V46-W248 HydrophobicContact CG1-CZ3 3.81Å; M50-W248 HydrophobicContact SD-CZ3 4.45Å; F240-W248 HydrophobicContact CD1-CZ2 4.49Å; F240-W248 HydrophobicContact CE1-CH2 4.34Å; Y243-W248 HydrophobicContact CD1-CD2 4.22Å; Y243-W248 AromaticContact CD1-CE2 3.81Å; Y243-W248 HydrophobicContact CD1-CZ2 4.03Å; Y243-W248 AromaticContact CD1-NE1 3.94Å; N244-W248 PolarHBondContact O-N 3.37Å; I246-W248 VanDerWaalsContact C-N 3.33Å; I246-W248 PolarHBondContact O-N 2.93Å; W248-V251 PolarHBondContact O-N 3.14Å; W248-A252 WeakPolarHBondContact O-CB 3.12Å; W248-A252 PolarHBondContact O-N 3.45Å |
| 249 | T | 93.1 | Very high | 91.7 | Very high | 65 Ų | 65 | 43 Ų | 43 | 40% | 0.399 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.9 | -42.2 | 174 | -55.7 | 0 | 0 | 0 | 0 | 111.5 | T24 T245 I246 T247 A252 L253 | T24-T249 HydrophobicContact CG2-CG2 4.26Å; T245-T249 WeakPolarHBondContact O-CB 3.22Å; T245-T249 PolarHBondContact O-N 3.01Å; T245-T249 PolarHBondContact O-OG1 3.49Å; I246-T249 CarbonylContact O-C 3.59Å; I246-T249 WeakPolarHBondContact O-CA 3.4Å; I246-T249 WeakPolarHBondContact O-CB 3.34Å; I246-T249 PolarHBondContact O-N 3.24Å; T247-T249 VanDerWaalsContact C-N 3.31Å; T247-T249 PolarHBondContact O-N 2.96Å; T249-A252 PolarHBondContact O-N 3.49Å; T249-L253 HydrophobicContact CG2-CD1 4.12Å; T249-L253 HydrophobicContact CG2-CG 4.48Å; T249-L253 WeakPolarHBondContact O-CB 3.46Å; T249-L253 WeakPolarHBondContact O-CG 3.47Å; T249-L253 PolarHBondContact O-N 3.32Å |
| 250 | V | 91.6 | Very high | 91.9 | Very high | 1 Ų | 1 | 41.7 Ų | 41.7 | 1% | 0.006 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.2 | -48.1 | 174.4 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | L21 T24 M25 I246 T247 A252 L253 Q254 | L21-V250 HydrophobicContact CD1-CG1 4.26Å; T24-V250 HydrophobicContact CG2-CG2 3.75Å; M25-V250 HydrophobicContact CG-CG1 3.6Å; M25-V250 HydrophobicContact CG-CG2 4.18Å; M25-V250 HydrophobicContact SD-CG1 4.19Å; I246-V250 WeakPolarHBondContact O-CG2 3.37Å; I246-V250 PolarHBondContact O-N 3.31Å; T247-V250 WeakPolarHBondContact O-CB 3.25Å; T247-V250 PolarHBondContact O-N 3.36Å; V250-A252 VanDerWaalsContact C-N 3.35Å; V250-A252 PolarHBondContact O-N 3.31Å; V250-L253 PolarHBondContact O-N 2.94Å; V250-Q254 WeakPolarHBondContact O-CB 3.47Å; V250-Q254 PolarHBondContact O-N 3.39Å |
| 251 | V | 94.1 | Very high | 92 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.4 | -43.7 | 179.4 | 174.2 | 0 | 0 | 0 | 0 | 111 | A43 V46 A47 M50 Y243 T247 W248 Q254 A255 | A43-V251 HydrophobicContact CB-CG2 3.85Å; V46-V251 HydrophobicContact CB-CG1 3.94Å; V46-V251 HydrophobicContact CG1-CG1 3.68Å; A47-V251 HydrophobicContact CB-CG1 4.12Å; M50-V251 HydrophobicContact SD-CG1 3.75Å; Y243-V251 HydrophobicContact CE1-CG2 4.25Å; T247-V251 VanDerWaalsContact O-CG2 3.31Å; T247-V251 WeakPolarHBondContact O-CG2 3.38Å; T247-V251 PolarHBondContact O-N 2.97Å; W248-V251 PolarHBondContact O-N 3.14Å; V251-Q254 PolarHBondContact O-N 2.99Å; V251-A255 PolarHBondContact O-N 2.82Å |
| 252 | A | 95.4 | Very high | 92.1 | Very high | 39 Ų | 39 | 38.2 Ų | 38.2 | 32% | 0.322 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.8 | -44.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | M50 W248 T249 V250 Q254 A255 L256 | M50-A252 HydrophobicContact CE-CB 4.26Å; W248-A252 WeakPolarHBondContact O-CB 3.12Å; W248-A252 PolarHBondContact O-N 3.45Å; T249-A252 PolarHBondContact O-N 3.49Å; V250-A252 VanDerWaalsContact C-N 3.35Å; V250-A252 PolarHBondContact O-N 3.31Å; A252-Q254 VanDerWaalsContact C-N 3.3Å; A252-Q254 PolarHBondContact O-N 2.93Å; A252-A255 PolarHBondContact O-N 2.92Å; A252-L256 WeakPolarHBondContact O-CB 3.25Å; A252-L256 PolarHBondContact O-N 2.91Å |
| 253 | L | 93.6 | Very high | 92.4 | Very high | 36 Ų | 36 | 37.5 Ų | 37.5 | 19% | 0.188 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.2 | -35.9 | 175.7 | -77.9 | 172.6 | 0 | 0 | 0 | 112.1 | Q17 L21 T24 T249 V250 G257 | Q17-L253 PolarHBondContact NE2-O 3.48Å; L21-L253 HydrophobicContact CB-CB 4.41Å; L21-L253 HydrophobicContact CD1-CB 3.84Å; T24-L253 HydrophobicContact CG2-CD1 4.24Å; T249-L253 HydrophobicContact CG2-CD1 4.12Å; T249-L253 HydrophobicContact CG2-CG 4.48Å; T249-L253 WeakPolarHBondContact O-CB 3.46Å; T249-L253 WeakPolarHBondContact O-CG 3.47Å; T249-L253 PolarHBondContact O-N 3.32Å; V250-L253 PolarHBondContact O-N 2.94Å; L253-G257 PolarHBondContact O-N 3.32Å |
| 254 | Q | 93.4 | Very high | 92.6 | Very high | 52 Ų | 52 | 35.8 Ų | 35.8 | 24% | 0.243 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -68.5 | -44.4 | 176.3 | -175.5 | 174.6 | -11.6 | 0 | 0 | 111.4 | L21 A47 V250 V251 A252 G257 G258 | L21-Q254 HydrophobicContact CD1-CB 4.37Å; A47-Q254 HydrophobicContact CB-CB 4.12Å; A47-Q254 HydrophobicContact CB-CG 3.94Å; V250-Q254 WeakPolarHBondContact O-CB 3.47Å; V250-Q254 PolarHBondContact O-N 3.39Å; V251-Q254 PolarHBondContact O-N 2.99Å; A252-Q254 VanDerWaalsContact C-N 3.3Å; A252-Q254 PolarHBondContact O-N 2.93Å; Q254-G257 PolarHBondContact O-N 3.47Å; Q254-G258 PolarHBondContact O-N 3.12Å |
| 255 | A | 94.4 | Very high | 92.7 | Very high | 7 Ų | 7 | 33.2 Ų | 33.2 | 6% | 0.058 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.1 | -47.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | A47 M50 K51 V251 A252 G257 G258 L259 | A47-A255 HydrophobicContact CB-CB 4.46Å; A47-A255 WeakPolarHBondContact O-CB 3.48Å; M50-A255 HydrophobicContact CB-CB 3.86Å; K51-A255 HydrophobicContact CB-CB 4.32Å; V251-A255 PolarHBondContact O-N 2.82Å; A252-A255 PolarHBondContact O-N 2.92Å; A255-G257 VanDerWaalsContact C-N 3.34Å; A255-G257 PolarHBondContact O-N 3.4Å; A255-G258 PolarHBondContact O-N 3.33Å; A255-L259 PolarHBondContact O-N 3.5Å |
| 256 | L | 95.1 | Very high | 92.7 | Very high | 87 Ų | 87 | 31.3 Ų | 31.3 | 46% | 0.455 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -61.5 | -41.3 | 176.9 | -172.8 | 146.2 | 0 | 0 | 0 | 111.7 | Q17 A252 G258 L259 V260 | Q17-L256 HydrophobicContact CB-CD2 4.24Å; Q17-L256 HydrophobicContact CG-CD2 3.49Å; Q17-L256 VanDerWaalsContact CG-CD2 3.49Å; A252-L256 WeakPolarHBondContact O-CB 3.25Å; A252-L256 PolarHBondContact O-N 2.91Å; L256-G258 VanDerWaalsContact C-N 3.31Å; L256-G258 PolarHBondContact O-N 3.25Å; L256-L259 WeakPolarHBondContact O-CB 3.27Å; L256-L259 PolarHBondContact O-N 3.32Å; L256-L259 VanDerWaalsContact O-N 3.1Å; L256-V260 HydrophobicContact CD2-CG2 3.78Å; L256-V260 WeakPolarHBondContact O-CG2 3.31Å; L256-V260 PolarHBondContact O-N 3.48Å |
| 257 | G | 92.9 | Very high | 92.7 | Very high | 4 Ų | 4 | 33.6 Ų | 33.6 | 4% | 0.041 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -57.1 | -42.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L253 Q254 A255 L259 V260 I261 | L253-G257 PolarHBondContact O-N 3.32Å; Q254-G257 PolarHBondContact O-N 3.47Å; A255-G257 VanDerWaalsContact C-N 3.34Å; A255-G257 PolarHBondContact O-N 3.4Å; G257-L259 VanDerWaalsContact C-N 3.32Å; G257-L259 PolarHBondContact O-N 3.13Å; G257-V260 PolarHBondContact O-N 3.48Å; G257-I261 WeakPolarHBondContact O-CB 3.3Å; G257-I261 VanDerWaalsContact O-CG1 3.23Å; G257-I261 WeakPolarHBondContact O-CG1 3.28Å; G257-I261 PolarHBondContact O-N 3.14Å |
| 258 | G | 91.9 | Very high | 92.7 | Very high | 14 Ų | 14 | 33.8 Ų | 33.8 | 14% | 0.144 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.8 | -41.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q254 A255 L256 A262 | Q254-G258 PolarHBondContact O-N 3.12Å; A255-G258 PolarHBondContact O-N 3.33Å; L256-G258 VanDerWaalsContact C-N 3.31Å; L256-G258 PolarHBondContact O-N 3.25Å; G258-A262 PolarHBondContact O-N 3.14Å; G258-A262 VanDerWaalsContact O-N 3.12Å |
| 259 | L | 93.3 | Very high | 92.6 | Very high | 26 Ų | 26 | 29 Ų | 29 | 14% | 0.136 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.1 | -43.6 | 175.9 | -58.3 | -179.8 | 0 | 0 | 0 | 112 | K51 A54 C55 W208 N211 A255 L256 G257 I261 A262 A263 | K51-L259 HydrophobicContact CG-CD2 3.71Å; K51-L259 HydrophobicContact CG-CG 4.26Å; A54-L259 HydrophobicContact CB-CD1 3.83Å; C55-L259 WeakPolarHBondContact SG-CD2 3.35Å; W208-L259 HydrophobicContact CZ3-CB 4.37Å; W208-L259 HydrophobicContact CZ3-CD2 4.36Å; N211-L259 WeakPolarHBondContact ND2-CD2 3.33Å; A255-L259 PolarHBondContact O-N 3.5Å; L256-L259 WeakPolarHBondContact O-CB 3.27Å; L256-L259 PolarHBondContact O-N 3.32Å; L256-L259 VanDerWaalsContact O-N 3.1Å; G257-L259 VanDerWaalsContact C-N 3.32Å; G257-L259 PolarHBondContact O-N 3.13Å; L259-I261 VanDerWaalsContact C-N 3.34Å; L259-A262 PolarHBondContact O-N 2.96Å; L259-A263 PolarHBondContact O-N 3.06Å |
| 260 | V | 94.1 | Very high | 92.4 | Very high | 16 Ų | 16 | 26 Ų | 26 | 10% | 0.097 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.8 | -41.5 | 178.2 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | V13 L14 L256 G257 A262 A263 V264 | V13-V260 HydrophobicContact CB-CG1 4.45Å; V13-V260 HydrophobicContact CG1-CG1 3.97Å; V13-V260 HydrophobicContact CG1-CG2 3.77Å; L14-V260 HydrophobicContact CB-CG1 3.78Å; L14-V260 HydrophobicContact CD1-CG1 4.02Å; L256-V260 HydrophobicContact CD2-CG2 3.78Å; L256-V260 WeakPolarHBondContact O-CG2 3.31Å; L256-V260 PolarHBondContact O-N 3.48Å; G257-V260 PolarHBondContact O-N 3.48Å; V260-A262 PolarHBondContact O-N 2.78Å; V260-A263 WeakPolarHBondContact O-CB 3.47Å; V260-A263 PolarHBondContact O-N 2.99Å; V260-V264 HydrophobicContact CG1-CG2 4.23Å; V260-V264 WeakPolarHBondContact O-CG2 3.3Å; V260-V264 PolarHBondContact O-N 3.38Å |
| 261 | I | 92.4 | Very high | 92.4 | Very high | 62 Ų | 62 | 26.3 Ų | 26.3 | 32% | 0.318 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -59.6 | -45.5 | 174.9 | -71 | 165.2 | 0 | 0 | 0 | 110.8 | L14 G257 L259 A263 V264 I265 K273 | L14-I261 HydrophobicContact CD1-CG1 3.86Å; G257-I261 WeakPolarHBondContact O-CB 3.3Å; G257-I261 VanDerWaalsContact O-CG1 3.23Å; G257-I261 WeakPolarHBondContact O-CG1 3.28Å; G257-I261 PolarHBondContact O-N 3.14Å; L259-I261 VanDerWaalsContact C-N 3.34Å; I261-A263 VanDerWaalsContact C-N 3.29Å; I261-A263 PolarHBondContact O-N 3.42Å; I261-V264 PolarHBondContact O-N 2.85Å; I261-I265 HydrophobicContact CG2-CD1 3.77Å; I261-I265 HydrophobicContact CG2-CG1 4.36Å; I261-I265 VanDerWaalsContact O-CG1 3.32Å; I261-I265 WeakPolarHBondContact O-CG1 3.46Å; I261-I265 PolarHBondContact O-N 3.17Å; I261-K273 HydrophobicContact CG2-CD 4.13Å |
| 262 | A | 91.6 | Very high | 92.3 | Very high | 1 Ų | 1 | 27.3 Ų | 27.3 | 1% | 0.008 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.2 | -40.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V207 G258 L259 V260 I265 K266 | V207-A262 HydrophobicContact CG1-CB 3.97Å; G258-A262 PolarHBondContact O-N 3.14Å; G258-A262 VanDerWaalsContact O-N 3.12Å; L259-A262 PolarHBondContact O-N 2.96Å; V260-A262 PolarHBondContact O-N 2.78Å; A262-I265 PolarHBondContact O-N 3.48Å; A262-K266 WeakPolarHBondContact O-CB 3.33Å; A262-K266 PolarHBondContact O-N 3.45Å |
| 263 | A | 91.7 | Very high | 92.2 | Very high | 19 Ų | 19 | 27.4 Ų | 27.4 | 16% | 0.157 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.4 | -42.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L259 V260 I261 I265 K266 Y267 | L259-A263 PolarHBondContact O-N 3.06Å; V260-A263 WeakPolarHBondContact O-CB 3.47Å; V260-A263 PolarHBondContact O-N 2.99Å; I261-A263 VanDerWaalsContact C-N 3.29Å; I261-A263 PolarHBondContact O-N 3.42Å; A263-I265 PolarHBondContact O-N 2.83Å; A263-K266 WeakPolarHBondContact O-CB 3.49Å; A263-K266 PolarHBondContact O-N 2.92Å; A263-Y267 HydrophobicContact CB-CD2 4.35Å; A263-Y267 HydrophobicContact CB-CE2 4.35Å; A263-Y267 WeakPolarHBondContact O-CD2 3.36Å; A263-Y267 PolarHBondContact O-N 2.98Å |
| 264 | V | 93.4 | Very high | 92 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.4 | -44.5 | 175.7 | 174.5 | 0 | 0 | 0 | 0 | 110.5 | S10 L11 L14 V260 I261 K266 Y267 A268 D269 K273 | S10-V264 WeakPolarHBondContact O-CG2 3.45Å; L11-V264 HydrophobicContact CD2-CG1 3.74Å; L14-V264 HydrophobicContact CB-CG2 3.8Å; L14-V264 HydrophobicContact CD2-CB 4.33Å; L14-V264 HydrophobicContact CD2-CG1 4.09Å; L14-V264 HydrophobicContact CD2-CG2 3.77Å; L14-V264 HydrophobicContact CG-CG2 4.27Å; V260-V264 HydrophobicContact CG1-CG2 4.23Å; V260-V264 WeakPolarHBondContact O-CG2 3.3Å; V260-V264 PolarHBondContact O-N 3.38Å; I261-V264 PolarHBondContact O-N 2.85Å; V264-K266 VanDerWaalsContact C-N 3.27Å; V264-K266 PolarHBondContact O-N 3.26Å; V264-Y267 PolarHBondContact O-N 2.85Å; V264-A268 HydrophobicContact CG1-CB 4.1Å; V264-A268 CarbonylContact O-C 3.57Å; V264-A268 VanDerWaalsContact O-C 3.28Å; V264-A268 WeakPolarHBondContact O-CA 3.4Å; V264-A268 VanDerWaalsContact O-CB 3.23Å; V264-A268 WeakPolarHBondContact O-CB 3.34Å; V264-A268 PolarHBondContact O-N 3.21Å; V264-D269 PolarHBondContact O-N 3.4Å; V264-K273 HydrophobicContact CG1-CB 4.02Å; V264-K273 HydrophobicContact CG1-CG 4.39Å |
| 265 | I | 91.4 | Very high | 92 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.4 | -35.6 | 178.3 | -65.9 | 172.1 | 0 | 0 | 0 | 110.8 | F196 E197 L200 K201 I261 A262 A263 | F196-I265 HydrophobicContact CD1-CD1 3.79Å; F196-I265 HydrophobicContact CE1-CD1 4.08Å; E197-I265 HydrophobicContact CB-CG2 3.62Å; E197-I265 HydrophobicContact CG-CG2 3.82Å; L200-I265 HydrophobicContact CD1-CB 4.1Å; L200-I265 HydrophobicContact CD1-CG2 3.66Å; K201-I265 WeakPolarHBondContact CE-O 3.14Å; I261-I265 HydrophobicContact CG2-CD1 3.77Å; I261-I265 HydrophobicContact CG2-CG1 4.36Å; I261-I265 VanDerWaalsContact O-CG1 3.32Å; I261-I265 WeakPolarHBondContact O-CG1 3.46Å; I261-I265 PolarHBondContact O-N 3.17Å; A262-I265 PolarHBondContact O-N 3.48Å; A263-I265 PolarHBondContact O-N 2.83Å |
| 266 | K | 90.7 | Very high | 92 | Very high | 79 Ų | 79 | 24.4 Ų | 24.4 | 34% | 0.343 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -65.4 | -51.7 | 175.7 | -170.8 | -169 | -169.3 | 175.5 | 0 | 112.9 | V207 A262 A263 V264 | V207-K266 HydrophobicContact CB-CD 4.11Å; V207-K266 HydrophobicContact CG2-CB 4.05Å; V207-K266 HydrophobicContact CG2-CD 3.31Å; V207-K266 HydrophobicContact CG2-CG 3.63Å; A262-K266 WeakPolarHBondContact O-CB 3.33Å; A262-K266 PolarHBondContact O-N 3.45Å; A263-K266 WeakPolarHBondContact O-CB 3.49Å; A263-K266 PolarHBondContact O-N 2.92Å; V264-K266 VanDerWaalsContact C-N 3.27Å; V264-K266 PolarHBondContact O-N 3.26Å |
| 267 | Y | 89.1 | Confident | 91.9 | Very high | 82 Ų | 82 | 22.3 Ų | 22.3 | 32% | 0.322 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -96.6 | -22.6 | -169.4 | -60.2 | -62.1 | 0 | 0 | 0 | 114.2 | L6 A263 V264 | L6-Y267 HydrophobicContact CB-CD1 4.22Å; L6-Y267 HydrophobicContact CB-CG 4.22Å; L6-Y267 HydrophobicContact CD1-CD1 4.3Å; L6-Y267 HydrophobicContact CD1-CE1 4.01Å; A263-Y267 HydrophobicContact CB-CD2 4.35Å; A263-Y267 HydrophobicContact CB-CE2 4.35Å; A263-Y267 WeakPolarHBondContact O-CD2 3.36Å; A263-Y267 PolarHBondContact O-N 2.98Å; V264-Y267 PolarHBondContact O-N 2.85Å |
| 268 | A | 90.9 | Very high | 91.9 | Very high | 5 Ų | 5 | 22.5 Ų | 22.5 | 4% | 0.041 | 12% | 0.122 | C | C | . | . | S | Bend | trans | -116.9 | -127.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 108 | K7 L11 K201 V264 L272 | K7-A268 HydrophobicContact CG-CB 3.84Å; L11-A268 HydrophobicContact CD1-CB 4.36Å; L11-A268 HydrophobicContact CD2-CB 4.23Å; L11-A268 HydrophobicContact CG-CB 4.3Å; K201-A268 PolarHBondContact NZ-O 3.36Å; V264-A268 HydrophobicContact CG1-CB 4.1Å; V264-A268 CarbonylContact O-C 3.57Å; V264-A268 VanDerWaalsContact O-C 3.28Å; V264-A268 WeakPolarHBondContact O-CA 3.4Å; V264-A268 VanDerWaalsContact O-CB 3.23Å; V264-A268 WeakPolarHBondContact O-CB 3.34Å; V264-A268 PolarHBondContact O-N 3.21Å; A268-L272 HydrophobicContact CB-CB 4.29Å; A268-L272 HydrophobicContact CB-CD1 4.06Å |
| 269 | D | 89.9 | Confident | 92 | Very high | 13 Ų | 13 | 24.4 Ų | 24.4 | 7% | 0.07 | 13% | 0.129 | C | C | . | . | trans | -163.5 | 170.9 | 178.9 | 54.3 | 62.8 | 0 | 0 | 0 | 112.2 | R135 E197 V264 I271 L272 K273 | R135-D269 IonicContact CZ-OD2 3.99Å; R135-D269 VanDerWaalsContact NH1-CB 3.34Å; R135-D269 IonicContact NH1-OD1 2.96Å; R135-D269 IonicContact NH1-OD2 3.81Å; R135-D269 PolarHBondContact NH1-OD2 3.45Å; R135-D269 IonicContact NH2-OD2 2.71Å; E197-D269 WeakPolarHBondContact OE1-CB 3.36Å; V264-D269 PolarHBondContact O-N 3.4Å; D269-I271 PolarHBondContact O-N 2.9Å; D269-I271 WeakPolarHBondContact OD1-CA 3.38Å; D269-I271 WeakPolarHBondContact OD1-CB 3.32Å; D269-I271 PolarHBondContact OD1-N 2.93Å; D269-I271 VanDerWaalsContact OD1-N 3.12Å; D269-L272 PolarHBondContact O-N 2.84Å; D269-L272 WeakPolarHBondContact OD1-CB 3.2Å; D269-L272 WeakPolarHBondContact OD1-CG 3.34Å; D269-L272 PolarHBondContact OD1-N 2.68Å; D269-L272 WeakPolarHBondContact OD2-CD1 3.37Å; D269-K273 PolarHBondContact O-N 3.44Å | ||
| 270 | N | 90.2 | Very high | 91.9 | Very high | 4 Ų | 4 | 23.2 Ų | 23.2 | 2% | 0.021 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -68.5 | -21.2 | -176.4 | -156.6 | 38.9 | 0 | 0 | 0 | 113.1 | T125 G193 E197 K273 G274 | T125-N270 HydrophobicContact CG2-CB 4.07Å; T125-N270 WeakPolarHBondContact CG2-ND2 3.22Å; G193-N270 WeakPolarHBondContact CA-ND2 3.23Å; E197-N270 WeakPolarHBondContact OE2-CB 3.34Å; E197-N270 PolarHBondContact OE2-N 3.34Å; N270-K273 WeakPolarHBondContact OD1-CE 3.44Å; N270-K273 PolarHBondContact OD1-NZ 3.34Å; N270-G274 PolarHBondContact O-N 3.35Å |
| 271 | I | 91.4 | Very high | 91.7 | Very high | 6 Ų | 6 | 24 Ų | 24 | 3% | 0.031 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -73.6 | -51.5 | 174.6 | -64.2 | 172 | 0 | 0 | 0 | 109.9 | T125 A126 L137 L145 D269 K273 G274 F275 Y315 | T125-I271 HydrophobicContact CG2-CG1 4.45Å; A126-I271 HydrophobicContact CB-CD1 4.37Å; L137-I271 HydrophobicContact CD1-CD1 4.14Å; L137-I271 HydrophobicContact CD2-CD1 4.26Å; L145-I271 HydrophobicContact CD2-CG2 3.75Å; D269-I271 PolarHBondContact O-N 2.9Å; D269-I271 WeakPolarHBondContact OD1-CA 3.38Å; D269-I271 WeakPolarHBondContact OD1-CB 3.32Å; D269-I271 PolarHBondContact OD1-N 2.93Å; D269-I271 VanDerWaalsContact OD1-N 3.12Å; I271-K273 VanDerWaalsContact C-N 3.26Å; I271-K273 PolarHBondContact O-N 3.04Å; I271-G274 VanDerWaalsContact O-CA 3.28Å; I271-G274 WeakPolarHBondContact O-CA 3.3Å; I271-G274 PolarHBondContact O-N 2.93Å; I271-F275 HydrophobicContact CG2-CD2 4.15Å; I271-F275 HydrophobicContact CG2-CE2 3.88Å; I271-F275 WeakPolarHBondContact O-CD2 3.31Å; I271-F275 PolarHBondContact O-N 3.5Å; I271-Y315 HydrophobicContact CG2-CE1 4.42Å; I271-Y315 HydrophobicContact CG2-CE2 3.91Å |
| 272 | L | 91.4 | Very high | 91.7 | Very high | 21 Ų | 21 | 21.7 Ų | 21.7 | 11% | 0.11 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -63.6 | -32 | 177.3 | -71.6 | 173.5 | 0 | 0 | 0 | 112.4 | K7 L11 A268 D269 G274 F275 A276 Y315 | K7-L272 HydrophobicContact CD-CD1 4.47Å; L11-L272 HydrophobicContact CD1-CB 4.33Å; L11-L272 HydrophobicContact CD1-CD1 4.46Å; L11-L272 HydrophobicContact CD2-CB 4.01Å; A268-L272 HydrophobicContact CB-CB 4.29Å; A268-L272 HydrophobicContact CB-CD1 4.06Å; D269-L272 PolarHBondContact O-N 2.84Å; D269-L272 WeakPolarHBondContact OD1-CB 3.2Å; D269-L272 WeakPolarHBondContact OD1-CG 3.34Å; D269-L272 PolarHBondContact OD1-N 2.68Å; D269-L272 WeakPolarHBondContact OD2-CD1 3.37Å; L272-G274 VanDerWaalsContact C-N 3.26Å; L272-G274 PolarHBondContact O-N 2.98Å; L272-F275 PolarHBondContact O-N 3.33Å; L272-A276 PolarHBondContact O-N 2.72Å; L272-Y315 HydrophobicContact CD2-CD1 3.92Å; L272-Y315 HydrophobicContact CD2-CE1 3.68Å; L272-Y315 HydrophobicContact CG-CE1 4.22Å |
| 273 | K | 92.8 | Very high | 91.7 | Very high | 42 Ų | 42 | 25.1 Ų | 25.1 | 18% | 0.183 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -55.1 | -45.1 | 166.8 | -172.1 | -161.6 | 76.6 | -175.1 | 0 | 110.7 | L14 I261 V264 D269 N270 I271 A276 T277 | L14-K273 HydrophobicContact CD2-CB 4.46Å; L14-K273 HydrophobicContact CD2-CG 3.77Å; I261-K273 HydrophobicContact CG2-CD 4.13Å; V264-K273 HydrophobicContact CG1-CB 4.02Å; V264-K273 HydrophobicContact CG1-CG 4.39Å; D269-K273 PolarHBondContact O-N 3.44Å; N270-K273 WeakPolarHBondContact OD1-CE 3.44Å; N270-K273 PolarHBondContact OD1-NZ 3.34Å; I271-K273 VanDerWaalsContact C-N 3.26Å; I271-K273 PolarHBondContact O-N 3.04Å; K273-A276 PolarHBondContact O-N 3.33Å; K273-T277 PolarHBondContact O-N 2.95Å; K273-T277 PolarHBondContact O-OG1 3.19Å |
| 274 | G | 90.9 | Very high | 91.5 | Very high | 19 Ų | 19 | 24.7 Ų | 24.7 | 20% | 0.196 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -56.3 | -50.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | N270 I271 L272 A276 T277 S278 | N270-G274 PolarHBondContact O-N 3.35Å; I271-G274 VanDerWaalsContact O-CA 3.28Å; I271-G274 WeakPolarHBondContact O-CA 3.3Å; I271-G274 PolarHBondContact O-N 2.93Å; L272-G274 VanDerWaalsContact C-N 3.26Å; L272-G274 PolarHBondContact O-N 2.98Å; G274-A276 PolarHBondContact O-N 3.47Å; G274-T277 PolarHBondContact O-N 2.82Å; G274-S278 PolarHBondContact O-N 3.01Å; G274-S278 PolarHBondContact O-OG 2.93Å |
| 275 | F | 93.4 | Very high | 91.2 | Very high | 7 Ų | 7 | 25.7 Ų | 25.7 | 3% | 0.031 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -58.8 | -46.2 | 175.4 | -78.6 | -87.2 | 0 | 0 | 0 | 112.7 | L145 L148 I271 L272 T277 S278 L279 A311 Y315 | L145-F275 HydrophobicContact CD2-CE2 3.75Å; L145-F275 HydrophobicContact CD2-CZ 4.09Å; L148-F275 HydrophobicContact CB-CE1 4.14Å; L148-F275 HydrophobicContact CB-CZ 4.41Å; L148-F275 HydrophobicContact CD1-CD1 3.76Å; L148-F275 HydrophobicContact CD1-CE1 3.91Å; L148-F275 HydrophobicContact CD2-CD1 3.71Å; L148-F275 HydrophobicContact CD2-CD2 3.98Å; L148-F275 HydrophobicContact CD2-CE1 3.7Å; L148-F275 HydrophobicContact CD2-CE2 3.97Å; L148-F275 HydrophobicContact CD2-CG 3.85Å; L148-F275 HydrophobicContact CD2-CZ 3.83Å; L148-F275 HydrophobicContact CG-CD1 4.27Å; L148-F275 HydrophobicContact CG-CE1 4.13Å; I271-F275 HydrophobicContact CG2-CD2 4.15Å; I271-F275 HydrophobicContact CG2-CE2 3.88Å; I271-F275 WeakPolarHBondContact O-CD2 3.31Å; I271-F275 PolarHBondContact O-N 3.5Å; L272-F275 PolarHBondContact O-N 3.33Å; F275-T277 PolarHBondContact O-N 3.48Å; F275-S278 WeakPolarHBondContact O-CB 3.31Å; F275-S278 PolarHBondContact O-N 3.32Å; F275-L279 WeakPolarHBondContact O-CG 3.39Å; F275-L279 PolarHBondContact O-N 3.38Å; F275-A311 HydrophobicContact CE1-CB 4.06Å; F275-Y315 HydrophobicContact CE2-CD1 4.08Å; F275-Y315 AromaticContact CE2-CD2 3.79Å; F275-Y315 HydrophobicContact CE2-CD2 3.79Å; F275-Y315 HydrophobicContact CE2-CE2 4.24Å; F275-Y315 AromaticContact CE2-CG 3.7Å; F275-Y315 HydrophobicContact CE2-CG 3.7Å; F275-Y315 HydrophobicContact CZ-CD1 4.46Å; F275-Y315 AromaticContact CZ-CD2 3.89Å; F275-Y315 HydrophobicContact CZ-CD2 3.89Å; F275-Y315 AromaticContact CZ-CG 3.72Å; F275-Y315 HydrophobicContact CZ-CG 3.72Å |
| 276 | A | 93.9 | Very high | 91 | Very high | 5 Ų | 5 | 28.3 Ų | 28.3 | 4% | 0.041 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.8 | -42.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | L11 L14 V15 L272 K273 G274 S278 L279 S280 | L11-A276 HydrophobicContact CD2-CB 3.91Å; L14-A276 HydrophobicContact CD2-CB 3.84Å; L14-A276 HydrophobicContact CG-CB 4.41Å; V15-A276 HydrophobicContact CG2-CB 3.93Å; V15-A276 WeakPolarHBondContact CG2-O 3.31Å; L272-A276 PolarHBondContact O-N 2.72Å; K273-A276 PolarHBondContact O-N 3.33Å; G274-A276 PolarHBondContact O-N 3.47Å; A276-S278 PolarHBondContact O-N 3.36Å; A276-L279 PolarHBondContact O-N 3.2Å; A276-S280 PolarHBondContact O-N 2.85Å |
| 277 | T | 92.1 | Very high | 90.8 | Very high | 44 Ų | 44 | 26.8 Ų | 26.8 | 27% | 0.27 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -63.1 | -41.8 | 174.7 | -56.8 | 0 | 0 | 0 | 0 | 111.3 | K273 G274 F275 L279 S280 I281 | K273-T277 PolarHBondContact O-N 2.95Å; K273-T277 PolarHBondContact O-OG1 3.19Å; G274-T277 PolarHBondContact O-N 2.82Å; F275-T277 PolarHBondContact O-N 3.48Å; T277-L279 PolarHBondContact O-N 3.49Å; T277-S280 WeakPolarHBondContact CA-OG 3.27Å; T277-S280 PolarHBondContact O-N 2.66Å; T277-S280 PolarHBondContact O-OG 3.02Å; T277-I281 HydrophobicContact CG2-CD1 4.48Å; T277-I281 WeakPolarHBondContact O-CD1 3.42Å; T277-I281 WeakPolarHBondContact O-CG1 3.25Å; T277-I281 PolarHBondContact O-N 3.17Å; T277-I281 VanDerWaalsContact O-N 3.11Å |
| 278 | S | 92.9 | Very high | 90.5 | Very high | 7 Ų | 7 | 23 Ų | 23 | 5% | 0.049 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.9 | -42.9 | 175.3 | -58.2 | 0 | 0 | 0 | 0 | 113 | V152 G274 F275 A276 S280 I281 I282 | V152-S278 WeakPolarHBondContact CG2-OG 3.27Å; G274-S278 PolarHBondContact O-N 3.01Å; G274-S278 PolarHBondContact O-OG 2.93Å; F275-S278 WeakPolarHBondContact O-CB 3.31Å; F275-S278 PolarHBondContact O-N 3.32Å; A276-S278 PolarHBondContact O-N 3.36Å; S278-S280 VanDerWaalsContact C-N 3.35Å; S278-I281 PolarHBondContact O-N 2.99Å; S278-I282 PolarHBondContact O-N 2.99Å |
| 279 | L | 93.7 | Very high | 90.1 | Very high | 55 Ų | 55 | 27 Ų | 27 | 29% | 0.288 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -64.6 | -38.7 | 174.6 | -70.9 | 170.9 | 0 | 0 | 0 | 112.2 | V15 F275 A276 T277 I281 I282 L283 V308 T312 | V15-L279 HydrophobicContact CG2-CB 4.43Å; F275-L279 WeakPolarHBondContact O-CG 3.39Å; F275-L279 PolarHBondContact O-N 3.38Å; A276-L279 PolarHBondContact O-N 3.2Å; T277-L279 PolarHBondContact O-N 3.49Å; L279-I281 VanDerWaalsContact C-N 3.27Å; L279-I281 PolarHBondContact O-N 3.5Å; L279-I282 PolarHBondContact O-N 3.44Å; L279-L283 PolarHBondContact O-N 3.46Å; L279-V308 HydrophobicContact CD2-CG1 4.2Å; L279-T312 HydrophobicContact CD1-CG2 4.18Å |
| 280 | S | 92.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63.4 | -32.6 | 177.3 | 75.6 | 0 | 0 | 0 | 0 | 112.9 | T18 T19 A276 T277 S278 L283 S284 | T18-S280 VanDerWaalsContact CG2-OG 3.22Å; T18-S280 WeakPolarHBondContact CG2-OG 3.18Å; T19-S280 PolarHBondContact OG1-O 3.42Å; A276-S280 PolarHBondContact O-N 2.85Å; T277-S280 WeakPolarHBondContact CA-OG 3.27Å; T277-S280 PolarHBondContact O-N 2.66Å; T277-S280 PolarHBondContact O-OG 3.02Å; S278-S280 VanDerWaalsContact C-N 3.35Å; S280-L283 PolarHBondContact O-N 3.28Å; S280-S284 VanDerWaalsContact O-CB 3.25Å; S280-S284 WeakPolarHBondContact O-CB 3.44Å; S280-S284 PolarHBondContact O-N 2.97Å; S280-S284 PolarHBondContact O-OG 3.35Å |
| 281 | I | 90.3 | Very high | 89.3 | Confident | 34 Ų | 34 | 39.7 Ų | 39.7 | 17% | 0.174 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.1 | -51 | 175.3 | -67.6 | 152.6 | 0 | 0 | 0 | 109.5 | V152 V155 Q156 T277 S278 L279 L283 S284 T285 | V152-I281 HydrophobicContact CG1-CD1 4.41Å; V155-I281 HydrophobicContact CG1-CG2 3.57Å; Q156-I281 HydrophobicContact CG-CG2 4.33Å; T277-I281 HydrophobicContact CG2-CD1 4.48Å; T277-I281 WeakPolarHBondContact O-CD1 3.42Å; T277-I281 WeakPolarHBondContact O-CG1 3.25Å; T277-I281 PolarHBondContact O-N 3.17Å; T277-I281 VanDerWaalsContact O-N 3.11Å; S278-I281 PolarHBondContact O-N 2.99Å; L279-I281 VanDerWaalsContact C-N 3.27Å; L279-I281 PolarHBondContact O-N 3.5Å; I281-L283 VanDerWaalsContact C-N 3.34Å; I281-L283 PolarHBondContact O-N 3.23Å; I281-S284 PolarHBondContact O-N 3.23Å; I281-S284 PolarHBondContact O-OG 3.33Å; I281-T285 PolarHBondContact O-N 3.42Å; I281-T285 PolarHBondContact O-OG1 3.49Å; I281-T285 VanDerWaalsContact O-OG1 3.13Å |
| 282 | I | 91.8 | Very high | 88.4 | Confident | 13 Ų | 13 | 42.5 Ų | 42.5 | 7% | 0.067 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.2 | -48.4 | 178.1 | -62.8 | 167 | 0 | 0 | 0 | 110.5 | V155 S278 L279 S284 T285 L286 F301 A305 V308 | V155-I282 HydrophobicContact CG1-CG1 4.36Å; V155-I282 HydrophobicContact CG2-CG1 4.16Å; S278-I282 PolarHBondContact O-N 2.99Å; L279-I282 PolarHBondContact O-N 3.44Å; I282-S284 VanDerWaalsContact C-N 3.34Å; I282-S284 PolarHBondContact O-N 3.47Å; I282-T285 PolarHBondContact O-N 2.76Å; I282-L286 HydrophobicContact CG2-CD1 4.02Å; I282-L286 HydrophobicContact CG2-CG 4.37Å; I282-L286 WeakPolarHBondContact O-CG 3.31Å; I282-L286 PolarHBondContact O-N 2.83Å; I282-F301 HydrophobicContact CG2-CZ 4.25Å; I282-A305 HydrophobicContact CD1-CB 4.01Å; I282-A305 HydrophobicContact CG1-CB 4.25Å; I282-A305 HydrophobicContact CG2-CB 4.1Å; I282-V308 HydrophobicContact CD1-CB 3.59Å; I282-V308 HydrophobicContact CD1-CG1 3.56Å; I282-V308 HydrophobicContact CD1-CG2 4.08Å |
| 283 | L | 91 | Very high | 87.5 | Confident | 73 Ų | 73 | 49.5 Ų | 49.5 | 38% | 0.382 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | -179.8 | -174 | 61.8 | 0 | 0 | 0 | 111.8 | V15 T19 L279 S280 I281 T285 L286 I287 | V15-L283 HydrophobicContact CG1-CD2 3.98Å; T19-L283 HydrophobicContact CG2-CB 4.47Å; T19-L283 HydrophobicContact CG2-CD2 4.21Å; T19-L283 HydrophobicContact CG2-CG 4.09Å; L279-L283 PolarHBondContact O-N 3.46Å; S280-L283 PolarHBondContact O-N 3.28Å; I281-L283 VanDerWaalsContact C-N 3.34Å; I281-L283 PolarHBondContact O-N 3.23Å; L283-T285 VanDerWaalsContact C-N 3.33Å; L283-T285 PolarHBondContact O-N 3Å; L283-L286 PolarHBondContact O-N 2.83Å; L283-I287 HydrophobicContact CD1-CD1 4.15Å; L283-I287 HydrophobicContact CD1-CG1 4.43Å; L283-I287 HydrophobicContact CG-CD1 3.9Å; L283-I287 WeakPolarHBondContact O-CB 3.48Å; L283-I287 WeakPolarHBondContact O-CG1 3.47Å; L283-I287 PolarHBondContact O-N 3.02Å |
| 284 | S | 88.3 | Confident | 86.2 | Confident | 9 Ų | 9 | 52 Ų | 52 | 6% | 0.063 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64 | -37.3 | 177.4 | 71.7 | 0 | 0 | 0 | 0 | 112.5 | S280 I281 I282 S288 | S280-S284 VanDerWaalsContact O-CB 3.25Å; S280-S284 WeakPolarHBondContact O-CB 3.44Å; S280-S284 PolarHBondContact O-N 2.97Å; S280-S284 PolarHBondContact O-OG 3.35Å; I281-S284 PolarHBondContact O-N 3.23Å; I281-S284 PolarHBondContact O-OG 3.33Å; I282-S284 VanDerWaalsContact C-N 3.34Å; I282-S284 PolarHBondContact O-N 3.47Å; S284-S288 WeakPolarHBondContact O-CB 3.45Å; S284-S288 PolarHBondContact O-N 3.12Å; S284-S288 PolarHBondContact O-OG 3.1Å |
| 285 | T | 86.1 | Confident | 85.1 | Confident | 22 Ų | 22 | 54.5 Ų | 54.5 | 14% | 0.135 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -70.2 | -43.9 | 175.9 | -55.9 | 0 | 0 | 0 | 0 | 111.3 | I281 I282 L283 I287 S288 Y289 F295 F301 | I281-T285 PolarHBondContact O-N 3.42Å; I281-T285 PolarHBondContact O-OG1 3.49Å; I281-T285 VanDerWaalsContact O-OG1 3.13Å; I282-T285 PolarHBondContact O-N 2.76Å; L283-T285 VanDerWaalsContact C-N 3.33Å; L283-T285 PolarHBondContact O-N 3Å; T285-I287 PolarHBondContact O-N 3.03Å; T285-S288 WeakPolarHBondContact O-CB 3.39Å; T285-S288 PolarHBondContact O-N 2.89Å; T285-Y289 PolarHBondContact O-N 3.08Å; T285-F295 HydrophobicContact CG2-CD1 3.58Å; T285-F295 HydrophobicContact CG2-CE1 3.61Å; T285-F301 VanDerWaalsContact CB-CE2 3.48Å; T285-F301 HydrophobicContact CG2-CD2 4.02Å; T285-F301 HydrophobicContact CG2-CE1 4.33Å; T285-F301 HydrophobicContact CG2-CE2 3.4Å; T285-F301 HydrophobicContact CG2-CZ 3.59Å |
| 286 | L | 87.1 | Confident | 84.2 | Confident | 54 Ų | 54 | 60.2 Ų | 60.2 | 28% | 0.283 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.1 | -43.9 | 176.6 | -70.1 | 176.7 | 0 | 0 | 0 | 111.7 | I282 L283 S288 Y289 F290 F301 | I282-L286 HydrophobicContact CG2-CD1 4.02Å; I282-L286 HydrophobicContact CG2-CG 4.37Å; I282-L286 WeakPolarHBondContact O-CG 3.31Å; I282-L286 PolarHBondContact O-N 2.83Å; L283-L286 PolarHBondContact O-N 2.83Å; L286-S288 VanDerWaalsContact C-N 3.34Å; L286-Y289 PolarHBondContact O-N 3.16Å; L286-F290 HydrophobicContact CB-CD2 4.48Å; L286-F290 HydrophobicContact CD2-CE2 4.33Å; L286-F290 WeakPolarHBondContact O-CD2 3.38Å; L286-F290 PolarHBondContact O-N 3.41Å; L286-F301 HydrophobicContact CD2-CE1 4.29Å |
| 287 | I | 86.8 | Confident | 83.3 | Confident | 47 Ų | 47 | 60.9 Ų | 60.9 | 24% | 0.241 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62 | -43.7 | 174.3 | -73 | 168.1 | 0 | 0 | 0 | 110.5 | T19 L23 L283 T285 Y289 F290 L291 | T19-I287 HydrophobicContact CG2-CD1 3.74Å; L23-I287 HydrophobicContact CD1-CB 4.08Å; L23-I287 HydrophobicContact CD1-CD1 4.22Å; L23-I287 HydrophobicContact CD1-CG2 3.39Å; L23-I287 HydrophobicContact CD2-CG2 4.09Å; L23-I287 HydrophobicContact CG-CG2 4.4Å; L283-I287 HydrophobicContact CD1-CD1 4.15Å; L283-I287 HydrophobicContact CD1-CG1 4.43Å; L283-I287 HydrophobicContact CG-CD1 3.9Å; L283-I287 WeakPolarHBondContact O-CB 3.48Å; L283-I287 WeakPolarHBondContact O-CG1 3.47Å; L283-I287 PolarHBondContact O-N 3.02Å; T285-I287 PolarHBondContact O-N 3.03Å; I287-Y289 VanDerWaalsContact C-N 3.29Å; I287-Y289 PolarHBondContact O-N 3.4Å; I287-F290 PolarHBondContact O-N 3.11Å; I287-L291 HydrophobicContact CG2-CB 4.42Å; I287-L291 HydrophobicContact CG2-CD1 3.78Å; I287-L291 VanDerWaalsContact O-CB 3.31Å; I287-L291 WeakPolarHBondContact O-CB 3.41Å; I287-L291 PolarHBondContact O-N 3.34Å |
| 288 | S | 83.4 | Confident | 83 | Confident | 4 Ų | 4 | 60.3 Ų | 60.3 | 3% | 0.028 | 30% | 0.304 | C | S | . | . | I | π-helix | trans | -60.8 | -39.3 | 176.9 | -60.2 | 0 | 0 | 0 | 0 | 112.1 | L23 R26 S284 T285 L286 L292 Q293 | L23-S288 WeakPolarHBondContact CD2-OG 3.48Å; R26-S288 PolarHBondContact NH1-OG 2.92Å; S284-S288 WeakPolarHBondContact O-CB 3.45Å; S284-S288 PolarHBondContact O-N 3.12Å; S284-S288 PolarHBondContact O-OG 3.1Å; T285-S288 WeakPolarHBondContact O-CB 3.39Å; T285-S288 PolarHBondContact O-N 2.89Å; L286-S288 VanDerWaalsContact C-N 3.34Å; S288-L292 CarbonylContact O-C 3.58Å; S288-L292 WeakPolarHBondContact O-CA 3.45Å; S288-L292 VanDerWaalsContact O-CB 3.31Å; S288-L292 WeakPolarHBondContact O-CB 3.29Å; S288-L292 PolarHBondContact O-N 2.86Å; S288-L292 VanDerWaalsContact O-N 3.16Å; S288-Q293 PolarHBondContact O-N 3.21Å |
| 289 | Y | 83 | Confident | 82.6 | Confident | 87 Ų | 87 | 64.7 Ų | 64.7 | 34% | 0.341 | 34% | 0.335 | S | S | . | . | I | π-helix | trans | -67.2 | -52.7 | 176.8 | 175.2 | -113 | 0 | 0 | 0 | 111.9 | T285 L286 I287 Q293 F295 P297 | T285-Y289 PolarHBondContact O-N 3.08Å; L286-Y289 PolarHBondContact O-N 3.16Å; I287-Y289 VanDerWaalsContact C-N 3.29Å; I287-Y289 PolarHBondContact O-N 3.4Å; Y289-Q293 WeakPolarHBondContact O-CA 3.27Å; Y289-Q293 PolarHBondContact O-N 3.34Å; Y289-F295 VanDerWaalsContact CD2-O 3.23Å; Y289-F295 WeakPolarHBondContact CD2-O 3.5Å; Y289-P297 HydrophobicContact CD1-CG 4.42Å; Y289-P297 HydrophobicContact CD2-CG 4.15Å; Y289-P297 HydrophobicContact CE2-CG 4.43Å; Y289-P297 HydrophobicContact CG-CG 4.11Å |
| 290 | F | 84.1 | Confident | 82.4 | Confident | 148 Ų | 148 | 64.6 Ų | 64.6 | 65% | 0.649 | 34% | 0.336 | S | S | * | . | I | π-helix | trans | -75.5 | -38 | -173.9 | -74.5 | -64.5 | 0 | 0 | 0 | 114.2 | L286 I287 | L286-F290 HydrophobicContact CB-CD2 4.48Å; L286-F290 HydrophobicContact CD2-CE2 4.33Å; L286-F290 WeakPolarHBondContact O-CD2 3.38Å; L286-F290 PolarHBondContact O-N 3.41Å; I287-F290 PolarHBondContact O-N 3.11Å |
| 291 | L | 79.3 | Confident | 82.3 | Confident | 136 Ų | 136 | 64.8 Ų | 64.8 | 71% | 0.712 | 34% | 0.337 | S | S | * | . | I | π-helix | trans | -100.9 | -36.6 | -172.9 | -72.3 | 166.7 | 0 | 0 | 0 | 113.3 | I287 | I287-L291 HydrophobicContact CG2-CB 4.42Å; I287-L291 HydrophobicContact CG2-CD1 3.78Å; I287-L291 VanDerWaalsContact O-CB 3.31Å; I287-L291 WeakPolarHBondContact O-CB 3.41Å; I287-L291 PolarHBondContact O-N 3.34Å |
| 292 | L | 71.9 | Confident | 82.3 | Confident | 65 Ų | 65 | 68.2 Ų | 68.2 | 34% | 0.34 | 35% | 0.351 | S | S | . | . | I | π-helix | trans | -98.1 | -18.1 | -177.3 | -61.3 | 171 | 0 | 0 | 0 | 112.8 | L23 S288 D294 | L23-L292 HydrophobicContact CD2-CD1 4.15Å; S288-L292 CarbonylContact O-C 3.58Å; S288-L292 WeakPolarHBondContact O-CA 3.45Å; S288-L292 VanDerWaalsContact O-CB 3.31Å; S288-L292 WeakPolarHBondContact O-CB 3.29Å; S288-L292 PolarHBondContact O-N 2.86Å; S288-L292 VanDerWaalsContact O-N 3.16Å; L292-D294 HydrophobicContact CB-CB 4.21Å; L292-D294 VanDerWaalsContact O-CG 3.3Å; L292-D294 PolarHBondContact O-N 3.25Å |
| 293 | Q | 71.9 | Confident | 82.4 | Confident | 169 Ų | 169 | 72.5 Ų | 72.5 | 79% | 0.79 | 37% | 0.373 | S | S | * | . | trans | 51.9 | 19.8 | -175 | -62.5 | -173.3 | -30.8 | 0 | 0 | 114.3 | S288 Y289 | S288-Q293 PolarHBondContact O-N 3.21Å; Y289-Q293 WeakPolarHBondContact O-CA 3.27Å; Y289-Q293 PolarHBondContact O-N 3.34Å | ||
| 294 | D | 66.1 | Low | 82.6 | Confident | 93 Ų | 93 | 69 Ų | 69 | 50% | 0.497 | 36% | 0.355 | S | S | . | . | trans | -94.9 | 1 | -171.9 | -74.2 | -30 | 0 | 0 | 0 | 113.2 | R26 L292 | R26-D294 PolarHBondContact NH2-O 3.04Å; L292-D294 HydrophobicContact CB-CB 4.21Å; L292-D294 VanDerWaalsContact O-CG 3.3Å; L292-D294 PolarHBondContact O-N 3.25Å | ||
| 295 | F | 68 | Low | 82.8 | Confident | 73 Ų | 73 | 69 Ų | 69 | 32% | 0.32 | 36% | 0.356 | S | S | . | . | trans | -157.8 | 117.6 | -175.6 | -173.9 | -97.6 | 0 | 0 | 0 | 112.8 | T285 Y289 P297 | T285-F295 HydrophobicContact CG2-CD1 3.58Å; T285-F295 HydrophobicContact CG2-CE1 3.61Å; Y289-F295 VanDerWaalsContact CD2-O 3.23Å; Y289-F295 WeakPolarHBondContact CD2-O 3.5Å; F295-P297 WeakPolarHBondContact O-CD 3.4Å | ||
| 296 | D | 73.9 | Confident | 83.3 | Confident | 127 Ų | 127 | 72.1 Ų | 72.1 | 68% | 0.679 | 37% | 0.374 | S | S | * | . | trans | -86.3 | 113.3 | 173.1 | -68.3 | -52.2 | 0 | 0 | 0 | 111.2 | S298 | D296-S298 PolarHBondContact O-N 3.25Š| ||
| 297 | P | 76.4 | Confident | 83.7 | Confident | 18 Ų | 18 | 71.9 Ų | 71.9 | 12% | 0.117 | 37% | 0.373 | C | S | . | . | trans | -66.5 | 126.8 | 177.7 | 24.9 | -30.4 | 0 | 0 | 0 | 110.9 | Y289 F295 F301 F302 | Y289-P297 HydrophobicContact CD1-CG 4.42Å; Y289-P297 HydrophobicContact CD2-CG 4.15Å; Y289-P297 HydrophobicContact CE2-CG 4.43Å; Y289-P297 HydrophobicContact CG-CG 4.11Å; F295-P297 WeakPolarHBondContact O-CD 3.4Å; P297-F301 HydrophobicContact CB-CB 4.26Å; P297-F301 HydrophobicContact CB-CD1 3.46Å; P297-F301 VanDerWaalsContact CB-CD1 3.46Å; P297-F301 HydrophobicContact CB-CE1 3.98Å; P297-F301 HydrophobicContact CB-CG 3.93Å; P297-F302 HydrophobicContact CB-CE2 3.91Å; P297-F302 HydrophobicContact CB-CZ 4.06Å; P297-F302 HydrophobicContact CG-CE2 3.86Å; P297-F302 HydrophobicContact CG-CZ 3.7Å | ||
| 298 | S | 83.8 | Confident | 84.2 | Confident | 33 Ų | 33 | 69.7 Ų | 69.7 | 23% | 0.231 | 36% | 0.362 | C | S | . | . | trans | -70.3 | 162.6 | 176.2 | 66.4 | 0 | 0 | 0 | 0 | 112 | D296 V300 F301 F302 | D296-S298 PolarHBondContact O-N 3.25Å; S298-V300 PolarHBondContact O-N 3.26Å; S298-F301 VanDerWaalsContact O-CB 3.31Å; S298-F301 WeakPolarHBondContact O-CB 3.33Å; S298-F301 PolarHBondContact O-N 2.84Å; S298-F301 PolarHBondContact OG-N 3.38Å; S298-F302 VanDerWaalsContact O-CD2 3.26Å; S298-F302 WeakPolarHBondContact O-CD2 3.22Å; S298-F302 PolarHBondContact O-N 3.06Å | ||
| 299 | S | 86.3 | Confident | 84.7 | Confident | 99 Ų | 99 | 73 Ų | 73 | 69% | 0.692 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -56 | -34.7 | 170.8 | 52.8 | 0 | 0 | 0 | 0 | 112.3 | F301 F302 L303 | S299-F301 VanDerWaalsContact C-N 3.35Å; S299-F302 PolarHBondContact O-N 2.9Å; S299-L303 PolarHBondContact O-N 3.13Å; S299-L303 VanDerWaalsContact O-N 3.15Å |
| 300 | V | 89.1 | Confident | 85.2 | Confident | 52 Ų | 52 | 72.2 Ų | 72.2 | 32% | 0.315 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64 | -38.5 | 175.5 | -176.9 | 0 | 0 | 0 | 0 | 111.6 | L154 W157 S298 F302 L303 G304 | L154-V300 HydrophobicContact CB-CG1 4.02Å; L154-V300 HydrophobicContact CD2-CG1 3.84Å; L154-V300 HydrophobicContact CG-CG1 4.44Å; W157-V300 HydrophobicContact CB-CG1 4.35Å; S298-V300 PolarHBondContact O-N 3.26Å; V300-F302 PolarHBondContact O-N 2.7Å; V300-L303 PolarHBondContact O-N 3.45Å; V300-G304 PolarHBondContact O-N 2.76Å |
| 301 | F | 89.5 | Confident | 85.8 | Confident | 5 Ų | 5 | 65.1 Ų | 65.1 | 2% | 0.022 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -60.1 | -46.1 | 174.5 | 169.9 | -87.3 | 0 | 0 | 0 | 111.6 | V155 I282 T285 L286 P297 S298 S299 L303 G304 A305 | V155-F301 HydrophobicContact CB-CD2 4.29Å; V155-F301 HydrophobicContact CB-CE2 4.5Å; V155-F301 HydrophobicContact CG1-CD2 3.83Å; V155-F301 HydrophobicContact CG1-CE2 3.67Å; V155-F301 HydrophobicContact CG2-CD2 4.3Å; V155-F301 HydrophobicContact CG2-CE2 4.42Å; I282-F301 HydrophobicContact CG2-CZ 4.25Å; T285-F301 VanDerWaalsContact CB-CE2 3.48Å; T285-F301 HydrophobicContact CG2-CD2 4.02Å; T285-F301 HydrophobicContact CG2-CE1 4.33Å; T285-F301 HydrophobicContact CG2-CE2 3.4Å; T285-F301 HydrophobicContact CG2-CZ 3.59Å; L286-F301 HydrophobicContact CD2-CE1 4.29Å; P297-F301 HydrophobicContact CB-CB 4.26Å; P297-F301 HydrophobicContact CB-CD1 3.46Å; P297-F301 VanDerWaalsContact CB-CD1 3.46Å; P297-F301 HydrophobicContact CB-CE1 3.98Å; P297-F301 HydrophobicContact CB-CG 3.93Å; S298-F301 VanDerWaalsContact O-CB 3.31Å; S298-F301 WeakPolarHBondContact O-CB 3.33Å; S298-F301 PolarHBondContact O-N 2.84Å; S298-F301 PolarHBondContact OG-N 3.38Å; S299-F301 VanDerWaalsContact C-N 3.35Å; F301-L303 PolarHBondContact O-N 2.99Å; F301-G304 PolarHBondContact O-N 3.24Å; F301-A305 WeakPolarHBondContact O-CB 3.31Å; F301-A305 PolarHBondContact O-N 3.43Å |
| 302 | F | 90.6 | Very high | 86.4 | Confident | 106 Ų | 106 | 60.6 Ų | 60.6 | 47% | 0.465 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 179.4 | -71.3 | -74.8 | 0 | 0 | 0 | 112.2 | P297 S298 S299 V300 A305 V306 | P297-F302 HydrophobicContact CB-CE2 3.91Å; P297-F302 HydrophobicContact CB-CZ 4.06Å; P297-F302 HydrophobicContact CG-CE2 3.86Å; P297-F302 HydrophobicContact CG-CZ 3.7Å; S298-F302 VanDerWaalsContact O-CD2 3.26Å; S298-F302 WeakPolarHBondContact O-CD2 3.22Å; S298-F302 PolarHBondContact O-N 3.06Å; S299-F302 PolarHBondContact O-N 2.9Å; V300-F302 PolarHBondContact O-N 2.7Å; F302-A305 PolarHBondContact O-N 3.42Å; F302-V306 WeakPolarHBondContact O-CG2 3.38Å; F302-V306 PolarHBondContact O-N 3.16Å |
| 303 | L | 93.9 | Very high | 87.3 | Confident | 102 Ų | 102 | 64.9 Ų | 64.9 | 53% | 0.534 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59.2 | -47.7 | 173.6 | 178.9 | 62.2 | 0 | 0 | 0 | 111.2 | L154 S299 V300 F301 A305 V306 L307 | L154-L303 HydrophobicContact CD1-CD2 4.04Å; L154-L303 HydrophobicContact CD1-CG 4.08Å; S299-L303 PolarHBondContact O-N 3.13Å; S299-L303 VanDerWaalsContact O-N 3.15Å; V300-L303 PolarHBondContact O-N 3.45Å; F301-L303 PolarHBondContact O-N 2.99Å; L303-A305 VanDerWaalsContact C-N 3.32Å; L303-A305 PolarHBondContact O-N 2.9Å; L303-V306 PolarHBondContact O-N 3.02Å; L303-L307 WeakPolarHBondContact O-CG 3.31Å; L303-L307 PolarHBondContact O-N 3.5Å; L303-L307 VanDerWaalsContact O-N 3.11Å |
| 304 | G | 94.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.8 | -41.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | G151 V155 V300 F301 V306 L307 V308 | G151-G304 WeakPolarHBondContact CA-O 3.42Å; G151-G304 WeakPolarHBondContact O-CA 3.32Å; V155-G304 VanDerWaalsContact CG2-C 3.46Å; V300-G304 PolarHBondContact O-N 2.76Å; F301-G304 PolarHBondContact O-N 3.24Å; G304-V306 PolarHBondContact O-N 3.46Å; G304-L307 PolarHBondContact O-N 2.74Å; G304-V308 WeakPolarHBondContact O-CG2 3.44Å; G304-V308 PolarHBondContact O-N 3.25Å |
| 305 | A | 94.2 | Very high | 89.5 | Confident | 10 Ų | 10 | 55.3 Ų | 55.3 | 8% | 0.083 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -62.8 | -43.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | V155 I282 F301 F302 L303 L307 V308 I309 | V155-A305 HydrophobicContact CG2-CB 4.45Å; I282-A305 HydrophobicContact CD1-CB 4.01Å; I282-A305 HydrophobicContact CG1-CB 4.25Å; I282-A305 HydrophobicContact CG2-CB 4.1Å; F301-A305 WeakPolarHBondContact O-CB 3.31Å; F301-A305 PolarHBondContact O-N 3.43Å; F302-A305 PolarHBondContact O-N 3.42Å; L303-A305 VanDerWaalsContact C-N 3.32Å; L303-A305 PolarHBondContact O-N 2.9Å; A305-L307 VanDerWaalsContact C-N 3.34Å; A305-L307 PolarHBondContact O-N 3.37Å; A305-V308 PolarHBondContact O-N 3.4Å; A305-I309 VanDerWaalsContact O-CG1 3.28Å; A305-I309 WeakPolarHBondContact O-CG1 3.28Å; A305-I309 PolarHBondContact O-N 3.24Å |
| 306 | V | 95.6 | Very high | 90.2 | Very high | 86 Ų | 86 | 54.7 Ų | 54.7 | 52% | 0.521 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.5 | -47.2 | 173.9 | 172 | 0 | 0 | 0 | 0 | 110.5 | F302 L303 G304 V308 I309 T310 | F302-V306 WeakPolarHBondContact O-CG2 3.38Å; F302-V306 PolarHBondContact O-N 3.16Å; L303-V306 PolarHBondContact O-N 3.02Å; G304-V306 PolarHBondContact O-N 3.46Å; V306-V308 PolarHBondContact O-N 3.28Å; V306-I309 PolarHBondContact O-N 3.48Å; V306-T310 WeakPolarHBondContact O-CB 3.49Å; V306-T310 PolarHBondContact O-N 3.03Å; V306-T310 PolarHBondContact O-OG1 3.47Å |
| 307 | L | 96.5 | Very high | 90.6 | Very high | 49 Ų | 49 | 55.8 Ų | 55.8 | 26% | 0.257 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.4 | -43.4 | 178.7 | -66.7 | 179 | 0 | 0 | 0 | 112.6 | I147 L154 L303 G304 A305 I309 T310 A311 | I147-L307 HydrophobicContact CG2-CB 3.99Å; I147-L307 HydrophobicContact CG2-CD2 4.12Å; I147-L307 WeakPolarHBondContact CG2-O 3.47Å; L154-L307 HydrophobicContact CD1-CD1 3.83Å; L303-L307 WeakPolarHBondContact O-CG 3.31Å; L303-L307 PolarHBondContact O-N 3.5Å; L303-L307 VanDerWaalsContact O-N 3.11Å; G304-L307 PolarHBondContact O-N 2.74Å; A305-L307 VanDerWaalsContact C-N 3.34Å; A305-L307 PolarHBondContact O-N 3.37Å; L307-I309 VanDerWaalsContact C-N 3.34Å; L307-I309 PolarHBondContact O-N 3.15Å; L307-T310 PolarHBondContact O-N 2.94Å; L307-A311 VanDerWaalsContact O-CB 3.27Å; L307-A311 WeakPolarHBondContact O-CB 3.42Å; L307-A311 PolarHBondContact O-N 3.14Å |
| 308 | V | 95.9 | Very high | 89.8 | Confident | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.006 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.7 | -41.6 | 177.2 | 171.5 | 0 | 0 | 0 | 0 | 111.4 | L148 V152 L279 I282 G304 A305 V306 A311 T312 | L148-V308 HydrophobicContact CD1-CB 4.36Å; L148-V308 HydrophobicContact CD1-CG1 3.86Å; L148-V308 HydrophobicContact CD1-CG2 4.28Å; V152-V308 HydrophobicContact CG2-CG2 4Å; L279-V308 HydrophobicContact CD2-CG1 4.2Å; I282-V308 HydrophobicContact CD1-CB 3.59Å; I282-V308 HydrophobicContact CD1-CG1 3.56Å; I282-V308 HydrophobicContact CD1-CG2 4.08Å; G304-V308 WeakPolarHBondContact O-CG2 3.44Å; G304-V308 PolarHBondContact O-N 3.25Å; A305-V308 PolarHBondContact O-N 3.4Å; V306-V308 PolarHBondContact O-N 3.28Å; V308-A311 PolarHBondContact O-N 2.84Å; V308-T312 PolarHBondContact O-N 3.42Å; V308-T312 PolarHBondContact O-OG1 2.92Å |
| 309 | I | 94.2 | Very high | 88.3 | Confident | 75 Ų | 75 | 63.9 Ų | 63.9 | 39% | 0.385 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -65.3 | -48.6 | 177.5 | -66.9 | 167.3 | 0 | 0 | 0 | 110 | A305 V306 L307 A311 T312 F313 | A305-I309 VanDerWaalsContact O-CG1 3.28Å; A305-I309 WeakPolarHBondContact O-CG1 3.28Å; A305-I309 PolarHBondContact O-N 3.24Å; V306-I309 PolarHBondContact O-N 3.48Å; L307-I309 VanDerWaalsContact C-N 3.34Å; L307-I309 PolarHBondContact O-N 3.15Å; I309-A311 VanDerWaalsContact C-N 3.34Å; I309-A311 PolarHBondContact O-N 3.18Å; I309-T312 WeakPolarHBondContact O-CB 3.23Å; I309-T312 PolarHBondContact O-N 2.99Å; I309-T312 VanDerWaalsContact O-N 3.12Å; I309-F313 HydrophobicContact CG2-CD2 3.84Å; I309-F313 HydrophobicContact CG2-CE2 3.64Å; I309-F313 VanDerWaalsContact O-CD2 3.27Å; I309-F313 WeakPolarHBondContact O-CD2 3.4Å; I309-F313 PolarHBondContact O-N 2.85Å; I309-F313 VanDerWaalsContact O-N 3.12Å |
| 310 | T | 94.8 | Very high | 86.2 | Confident | 69 Ų | 69 | 68 Ų | 68 | 42% | 0.423 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58 | -45.3 | 176.5 | -59.3 | 0 | 0 | 0 | 0 | 111.6 | V306 L307 T312 F313 L314 | V306-T310 WeakPolarHBondContact O-CB 3.49Å; V306-T310 PolarHBondContact O-N 3.03Å; V306-T310 PolarHBondContact O-OG1 3.47Å; L307-T310 PolarHBondContact O-N 2.94Å; T310-T312 VanDerWaalsContact C-N 3.3Å; T310-T312 PolarHBondContact O-N 3.16Å; T310-F313 PolarHBondContact O-N 3.45Å; T310-L314 VanDerWaalsContact O-CB 3.29Å; T310-L314 WeakPolarHBondContact O-CB 3.36Å; T310-L314 PolarHBondContact O-N 3.33Å |
| 311 | A | 95.3 | Very high | 84.1 | Confident | 0 Ų | 0 | 71.3 Ų | 71.3 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.2 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | S144 I147 L148 F275 L307 V308 I309 L314 Y315 | S144-A311 WeakPolarHBondContact CB-O 3.46Å; S144-A311 VanDerWaalsContact O-CB 3.31Å; S144-A311 WeakPolarHBondContact O-CB 3.31Å; I147-A311 HydrophobicContact CB-CB 4.07Å; I147-A311 HydrophobicContact CG2-CB 3.88Å; L148-A311 HydrophobicContact CB-CB 3.91Å; L148-A311 HydrophobicContact CD1-CB 4.35Å; F275-A311 HydrophobicContact CE1-CB 4.06Å; L307-A311 VanDerWaalsContact O-CB 3.27Å; L307-A311 WeakPolarHBondContact O-CB 3.42Å; L307-A311 PolarHBondContact O-N 3.14Å; V308-A311 PolarHBondContact O-N 2.84Å; I309-A311 VanDerWaalsContact C-N 3.34Å; I309-A311 PolarHBondContact O-N 3.18Å; A311-L314 PolarHBondContact O-N 2.99Å; A311-Y315 WeakPolarHBondContact O-CB 3.19Å; A311-Y315 PolarHBondContact O-N 3.36Å |
| 312 | T | 92.2 | Very high | 81.9 | Confident | 40 Ų | 40 | 76.2 Ų | 76.2 | 25% | 0.245 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -61.5 | -46.3 | 179.6 | -57.5 | 0 | 0 | 0 | 0 | 111.3 | L279 V308 I309 T310 G316 | L279-T312 HydrophobicContact CD1-CG2 4.18Å; V308-T312 PolarHBondContact O-N 3.42Å; V308-T312 PolarHBondContact O-OG1 2.92Å; I309-T312 WeakPolarHBondContact O-CB 3.23Å; I309-T312 PolarHBondContact O-N 2.99Å; I309-T312 VanDerWaalsContact O-N 3.12Å; T310-T312 VanDerWaalsContact C-N 3.3Å; T310-T312 PolarHBondContact O-N 3.16Å; T312-G316 PolarHBondContact O-N 3.2Å |
| 313 | F | 91.1 | Very high | 79.6 | Confident | 156 Ų | 156 | 75.4 Ų | 75.4 | 68% | 0.684 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -68.4 | -39.8 | 176.6 | -75.5 | -70.9 | 0 | 0 | 0 | 112.3 | I309 T310 Y315 G316 Y317 | I309-F313 HydrophobicContact CG2-CD2 3.84Å; I309-F313 HydrophobicContact CG2-CE2 3.64Å; I309-F313 VanDerWaalsContact O-CD2 3.27Å; I309-F313 WeakPolarHBondContact O-CD2 3.4Å; I309-F313 PolarHBondContact O-N 2.85Å; I309-F313 VanDerWaalsContact O-N 3.12Å; T310-F313 PolarHBondContact O-N 3.45Å; F313-Y315 PolarHBondContact O-N 3.28Å; F313-G316 PolarHBondContact O-N 2.88Å; F313-Y317 PolarHBondContact O-N 2.92Å; F313-Y317 VanDerWaalsContact O-N 3.13Å |
| 314 | L | 92.6 | Very high | 77 | Confident | 40 Ų | 40 | 77 Ų | 77 | 21% | 0.209 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -64.2 | -39.5 | 179.5 | -174.2 | 62.4 | 0 | 0 | 0 | 112.3 | Y140 L143 I147 T310 A311 G316 Y317 | Y140-L314 HydrophobicContact CD1-CD1 4.08Å; L143-L314 HydrophobicContact CD2-CD2 4.26Å; L143-L314 HydrophobicContact CG-CD2 4.29Å; I147-L314 HydrophobicContact CD1-CD2 3.94Å; T310-L314 VanDerWaalsContact O-CB 3.29Å; T310-L314 WeakPolarHBondContact O-CB 3.36Å; T310-L314 PolarHBondContact O-N 3.33Å; A311-L314 PolarHBondContact O-N 2.99Å; L314-G316 VanDerWaalsContact C-N 3.32Å; L314-G316 PolarHBondContact O-N 3.49Å; L314-Y317 PolarHBondContact O-N 3.39Å |
| 315 | Y | 90.8 | Very high | 75 | Confident | 21 Ų | 21 | 83 Ų | 83 | 8% | 0.082 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -66.9 | -34.9 | 176.5 | -171.4 | -94.8 | 0 | 0 | 0 | 112.4 | L137 Q141 S144 I271 L272 F275 A311 F313 Y317 | L137-Y315 HydrophobicContact CD2-CE2 4.34Å; Q141-Y315 HydrophobicContact CB-CD2 3.85Å; Q141-Y315 HydrophobicContact CB-CE2 3.83Å; Q141-Y315 HydrophobicContact CG-CD2 3.82Å; Q141-Y315 HydrophobicContact CG-CE2 3.88Å; S144-Y315 WeakPolarHBondContact OG-CB 3.36Å; S144-Y315 VanDerWaalsContact OG-CD2 3.3Å; S144-Y315 WeakPolarHBondContact OG-CD2 3.26Å; I271-Y315 HydrophobicContact CG2-CE1 4.42Å; I271-Y315 HydrophobicContact CG2-CE2 3.91Å; L272-Y315 HydrophobicContact CD2-CD1 3.92Å; L272-Y315 HydrophobicContact CD2-CE1 3.68Å; L272-Y315 HydrophobicContact CG-CE1 4.22Å; F275-Y315 HydrophobicContact CE2-CD1 4.08Å; F275-Y315 AromaticContact CE2-CD2 3.79Å; F275-Y315 HydrophobicContact CE2-CD2 3.79Å; F275-Y315 HydrophobicContact CE2-CE2 4.24Å; F275-Y315 AromaticContact CE2-CG 3.7Å; F275-Y315 HydrophobicContact CE2-CG 3.7Å; F275-Y315 HydrophobicContact CZ-CD1 4.46Å; F275-Y315 AromaticContact CZ-CD2 3.89Å; F275-Y315 HydrophobicContact CZ-CD2 3.89Å; F275-Y315 AromaticContact CZ-CG 3.72Å; F275-Y315 HydrophobicContact CZ-CG 3.72Å; A311-Y315 WeakPolarHBondContact O-CB 3.19Å; A311-Y315 PolarHBondContact O-N 3.36Å; F313-Y315 PolarHBondContact O-N 3.28Å; Y315-Y317 VanDerWaalsContact C-N 3.29Å |
| 316 | G | 83.7 | Confident | 72.9 | Confident | 59 Ų | 59 | 86.7 Ų | 86.7 | 61% | 0.608 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -77.3 | -11.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | T312 F313 L314 E318 | T312-G316 PolarHBondContact O-N 3.2Å; F313-G316 PolarHBondContact O-N 2.88Å; L314-G316 VanDerWaalsContact C-N 3.32Å; L314-G316 PolarHBondContact O-N 3.49Å; G316-E318 PolarHBondContact O-N 3.19Å; G316-E318 VanDerWaalsContact O-N 3.1Å |
| 317 | Y | 81.6 | Confident | 70.6 | Confident | 150 Ų | 150 | 94.5 Ų | 94.5 | 59% | 0.588 | 52% | 0.523 | S | S | * | . | trans | -78.6 | 91.4 | 178 | -165.5 | -97.9 | 0 | 0 | 0 | 110.2 | F313 L314 Y315 G319 | F313-Y317 PolarHBondContact O-N 2.92Å; F313-Y317 VanDerWaalsContact O-N 3.13Å; L314-Y317 PolarHBondContact O-N 3.39Å; Y315-Y317 VanDerWaalsContact C-N 3.29Å; Y317-G319 PolarHBondContact O-N 2.92Å | ||
| 318 | E | 59.8 | Low | 67.9 | Low | 171 Ų | 171 | 100.3 Ų | 100.3 | 80% | 0.799 | 58% | 0.579 | S | S | * | * | trans | -71.2 | 111 | 165.5 | -72.5 | -179.6 | 175.7 | 0 | 0 | 108 | G316 K320 | G316-E318 PolarHBondContact O-N 3.19Å; G316-E318 VanDerWaalsContact O-N 3.1Å; E318-K320 PolarHBondContact O-N 3.23Å | ||
| 319 | G | 53.3 | Low | 66.5 | Low | 50 Ų | 50 | 105.3 Ų | 105.3 | 52% | 0.515 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -52.8 | 126.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y317 | Y317-G319 PolarHBondContact O-N 2.92Š|
| 320 | K | 41.1 | Very low | 65 | Low | 185 Ų | 185 | 106.9 Ų | 106.9 | 80% | 0.804 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 127.2 | 172.1 | -85 | 179.5 | 176.3 | 175.1 | 0 | 107.8 | E318 S322 | E318-K320 PolarHBondContact O-N 3.23Å; K320-S322 PolarHBondContact O-N 3.31Å |
| 321 | P | 46 | Very low | 63.4 | Low | 122 Ų | 122 | 109 Ų | 109 | 79% | 0.792 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 121.7 | 171.3 | 21.8 | -29.1 | 0 | 0 | 0 | 107 | A323 | P321-A323 PolarHBondContact O-N 3.31Š|
| 322 | S | 41.8 | Very low | 61.5 | Low | 109 Ų | 109 | 115.4 Ų | 115.4 | 76% | 0.762 | 67% | 0.667 | S | S | * | * | trans | -53.7 | 114.4 | 173.3 | 42.8 | 0 | 0 | 0 | 0 | 107.4 | K320 N324 | K320-S322 PolarHBondContact O-N 3.31Å; S322-N324 PolarHBondContact O-N 2.98Å | ||
| 323 | A | 42.2 | Very low | 59.6 | Low | 89 Ų | 89 | 120.1 Ų | 120.1 | 74% | 0.736 | 69% | 0.693 | S | S | * | * | trans | -56 | 113.2 | 173 | 0 | 0 | 0 | 0 | 0 | 107.1 | P321 P325 | P321-A323 PolarHBondContact O-N 3.31Å; A323-P325 WeakPolarHBondContact O-CD 3.48Å | ||
| 324 | N | 40.5 | Very low | 57.5 | Low | 135 Ų | 135 | 117.7 Ų | 117.7 | 72% | 0.722 | 69% | 0.694 | S | S | * | * | trans | -61.6 | 116.5 | 176.5 | -121.6 | 1.9 | 0 | 0 | 0 | 107.5 | S322 S326 | S322-N324 PolarHBondContact O-N 2.98Å; N324-S326 PolarHBondContact O-N 3.38Å; N324-S326 VanDerWaalsContact O-N 3.09Å | ||
| 325 | P | 51.7 | Low | 55 | Low | 125 Ų | 125 | 123.3 Ų | 123.3 | 81% | 0.812 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -73.5 | 5.4 | -179.4 | -14.1 | 29.9 | 0 | 0 | 0 | 113.8 | A323 | A323-P325 WeakPolarHBondContact O-CD 3.48Š|
| 326 | S | 49.8 | Very low | 52.2 | Low | 88 Ų | 88 | 131.2 Ų | 131.2 | 62% | 0.615 | 78% | 0.778 | S | S | * | * | trans | -104.7 | 41.6 | -167 | 69.9 | 0 | 0 | 0 | 0 | 114.4 | N324 | N324-S326 PolarHBondContact O-N 3.38Å; N324-S326 VanDerWaalsContact O-N 3.09Å | ||
| 327 | R | 46.8 | Very low | 49.6 | Very low | 250 Ų | 250 | 137.2 Ų | 137.2 | 94% | 0.943 | 79% | 0.793 | S | S | * | * | trans | -152.7 | 75.1 | 160.5 | -78.8 | -163.1 | 175.1 | 172.6 | -3.1 | 109.3 | ||||
| 328 | A | 41 | Very low | 46.7 | Very low | 172 Ų | 172 | 136 Ų | 136 | 100% | 1.421 | 81% | 0.811 | S | S | * | * | trans | -124 | 0 | 158.1 | 0 | 0 | 0 | 0 | 0 | 107.2 |
Retrieved 328 of 328 residues in 345.9 ms
(Link to these results)