| 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 | 34.3 | Very low | 29.9 | Very low | 248 Ų | 248 | 159.3 Ų | 159.3 | 100% | 1.222 | 87% | 0.867 | S | S | * | * | 0 | 90 | 0 | -93 | 179.3 | 168.7 | 0 | 0 | 107 | |||||
| 2 | E | 27.8 | Very low | 30.3 | Very low | 194 Ų | 194 | 156.2 Ų | 156.2 | 91% | 0.907 | 86% | 0.861 | S | S | * | * | trans | -142.6 | 120.4 | 165.1 | -99.7 | 172.3 | 146.8 | 0 | 0 | 105.6 | ||||
| 3 | R | 25.8 | Very low | 30.5 | Very low | 245 Ų | 245 | 158.8 Ų | 158.8 | 93% | 0.925 | 86% | 0.863 | S | S | * | * | trans | -102.7 | 109.1 | -171.2 | -140 | -178 | -162.8 | 177.3 | 3.9 | 107.1 | A5 | R3-A5 PolarHBondContact O-N 3.09Š| ||
| 4 | S | 29.7 | Very low | 30.5 | Very low | 123 Ų | 123 | 160.2 Ų | 160.2 | 86% | 0.86 | 86% | 0.861 | S | S | * | * | trans | -56.9 | 123.5 | 165.2 | -34.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 5 | A | 30.2 | Very low | 31 | Very low | 104 Ų | 104 | 157.4 Ų | 157.4 | 86% | 0.86 | 86% | 0.855 | S | S | * | * | trans | -109.5 | 118.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | R3 | R3-A5 PolarHBondContact O-N 3.09Š| ||
| 6 | S | 27.4 | Very low | 31.6 | Very low | 97 Ų | 97 | 150.3 Ų | 150.3 | 68% | 0.678 | 83% | 0.83 | S | S | * | * | trans | -92.2 | 148.1 | -179.3 | 57.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 7 | I | 30.4 | Very low | 32.8 | Very low | 146 Ų | 146 | 148.6 Ų | 148.6 | 75% | 0.749 | 83% | 0.825 | S | S | * | * | trans | 71.6 | 122.9 | 138.3 | -62.5 | 161 | 0 | 0 | 0 | 118.7 | ||||
| 8 | N | 34.6 | Very low | 34.3 | Very low | 157 Ų | 157 | 147.5 Ų | 147.5 | 84% | 0.84 | 82% | 0.817 | S | S | * | * | trans | 33.2 | 113.8 | 148.2 | -63 | -24.3 | 0 | 0 | 0 | 118.8 | ||||
| 9 | A | 28 | Very low | 36.1 | Very low | 96 Ų | 96 | 141.4 Ų | 141.4 | 79% | 0.793 | 79% | 0.792 | S | S | * | * | trans | -133.9 | 109.5 | 143.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | Q11 | A9-Q11 PolarHBondContact O-N 3.34Å; A9-Q11 VanDerWaalsContact O-N 3.16Å | ||
| 10 | D | 34.3 | Very low | 38 | Very low | 162 Ų | 162 | 138.1 Ų | 138.1 | 87% | 0.866 | 78% | 0.777 | S | S | * | * | trans | -43.5 | 118.9 | 157 | -84.9 | -41.8 | 0 | 0 | 0 | 108.1 | P12 | D10-P12 WeakPolarHBondContact O-CD 3.43Š| ||
| 11 | Q | 26.6 | Very low | 40 | Very low | 180 Ų | 180 | 135.6 Ų | 135.6 | 84% | 0.841 | 77% | 0.768 | S | S | * | * | trans | -64.2 | 123.3 | 167.2 | -82 | -171.8 | -18.8 | 0 | 0 | 108.1 | A9 Q13 | A9-Q11 PolarHBondContact O-N 3.34Å; A9-Q11 VanDerWaalsContact O-N 3.16Å; Q11-Q13 PolarHBondContact O-N 2.96Å | ||
| 12 | P | 34.3 | Very low | 42.3 | Very low | 122 Ų | 122 | 126.3 Ų | 126.3 | 79% | 0.792 | 73% | 0.725 | S | S | * | * | trans | -71.7 | 101.2 | 173.8 | 27.8 | -29.2 | 0 | 0 | 0 | 108.3 | D10 Q14 | D10-P12 WeakPolarHBondContact O-CD 3.43Å; P12-Q14 PolarHBondContact O-N 3.1Å; P12-Q14 VanDerWaalsContact O-N 3.09Å | ||
| 13 | Q | 32.5 | Very low | 45 | Very low | 190 Ų | 190 | 122 Ų | 122 | 89% | 0.888 | 70% | 0.703 | S | S | * | * | trans | -57.2 | 115.7 | 161.8 | -84.2 | -179.2 | -19.7 | 0 | 0 | 108.1 | Q11 | Q11-Q13 PolarHBondContact O-N 2.96Š| ||
| 14 | Q | 31 | Very low | 47.9 | Very low | 179 Ų | 179 | 117.4 Ų | 117.4 | 84% | 0.836 | 69% | 0.686 | S | S | * | * | trans | -50.6 | 131 | 171.8 | -72.7 | 178.3 | -19.5 | 0 | 0 | 109.4 | P12 G16 | P12-Q14 PolarHBondContact O-N 3.1Å; P12-Q14 VanDerWaalsContact O-N 3.09Å; Q14-G16 VanDerWaalsContact C-N 3.27Å; Q14-G16 PolarHBondContact O-N 3.35Å | ||
| 15 | P | 38.3 | Very low | 50.8 | Low | 118 Ų | 118 | 117.1 Ų | 117.1 | 77% | 0.766 | 67% | 0.666 | S | S | * | * | trans | -74.2 | 87 | 176.3 | 29.8 | -30.5 | 0 | 0 | 0 | 108.4 | ||||
| 16 | G | 40.6 | Very low | 53.6 | Low | 44 Ų | 44 | 112.3 Ų | 112.3 | 45% | 0.454 | 63% | 0.626 | S | S | . | * | trans | -54.2 | 143.6 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | Q14 N18 G19 | Q14-G16 VanDerWaalsContact C-N 3.27Å; Q14-G16 PolarHBondContact O-N 3.35Å; G16-N18 PolarHBondContact O-N 3.15Å; G16-G19 PolarHBondContact O-N 2.71Å | ||
| 17 | T | 51.9 | Low | 56.7 | Low | 122 Ų | 122 | 109.5 Ų | 109.5 | 75% | 0.748 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -45.9 | -32.4 | 176.7 | 32.3 | 0 | 0 | 0 | 0 | 113.2 | G19 C20 C21 | T17-G19 PolarHBondContact O-N 3.28Å; T17-C20 PolarHBondContact O-N 3.23Å; T17-C21 PolarHBondContact O-N 2.86Å |
| 18 | N | 59.2 | Low | 59.6 | Low | 128 Ų | 128 | 107.7 Ų | 107.7 | 68% | 0.684 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -62.2 | -35 | 174.1 | -69.4 | -8.1 | 0 | 0 | 0 | 113.9 | G16 C20 C21 V22 | G16-N18 PolarHBondContact O-N 3.15Å; N18-C20 PolarHBondContact O-N 2.72Å; N18-C21 PolarHBondContact O-N 2.69Å; N18-V22 VanDerWaalsContact O-CG2 3.3Å; N18-V22 WeakPolarHBondContact O-CG2 3.43Å; N18-V22 PolarHBondContact O-N 3.44Å |
| 19 | G | 68.6 | Low | 62.3 | Low | 32 Ų | 32 | 100.2 Ų | 100.2 | 33% | 0.33 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.5 | -31.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | G16 T17 K23 | G16-G19 PolarHBondContact O-N 2.71Å; T17-G19 PolarHBondContact O-N 3.28Å; G19-K23 WeakPolarHBondContact O-CB 3.34Å; G19-K23 WeakPolarHBondContact O-CG 3.5Å; G19-K23 PolarHBondContact O-N 2.87Å; G19-K23 VanDerWaalsContact O-N 3.12Å |
| 20 | C | 74 | Confident | 65.4 | Low | 75 Ų | 75 | 95.7 Ų | 95.7 | 51% | 0.507 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -71.6 | -44.1 | 174.9 | -167.5 | 0 | 0 | 0 | 0 | 111.2 | T17 N18 V22 K23 W24 | T17-C20 PolarHBondContact O-N 3.23Å; N18-C20 PolarHBondContact O-N 2.72Å; C20-V22 PolarHBondContact O-N 3.06Å; C20-K23 PolarHBondContact O-N 3.3Å; C20-W24 WeakPolarHBondContact O-CB 3.45Å; C20-W24 PolarHBondContact O-N 2.93Å |
| 21 | C | 80.1 | Confident | 68.3 | Low | 86 Ų | 86 | 90.4 Ų | 90.4 | 58% | 0.581 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.2 | -42.2 | 175.9 | -70.9 | 0 | 0 | 0 | 0 | 112.3 | T17 N18 W24 R25 | T17-C21 PolarHBondContact O-N 2.86Å; N18-C21 PolarHBondContact O-N 2.69Å; C21-W24 PolarHBondContact O-N 3.27Å; C21-R25 WeakPolarHBondContact O-CB 3.24Å; C21-R25 PolarHBondContact O-N 2.94Å |
| 22 | V | 83.8 | Confident | 71.5 | Confident | 52 Ų | 52 | 84.1 Ų | 84.1 | 32% | 0.315 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65 | -43 | 176.4 | 172 | 0 | 0 | 0 | 0 | 111.4 | N18 C20 W24 R25 N26 V225 | N18-V22 VanDerWaalsContact O-CG2 3.3Å; N18-V22 WeakPolarHBondContact O-CG2 3.43Å; N18-V22 PolarHBondContact O-N 3.44Å; C20-V22 PolarHBondContact O-N 3.06Å; V22-W24 PolarHBondContact O-N 2.91Å; V22-R25 PolarHBondContact O-N 3.38Å; V22-N26 WeakPolarHBondContact O-CB 3.17Å; V22-N26 PolarHBondContact O-N 3.04Å; V22-N26 PolarHBondContact O-ND2 3Å; V22-V225 HydrophobicContact CG1-CB 4.4Å; V22-V225 HydrophobicContact CG1-CG2 4.1Å |
| 23 | K | 83.9 | Confident | 74.3 | Confident | 104 Ų | 104 | 78.3 Ų | 78.3 | 45% | 0.452 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.7 | -44.4 | 175.4 | -75.8 | 172.6 | -177.4 | -179.5 | 0 | 112.1 | G19 C20 W27 | G19-K23 WeakPolarHBondContact O-CB 3.34Å; G19-K23 WeakPolarHBondContact O-CG 3.5Å; G19-K23 PolarHBondContact O-N 2.87Å; G19-K23 VanDerWaalsContact O-N 3.12Å; C20-K23 PolarHBondContact O-N 3.3Å; K23-W27 WeakPolarHBondContact O-CB 3.4Å; K23-W27 PolarHBondContact O-N 3.38Å |
| 24 | W | 86.4 | Confident | 77.2 | Confident | 148 Ų | 148 | 69.2 Ų | 69.2 | 56% | 0.561 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -65.5 | -42.8 | 176.8 | -103.2 | 78.1 | 0 | 0 | 0 | 112.4 | C20 C21 V22 W27 W28 | C20-W24 WeakPolarHBondContact O-CB 3.45Å; C20-W24 PolarHBondContact O-N 2.93Å; C21-W24 PolarHBondContact O-N 3.27Å; V22-W24 PolarHBondContact O-N 2.91Å; W24-W27 WeakPolarHBondContact O-CB 3.45Å; W24-W27 PolarHBondContact O-N 3.39Å; W24-W28 AromaticContact CE3-CD1 3.6Å; W24-W28 AromaticContact CE3-NE1 3.21Å; W24-W28 HydrophobicContact CZ3-CZ2 4.49Å; W24-W28 AromaticContact CZ3-NE1 3.15Å; W24-W28 PolarHBondContact O-N 3.49Å |
| 25 | R | 89.8 | Confident | 80.2 | Confident | 118 Ų | 118 | 62 Ų | 62 | 45% | 0.445 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.4 | -47.7 | 177.7 | 179.9 | 166.7 | 71.4 | 176.6 | 1.4 | 111.3 | C21 V22 W27 W28 G29 L223 | C21-R25 WeakPolarHBondContact O-CB 3.24Å; C21-R25 PolarHBondContact O-N 2.94Å; V22-R25 PolarHBondContact O-N 3.38Å; R25-W27 VanDerWaalsContact C-N 3.31Å; R25-W27 PolarHBondContact O-N 3.35Å; R25-W28 PolarHBondContact O-N 2.95Å; R25-G29 PolarHBondContact O-N 2.95Å; R25-L223 WeakPolarHBondContact CD-O 3.3Å; R25-L223 HydrophobicContact CG-CG 4.34Å; R25-L223 WeakPolarHBondContact CG-O 3.29Å; R25-L223 WeakPolarHBondContact O-CD2 3.41Å |
| 26 | N | 89.9 | Confident | 82.9 | Confident | 3 Ų | 3 | 56.8 Ų | 56.8 | 2% | 0.016 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.2 | -37.3 | 175.6 | -71.3 | -17.9 | 0 | 0 | 0 | 111.9 | V22 G29 F30 F169 V173 V225 | V22-N26 WeakPolarHBondContact O-CB 3.17Å; V22-N26 PolarHBondContact O-N 3.04Å; V22-N26 PolarHBondContact O-ND2 3Å; N26-G29 PolarHBondContact O-N 3.32Å; N26-F30 WeakPolarHBondContact O-CD2 3.48Å; N26-F30 PolarHBondContact O-N 3.38Å; N26-F169 HydrophobicContact CB-CD1 4.15Å; N26-F169 HydrophobicContact CB-CE1 4.45Å; N26-F169 WeakPolarHBondContact ND2-CD1 3.22Å; N26-V173 HydrophobicContact CB-CG1 4.1Å; N26-V225 WeakPolarHBondContact OD1-CG2 3.13Å; N26-V225 PolarHBondContact OD1-N 3.33Å |
| 27 | W | 91.7 | Very high | 85.4 | Confident | 37 Ų | 37 | 54.8 Ų | 54.8 | 14% | 0.14 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.2 | -49.3 | 175.5 | -172.9 | 90.6 | 0 | 0 | 0 | 112 | K23 W24 R25 G29 F30 W31 N172 R346 | K23-W27 WeakPolarHBondContact O-CB 3.4Å; K23-W27 PolarHBondContact O-N 3.38Å; W24-W27 WeakPolarHBondContact O-CB 3.45Å; W24-W27 PolarHBondContact O-N 3.39Å; R25-W27 VanDerWaalsContact C-N 3.31Å; R25-W27 PolarHBondContact O-N 3.35Å; W27-G29 PolarHBondContact O-N 3.14Å; W27-F30 PolarHBondContact O-N 3.22Å; W27-W31 HydrophobicContact CE3-CB 4.46Å; W27-W31 HydrophobicContact CH2-CB 4.5Å; W27-W31 AromaticContact CH2-CD1 3.78Å; W27-W31 HydrophobicContact CH2-CG 4.22Å; W27-W31 HydrophobicContact CZ3-CB 4.23Å; W27-W31 HydrophobicContact CZ3-CG 4.22Å; W27-W31 WeakPolarHBondContact O-CB 3.41Å; W27-W31 PolarHBondContact O-N 2.8Å; W27-N172 PolarHBondContact NE1-O 3.45Å; W27-R346 VanDerWaalsContact CZ2-NH2 3.31Å |
| 28 | W | 91.6 | Very high | 87.2 | Confident | 109 Ų | 109 | 50.1 Ų | 50.1 | 41% | 0.413 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.9 | -32 | 175.4 | -83.8 | 107.2 | 0 | 0 | 0 | 112.7 | W24 R25 W31 L32 L223 | W24-W28 AromaticContact CE3-CD1 3.6Å; W24-W28 AromaticContact CE3-NE1 3.21Å; W24-W28 HydrophobicContact CZ3-CZ2 4.49Å; W24-W28 AromaticContact CZ3-NE1 3.15Å; W24-W28 PolarHBondContact O-N 3.49Å; R25-W28 PolarHBondContact O-N 2.95Å; W28-W31 HydrophobicContact CE3-CB 4.45Å; W28-W31 HydrophobicContact CE3-CD2 4.09Å; W28-W31 AromaticContact CE3-CE3 3.74Å; W28-W31 HydrophobicContact CE3-CE3 3.74Å; W28-W31 HydrophobicContact CE3-CG 4.4Å; W28-W31 HydrophobicContact CE3-CZ3 4.36Å; W28-W31 AromaticContact CZ3-CD2 3.87Å; W28-W31 HydrophobicContact CZ3-CD2 3.87Å; W28-W31 AromaticContact CZ3-CE3 3.59Å; W28-W31 HydrophobicContact CZ3-CE3 3.59Å; W28-W31 HydrophobicContact CZ3-CG 4.47Å; W28-W31 HydrophobicContact CZ3-CH2 4.36Å; W28-W31 AromaticContact CZ3-CZ3 3.87Å; W28-W31 HydrophobicContact CZ3-CZ3 3.87Å; W28-W31 PolarHBondContact O-N 2.99Å; W28-L32 WeakPolarHBondContact O-CB 3.46Å; W28-L32 PolarHBondContact O-N 3.5Å; W28-L223 HydrophobicContact CB-CD2 3.89Å |
| 29 | G | 91.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.1 | -54.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | R25 N26 W27 W31 L32 L33 S219 | R25-G29 PolarHBondContact O-N 2.95Å; N26-G29 PolarHBondContact O-N 3.32Å; W27-G29 PolarHBondContact O-N 3.14Å; G29-W31 VanDerWaalsContact C-N 3.29Å; G29-W31 PolarHBondContact O-N 3.17Å; G29-L32 PolarHBondContact O-N 3.36Å; G29-L33 WeakPolarHBondContact O-CB 3.3Å; G29-L33 VanDerWaalsContact O-CG 3.23Å; G29-L33 WeakPolarHBondContact O-CG 3.41Å; G29-L33 PolarHBondContact O-N 2.78Å; G29-S219 WeakPolarHBondContact CA-OG 3.49Å; G29-S219 PolarHBondContact O-OG 2.92Å |
| 30 | F | 93 | Very high | 89.7 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.6 | -32.8 | 176.3 | -86.8 | -94.5 | 0 | 0 | 0 | 113.2 | N26 W27 G34 F162 L165 F169 V173 W177 L224 | N26-F30 WeakPolarHBondContact O-CD2 3.48Å; N26-F30 PolarHBondContact O-N 3.38Å; W27-F30 PolarHBondContact O-N 3.22Å; F30-G34 PolarHBondContact O-N 3.24Å; F30-F162 WeakPolarHBondContact CE1-O 3.33Å; F30-L165 HydrophobicContact CZ-CB 4.31Å; F30-L165 HydrophobicContact CZ-CD2 4.04Å; F30-L165 HydrophobicContact CZ-CG 3.97Å; F30-F169 HydrophobicContact CE2-CB 4.31Å; F30-F169 HydrophobicContact CE2-CD1 4.26Å; F30-F169 AromaticContact CE2-CD2 3.51Å; F30-F169 HydrophobicContact CE2-CD2 3.51Å; F30-F169 HydrophobicContact CE2-CE1 4.49Å; F30-F169 AromaticContact CE2-CE2 3.81Å; F30-F169 HydrophobicContact CE2-CE2 3.81Å; F30-F169 AromaticContact CE2-CG 3.77Å; F30-F169 HydrophobicContact CE2-CG 3.77Å; F30-F169 HydrophobicContact CE2-CZ 4.29Å; F30-F169 AromaticContact CZ-CD2 3.59Å; F30-F169 HydrophobicContact CZ-CD2 3.59Å; F30-F169 AromaticContact CZ-CE2 3.97Å; F30-F169 HydrophobicContact CZ-CE2 3.97Å; F30-F169 HydrophobicContact CZ-CG 4.21Å; F30-V173 HydrophobicContact CB-CB 4Å; F30-V173 HydrophobicContact CD1-CB 4.3Å; F30-V173 HydrophobicContact CD1-CG2 4.19Å; F30-V173 HydrophobicContact CD2-CB 3.63Å; F30-V173 HydrophobicContact CD2-CG1 3.91Å; F30-V173 HydrophobicContact CD2-CG2 3.96Å; F30-V173 HydrophobicContact CE1-CG2 4.21Å; F30-V173 HydrophobicContact CE2-CB 4.13Å; F30-V173 HydrophobicContact CE2-CG1 4.33Å; F30-V173 HydrophobicContact CE2-CG2 3.97Å; F30-V173 HydrophobicContact CG-CB 3.7Å; F30-V173 HydrophobicContact CG-CG1 4.46Å; F30-V173 HydrophobicContact CG-CG2 4.05Å; F30-V173 HydrophobicContact CZ-CG2 4.09Å; F30-W177 HydrophobicContact CB-CB 4.38Å; F30-W177 HydrophobicContact CD1-CB 4.27Å; F30-L224 HydrophobicContact CD2-CD2 4.22Å; F30-L224 HydrophobicContact CE2-CD2 3.7Å; F30-L224 HydrophobicContact CE2-CG 4.36Å; F30-L224 HydrophobicContact CZ-CD2 4.28Å |
| 31 | W | 94.6 | Very high | 90.2 | Very high | 52 Ų | 52 | 40.4 Ų | 40.4 | 20% | 0.197 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.8 | -48.1 | 173.5 | -173.3 | 89.4 | 0 | 0 | 0 | 111.8 | W27 W28 G29 G34 L35 G176 S179 G180 A183 | W27-W31 HydrophobicContact CE3-CB 4.46Å; W27-W31 HydrophobicContact CH2-CB 4.5Å; W27-W31 AromaticContact CH2-CD1 3.78Å; W27-W31 HydrophobicContact CH2-CG 4.22Å; W27-W31 HydrophobicContact CZ3-CB 4.23Å; W27-W31 HydrophobicContact CZ3-CG 4.22Å; W27-W31 WeakPolarHBondContact O-CB 3.41Å; W27-W31 PolarHBondContact O-N 2.8Å; W28-W31 HydrophobicContact CE3-CB 4.45Å; W28-W31 HydrophobicContact CE3-CD2 4.09Å; W28-W31 AromaticContact CE3-CE3 3.74Å; W28-W31 HydrophobicContact CE3-CE3 3.74Å; W28-W31 HydrophobicContact CE3-CG 4.4Å; W28-W31 HydrophobicContact CE3-CZ3 4.36Å; W28-W31 AromaticContact CZ3-CD2 3.87Å; W28-W31 HydrophobicContact CZ3-CD2 3.87Å; W28-W31 AromaticContact CZ3-CE3 3.59Å; W28-W31 HydrophobicContact CZ3-CE3 3.59Å; W28-W31 HydrophobicContact CZ3-CG 4.47Å; W28-W31 HydrophobicContact CZ3-CH2 4.36Å; W28-W31 AromaticContact CZ3-CZ3 3.87Å; W28-W31 HydrophobicContact CZ3-CZ3 3.87Å; W28-W31 PolarHBondContact O-N 2.99Å; G29-W31 VanDerWaalsContact C-N 3.29Å; G29-W31 PolarHBondContact O-N 3.17Å; W31-G34 PolarHBondContact O-N 2.79Å; W31-L35 HydrophobicContact CH2-CD1 3.6Å; W31-L35 HydrophobicContact CZ2-CD1 4.2Å; W31-L35 HydrophobicContact CZ3-CD1 3.87Å; W31-L35 PolarHBondContact O-N 2.93Å; W31-G176 WeakPolarHBondContact CA-O 3.29Å; W31-S179 PolarHBondContact NE1-OG 3.03Å; W31-G180 WeakPolarHBondContact O-CA 3.46Å; W31-A183 HydrophobicContact CZ2-CB 3.99Å |
| 32 | L | 94.3 | Very high | 90.4 | Very high | 47 Ų | 47 | 37 Ų | 37 | 25% | 0.246 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -68.2 | -38.1 | 178.1 | -173.6 | 61.6 | 0 | 0 | 0 | 111.7 | W28 G29 G34 L35 C36 | W28-L32 WeakPolarHBondContact O-CB 3.46Å; W28-L32 PolarHBondContact O-N 3.5Å; G29-L32 PolarHBondContact O-N 3.36Å; L32-G34 PolarHBondContact O-N 3.07Å; L32-L35 PolarHBondContact O-N 3.14Å; L32-C36 PolarHBondContact O-N 3.05Å; L32-C36 PolarHBondContact O-SG 3.11Å |
| 33 | L | 94.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.6 | -44.6 | 173.2 | -70.1 | 173.5 | 0 | 0 | 0 | 111.4 | G29 L35 C36 N37 F162 W177 M216 L224 | G29-L33 WeakPolarHBondContact O-CB 3.3Å; G29-L33 VanDerWaalsContact O-CG 3.23Å; G29-L33 WeakPolarHBondContact O-CG 3.41Å; G29-L33 PolarHBondContact O-N 2.78Å; L33-L35 VanDerWaalsContact C-N 3.32Å; L33-L35 PolarHBondContact O-N 3.5Å; L33-C36 PolarHBondContact O-N 2.79Å; L33-N37 WeakPolarHBondContact O-CB 3.21Å; L33-N37 PolarHBondContact O-N 3.42Å; L33-F162 HydrophobicContact CB-CD1 4.42Å; L33-F162 HydrophobicContact CB-CE1 4.43Å; L33-F162 HydrophobicContact CD1-CD1 3.78Å; L33-F162 HydrophobicContact CD1-CE1 3.78Å; L33-F162 HydrophobicContact CD2-CD1 4.43Å; L33-F162 HydrophobicContact CD2-CE1 3.7Å; L33-F162 HydrophobicContact CD2-CZ 3.76Å; L33-F162 HydrophobicContact CG-CD1 4.43Å; L33-F162 HydrophobicContact CG-CE1 4.17Å; L33-W177 HydrophobicContact CB-CE3 4.32Å; L33-W177 HydrophobicContact CB-CZ3 4.06Å; L33-M216 HydrophobicContact CD2-CG 3.87Å; L33-M216 WeakPolarHBondContact CD2-O 3.31Å; L33-L224 HydrophobicContact CD1-CD1 3.62Å; L33-L224 HydrophobicContact CD1-CD2 4Å; L33-L224 HydrophobicContact CD1-CG 4.5Å; L33-L224 HydrophobicContact CG-CD1 4.34Å |
| 34 | G | 92.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.8 | -40.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F30 W31 L32 W177 T181 | F30-G34 PolarHBondContact O-N 3.24Å; W31-G34 PolarHBondContact O-N 2.79Å; L32-G34 PolarHBondContact O-N 3.07Å; G34-W177 VanDerWaalsContact N-CZ3 3.33Å; G34-T181 WeakPolarHBondContact O-CA 3.41Å; G34-T181 WeakPolarHBondContact O-CG2 3.4Å |
| 35 | L | 93.8 | Very high | 89.8 | Confident | 26 Ų | 26 | 25 Ų | 25 | 14% | 0.136 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.4 | -54.1 | 176 | -174.9 | 150.6 | 0 | 0 | 0 | 111.2 | W31 L32 L33 N37 F39 G180 A183 A184 | W31-L35 HydrophobicContact CH2-CD1 3.6Å; W31-L35 HydrophobicContact CZ2-CD1 4.2Å; W31-L35 HydrophobicContact CZ3-CD1 3.87Å; W31-L35 PolarHBondContact O-N 2.93Å; L32-L35 PolarHBondContact O-N 3.14Å; L33-L35 VanDerWaalsContact C-N 3.32Å; L33-L35 PolarHBondContact O-N 3.5Å; L35-N37 PolarHBondContact O-N 3.27Å; L35-F39 WeakPolarHBondContact O-CB 3.32Å; L35-F39 PolarHBondContact O-N 3.49Å; L35-G180 VanDerWaalsContact CA-O 3.25Å; L35-G180 WeakPolarHBondContact CA-O 3.3Å; L35-G180 PolarHBondContact N-O 3.43Å; L35-A183 HydrophobicContact CD1-CB 4.13Å; L35-A184 WeakPolarHBondContact O-CB 3.48Å |
| 36 | C | 94.4 | Very high | 88.9 | Confident | 10 Ų | 10 | 21.6 Ų | 21.6 | 7% | 0.068 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -70.3 | -35.1 | -173.7 | -59.2 | 0 | 0 | 0 | 0 | 113.1 | L32 L33 N38 F39 V212 M216 | L32-C36 PolarHBondContact O-N 3.05Å; L32-C36 PolarHBondContact O-SG 3.11Å; L33-C36 PolarHBondContact O-N 2.79Å; C36-N38 VanDerWaalsContact C-N 3.34Å; C36-N38 PolarHBondContact O-N 2.81Å; C36-F39 PolarHBondContact O-N 2.95Å; C36-V212 HydrophobicContact CB-CG1 3.72Å; C36-M216 HydrophobicContact CB-CB 3.6Å; C36-M216 HydrophobicContact CB-CG 4.02Å; C36-M216 HydrophobicContact CB-SD 4.3Å |
| 37 | N | 94.3 | Very high | 88 | Confident | 2 Ų | 2 | 21.4 Ų | 21.4 | 1% | 0.011 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -59 | -43.4 | -177.5 | -176.4 | 74.8 | 0 | 0 | 0 | 113 | L33 L35 S155 G158 E159 F162 W177 M216 | L33-N37 WeakPolarHBondContact O-CB 3.21Å; L33-N37 PolarHBondContact O-N 3.42Å; L35-N37 PolarHBondContact O-N 3.27Å; N37-S155 PolarHBondContact ND2-O 2.89Å; N37-S155 WeakPolarHBondContact O-CB 3.36Å; N37-G158 WeakPolarHBondContact OD1-CA 3.27Å; N37-E159 PolarHBondContact ND2-N 3.31Å; N37-F162 HydrophobicContact CB-CD2 4.37Å; N37-F162 HydrophobicContact CB-CE2 4.24Å; N37-W177 HydrophobicContact CB-CH2 3.84Å; N37-W177 HydrophobicContact CB-CZ3 4.33Å; N37-M216 HydrophobicContact CB-SD 4.41Å |
| 38 | N | 90.1 | Very high | 86.7 | Confident | 24 Ų | 24 | 20.4 Ų | 20.4 | 13% | 0.128 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -95.2 | -5.2 | -176.4 | -65.8 | -42 | 0 | 0 | 0 | 113.1 | C36 Y41 V42 T181 A184 | C36-N38 VanDerWaalsContact C-N 3.34Å; C36-N38 PolarHBondContact O-N 2.81Å; N38-Y41 WeakPolarHBondContact O-CB 3.32Å; N38-Y41 PolarHBondContact O-N 3.06Å; N38-V42 VanDerWaalsContact O-CG2 3.32Å; N38-V42 WeakPolarHBondContact O-CG2 3.35Å; N38-V42 PolarHBondContact O-N 3.26Å; N38-V42 VanDerWaalsContact O-N 3.1Å; N38-T181 WeakPolarHBondContact ND2-CB 3.25Å; N38-T181 WeakPolarHBondContact ND2-CG2 3.15Å; N38-A184 HydrophobicContact CB-CB 3.82Å |
| 39 | F | 90.6 | Very high | 85.3 | Confident | 4 Ų | 4 | 21.4 Ų | 21.4 | 2% | 0.018 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -62.8 | -48 | -175.3 | -170.9 | -90.2 | 0 | 0 | 0 | 112.4 | L35 C36 Y41 V42 V43 F132 A187 G188 L191 M209 V212 | L35-F39 WeakPolarHBondContact O-CB 3.32Å; L35-F39 PolarHBondContact O-N 3.49Å; C36-F39 PolarHBondContact O-N 2.95Å; F39-Y41 VanDerWaalsContact C-N 3.34Å; F39-Y41 PolarHBondContact O-N 3.3Å; F39-V42 PolarHBondContact O-N 2.94Å; F39-V43 HydrophobicContact CD1-CG2 3.96Å; F39-V43 HydrophobicContact CE1-CG2 3.51Å; F39-V43 HydrophobicContact CZ-CG2 3.8Å; F39-V43 WeakPolarHBondContact O-CG2 3.3Å; F39-V43 PolarHBondContact O-N 3.31Å; F39-F132 HydrophobicContact CD1-CZ 4.04Å; F39-F132 HydrophobicContact CE1-CZ 4.35Å; F39-A187 HydrophobicContact CE2-CB 4.42Å; F39-G188 VanDerWaalsContact CE2-CA 3.43Å; F39-L191 HydrophobicContact CE2-CD2 4.44Å; F39-L191 HydrophobicContact CZ-CD2 3.93Å; F39-M209 HydrophobicContact CE1-CB 4.07Å; F39-M209 HydrophobicContact CE1-CG 3.95Å; F39-M209 HydrophobicContact CE1-SD 3.86Å; F39-M209 HydrophobicContact CZ-CE 4.21Å; F39-M209 HydrophobicContact CZ-CG 4.27Å; F39-M209 HydrophobicContact CZ-SD 4.14Å; F39-V212 HydrophobicContact CB-CG1 3.73Å; F39-V212 HydrophobicContact CD1-CB 4Å; F39-V212 HydrophobicContact CD1-CG1 3.82Å; F39-V212 HydrophobicContact CD1-CG2 3.81Å; F39-V212 HydrophobicContact CE1-CB 4.44Å; F39-V212 HydrophobicContact CE1-CG2 3.81Å; F39-V212 HydrophobicContact CG-CB 4.4Å; F39-V212 HydrophobicContact CG-CG1 3.76Å; F39-V212 HydrophobicContact CG-CG2 4.23Å; F39-V212 HydrophobicContact CZ-CG2 4.23Å |
| 40 | A | 88.5 | Confident | 84.1 | Confident | 4 Ų | 4 | 23.9 Ų | 23.9 | 3% | 0.033 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -60.5 | -44.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | V42 V43 M44 F132 A151 | A40-V42 PolarHBondContact O-N 3.11Å; A40-V43 PolarHBondContact O-N 3.11Å; A40-M44 WeakPolarHBondContact O-CB 3.49Å; A40-M44 VanDerWaalsContact O-CG 3.24Å; A40-M44 WeakPolarHBondContact O-CG 3.5Å; A40-M44 PolarHBondContact O-N 2.89Å; A40-F132 HydrophobicContact CB-CE1 4.39Å; A40-F132 HydrophobicContact CB-CE2 3.82Å; A40-F132 HydrophobicContact CB-CZ 3.64Å; A40-A151 HydrophobicContact CB-CB 4.07Å |
| 41 | Y | 85 | Confident | 82.8 | Confident | 22 Ų | 22 | 24.9 Ų | 24.9 | 9% | 0.086 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -54.8 | -51.4 | 176.2 | -179.1 | -93.2 | 0 | 0 | 0 | 111.8 | N38 F39 V43 M44 L45 D97 | N38-Y41 WeakPolarHBondContact O-CB 3.32Å; N38-Y41 PolarHBondContact O-N 3.06Å; F39-Y41 VanDerWaalsContact C-N 3.34Å; F39-Y41 PolarHBondContact O-N 3.3Å; Y41-V43 PolarHBondContact O-N 3.49Å; Y41-M44 PolarHBondContact O-N 3.37Å; Y41-L45 HydrophobicContact CD1-CD1 3.71Å; Y41-L45 HydrophobicContact CE1-CD1 3.3Å; Y41-L45 HydrophobicContact CE2-CD1 4.45Å; Y41-L45 HydrophobicContact CG-CD1 4.41Å; Y41-L45 PolarHBondContact O-N 3.06Å; Y41-L45 VanDerWaalsContact O-N 3.12Å; Y41-D97 WeakPolarHBondContact CD2-OD1 3.47Å; Y41-D97 WeakPolarHBondContact CD2-OD2 3.48Å; Y41-D97 HydrophobicContact CE2-CB 4.24Å; Y41-D97 WeakPolarHBondContact CE2-OD1 3.23Å; Y41-D97 WeakPolarHBondContact CE2-OD2 3.34Å |
| 42 | V | 84.3 | Confident | 81.3 | Confident | 16 Ų | 16 | 24.9 Ų | 24.9 | 10% | 0.097 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63.9 | -42.1 | -179.7 | 172.9 | 0 | 0 | 0 | 0 | 112.3 | N38 F39 A40 L45 S46 | N38-V42 VanDerWaalsContact O-CG2 3.32Å; N38-V42 WeakPolarHBondContact O-CG2 3.35Å; N38-V42 PolarHBondContact O-N 3.26Å; N38-V42 VanDerWaalsContact O-N 3.1Å; F39-V42 PolarHBondContact O-N 2.94Å; A40-V42 PolarHBondContact O-N 3.11Å; V42-L45 PolarHBondContact O-N 2.89Å; V42-S46 WeakPolarHBondContact O-CB 3.26Å; V42-S46 PolarHBondContact O-N 3.26Å; V42-S46 PolarHBondContact O-OG 3.43Å |
| 43 | V | 84.6 | Confident | 79.8 | Confident | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.8 | -39.1 | 179.3 | 170.4 | 0 | 0 | 0 | 0 | 111 | F39 A40 Y41 S46 A47 F132 Y192 L206 M209 | F39-V43 HydrophobicContact CD1-CG2 3.96Å; F39-V43 HydrophobicContact CE1-CG2 3.51Å; F39-V43 HydrophobicContact CZ-CG2 3.8Å; F39-V43 WeakPolarHBondContact O-CG2 3.3Å; F39-V43 PolarHBondContact O-N 3.31Å; A40-V43 PolarHBondContact O-N 3.11Å; Y41-V43 PolarHBondContact O-N 3.49Å; V43-S46 PolarHBondContact O-N 3.14Å; V43-A47 WeakPolarHBondContact O-CB 3.08Å; V43-A47 PolarHBondContact O-N 3.34Å; V43-F132 HydrophobicContact CB-CE1 4.39Å; V43-F132 HydrophobicContact CG1-CE1 4.15Å; V43-Y192 HydrophobicContact CG1-CD2 4.04Å; V43-L206 HydrophobicContact CG1-CD2 3.66Å; V43-M209 HydrophobicContact CB-SD 4.37Å; V43-M209 HydrophobicContact CG1-SD 3.68Å; V43-M209 HydrophobicContact CG2-CE 4.27Å; V43-M209 HydrophobicContact CG2-SD 3.79Å |
| 44 | M | 82.3 | Confident | 78.3 | Confident | 3 Ų | 3 | 33.3 Ų | 33.3 | 2% | 0.015 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.4 | -41.8 | 178.1 | -69.7 | -55.3 | 142.7 | 0 | 0 | 112 | A40 Y41 S46 A47 A48 F132 V135 V148 A151 L206 | A40-M44 WeakPolarHBondContact O-CB 3.49Å; A40-M44 VanDerWaalsContact O-CG 3.24Å; A40-M44 WeakPolarHBondContact O-CG 3.5Å; A40-M44 PolarHBondContact O-N 2.89Å; Y41-M44 PolarHBondContact O-N 3.37Å; M44-S46 VanDerWaalsContact C-N 3.32Å; M44-S46 PolarHBondContact O-N 2.97Å; M44-A47 PolarHBondContact O-N 2.96Å; M44-A48 WeakPolarHBondContact O-CB 3.45Å; M44-A48 PolarHBondContact O-N 3.13Å; M44-F132 HydrophobicContact CE-CD1 3.41Å; M44-F132 VanDerWaalsContact CE-CD1 3.41Å; M44-F132 HydrophobicContact CE-CE1 3.6Å; M44-F132 HydrophobicContact CE-CG 4.4Å; M44-V135 HydrophobicContact CE-CB 4.3Å; M44-V135 HydrophobicContact CE-CG2 4.19Å; M44-V135 HydrophobicContact SD-CB 4.19Å; M44-V135 HydrophobicContact SD-CG1 4.12Å; M44-V135 HydrophobicContact SD-CG2 3.7Å; M44-V148 HydrophobicContact CB-CG2 4.33Å; M44-A151 HydrophobicContact CG-CB 4.01Å; M44-L206 HydrophobicContact CE-CD2 3.96Å |
| 45 | L | 73.8 | Confident | 76.9 | Confident | 48 Ų | 48 | 34.1 Ų | 34.1 | 25% | 0.251 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -59.2 | -43 | 171.3 | -81.6 | 153.8 | 0 | 0 | 0 | 112.1 | Y41 V42 L94 D97 | Y41-L45 HydrophobicContact CD1-CD1 3.71Å; Y41-L45 HydrophobicContact CE1-CD1 3.3Å; Y41-L45 HydrophobicContact CE2-CD1 4.45Å; Y41-L45 HydrophobicContact CG-CD1 4.41Å; Y41-L45 PolarHBondContact O-N 3.06Å; Y41-L45 VanDerWaalsContact O-N 3.12Å; V42-L45 PolarHBondContact O-N 2.89Å; L45-L94 HydrophobicContact CD2-CD1 4.44Å; L45-D97 WeakPolarHBondContact CD1-OD2 3.42Å; L45-D97 WeakPolarHBondContact CG-OD2 3.27Å |
| 46 | S | 72.3 | Confident | 75.2 | Confident | 46 Ų | 46 | 38 Ų | 38 | 32% | 0.322 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -70.2 | -34.5 | 180 | -54.6 | 0 | 0 | 0 | 0 | 112.7 | V42 V43 M44 | V42-S46 WeakPolarHBondContact O-CB 3.26Å; V42-S46 PolarHBondContact O-N 3.26Å; V42-S46 PolarHBondContact O-OG 3.43Å; V43-S46 PolarHBondContact O-N 3.14Å; M44-S46 VanDerWaalsContact C-N 3.32Å; M44-S46 PolarHBondContact O-N 2.97Å |
| 47 | A | 69.9 | Low | 73.4 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -86.7 | -15.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | V43 M44 H49 D50 I51 Y192 | V43-A47 WeakPolarHBondContact O-CB 3.08Å; V43-A47 PolarHBondContact O-N 3.34Å; M44-A47 PolarHBondContact O-N 2.96Å; A47-H49 VanDerWaalsContact C-N 3.27Å; A47-H49 PolarHBondContact O-N 3.25Å; A47-D50 PolarHBondContact O-N 2.97Å; A47-I51 HydrophobicContact CB-CD1 3.68Å; A47-I51 HydrophobicContact CB-CG1 4.37Å; A47-I51 WeakPolarHBondContact O-CB 3.35Å; A47-I51 WeakPolarHBondContact O-CD1 3.17Å; A47-I51 WeakPolarHBondContact O-CG1 3.46Å; A47-I51 PolarHBondContact O-N 3.06Å; A47-Y192 HydrophobicContact CB-CE1 4.24Å; A47-Y192 HydrophobicContact CB-CE2 3.76Å |
| 48 | A | 65.9 | Low | 71.4 | Confident | 16 Ų | 16 | 47.1 Ų | 47.1 | 13% | 0.132 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -54.6 | -41.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | M44 L52 V93 | M44-A48 WeakPolarHBondContact O-CB 3.45Å; M44-A48 PolarHBondContact O-N 3.13Å; A48-L52 WeakPolarHBondContact O-CB 3.29Å; A48-L52 WeakPolarHBondContact O-CD1 3.35Å; A48-L52 WeakPolarHBondContact O-CG 3.41Å; A48-L52 PolarHBondContact O-N 3.4Å; A48-L52 VanDerWaalsContact O-N 3.07Å; A48-V93 HydrophobicContact CB-CG1 3.79Å |
| 49 | H | 61.4 | Low | 69.5 | Low | 129 Ų | 129 | 49.9 Ų | 49.9 | 60% | 0.597 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -65.2 | -49.4 | 179.9 | -159.8 | 65.5 | 0 | 0 | 0 | 111.9 | A47 I51 L52 E53 | A47-H49 VanDerWaalsContact C-N 3.27Å; A47-H49 PolarHBondContact O-N 3.25Å; H49-I51 VanDerWaalsContact C-N 3.29Å; H49-I51 PolarHBondContact O-N 3.3Å; H49-L52 PolarHBondContact O-N 3.36Å; H49-E53 PolarHBondContact O-N 3.22Å |
| 50 | D | 65.8 | Low | 67.5 | Low | 53 Ų | 53 | 53.2 Ų | 53.2 | 28% | 0.283 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.1 | -35.2 | 179.5 | -60 | -23.6 | 0 | 0 | 0 | 112.6 | A47 K54 Y192 | A47-D50 PolarHBondContact O-N 2.97Å; D50-K54 VanDerWaalsContact O-CB 3.26Å; D50-K54 WeakPolarHBondContact O-CB 3.28Å; D50-K54 PolarHBondContact O-N 3.36Å; D50-Y192 VanDerWaalsContact OD2-CE1 3.27Å; D50-Y192 WeakPolarHBondContact OD2-CE1 3.38Å; D50-Y192 PolarHBondContact OD2-OH 3.09Å |
| 51 | I | 65.7 | Low | 65.4 | Low | 21 Ų | 21 | 58.7 Ų | 58.7 | 11% | 0.108 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -71.2 | -44.5 | -179.7 | -68.2 | 161.6 | 0 | 0 | 0 | 110.3 | A47 H49 Q55 V135 S144 | A47-I51 HydrophobicContact CB-CD1 3.68Å; A47-I51 HydrophobicContact CB-CG1 4.37Å; A47-I51 WeakPolarHBondContact O-CB 3.35Å; A47-I51 WeakPolarHBondContact O-CD1 3.17Å; A47-I51 WeakPolarHBondContact O-CG1 3.46Å; A47-I51 PolarHBondContact O-N 3.06Å; H49-I51 VanDerWaalsContact C-N 3.29Å; H49-I51 PolarHBondContact O-N 3.3Å; I51-Q55 WeakPolarHBondContact O-CB 3.37Å; I51-Q55 VanDerWaalsContact O-CG 3.27Å; I51-Q55 WeakPolarHBondContact O-CG 3.18Å; I51-Q55 PolarHBondContact O-N 2.89Å; I51-V135 HydrophobicContact CD1-CG1 3.38Å; I51-V135 HydrophobicContact CG1-CG1 4.32Å; I51-S144 WeakPolarHBondContact CG2-OG 3.35Å |
| 52 | L | 62.8 | Low | 63.7 | Low | 52 Ų | 52 | 63.2 Ų | 63.2 | 27% | 0.272 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -65.8 | -46.5 | -179.9 | -70.8 | 170.7 | 0 | 0 | 0 | 111.3 | A48 H49 K54 Q55 E56 V141 | A48-L52 WeakPolarHBondContact O-CB 3.29Å; A48-L52 WeakPolarHBondContact O-CD1 3.35Å; A48-L52 WeakPolarHBondContact O-CG 3.41Å; A48-L52 PolarHBondContact O-N 3.4Å; A48-L52 VanDerWaalsContact O-N 3.07Å; H49-L52 PolarHBondContact O-N 3.36Å; L52-K54 PolarHBondContact O-N 3.42Å; L52-Q55 PolarHBondContact O-N 3.46Å; L52-Q55 VanDerWaalsContact O-N 3.14Å; L52-E56 PolarHBondContact O-N 3.07Å; L52-V141 HydrophobicContact CD2-CG1 4.02Å |
| 53 | E | 63.6 | Low | 61.4 | Low | 126 Ų | 126 | 65 Ų | 65 | 59% | 0.589 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -61.8 | -41.7 | 179.7 | -169.2 | -175.5 | 179.1 | 0 | 0 | 112.3 | H49 Q55 S57 | H49-E53 PolarHBondContact O-N 3.22Å; E53-Q55 VanDerWaalsContact C-N 3.27Å; E53-Q55 PolarHBondContact O-N 3.39Å; E53-S57 WeakPolarHBondContact O-CB 3.44Å; E53-S57 PolarHBondContact O-N 3.01Å; E53-S57 VanDerWaalsContact O-N 3.11Å; E53-S57 PolarHBondContact O-OG 3.28Å |
| 54 | K | 63.2 | Low | 59.3 | Low | 97 Ų | 97 | 69.7 Ų | 69.7 | 42% | 0.422 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -68.5 | -25.4 | 178.1 | -169.6 | 172.3 | -174.5 | 171.6 | 0 | 113.4 | D50 L52 S57 | D50-K54 VanDerWaalsContact O-CB 3.26Å; D50-K54 WeakPolarHBondContact O-CB 3.28Å; D50-K54 PolarHBondContact O-N 3.36Å; L52-K54 PolarHBondContact O-N 3.42Å; K54-S57 WeakPolarHBondContact CA-OG 3.42Å; K54-S57 PolarHBondContact O-OG 2.82Å; K54-S57 VanDerWaalsContact O-OG 3.09Å |
| 55 | Q | 62.7 | Low | 57.2 | Low | 17 Ų | 17 | 74.7 Ų | 74.7 | 8% | 0.079 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -90.6 | -34.6 | 179.6 | -71.5 | 178.7 | -35.3 | 0 | 0 | 111.8 | I51 L52 E53 K58 N59 S138 A140 V141 S144 | I51-Q55 WeakPolarHBondContact O-CB 3.37Å; I51-Q55 VanDerWaalsContact O-CG 3.27Å; I51-Q55 WeakPolarHBondContact O-CG 3.18Å; I51-Q55 PolarHBondContact O-N 2.89Å; L52-Q55 PolarHBondContact O-N 3.46Å; L52-Q55 VanDerWaalsContact O-N 3.14Å; E53-Q55 VanDerWaalsContact C-N 3.27Å; E53-Q55 PolarHBondContact O-N 3.39Å; Q55-K58 PolarHBondContact O-N 2.86Å; Q55-N59 PolarHBondContact O-N 3.43Å; Q55-S138 PolarHBondContact NE2-OG 2.79Å; Q55-A140 PolarHBondContact NE2-O 3.28Å; Q55-V141 HydrophobicContact CB-CG2 3.73Å; Q55-V141 HydrophobicContact CG-CG2 4.48Å; Q55-S144 PolarHBondContact NE2-OG 3.17Å; Q55-S144 PolarHBondContact OE1-OG 3.33Å; Q55-S144 VanDerWaalsContact OE1-OG 3.08Å |
| 56 | E | 58.6 | Low | 55.3 | Low | 109 Ų | 109 | 78.9 Ų | 78.9 | 51% | 0.509 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64 | -41.4 | 171.3 | -76.9 | -170.3 | 159.9 | 0 | 0 | 112.4 | L52 K58 N59 S60 | L52-E56 PolarHBondContact O-N 3.07Å; E56-K58 VanDerWaalsContact C-N 3.27Å; E56-K58 PolarHBondContact O-N 3.39Å; E56-N59 PolarHBondContact O-N 3.27Å; E56-S60 WeakPolarHBondContact O-CB 3.49Å; E56-S60 PolarHBondContact O-N 2.91Å; E56-S60 PolarHBondContact O-OG 3.38Å |
| 57 | S | 55.9 | Low | 53.7 | Low | 71 Ų | 71 | 82.9 Ų | 82.9 | 50% | 0.497 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63 | -31.7 | 174.9 | 51.1 | 0 | 0 | 0 | 0 | 113 | E53 K54 | E53-S57 WeakPolarHBondContact O-CB 3.44Å; E53-S57 PolarHBondContact O-N 3.01Å; E53-S57 VanDerWaalsContact O-N 3.11Å; E53-S57 PolarHBondContact O-OG 3.28Å; K54-S57 WeakPolarHBondContact CA-OG 3.42Å; K54-S57 PolarHBondContact O-OG 2.82Å; K54-S57 VanDerWaalsContact O-OG 3.09Å |
| 58 | K | 53.2 | Low | 52.1 | Low | 132 Ų | 132 | 90.2 Ų | 90.2 | 57% | 0.574 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -80.7 | -36.8 | 175 | -79 | -177.1 | 175.7 | -174.6 | 0 | 113.8 | Q55 E56 S60 T61 | Q55-K58 PolarHBondContact O-N 2.86Å; E56-K58 VanDerWaalsContact C-N 3.27Å; E56-K58 PolarHBondContact O-N 3.39Å; K58-S60 VanDerWaalsContact C-N 3.34Å; K58-T61 PolarHBondContact O-N 2.87Å; K58-T61 PolarHBondContact O-OG1 3.2Å |
| 59 | N | 50.1 | Low | 50.6 | Low | 82 Ų | 82 | 93.8 Ų | 93.8 | 44% | 0.439 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -72.7 | -29.5 | 176.6 | -82.2 | -6.8 | 0 | 0 | 0 | 112.3 | Q55 E56 T61 V62 T63 | Q55-N59 PolarHBondContact O-N 3.43Å; E56-N59 PolarHBondContact O-N 3.27Å; N59-T61 PolarHBondContact O-N 3.31Å; N59-V62 PolarHBondContact O-N 2.98Å; N59-V62 VanDerWaalsContact O-N 3.09Å; N59-T63 PolarHBondContact O-N 3.24Å; N59-T63 VanDerWaalsContact O-N 3.08Å; N59-T63 PolarHBondContact O-OG1 2.93Å |
| 60 | S | 47 | Very low | 49.5 | Very low | 73 Ų | 73 | 93.8 Ų | 93.8 | 51% | 0.51 | 54% | 0.538 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -23.1 | 174.9 | -60 | 0 | 0 | 0 | 0 | 113.5 | E56 K58 | E56-S60 WeakPolarHBondContact O-CB 3.49Å; E56-S60 PolarHBondContact O-N 2.91Å; E56-S60 PolarHBondContact O-OG 3.38Å; K58-S60 VanDerWaalsContact C-N 3.34Å |
| 61 | T | 46.3 | Very low | 47.9 | Very low | 120 Ų | 120 | 93.7 Ų | 93.7 | 74% | 0.736 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -12.6 | 174 | 41.8 | 0 | 0 | 0 | 0 | 113.5 | K58 N59 | K58-T61 PolarHBondContact O-N 2.87Å; K58-T61 PolarHBondContact O-OG1 3.2Å; N59-T61 PolarHBondContact O-N 3.31Å |
| 62 | V | 47.5 | Very low | 46.4 | Very low | 117 Ų | 117 | 99.7 Ų | 99.7 | 71% | 0.709 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.1 | -21 | -178.2 | -178.7 | 0 | 0 | 0 | 0 | 112.5 | N59 | N59-V62 PolarHBondContact O-N 2.98Å; N59-V62 VanDerWaalsContact O-N 3.09Å |
| 63 | T | 37.5 | Very low | 44.9 | Very low | 52 Ų | 52 | 109.1 Ų | 109.1 | 32% | 0.319 | 61% | 0.613 | S | S | . | * | trans | -116.5 | 37.6 | -168.7 | -23.8 | 0 | 0 | 0 | 0 | 113.6 | N59 S65 | N59-T63 PolarHBondContact O-N 3.24Å; N59-T63 VanDerWaalsContact O-N 3.08Å; N59-T63 PolarHBondContact O-OG1 2.93Å; T63-S65 PolarHBondContact O-N 3.1Å | ||
| 64 | A | 39.7 | Very low | 43.7 | Very low | 99 Ų | 99 | 107.6 Ų | 107.6 | 82% | 0.818 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | 0.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 65 | S | 38.1 | Very low | 42.4 | Very low | 108 Ų | 108 | 106.1 Ų | 106.1 | 76% | 0.755 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.4 | -5.2 | -175 | 51.7 | 0 | 0 | 0 | 0 | 116.4 | T63 | T63-S65 PolarHBondContact O-N 3.1Š|
| 66 | D | 35.1 | Very low | 41.1 | Very low | 137 Ų | 137 | 113 Ų | 113 | 73% | 0.733 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.2 | -0.1 | -174.9 | -120 | 1.6 | 0 | 0 | 0 | 115.5 | ||
| 67 | Q | 36.9 | Very low | 40 | Very low | 129 Ų | 129 | 112.4 Ų | 112.4 | 60% | 0.603 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -87.4 | 0.4 | 176.9 | -71.4 | -169.9 | -24.9 | 0 | 0 | 114.4 | A69 G71 | Q67-A69 PolarHBondContact O-N 3.1Å; Q67-G71 PolarHBondContact O-N 3.09Å |
| 68 | L | 37.3 | Very low | 39.2 | Very low | 154 Ų | 154 | 120.8 Ų | 120.8 | 81% | 0.806 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -69.5 | -13.6 | -179.2 | -149.8 | 81.5 | 0 | 0 | 0 | 113.5 | ||
| 69 | A | 35.1 | Very low | 38.7 | Very low | 91 Ų | 91 | 121.1 Ų | 121.1 | 75% | 0.752 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -101.8 | -13 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | Q67 | Q67-A69 PolarHBondContact O-N 3.1Š|
| 70 | V | 37.3 | Very low | 38.4 | Very low | 130 Ų | 130 | 123.2 Ų | 123.2 | 79% | 0.788 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.1 | -18.1 | 176.8 | -175.9 | 0 | 0 | 0 | 0 | 112 | L72 | V70-L72 VanDerWaalsContact C-N 3.34Å; V70-L72 PolarHBondContact O-N 3.38Å |
| 71 | G | 32.8 | Very low | 38.6 | Very low | 50 Ų | 50 | 121.9 Ų | 121.9 | 52% | 0.515 | 72% | 0.72 | S | S | . | * | G | 310 helix | trans | -76.9 | -5.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | Q67 | Q67-G71 PolarHBondContact O-N 3.09Š|
| 72 | L | 33.2 | Very low | 39.1 | Very low | 147 Ų | 147 | 123.9 Ų | 123.9 | 77% | 0.77 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -90.6 | 7.5 | -175.1 | -100.4 | 151.9 | 0 | 0 | 0 | 115.2 | V70 | V70-L72 VanDerWaalsContact C-N 3.34Å; V70-L72 PolarHBondContact O-N 3.38Å |
| 73 | R | 31.7 | Very low | 39.6 | Very low | 250 Ų | 250 | 119 Ų | 119 | 94% | 0.943 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -109.7 | -2.4 | 167.6 | -88.2 | -171.8 | 175.3 | 177.5 | -0.1 | 115.2 | ||
| 74 | A | 37.6 | Very low | 40.4 | Very low | 95 Ų | 95 | 122.1 Ų | 122.1 | 79% | 0.785 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -106.6 | 21.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 75 | G | 36.5 | Very low | 41.5 | Very low | 65 Ų | 65 | 119.1 Ų | 119.1 | 67% | 0.67 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -121.2 | 52.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 76 | N | 35.3 | Very low | 42.5 | Very low | 162 Ų | 162 | 115.3 Ų | 115.3 | 87% | 0.866 | 64% | 0.643 | S | S | * | * | trans | -170.2 | 57.3 | 149.6 | -137.4 | 9.4 | 0 | 0 | 0 | 114.8 | ||||
| 77 | S | 35.6 | Very low | 43.4 | Very low | 97 Ų | 97 | 114.9 Ų | 114.9 | 68% | 0.678 | 65% | 0.648 | S | S | * | * | trans | -128.7 | 79.6 | 162.4 | 62.8 | 0 | 0 | 0 | 0 | 110.5 | N79 | S77-N79 PolarHBondContact O-N 3.48Š| ||
| 78 | R | 40.1 | Very low | 44.4 | Very low | 247 Ų | 247 | 112.1 Ų | 112.1 | 93% | 0.932 | 64% | 0.64 | S | S | * | * | trans | -67.8 | 67.3 | 145.1 | -87.2 | -179.5 | 171.3 | 166.7 | -2.4 | 108.3 | ||||
| 79 | N | 41.4 | Very low | 45.6 | Very low | 139 Ų | 139 | 105.2 Ų | 105.2 | 74% | 0.743 | 61% | 0.605 | S | S | * | * | trans | -117.5 | 109.5 | 155 | -83 | -5.8 | 0 | 0 | 0 | 104 | S77 S81 | S77-N79 PolarHBondContact O-N 3.48Å; N79-S81 VanDerWaalsContact C-N 3.26Å; N79-S81 PolarHBondContact O-N 2.99Å | ||
| 80 | S | 44.6 | Very low | 47 | Very low | 126 Ų | 126 | 102.3 Ų | 102.3 | 88% | 0.881 | 58% | 0.578 | S | S | * | * | trans | -61.9 | 95 | 169.4 | -178.4 | 0 | 0 | 0 | 0 | 106.6 | R82 | S80-R82 PolarHBondContact O-N 3.06Š| ||
| 81 | S | 51.8 | Low | 48.3 | Very low | 45 Ų | 45 | 96.1 Ų | 96.1 | 32% | 0.315 | 54% | 0.54 | S | S | . | . | trans | -54.2 | 141.1 | 168.9 | 50.8 | 0 | 0 | 0 | 0 | 107.5 | N79 Y83 | N79-S81 VanDerWaalsContact C-N 3.26Å; N79-S81 PolarHBondContact O-N 2.99Å; S81-Y83 PolarHBondContact O-N 3.31Å; S81-Y83 VanDerWaalsContact O-N 3.1Å; S81-Y83 PolarHBondContact OG-O 3.34Å | ||
| 82 | R | 55.2 | Low | 50 | Low | 161 Ų | 161 | 95.7 Ų | 95.7 | 61% | 0.608 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -62.7 | -15.8 | 176.9 | 177.3 | 178 | -79.9 | 179.1 | -2.4 | 111.8 | S80 | S80-R82 PolarHBondContact O-N 3.06Š|
| 83 | Y | 58.1 | Low | 51.8 | Low | 15 Ų | 15 | 90.6 Ų | 90.6 | 6% | 0.059 | 51% | 0.506 | C | S | . | . | S | Bend | trans | -114.2 | 137 | -176.8 | -54.1 | -80.5 | 0 | 0 | 0 | 110.8 | S81 C85 L313 V371 F442 | S81-Y83 PolarHBondContact O-N 3.31Å; S81-Y83 VanDerWaalsContact O-N 3.1Å; S81-Y83 PolarHBondContact OG-O 3.34Å; Y83-C85 PolarHBondContact O-N 3.06Å; Y83-L313 HydrophobicContact CD1-CB 4.2Å; Y83-L313 HydrophobicContact CD1-CD2 4.34Å; Y83-L313 HydrophobicContact CE1-CB 4.5Å; Y83-L313 HydrophobicContact CG-CD2 4.39Å; Y83-V371 HydrophobicContact CE1-CG1 4.05Å; Y83-V371 PolarHBondContact OH-O 3.21Å; Y83-F442 HydrophobicContact CD2-CB 4.43Å; Y83-F442 VanDerWaalsContact CD2-O 3.24Å; Y83-F442 WeakPolarHBondContact CD2-O 3.34Å; Y83-F442 HydrophobicContact CE2-CB 4.45Å; Y83-F442 HydrophobicContact CE2-CD1 4.08Å |
| 84 | D | 55.5 | Low | 53.8 | Low | 118 Ų | 118 | 78.7 Ų | 78.7 | 63% | 0.631 | 46% | 0.461 | S | S | * | . | trans | -86.2 | 100.4 | 171.9 | -164 | 6.8 | 0 | 0 | 0 | 107.9 | ||||
| 85 | C | 62.3 | Low | 55.8 | Low | 36 Ų | 36 | 76 Ų | 76 | 24% | 0.243 | 43% | 0.434 | C | S | . | . | trans | -102.9 | 131.9 | -170.5 | -67.6 | 0 | 0 | 0 | 0 | 111.6 | Y83 C443 | Y83-C85 PolarHBondContact O-N 3.06Å; C85-C443 HydrophobicContact CB-CB 3.88Å; C85-C443 WeakPolarHBondContact CB-SG 3.48Å; C85-C443 VanDerWaalsContact SG-CA 3.56Å; C85-C443 WeakPolarHBondContact SG-CB 3.19Å; C85-C443 CovalentContact SG-SG 2.02Å; C85-C443 PolarHBondContact SG-SG 2.98Å | ||
| 86 | S | 59.5 | Low | 57.5 | Low | 27 Ų | 27 | 75.2 Ų | 75.2 | 19% | 0.189 | 42% | 0.421 | C | S | . | . | trans | -70.8 | 145.3 | 171.6 | 62 | 0 | 0 | 0 | 0 | 111.1 | V88 E312 | S86-V88 PolarHBondContact O-N 2.72Å; S86-V88 PolarHBondContact OG-O 3.36Å; S86-E312 VanDerWaalsContact CB-OE1 3.32Å; S86-E312 WeakPolarHBondContact CB-OE1 3.42Å; S86-E312 PolarHBondContact OG-OE1 2.77Å | ||
| 87 | P | 53 | Low | 59.6 | Low | 129 Ų | 129 | 67.6 Ų | 67.6 | 84% | 0.838 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -67.7 | -19.9 | -178.1 | 25.7 | -33.7 | 0 | 0 | 0 | 113.2 | ||
| 88 | V | 58.3 | Low | 62 | Low | 71 Ų | 71 | 63.1 Ų | 63.1 | 43% | 0.43 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -122 | 112.1 | 174.9 | -178.2 | 0 | 0 | 0 | 0 | 108.1 | S86 T90 | S86-V88 PolarHBondContact O-N 2.72Å; S86-V88 PolarHBondContact OG-O 3.36Å; V88-T90 PolarHBondContact O-N 3.37Å |
| 89 | S | 62.4 | Low | 64.2 | Low | 9 Ų | 9 | 55.6 Ų | 55.6 | 6% | 0.063 | 33% | 0.327 | C | S | . | . | trans | -57 | 128.7 | 177.5 | 178 | 0 | 0 | 0 | 0 | 110.7 | G91 A92 | S89-G91 PolarHBondContact O-N 2.72Å; S89-G91 VanDerWaalsContact O-N 3.09Å; S89-G91 PolarHBondContact OG-N 3.36Å; S89-A92 WeakPolarHBondContact O-CB 3.4Å; S89-A92 PolarHBondContact O-N 3.27Å | ||
| 90 | T | 65.1 | Low | 66.5 | Low | 30 Ų | 30 | 50.3 Ų | 50.3 | 18% | 0.184 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -50.7 | -30.5 | 172.3 | 43.2 | 0 | 0 | 0 | 0 | 112.7 | V88 A92 V93 L94 Q308 E312 | V88-T90 PolarHBondContact O-N 3.37Å; T90-A92 VanDerWaalsContact C-N 3.31Å; T90-A92 PolarHBondContact O-N 2.83Å; T90-V93 PolarHBondContact O-N 2.78Å; T90-L94 PolarHBondContact O-N 3.18Å; T90-L94 VanDerWaalsContact O-N 3.13Å; T90-Q308 PolarHBondContact OG1-O 2.89Å; T90-E312 VanDerWaalsContact CG2-OE2 3.27Å; T90-E312 WeakPolarHBondContact CG2-OE2 3.35Å; T90-E312 PolarHBondContact OG1-OE2 2.91Å |
| 91 | G | 64.6 | Low | 68.6 | Low | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.2 | -29.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | S89 L95 | S89-G91 PolarHBondContact O-N 2.72Å; S89-G91 VanDerWaalsContact O-N 3.09Å; S89-G91 PolarHBondContact OG-N 3.36Å; G91-L95 WeakPolarHBondContact O-CG 3.31Å; G91-L95 PolarHBondContact O-N 3.24Å |
| 92 | A | 69.1 | Low | 70.5 | Confident | 40 Ų | 40 | 43.2 Ų | 43.2 | 33% | 0.331 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -71.7 | -38.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | S89 T90 L95 A96 | S89-A92 WeakPolarHBondContact O-CB 3.4Å; S89-A92 PolarHBondContact O-N 3.27Å; T90-A92 VanDerWaalsContact C-N 3.31Å; T90-A92 PolarHBondContact O-N 2.83Å; A92-L95 PolarHBondContact O-N 2.79Å; A92-A96 PolarHBondContact O-N 3.19Å |
| 93 | V | 70.9 | Confident | 72.1 | Confident | 40 Ų | 40 | 42.7 Ų | 42.7 | 24% | 0.242 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65 | -44.1 | 174.1 | -179.6 | 0 | 0 | 0 | 0 | 110 | A48 T90 L95 A96 D97 | A48-V93 HydrophobicContact CB-CG1 3.79Å; T90-V93 PolarHBondContact O-N 2.78Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 2.85Å; V93-A96 PolarHBondContact O-N 3.47Å; V93-D97 WeakPolarHBondContact O-CB 3.38Å; V93-D97 PolarHBondContact O-N 3.01Å; V93-D97 VanDerWaalsContact O-N 3.08Å |
| 94 | L | 73.5 | Confident | 73.6 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.5 | -44.7 | 174.9 | -179 | 73.2 | 0 | 0 | 0 | 111.8 | L45 T90 D97 I98 Y304 Q308 I428 | L45-L94 HydrophobicContact CD2-CD1 4.44Å; T90-L94 PolarHBondContact O-N 3.18Å; T90-L94 VanDerWaalsContact O-N 3.13Å; L94-D97 PolarHBondContact O-N 3.07Å; L94-I98 WeakPolarHBondContact O-CG2 3.32Å; L94-I98 PolarHBondContact O-N 3.36Å; L94-Y304 HydrophobicContact CD1-CD1 3.84Å; L94-Y304 HydrophobicContact CD1-CE1 4Å; L94-Y304 HydrophobicContact CD2-CD1 3.93Å; L94-Q308 HydrophobicContact CB-CG 4.43Å; L94-Q308 HydrophobicContact CD2-CB 4.33Å; L94-Q308 HydrophobicContact CD2-CG 3.86Å; L94-Q308 HydrophobicContact CG-CG 4.49Å; L94-I428 HydrophobicContact CD1-CG2 3.95Å; L94-I428 HydrophobicContact CD2-CG2 3.97Å; L94-I428 HydrophobicContact CG-CG2 4.15Å |
| 95 | L | 78.4 | Confident | 75.2 | Confident | 39 Ų | 39 | 37.6 Ų | 37.6 | 20% | 0.204 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.3 | -45.4 | 178 | -83.6 | 166.7 | 0 | 0 | 0 | 112 | G91 A92 V93 D97 I98 L99 A429 A433 | G91-L95 WeakPolarHBondContact O-CG 3.31Å; G91-L95 PolarHBondContact O-N 3.24Å; A92-L95 PolarHBondContact O-N 2.79Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 2.85Å; L95-D97 PolarHBondContact O-N 2.98Å; L95-I98 PolarHBondContact O-N 3.24Å; L95-L99 HydrophobicContact CD2-CG 4.48Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 WeakPolarHBondContact O-CD1 3.46Å; L95-L99 WeakPolarHBondContact O-CG 3.01Å; L95-L99 PolarHBondContact O-N 3.01Å; L95-A429 WeakPolarHBondContact CD2-O 3.34Å; L95-A433 HydrophobicContact CD2-CB 4.5Å |
| 96 | A | 73.8 | Confident | 76.4 | Confident | 49 Ų | 49 | 40.1 Ų | 40.1 | 41% | 0.405 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.2 | -32.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A92 V93 P100 | A92-A96 PolarHBondContact O-N 3.19Å; V93-A96 PolarHBondContact O-N 3.47Å; A96-P100 VanDerWaalsContact O-CD 3.24Å; A96-P100 WeakPolarHBondContact O-CD 3.13Å |
| 97 | D | 77.6 | Confident | 77.7 | Confident | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -85.1 | -34.6 | -179.4 | -164.9 | 22 | 0 | 0 | 0 | 113.3 | Y41 L45 V93 L94 L95 V148 S152 | Y41-D97 WeakPolarHBondContact CD2-OD1 3.47Å; Y41-D97 WeakPolarHBondContact CD2-OD2 3.48Å; Y41-D97 HydrophobicContact CE2-CB 4.24Å; Y41-D97 WeakPolarHBondContact CE2-OD1 3.23Å; Y41-D97 WeakPolarHBondContact CE2-OD2 3.34Å; L45-D97 WeakPolarHBondContact CD1-OD2 3.42Å; L45-D97 WeakPolarHBondContact CG-OD2 3.27Å; V93-D97 WeakPolarHBondContact O-CB 3.38Å; V93-D97 PolarHBondContact O-N 3.01Å; V93-D97 VanDerWaalsContact O-N 3.08Å; L94-D97 PolarHBondContact O-N 3.07Å; L95-D97 PolarHBondContact O-N 2.98Å; D97-V148 HydrophobicContact CB-CG1 4Å; D97-S152 WeakPolarHBondContact O-CB 3.19Å; D97-S152 PolarHBondContact O-OG 3.07Å; D97-S152 PolarHBondContact OD1-OG 3.25Å |
| 98 | I | 86.3 | Confident | 79.1 | Confident | 3 Ų | 3 | 35.5 Ų | 35.5 | 2% | 0.015 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -87.2 | -29.6 | -177.5 | -163 | 66.3 | 0 | 0 | 0 | 113.8 | L94 L95 T101 L102 I428 A429 | L94-I98 WeakPolarHBondContact O-CG2 3.32Å; L94-I98 PolarHBondContact O-N 3.36Å; L95-I98 PolarHBondContact O-N 3.24Å; I98-T101 HydrophobicContact CD1-CG2 4.43Å; I98-T101 WeakPolarHBondContact O-CB 3.36Å; I98-T101 PolarHBondContact O-N 3.2Å; I98-L102 PolarHBondContact O-N 3.42Å; I98-I428 HydrophobicContact CB-CG2 3.99Å; I98-I428 HydrophobicContact CD1-CB 4.08Å; I98-I428 HydrophobicContact CD1-CD1 3.97Å; I98-I428 HydrophobicContact CD1-CG2 3.84Å; I98-I428 HydrophobicContact CG1-CB 3.87Å; I98-I428 HydrophobicContact CG1-CG2 3.59Å; I98-I428 HydrophobicContact CG2-CG2 4.28Å; I98-A429 HydrophobicContact CG2-CB 3.94Å |
| 99 | L | 87.9 | Confident | 80.1 | Confident | 90 Ų | 90 | 32.6 Ų | 32.6 | 47% | 0.471 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -60.5 | -43.3 | -175.8 | -74.9 | 172.6 | 0 | 0 | 0 | 113.5 | L95 T101 L102 F103 | L95-L99 HydrophobicContact CD2-CG 4.48Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 WeakPolarHBondContact O-CD1 3.46Å; L95-L99 WeakPolarHBondContact O-CG 3.01Å; L95-L99 PolarHBondContact O-N 3.01Å; L99-T101 VanDerWaalsContact C-N 3.32Å; L99-T101 PolarHBondContact O-N 3.47Å; L99-L102 PolarHBondContact O-N 3.18Å; L99-F103 PolarHBondContact O-N 3.34Å |
| 100 | P | 89.1 | Confident | 80.9 | Confident | 27 Ų | 27 | 37 Ų | 37 | 18% | 0.175 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.9 | -42.1 | 174.9 | -21.4 | 32.7 | 0 | 0 | 0 | 112.1 | A96 F103 I104 I149 I153 | A96-P100 VanDerWaalsContact O-CD 3.24Å; A96-P100 WeakPolarHBondContact O-CD 3.13Å; P100-F103 PolarHBondContact O-N 3.38Å; P100-I104 WeakPolarHBondContact O-CG1 3.35Å; P100-I104 PolarHBondContact O-N 2.79Å; P100-I149 HydrophobicContact CB-CG2 4.29Å; P100-I149 HydrophobicContact CG-CG1 4.22Å; P100-I149 HydrophobicContact CG-CG2 4.13Å; P100-I153 HydrophobicContact CB-CG1 4.28Å |
| 101 | T | 89 | Confident | 81.6 | Confident | 4 Ų | 4 | 39.9 Ų | 39.9 | 3% | 0.025 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.1 | -47.4 | 176.6 | -55.2 | 0 | 0 | 0 | 0 | 111 | I98 L99 F103 I104 K105 S152 G156 | I98-T101 HydrophobicContact CD1-CG2 4.43Å; I98-T101 WeakPolarHBondContact O-CB 3.36Å; I98-T101 PolarHBondContact O-N 3.2Å; L99-T101 VanDerWaalsContact C-N 3.32Å; L99-T101 PolarHBondContact O-N 3.47Å; T101-F103 PolarHBondContact O-N 2.94Å; T101-I104 PolarHBondContact O-N 3.29Å; T101-K105 HydrophobicContact CG2-CD 4.36Å; T101-K105 HydrophobicContact CG2-CG 4.42Å; T101-K105 WeakPolarHBondContact O-CG 3.07Å; T101-K105 PolarHBondContact O-N 3.03Å; T101-S152 WeakPolarHBondContact OG1-CB 3.38Å; T101-S152 PolarHBondContact OG1-O 3.12Å; T101-G156 VanDerWaalsContact CG2-CA 3.45Å |
| 102 | L | 90.1 | Very high | 82.2 | Confident | 19 Ų | 19 | 40.6 Ų | 40.6 | 10% | 0.099 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.6 | -44.8 | 178.5 | 179 | 60.4 | 0 | 0 | 0 | 111.5 | I98 L99 I104 K105 I106 V422 L426 A429 | I98-L102 PolarHBondContact O-N 3.42Å; L99-L102 PolarHBondContact O-N 3.18Å; L102-I104 VanDerWaalsContact C-N 3.31Å; L102-I104 PolarHBondContact O-N 3.12Å; L102-K105 PolarHBondContact O-N 3.4Å; L102-I106 HydrophobicContact CD1-CD1 3.82Å; L102-I106 HydrophobicContact CD1-CG1 4.16Å; L102-I106 HydrophobicContact CG-CD1 3.88Å; L102-I106 VanDerWaalsContact O-CG1 3.32Å; L102-I106 WeakPolarHBondContact O-CG1 3.21Å; L102-I106 PolarHBondContact O-N 3.09Å; L102-V422 HydrophobicContact CD1-CG1 4.41Å; L102-L426 HydrophobicContact CD1-CB 4.22Å; L102-L426 HydrophobicContact CD2-CD1 4.43Å; L102-A429 HydrophobicContact CD2-CB 3.8Å |
| 103 | F | 90.5 | Very high | 82.4 | Confident | 149 Ų | 149 | 43.5 Ų | 43.5 | 65% | 0.654 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -59.3 | -43.4 | 176.6 | 179.5 | -98.5 | 0 | 0 | 0 | 111.8 | L99 P100 T101 I106 S107 | L99-F103 PolarHBondContact O-N 3.34Å; P100-F103 PolarHBondContact O-N 3.38Å; T101-F103 PolarHBondContact O-N 2.94Å; F103-I106 PolarHBondContact O-N 3.35Å; F103-S107 WeakPolarHBondContact O-CB 3.45Å; F103-S107 PolarHBondContact O-N 2.85Å; F103-S107 PolarHBondContact O-OG 3.48Å |
| 104 | I | 89.4 | Confident | 82.8 | Confident | 26 Ų | 26 | 49.5 Ų | 49.5 | 13% | 0.133 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.2 | -45.3 | 175.7 | -73.8 | 168.3 | 0 | 0 | 0 | 111.1 | P100 T101 L102 I106 S107 A108 I153 L157 L160 | P100-I104 WeakPolarHBondContact O-CG1 3.35Å; P100-I104 PolarHBondContact O-N 2.79Å; T101-I104 PolarHBondContact O-N 3.29Å; L102-I104 VanDerWaalsContact C-N 3.31Å; L102-I104 PolarHBondContact O-N 3.12Å; I104-I106 VanDerWaalsContact C-N 3.28Å; I104-I106 PolarHBondContact O-N 3.48Å; I104-S107 PolarHBondContact O-N 3.49Å; I104-S107 PolarHBondContact O-OG 2.9Å; I104-A108 HydrophobicContact CG2-CB 4.1Å; I104-A108 WeakPolarHBondContact O-CA 3.4Å; I104-A108 WeakPolarHBondContact O-CB 3.42Å; I104-A108 PolarHBondContact O-N 3.47Å; I104-I153 HydrophobicContact CD1-CB 3.82Å; I104-I153 HydrophobicContact CD1-CG1 3.65Å; I104-I153 HydrophobicContact CD1-CG2 3.67Å; I104-L157 HydrophobicContact CG2-CB 4.16Å; I104-L157 HydrophobicContact CG2-CD1 4.39Å; I104-L160 HydrophobicContact CG2-CD1 4.01Å |
| 105 | K | 89.4 | Confident | 83.3 | Confident | 1 Ų | 1 | 52.4 Ų | 52.4 | 0% | 0.004 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.4 | -32.1 | 179.5 | -69.6 | -167.6 | -179.4 | -177.7 | 0 | 113 | T101 L102 P109 E159 L160 S421 V422 D424 S425 | T101-K105 HydrophobicContact CG2-CD 4.36Å; T101-K105 HydrophobicContact CG2-CG 4.42Å; T101-K105 WeakPolarHBondContact O-CG 3.07Å; T101-K105 PolarHBondContact O-N 3.03Å; L102-K105 PolarHBondContact O-N 3.4Å; K105-P109 WeakPolarHBondContact O-CD 3.43Å; K105-P109 WeakPolarHBondContact O-CG 3.41Å; K105-E159 WeakPolarHBondContact CE-OE2 3.4Å; K105-E159 IonicContact NZ-OE2 2.8Å; K105-E159 PolarHBondContact NZ-OE2 3.23Å; K105-L160 HydrophobicContact CB-CD1 4.43Å; K105-L160 HydrophobicContact CB-CD2 4.42Å; K105-L160 HydrophobicContact CG-CD1 3.99Å; K105-L160 HydrophobicContact CG-CD2 4.03Å; K105-L160 HydrophobicContact CG-CG 4.02Å; K105-S421 VanDerWaalsContact CD-O 3.32Å; K105-S421 WeakPolarHBondContact CD-O 3.22Å; K105-S421 PolarHBondContact NZ-O 3.45Å; K105-V422 HydrophobicContact CB-CG2 3.98Å; K105-V422 WeakPolarHBondContact O-CG2 3.21Å; K105-D424 IonicContact NZ-OD1 3.67Å; K105-D424 PolarHBondContact NZ-OD1 3.49Å; K105-D424 IonicContact NZ-OD2 2.72Å; K105-S425 VanDerWaalsContact CD-OG 3.29Å; K105-S425 WeakPolarHBondContact CD-OG 3.36Å; K105-S425 WeakPolarHBondContact CE-OG 3.44Å; K105-S425 PolarHBondContact NZ-OG 2.83Å |
| 106 | I | 87.4 | Confident | 83.6 | Confident | 88 Ų | 88 | 53.3 Ų | 53.3 | 45% | 0.451 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -73.7 | -43.5 | 174.5 | -67.2 | 168 | 0 | 0 | 0 | 111 | L102 F103 I104 F110 V422 | L102-I106 HydrophobicContact CD1-CD1 3.82Å; L102-I106 HydrophobicContact CD1-CG1 4.16Å; L102-I106 HydrophobicContact CG-CD1 3.88Å; L102-I106 VanDerWaalsContact O-CG1 3.32Å; L102-I106 WeakPolarHBondContact O-CG1 3.21Å; L102-I106 PolarHBondContact O-N 3.09Å; F103-I106 PolarHBondContact O-N 3.35Å; I104-I106 VanDerWaalsContact C-N 3.28Å; I104-I106 PolarHBondContact O-N 3.48Å; I106-F110 WeakPolarHBondContact O-CD2 3.31Å; I106-F110 WeakPolarHBondContact O-CE2 3.34Å; I106-V422 HydrophobicContact CG1-CG1 3.84Å |
| 107 | S | 85.4 | Confident | 84.1 | Confident | 47 Ų | 47 | 51.4 Ų | 51.4 | 33% | 0.329 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -85.4 | -39.2 | -172.4 | 57.5 | 0 | 0 | 0 | 0 | 114 | F103 I104 F110 | F103-S107 WeakPolarHBondContact O-CB 3.45Å; F103-S107 PolarHBondContact O-N 2.85Å; F103-S107 PolarHBondContact O-OG 3.48Å; I104-S107 PolarHBondContact O-N 3.49Å; I104-S107 PolarHBondContact O-OG 2.9Å; S107-F110 PolarHBondContact O-N 2.89Å |
| 108 | A | 82.9 | Confident | 84.5 | Confident | 13 Ų | 13 | 52.3 Ų | 52.3 | 11% | 0.107 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.9 | -40.7 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | I104 F110 V111 I112 L160 | I104-A108 HydrophobicContact CG2-CB 4.1Å; I104-A108 WeakPolarHBondContact O-CA 3.4Å; I104-A108 WeakPolarHBondContact O-CB 3.42Å; I104-A108 PolarHBondContact O-N 3.47Å; A108-F110 PolarHBondContact O-N 3.43Å; A108-V111 PolarHBondContact O-N 3.03Å; A108-I112 HydrophobicContact CB-CB 4.47Å; A108-I112 HydrophobicContact CB-CD1 4.44Å; A108-I112 WeakPolarHBondContact O-CB 3.48Å; A108-I112 WeakPolarHBondContact O-CG2 3.23Å; A108-I112 PolarHBondContact O-N 3.2Å; A108-L160 HydrophobicContact CB-CD1 3.76Å |
| 109 | P | 79.4 | Confident | 84.6 | Confident | 9 Ų | 9 | 57.4 Ų | 57.4 | 6% | 0.058 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -54.3 | -23.5 | 179.8 | -27.8 | 35.9 | 0 | 0 | 0 | 114.4 | K105 F415 A418 | K105-P109 WeakPolarHBondContact O-CD 3.43Å; K105-P109 WeakPolarHBondContact O-CG 3.41Å; P109-F415 HydrophobicContact CB-CD2 4.21Å; P109-F415 HydrophobicContact CB-CE2 3.94Å; P109-A418 HydrophobicContact CG-CB 4.31Å |
| 110 | F | 78.3 | Confident | 84.7 | Confident | 101 Ų | 101 | 53.6 Ų | 53.6 | 44% | 0.443 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -80.4 | -25.5 | 177.4 | -59.6 | -75 | 0 | 0 | 0 | 114 | I106 S107 A108 H113 L279 | I106-F110 WeakPolarHBondContact O-CD2 3.31Å; I106-F110 WeakPolarHBondContact O-CE2 3.34Å; S107-F110 PolarHBondContact O-N 2.89Å; A108-F110 PolarHBondContact O-N 3.43Å; F110-H113 PolarHBondContact O-CE1 3.42Å; F110-H113 PolarHBondContact O-ND1 3.27Å; F110-L279 HydrophobicContact CD1-CD2 4.14Å; F110-L279 HydrophobicContact CE1-CD2 4.22Å |
| 111 | V | 79.9 | Confident | 84.8 | Confident | 92 Ų | 92 | 52.4 Ų | 52.4 | 56% | 0.558 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -115.3 | -28.9 | -172.6 | -174 | 0 | 0 | 0 | 0 | 112.2 | A108 H113 K114 | A108-V111 PolarHBondContact O-N 3.03Å; V111-H113 VanDerWaalsContact C-N 3.25Å; V111-H113 PolarHBondContact O-N 3.01Å; V111-H113 VanDerWaalsContact O-N 3.14Å; V111-K114 PolarHBondContact O-N 2.99Å; V111-K114 VanDerWaalsContact O-N 3.07Å |
| 112 | I | 77.5 | Confident | 84.9 | Confident | 15 Ų | 15 | 56.5 Ų | 56.5 | 8% | 0.077 | 29% | 0.29 | C | S | . | . | G | 310 helix | trans | -61.5 | -33.1 | -165.6 | -154.4 | 176.2 | 0 | 0 | 0 | 112.3 | A108 K114 V115 R120 L157 L160 | A108-I112 HydrophobicContact CB-CB 4.47Å; A108-I112 HydrophobicContact CB-CD1 4.44Å; A108-I112 WeakPolarHBondContact O-CB 3.48Å; A108-I112 WeakPolarHBondContact O-CG2 3.23Å; A108-I112 PolarHBondContact O-N 3.2Å; I112-K114 PolarHBondContact O-N 3.39Å; I112-V115 PolarHBondContact O-N 2.96Å; I112-R120 PolarHBondContact O-NE 3.3Å; I112-R120 PolarHBondContact O-NH2 3.5Å; I112-L157 HydrophobicContact CD1-CD1 3.73Å; I112-L157 HydrophobicContact CG1-CD1 4.46Å; I112-L160 HydrophobicContact CD1-CB 4.27Å |
| 113 | H | 74.6 | Confident | 85.1 | Confident | 101 Ų | 101 | 60 Ų | 60 | 47% | 0.468 | 30% | 0.304 | S | S | . | . | G | 310 helix | trans | -55.9 | -22.9 | 177.6 | 69.4 | -79.9 | 0 | 0 | 0 | 114.4 | F110 V111 | F110-H113 PolarHBondContact O-CE1 3.42Å; F110-H113 PolarHBondContact O-ND1 3.27Å; V111-H113 VanDerWaalsContact C-N 3.25Å; V111-H113 PolarHBondContact O-N 3.01Å; V111-H113 VanDerWaalsContact O-N 3.14Å |
| 114 | K | 78.9 | Confident | 85.2 | Confident | 166 Ų | 166 | 52.9 Ų | 52.9 | 72% | 0.722 | 27% | 0.273 | S | S | * | . | G | 310 helix | trans | -82.2 | -16 | 177.2 | -62.4 | -170.9 | 176.1 | -177.9 | 0 | 113.9 | V111 I112 | V111-K114 PolarHBondContact O-N 2.99Å; V111-K114 VanDerWaalsContact O-N 3.07Å; I112-K114 PolarHBondContact O-N 3.39Å |
| 115 | V | 82.6 | Confident | 85.5 | Confident | 60 Ų | 60 | 52 Ų | 52 | 36% | 0.364 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -101.4 | 127.7 | -174.6 | -175.5 | 0 | 0 | 0 | 0 | 109.3 | I112 F119 R120 | I112-V115 PolarHBondContact O-N 2.96Å; V115-F119 HydrophobicContact CG1-CB 3.98Å; V115-R120 HydrophobicContact CB-CG 4.27Å; V115-R120 HydrophobicContact CG1-CG 3.87Å; V115-R120 PolarHBondContact O-NE 3.29Å; V115-R120 PolarHBondContact O-NH2 3.38Å |
| 116 | P | 85.7 | Confident | 85.8 | Confident | 58 Ų | 58 | 54.3 Ų | 54.3 | 38% | 0.377 | 29% | 0.288 | S | S | . | . | trans | -63.3 | 146.8 | 175.4 | -20.9 | 31.5 | 0 | 0 | 0 | 112.6 | G118 F119 R120 | P116-G118 VanDerWaalsContact C-N 3.29Å; P116-G118 PolarHBondContact O-N 3.06Å; P116-F119 HydrophobicContact CB-CD2 4.16Å; P116-F119 HydrophobicContact CG-CD2 4.05Å; P116-F119 PolarHBondContact O-N 3.26Å; P116-F119 VanDerWaalsContact O-N 3.17Å; P116-R120 PolarHBondContact O-N 3.21Å | ||
| 117 | Y | 85.3 | Confident | 86.1 | Confident | 10 Ų | 10 | 51.9 Ų | 51.9 | 4% | 0.039 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -56.2 | -38.1 | -177.1 | -75.8 | -82.5 | 0 | 0 | 0 | 113.8 | F119 R120 V121 S161 S164 L165 F168 Y220 E414 | Y117-F119 VanDerWaalsContact C-N 3.33Å; Y117-F119 PolarHBondContact O-N 2.98Å; Y117-R120 WeakPolarHBondContact O-CB 3.46Å; Y117-R120 PolarHBondContact O-N 2.88Å; Y117-R120 VanDerWaalsContact O-N 3.14Å; Y117-V121 WeakPolarHBondContact O-CG2 3.41Å; Y117-V121 PolarHBondContact O-N 2.89Å; Y117-S161 VanDerWaalsContact CE1-O 3.29Å; Y117-S161 WeakPolarHBondContact CE1-O 3.48Å; Y117-S164 WeakPolarHBondContact OH-CB 3.48Å; Y117-L165 HydrophobicContact CD1-CB 4.12Å; Y117-L165 HydrophobicContact CD1-CD1 3.97Å; Y117-L165 HydrophobicContact CD2-CD1 4.21Å; Y117-L165 HydrophobicContact CE1-CB 3.85Å; Y117-L165 HydrophobicContact CE1-CD1 4.16Å; Y117-L165 HydrophobicContact CE2-CD1 4.4Å; Y117-L165 HydrophobicContact CG-CD1 3.99Å; Y117-F168 AromaticContact CE2-CE2 3.91Å; Y117-F168 HydrophobicContact CE2-CE2 3.91Å; Y117-Y220 VanDerWaalsContact CB-OH 3.29Å; Y117-Y220 WeakPolarHBondContact CB-OH 3.27Å; Y117-E414 PolarHBondContact OH-OE1 3.21Å; Y117-E414 PolarHBondContact OH-OE2 3.34Å |
| 118 | G | 85.6 | Confident | 86.5 | Confident | 20 Ų | 20 | 50 Ų | 50 | 21% | 0.206 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.7 | -41.3 | 179 | 0 | 0 | 0 | 0 | 0 | 113.4 | P116 V121 L122 Y220 | P116-G118 VanDerWaalsContact C-N 3.29Å; P116-G118 PolarHBondContact O-N 3.06Å; G118-V121 PolarHBondContact O-N 2.95Å; G118-L122 WeakPolarHBondContact O-CB 3.18Å; G118-L122 PolarHBondContact O-N 3.4Å; G118-Y220 PolarHBondContact N-OH 3.32Å |
| 119 | F | 87.3 | Confident | 87.1 | Confident | 109 Ų | 109 | 50 Ų | 50 | 48% | 0.478 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -68.1 | -39.6 | 175.6 | -76.4 | -76.2 | 0 | 0 | 0 | 112 | V115 P116 Y117 L122 F123 | V115-F119 HydrophobicContact CG1-CB 3.98Å; P116-F119 HydrophobicContact CB-CD2 4.16Å; P116-F119 HydrophobicContact CG-CD2 4.05Å; P116-F119 PolarHBondContact O-N 3.26Å; P116-F119 VanDerWaalsContact O-N 3.17Å; Y117-F119 VanDerWaalsContact C-N 3.33Å; Y117-F119 PolarHBondContact O-N 2.98Å; F119-L122 PolarHBondContact O-N 3.02Å; F119-F123 WeakPolarHBondContact O-CB 3.33Å; F119-F123 PolarHBondContact O-N 3.28Å |
| 120 | R | 90.2 | Very high | 87.8 | Confident | 11 Ų | 11 | 50.9 Ų | 50.9 | 4% | 0.042 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.4 | -48.2 | 176.3 | -55.4 | 178.7 | -161.3 | 176 | 8.2 | 110.6 | I112 V115 P116 Y117 F123 C124 S161 E414 | I112-R120 PolarHBondContact O-NE 3.3Å; I112-R120 PolarHBondContact O-NH2 3.5Å; V115-R120 HydrophobicContact CB-CG 4.27Å; V115-R120 HydrophobicContact CG1-CG 3.87Å; V115-R120 PolarHBondContact O-NE 3.29Å; V115-R120 PolarHBondContact O-NH2 3.38Å; P116-R120 PolarHBondContact O-N 3.21Å; Y117-R120 WeakPolarHBondContact O-CB 3.46Å; Y117-R120 PolarHBondContact O-N 2.88Å; Y117-R120 VanDerWaalsContact O-N 3.14Å; R120-F123 PolarHBondContact O-N 3.38Å; R120-C124 PolarHBondContact O-N 2.89Å; R120-C124 PolarHBondContact O-SG 3.33Å; R120-S161 WeakPolarHBondContact CD-OG 3.46Å; R120-E414 IonicContact NH1-OE1 3.76Å; R120-E414 IonicContact NH2-OE1 3.93Å |
| 121 | V | 90.9 | Very high | 88.5 | Confident | 1 Ų | 1 | 46.1 Ų | 46.1 | 1% | 0.006 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.1 | -45.2 | 179.9 | 176.5 | 0 | 0 | 0 | 0 | 111.4 | Y117 G118 F123 C124 V125 F162 Y220 | Y117-V121 WeakPolarHBondContact O-CG2 3.41Å; Y117-V121 PolarHBondContact O-N 2.89Å; G118-V121 PolarHBondContact O-N 2.95Å; V121-F123 VanDerWaalsContact C-N 3.29Å; V121-F123 PolarHBondContact O-N 3.26Å; V121-C124 PolarHBondContact O-N 3.41Å; V121-V125 HydrophobicContact CG1-CG2 4.39Å; V121-V125 WeakPolarHBondContact O-CG2 3.38Å; V121-V125 PolarHBondContact O-N 2.7Å; V121-F162 HydrophobicContact CG1-CZ 4.3Å; V121-F162 HydrophobicContact CG2-CE1 3.58Å; V121-F162 HydrophobicContact CG2-CZ 3.91Å; V121-Y220 HydrophobicContact CB-CD1 4.32Å; V121-Y220 HydrophobicContact CB-CG 4.33Å; V121-Y220 HydrophobicContact CG1-CD1 4.17Å; V121-Y220 HydrophobicContact CG1-CD2 4.46Å; V121-Y220 HydrophobicContact CG1-CG 3.94Å; V121-Y220 HydrophobicContact CG2-CD1 4.38Å; V121-Y220 HydrophobicContact CG2-CD2 3.83Å; V121-Y220 HydrophobicContact CG2-CE1 4.43Å; V121-Y220 HydrophobicContact CG2-CE2 3.89Å; V121-Y220 HydrophobicContact CG2-CG 4.08Å |
| 122 | L | 92 | Very high | 89.1 | Confident | 90 Ų | 90 | 41.8 Ų | 41.8 | 47% | 0.471 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.3 | -40.8 | 177.5 | -176.8 | 63.1 | 0 | 0 | 0 | 111.7 | G118 F119 V125 A126 L217 | G118-L122 WeakPolarHBondContact O-CB 3.18Å; G118-L122 PolarHBondContact O-N 3.4Å; F119-L122 PolarHBondContact O-N 3.02Å; L122-V125 PolarHBondContact O-N 3.4Å; L122-A126 WeakPolarHBondContact O-CB 3.27Å; L122-A126 PolarHBondContact O-N 3.5Å; L122-L217 HydrophobicContact CD1-CD1 4.34Å |
| 123 | F | 93.6 | Very high | 89.8 | Confident | 93 Ų | 93 | 44.3 Ų | 44.3 | 41% | 0.408 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.7 | -44.2 | 175.4 | -176.8 | -90.2 | 0 | 0 | 0 | 111.8 | F119 R120 V121 V125 A126 M127 I153 L157 | F119-F123 WeakPolarHBondContact O-CB 3.33Å; F119-F123 PolarHBondContact O-N 3.28Å; R120-F123 PolarHBondContact O-N 3.38Å; V121-F123 VanDerWaalsContact C-N 3.29Å; V121-F123 PolarHBondContact O-N 3.26Å; F123-V125 PolarHBondContact O-N 2.92Å; F123-A126 PolarHBondContact O-N 2.95Å; F123-M127 HydrophobicContact CD1-CG 4.01Å; F123-M127 HydrophobicContact CD2-CE 4.28Å; F123-M127 HydrophobicContact CE1-CE 4.37Å; F123-M127 HydrophobicContact CE1-CG 3.65Å; F123-M127 HydrophobicContact CE1-SD 4.46Å; F123-M127 HydrophobicContact CE2-CE 3.55Å; F123-M127 HydrophobicContact CE2-CG 4.4Å; F123-M127 HydrophobicContact CZ-CE 3.61Å; F123-M127 HydrophobicContact CZ-CG 3.87Å; F123-M127 HydrophobicContact CZ-SD 4.13Å; F123-M127 VanDerWaalsContact O-CG 3.3Å; F123-M127 WeakPolarHBondContact O-CG 3.47Å; F123-M127 PolarHBondContact O-N 3.36Å; F123-I153 HydrophobicContact CE1-CG2 3.96Å; F123-L157 HydrophobicContact CD1-CD2 3.52Å; F123-L157 HydrophobicContact CE1-CD2 3.96Å |
| 124 | C | 93.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.9 | -47.2 | 173.7 | -66.8 | 0 | 0 | 0 | 0 | 111.6 | R120 V121 A126 M127 A128 S154 G158 M216 | R120-C124 PolarHBondContact O-N 2.89Å; R120-C124 PolarHBondContact O-SG 3.33Å; V121-C124 PolarHBondContact O-N 3.41Å; C124-A126 VanDerWaalsContact C-N 3.33Å; C124-A126 PolarHBondContact O-N 3.33Å; C124-M127 PolarHBondContact O-N 3.47Å; C124-A128 WeakPolarHBondContact O-CB 3.44Å; C124-A128 PolarHBondContact O-N 3.45Å; C124-S154 PolarHBondContact O-OG 3.27Å; C124-G158 VanDerWaalsContact SG-CA 3.58Å; C124-G158 PolarHBondContact SG-N 2.99Å; C124-G158 VanDerWaalsContact SG-N 3.38Å; C124-M216 HydrophobicContact CB-CE 3.94Å |
| 125 | V | 94.5 | Very high | 91 | Very high | 7 Ų | 7 | 34.1 Ų | 34.1 | 4% | 0.042 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.3 | -45.5 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | V121 L122 F123 A128 A129 P213 M216 L217 | V121-V125 HydrophobicContact CG1-CG2 4.39Å; V121-V125 WeakPolarHBondContact O-CG2 3.38Å; V121-V125 PolarHBondContact O-N 2.7Å; L122-V125 PolarHBondContact O-N 3.4Å; F123-V125 PolarHBondContact O-N 2.92Å; V125-A128 PolarHBondContact O-N 3.22Å; V125-A129 VanDerWaalsContact O-CB 3.3Å; V125-A129 WeakPolarHBondContact O-CB 3.48Å; V125-A129 PolarHBondContact O-N 3.16Å; V125-P213 HydrophobicContact CG1-CB 4.1Å; V125-M216 HydrophobicContact CB-CE 4.14Å; V125-M216 HydrophobicContact CG2-CB 4.4Å; V125-M216 HydrophobicContact CG2-CE 3.36Å; V125-L217 HydrophobicContact CG1-CB 4.41Å; V125-L217 HydrophobicContact CG2-CB 4.01Å; V125-L217 HydrophobicContact CG2-CD1 4.12Å |
| 126 | A | 95.5 | Very high | 91.2 | Very high | 49 Ų | 49 | 31.7 Ų | 31.7 | 41% | 0.405 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -62.3 | -44.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L122 F123 C124 A129 A130 | L122-A126 WeakPolarHBondContact O-CB 3.27Å; L122-A126 PolarHBondContact O-N 3.5Å; F123-A126 PolarHBondContact O-N 2.95Å; C124-A126 VanDerWaalsContact C-N 3.33Å; C124-A126 PolarHBondContact O-N 3.33Å; A126-A129 PolarHBondContact O-N 2.82Å; A126-A130 WeakPolarHBondContact O-CB 3.35Å; A126-A130 PolarHBondContact O-N 3.38Å |
| 127 | M | 94.7 | Very high | 91.3 | Very high | 38 Ų | 38 | 34 Ų | 34 | 19% | 0.187 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -66.2 | -42.6 | 177.5 | -68.9 | -66.5 | 140.6 | 0 | 0 | 112 | F123 C124 A130 S131 F150 I153 | F123-M127 HydrophobicContact CD1-CG 4.01Å; F123-M127 HydrophobicContact CD2-CE 4.28Å; F123-M127 HydrophobicContact CE1-CE 4.37Å; F123-M127 HydrophobicContact CE1-CG 3.65Å; F123-M127 HydrophobicContact CE1-SD 4.46Å; F123-M127 HydrophobicContact CE2-CE 3.55Å; F123-M127 HydrophobicContact CE2-CG 4.4Å; F123-M127 HydrophobicContact CZ-CE 3.61Å; F123-M127 HydrophobicContact CZ-CG 3.87Å; F123-M127 HydrophobicContact CZ-SD 4.13Å; F123-M127 VanDerWaalsContact O-CG 3.3Å; F123-M127 WeakPolarHBondContact O-CG 3.47Å; F123-M127 PolarHBondContact O-N 3.36Å; C124-M127 PolarHBondContact O-N 3.47Å; M127-A130 PolarHBondContact O-N 3.16Å; M127-S131 WeakPolarHBondContact O-CB 3.44Å; M127-S131 PolarHBondContact O-N 3.08Å; M127-F150 HydrophobicContact SD-CD1 4.33Å; M127-F150 HydrophobicContact SD-CD2 4.2Å; M127-F150 HydrophobicContact SD-CE2 4.37Å; M127-F150 HydrophobicContact SD-CG 4.16Å; M127-I153 HydrophobicContact CG-CG2 4.22Å |
| 128 | A | 94 | Very high | 91.2 | Very high | 6 Ų | 6 | 34.9 Ų | 34.9 | 5% | 0.05 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.1 | -42 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | C124 V125 S131 F132 P213 | C124-A128 WeakPolarHBondContact O-CB 3.44Å; C124-A128 PolarHBondContact O-N 3.45Å; V125-A128 PolarHBondContact O-N 3.22Å; A128-S131 WeakPolarHBondContact O-CB 3.35Å; A128-S131 PolarHBondContact O-N 3.46Å; A128-F132 VanDerWaalsContact O-CD2 3.29Å; A128-F132 WeakPolarHBondContact O-CD2 3.38Å; A128-F132 PolarHBondContact O-N 2.97Å; A128-P213 HydrophobicContact CB-CB 4.16Å; A128-P213 HydrophobicContact CB-CG 3.83Å |
| 129 | A | 94.8 | Very high | 90.9 | Very high | 14 Ų | 14 | 41.6 Ų | 41.6 | 12% | 0.116 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -65.2 | -44.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | V125 A126 S131 F132 L133 L210 P213 | V125-A129 VanDerWaalsContact O-CB 3.3Å; V125-A129 WeakPolarHBondContact O-CB 3.48Å; V125-A129 PolarHBondContact O-N 3.16Å; A126-A129 PolarHBondContact O-N 2.82Å; A129-S131 VanDerWaalsContact C-N 3.3Å; A129-S131 PolarHBondContact O-N 3.43Å; A129-F132 PolarHBondContact O-N 3.31Å; A129-L133 VanDerWaalsContact O-CG 3.29Å; A129-L133 WeakPolarHBondContact O-CG 3.32Å; A129-L133 PolarHBondContact O-N 3.36Å; A129-L210 HydrophobicContact CB-CD1 3.89Å; A129-P213 HydrophobicContact CB-CB 4.38Å |
| 130 | A | 94.4 | Very high | 90.4 | Very high | 28 Ų | 28 | 37.3 Ų | 37.3 | 23% | 0.231 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.6 | -38.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A126 M127 L133 L134 F150 | A126-A130 WeakPolarHBondContact O-CB 3.35Å; A126-A130 PolarHBondContact O-N 3.38Å; M127-A130 PolarHBondContact O-N 3.16Å; A130-L133 PolarHBondContact O-N 2.63Å; A130-L134 VanDerWaalsContact O-CB 3.28Å; A130-L134 WeakPolarHBondContact O-CB 3.44Å; A130-L134 WeakPolarHBondContact O-CG 3.29Å; A130-L134 PolarHBondContact O-N 3.31Å; A130-F150 HydrophobicContact CB-CD2 3.64Å; A130-F150 HydrophobicContact CB-CE2 4.03Å |
| 131 | S | 92.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -55.9 | -56.8 | 173.4 | 175.8 | 0 | 0 | 0 | 0 | 112 | M127 A128 A129 L133 L134 V135 G147 A151 | M127-S131 WeakPolarHBondContact O-CB 3.44Å; M127-S131 PolarHBondContact O-N 3.08Å; A128-S131 WeakPolarHBondContact O-CB 3.35Å; A128-S131 PolarHBondContact O-N 3.46Å; A129-S131 VanDerWaalsContact C-N 3.3Å; A129-S131 PolarHBondContact O-N 3.43Å; S131-L133 VanDerWaalsContact C-N 3.29Å; S131-L133 PolarHBondContact O-N 3.3Å; S131-L134 PolarHBondContact O-N 3.3Å; S131-V135 WeakPolarHBondContact O-CG2 3.49Å; S131-V135 PolarHBondContact O-N 2.92Å; S131-G147 WeakPolarHBondContact CB-O 3.18Å; S131-G147 PolarHBondContact OG-O 2.96Å; S131-A151 WeakPolarHBondContact OG-CB 2.91Å |
| 132 | F | 91.8 | Very high | 89.1 | Confident | 1 Ų | 1 | 46 Ų | 46 | 0% | 0.004 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.4 | -39.9 | -179.9 | -74 | -56 | 0 | 0 | 0 | 112.8 | F39 A40 V43 M44 A128 A129 S136 L206 M209 L210 P213 | F39-F132 HydrophobicContact CD1-CZ 4.04Å; F39-F132 HydrophobicContact CE1-CZ 4.35Å; A40-F132 HydrophobicContact CB-CE1 4.39Å; A40-F132 HydrophobicContact CB-CE2 3.82Å; A40-F132 HydrophobicContact CB-CZ 3.64Å; V43-F132 HydrophobicContact CB-CE1 4.39Å; V43-F132 HydrophobicContact CG1-CE1 4.15Å; M44-F132 HydrophobicContact CE-CD1 3.41Å; M44-F132 VanDerWaalsContact CE-CD1 3.41Å; M44-F132 HydrophobicContact CE-CE1 3.6Å; M44-F132 HydrophobicContact CE-CG 4.4Å; A128-F132 VanDerWaalsContact O-CD2 3.29Å; A128-F132 WeakPolarHBondContact O-CD2 3.38Å; A128-F132 PolarHBondContact O-N 2.97Å; A129-F132 PolarHBondContact O-N 3.31Å; F132-S136 WeakPolarHBondContact O-CB 3.45Å; F132-S136 PolarHBondContact O-N 2.96Å; F132-L206 HydrophobicContact CD1-CB 4.49Å; F132-L206 HydrophobicContact CD1-CD2 4.02Å; F132-L206 HydrophobicContact CE1-CD2 4.23Å; F132-M209 HydrophobicContact CE1-CB 4.25Å; F132-M209 HydrophobicContact CZ-CB 4.35Å; F132-L210 HydrophobicContact CB-CD1 4.08Å; F132-L210 HydrophobicContact CD2-CD1 4.46Å; F132-P213 HydrophobicContact CD2-CG 3.92Å; F132-P213 HydrophobicContact CE2-CG 3.92Å |
| 133 | L | 92.8 | Very high | 88.7 | Confident | 68 Ų | 68 | 42.7 Ų | 42.7 | 36% | 0.356 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -66.8 | -50.1 | 177.4 | -68 | 171.4 | 0 | 0 | 0 | 111.6 | A129 A130 S131 V135 S136 F137 L207 L210 | A129-L133 VanDerWaalsContact O-CG 3.29Å; A129-L133 WeakPolarHBondContact O-CG 3.32Å; A129-L133 PolarHBondContact O-N 3.36Å; A130-L133 PolarHBondContact O-N 2.63Å; S131-L133 VanDerWaalsContact C-N 3.29Å; S131-L133 PolarHBondContact O-N 3.3Å; L133-V135 VanDerWaalsContact C-N 3.31Å; L133-V135 PolarHBondContact O-N 3.15Å; L133-S136 PolarHBondContact O-N 3.5Å; L133-F137 HydrophobicContact CD2-CD2 4.5Å; L133-F137 HydrophobicContact CD2-CE2 3.96Å; L133-F137 VanDerWaalsContact O-CD2 3.24Å; L133-F137 WeakPolarHBondContact O-CD2 3.43Å; L133-F137 PolarHBondContact O-N 2.91Å; L133-L207 HydrophobicContact CD2-CD2 4.16Å; L133-L210 HydrophobicContact CD2-CD2 4.08Å; L133-L210 HydrophobicContact CG-CD1 4.36Å |
| 134 | L | 90.8 | Very high | 88.1 | Confident | 49 Ų | 49 | 38.7 Ų | 38.7 | 26% | 0.257 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -58.7 | -44 | -179.2 | -74 | 172.3 | 0 | 0 | 0 | 111.6 | A130 S131 S138 L143 V146 F150 | A130-L134 VanDerWaalsContact O-CB 3.28Å; A130-L134 WeakPolarHBondContact O-CB 3.44Å; A130-L134 WeakPolarHBondContact O-CG 3.29Å; A130-L134 PolarHBondContact O-N 3.31Å; S131-L134 PolarHBondContact O-N 3.3Å; L134-S138 WeakPolarHBondContact O-CA 3.4Å; L134-S138 WeakPolarHBondContact O-CB 3.46Å; L134-S138 PolarHBondContact O-N 3.13Å; L134-L143 HydrophobicContact CD2-CD1 3.75Å; L134-V146 HydrophobicContact CD1-CG1 4.05Å; L134-F150 HydrophobicContact CD1-CD2 3.59Å; L134-F150 HydrophobicContact CD1-CE2 3.64Å; L134-F150 HydrophobicContact CD1-CG 4.4Å; L134-F150 HydrophobicContact CD1-CZ 4.48Å |
| 135 | V | 87.4 | Confident | 87.6 | Confident | 5 Ų | 5 | 42.6 Ų | 42.6 | 3% | 0.03 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -70.2 | -41.9 | 178.8 | -178.9 | 0 | 0 | 0 | 0 | 111.4 | M44 I51 S131 L133 F137 S138 L206 | M44-V135 HydrophobicContact CE-CB 4.3Å; M44-V135 HydrophobicContact CE-CG2 4.19Å; M44-V135 HydrophobicContact SD-CB 4.19Å; M44-V135 HydrophobicContact SD-CG1 4.12Å; M44-V135 HydrophobicContact SD-CG2 3.7Å; I51-V135 HydrophobicContact CD1-CG1 3.38Å; I51-V135 HydrophobicContact CG1-CG1 4.32Å; S131-V135 WeakPolarHBondContact O-CG2 3.49Å; S131-V135 PolarHBondContact O-N 2.92Å; L133-V135 VanDerWaalsContact C-N 3.31Å; L133-V135 PolarHBondContact O-N 3.15Å; V135-F137 PolarHBondContact O-N 3.41Å; V135-S138 WeakPolarHBondContact O-CB 3.21Å; V135-S138 PolarHBondContact O-N 3.41Å; V135-S138 PolarHBondContact O-OG 2.91Å; V135-L206 HydrophobicContact CB-CD1 4.06Å; V135-L206 HydrophobicContact CG1-CD1 3.54Å |
| 136 | S | 88.4 | Confident | 87.3 | Confident | 9 Ų | 9 | 44.5 Ų | 44.5 | 6% | 0.063 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63 | -39.9 | 179.5 | -177.4 | 0 | 0 | 0 | 0 | 113 | F132 L133 R203 L207 | F132-S136 WeakPolarHBondContact O-CB 3.45Å; F132-S136 PolarHBondContact O-N 2.96Å; L133-S136 PolarHBondContact O-N 3.5Å; S136-R203 WeakPolarHBondContact O-CG 3.26Å; S136-R203 VanDerWaalsContact OG-CG 3.27Å; S136-R203 WeakPolarHBondContact OG-CG 3.24Å; S136-R203 PolarHBondContact OG-O 2.73Å; S136-L207 WeakPolarHBondContact OG-CG 3.45Å |
| 137 | F | 87.9 | Confident | 86.9 | Confident | 107 Ų | 107 | 42.1 Ų | 42.1 | 47% | 0.469 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -93.2 | 9.4 | 178.3 | -66.1 | -82.1 | 0 | 0 | 0 | 113.4 | L133 V135 F139 L207 | L133-F137 HydrophobicContact CD2-CD2 4.5Å; L133-F137 HydrophobicContact CD2-CE2 3.96Å; L133-F137 VanDerWaalsContact O-CD2 3.24Å; L133-F137 WeakPolarHBondContact O-CD2 3.43Å; L133-F137 PolarHBondContact O-N 2.91Å; V135-F137 PolarHBondContact O-N 3.41Å; F137-F139 PolarHBondContact O-N 2.92Å; F137-L207 HydrophobicContact CE2-CD2 4.01Å; F137-L207 HydrophobicContact CZ-CD2 4.35Å |
| 138 | S | 83.1 | Confident | 86.5 | Confident | 28 Ų | 28 | 41.5 Ų | 41.5 | 20% | 0.196 | 21% | 0.213 | C | C | . | . | trans | -64.6 | 124 | -176.1 | 64.5 | 0 | 0 | 0 | 0 | 112.1 | Q55 L134 V135 S144 | Q55-S138 PolarHBondContact NE2-OG 2.79Å; L134-S138 WeakPolarHBondContact O-CA 3.4Å; L134-S138 WeakPolarHBondContact O-CB 3.46Å; L134-S138 PolarHBondContact O-N 3.13Å; V135-S138 WeakPolarHBondContact O-CB 3.21Å; V135-S138 PolarHBondContact O-N 3.41Å; V135-S138 PolarHBondContact O-OG 2.91Å; S138-S144 WeakPolarHBondContact CB-OG 3.48Å; S138-S144 PolarHBondContact OG-OG 3.08Å | ||
| 139 | F | 78.9 | Confident | 86.3 | Confident | 160 Ų | 160 | 44 Ų | 44 | 70% | 0.702 | 23% | 0.225 | S | C | * | . | S | Bend | trans | -104.4 | -11.7 | 172.2 | 50.8 | -93.4 | 0 | 0 | 0 | 112.4 | F137 L143 | F137-F139 PolarHBondContact O-N 2.92Å; F139-L143 HydrophobicContact CD1-CD2 3.96Å; F139-L143 HydrophobicContact CE1-CD2 3.57Å; F139-L143 HydrophobicContact CZ-CD2 3.97Å |
| 140 | A | 76.3 | Confident | 86.2 | Confident | 19 Ų | 19 | 46 Ų | 46 | 16% | 0.157 | 23% | 0.232 | C | C | . | . | S | Bend | trans | -137.6 | 150.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q55 W142 L143 S144 | Q55-A140 PolarHBondContact NE2-O 3.28Å; A140-W142 VanDerWaalsContact C-N 3.31Å; A140-W142 VanDerWaalsContact CB-CD1 3.49Å; A140-W142 HydrophobicContact CB-CG 4.4Å; A140-W142 PolarHBondContact O-N 3.27Å; A140-L143 WeakPolarHBondContact O-CB 3.07Å; A140-L143 PolarHBondContact O-N 3.03Å; A140-L143 VanDerWaalsContact O-N 3.1Å; A140-S144 PolarHBondContact O-N 3.33Å |
| 141 | V | 75.2 | Confident | 86 | Confident | 41 Ų | 41 | 44.7 Ų | 44.7 | 25% | 0.248 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.3 | -41.6 | -178.2 | -180 | 0 | 0 | 0 | 0 | 112.1 | L52 Q55 L143 S144 I145 | L52-V141 HydrophobicContact CD2-CG1 4.02Å; Q55-V141 HydrophobicContact CB-CG2 3.73Å; Q55-V141 HydrophobicContact CG-CG2 4.48Å; V141-L143 PolarHBondContact O-N 3.33Å; V141-S144 WeakPolarHBondContact O-CB 3.22Å; V141-S144 PolarHBondContact O-N 3.03Å; V141-S144 VanDerWaalsContact O-N 3.13Å; V141-I145 HydrophobicContact CG1-CD1 4.04Å; V141-I145 HydrophobicContact CG1-CG1 4.49Å; V141-I145 WeakPolarHBondContact O-CG1 3.44Å; V141-I145 PolarHBondContact O-N 2.92Å |
| 142 | W | 78.4 | Confident | 86 | Confident | 155 Ų | 155 | 44.7 Ų | 44.7 | 59% | 0.587 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -60.3 | -34.3 | 179.2 | 72.3 | -98.3 | 0 | 0 | 0 | 112.2 | A140 I145 V146 | A140-W142 VanDerWaalsContact C-N 3.31Å; A140-W142 VanDerWaalsContact CB-CD1 3.49Å; A140-W142 HydrophobicContact CB-CG 4.4Å; A140-W142 PolarHBondContact O-N 3.27Å; W142-I145 PolarHBondContact O-N 3.46Å; W142-V146 HydrophobicContact CE3-CG2 4.05Å; W142-V146 HydrophobicContact CZ3-CG2 4.31Å; W142-V146 WeakPolarHBondContact O-CG2 3.46Å; W142-V146 PolarHBondContact O-N 2.83Å |
| 143 | L | 83.9 | Confident | 86 | Confident | 20 Ų | 20 | 46.3 Ų | 46.3 | 11% | 0.105 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -71.6 | -35.8 | 179.9 | -170.6 | 58.9 | 0 | 0 | 0 | 111 | L134 F139 A140 V141 V146 G147 | L134-L143 HydrophobicContact CD2-CD1 3.75Å; F139-L143 HydrophobicContact CD1-CD2 3.96Å; F139-L143 HydrophobicContact CE1-CD2 3.57Å; F139-L143 HydrophobicContact CZ-CD2 3.97Å; A140-L143 WeakPolarHBondContact O-CB 3.07Å; A140-L143 PolarHBondContact O-N 3.03Å; A140-L143 VanDerWaalsContact O-N 3.1Å; V141-L143 PolarHBondContact O-N 3.33Å; L143-V146 PolarHBondContact O-N 3.37Å; L143-G147 PolarHBondContact O-N 3.35Å; L143-G147 VanDerWaalsContact O-N 3.1Å |
| 144 | S | 81.7 | Confident | 86 | Confident | 8 Ų | 8 | 43.2 Ų | 43.2 | 6% | 0.056 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.5 | -45.6 | 170.2 | -51 | 0 | 0 | 0 | 0 | 111.2 | I51 Q55 S138 A140 V141 V146 G147 V148 | I51-S144 WeakPolarHBondContact CG2-OG 3.35Å; Q55-S144 PolarHBondContact NE2-OG 3.17Å; Q55-S144 PolarHBondContact OE1-OG 3.33Å; Q55-S144 VanDerWaalsContact OE1-OG 3.08Å; S138-S144 WeakPolarHBondContact CB-OG 3.48Å; S138-S144 PolarHBondContact OG-OG 3.08Å; A140-S144 PolarHBondContact O-N 3.33Å; V141-S144 WeakPolarHBondContact O-CB 3.22Å; V141-S144 PolarHBondContact O-N 3.03Å; V141-S144 VanDerWaalsContact O-N 3.13Å; S144-V146 PolarHBondContact O-N 3.36Å; S144-G147 WeakPolarHBondContact O-CA 3.24Å; S144-G147 PolarHBondContact O-N 3.04Å; S144-G147 VanDerWaalsContact O-N 3.09Å; S144-V148 WeakPolarHBondContact O-CG2 3.37Å; S144-V148 PolarHBondContact O-N 2.69Å |
| 145 | I | 82.3 | Confident | 86.1 | Confident | 83 Ų | 83 | 41.1 Ų | 41.1 | 43% | 0.426 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -62.1 | -42.5 | 178.9 | -65.5 | 169 | 0 | 0 | 0 | 111.2 | V141 W142 G147 V148 I149 | V141-I145 HydrophobicContact CG1-CD1 4.04Å; V141-I145 HydrophobicContact CG1-CG1 4.49Å; V141-I145 WeakPolarHBondContact O-CG1 3.44Å; V141-I145 PolarHBondContact O-N 2.92Å; W142-I145 PolarHBondContact O-N 3.46Å; I145-G147 VanDerWaalsContact C-N 3.26Å; I145-G147 PolarHBondContact O-N 3.46Å; I145-V148 WeakPolarHBondContact O-CB 3.14Å; I145-V148 PolarHBondContact O-N 3.09Å; I145-V148 VanDerWaalsContact O-N 3.13Å; I145-I149 HydrophobicContact CG2-CD1 4.17Å; I145-I149 WeakPolarHBondContact O-CG1 3.27Å; I145-I149 PolarHBondContact O-N 2.79Å |
| 146 | V | 87.6 | Confident | 86.2 | Confident | 46 Ų | 46 | 40.9 Ų | 40.9 | 28% | 0.279 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60.1 | -39.7 | 174.4 | 174.1 | 0 | 0 | 0 | 0 | 111 | L134 W142 L143 S144 I149 F150 | L134-V146 HydrophobicContact CD1-CG1 4.05Å; W142-V146 HydrophobicContact CE3-CG2 4.05Å; W142-V146 HydrophobicContact CZ3-CG2 4.31Å; W142-V146 WeakPolarHBondContact O-CG2 3.46Å; W142-V146 PolarHBondContact O-N 2.83Å; L143-V146 PolarHBondContact O-N 3.37Å; S144-V146 PolarHBondContact O-N 3.36Å; V146-I149 PolarHBondContact O-N 3.13Å; V146-F150 HydrophobicContact CG1-CE1 4.21Å; V146-F150 HydrophobicContact CG1-CZ 4.36Å; V146-F150 PolarHBondContact O-N 3.36Å |
| 147 | G | 88.9 | Confident | 86.4 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.2 | -41.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S131 L143 S144 I145 F150 A151 | S131-G147 WeakPolarHBondContact CB-O 3.18Å; S131-G147 PolarHBondContact OG-O 2.96Å; L143-G147 PolarHBondContact O-N 3.35Å; L143-G147 VanDerWaalsContact O-N 3.1Å; S144-G147 WeakPolarHBondContact O-CA 3.24Å; S144-G147 PolarHBondContact O-N 3.04Å; S144-G147 VanDerWaalsContact O-N 3.09Å; I145-G147 VanDerWaalsContact C-N 3.26Å; I145-G147 PolarHBondContact O-N 3.46Å; G147-F150 PolarHBondContact O-N 3.13Å; G147-A151 PolarHBondContact O-N 2.96Å; G147-A151 VanDerWaalsContact O-N 3.15Å |
| 148 | V | 86.1 | Confident | 86.6 | Confident | 25 Ų | 25 | 36.5 Ų | 36.5 | 15% | 0.152 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.4 | -49.1 | 173.9 | 177.5 | 0 | 0 | 0 | 0 | 110.4 | M44 D97 S144 I145 F150 A151 S152 | M44-V148 HydrophobicContact CB-CG2 4.33Å; D97-V148 HydrophobicContact CB-CG1 4Å; S144-V148 WeakPolarHBondContact O-CG2 3.37Å; S144-V148 PolarHBondContact O-N 2.69Å; I145-V148 WeakPolarHBondContact O-CB 3.14Å; I145-V148 PolarHBondContact O-N 3.09Å; I145-V148 VanDerWaalsContact O-N 3.13Å; V148-F150 PolarHBondContact O-N 2.93Å; V148-A151 WeakPolarHBondContact O-CA 3.47Å; V148-A151 WeakPolarHBondContact O-CB 3.39Å; V148-A151 PolarHBondContact O-N 3.18Å; V148-S152 PolarHBondContact O-N 2.91Å; V148-S152 PolarHBondContact O-OG 2.99Å |
| 149 | I | 89.3 | Confident | 87 | Confident | 57 Ų | 57 | 36 Ų | 36 | 29% | 0.292 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -54.7 | -40.7 | 177.9 | -67.2 | 167.1 | 0 | 0 | 0 | 111.3 | P100 I145 V146 S152 I153 | P100-I149 HydrophobicContact CB-CG2 4.29Å; P100-I149 HydrophobicContact CG-CG1 4.22Å; P100-I149 HydrophobicContact CG-CG2 4.13Å; I145-I149 HydrophobicContact CG2-CD1 4.17Å; I145-I149 WeakPolarHBondContact O-CG1 3.27Å; I145-I149 PolarHBondContact O-N 2.79Å; V146-I149 PolarHBondContact O-N 3.13Å; I149-S152 WeakPolarHBondContact O-CB 3.25Å; I149-S152 PolarHBondContact O-N 3.04Å; I149-I153 HydrophobicContact CG2-CD1 3.78Å; I149-I153 HydrophobicContact CG2-CG1 4.27Å; I149-I153 VanDerWaalsContact O-CG1 3.22Å; I149-I153 WeakPolarHBondContact O-CG1 3.27Å; I149-I153 PolarHBondContact O-N 3.49Å |
| 150 | F | 92.3 | Very high | 87.4 | Confident | 58 Ų | 58 | 28.4 Ų | 28.4 | 25% | 0.254 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -66.7 | -35.6 | 177.3 | -79 | 14.6 | 0 | 0 | 0 | 112.9 | M127 A130 L134 V146 G147 V148 I153 S154 | M127-F150 HydrophobicContact SD-CD1 4.33Å; M127-F150 HydrophobicContact SD-CD2 4.2Å; M127-F150 HydrophobicContact SD-CE2 4.37Å; M127-F150 HydrophobicContact SD-CG 4.16Å; A130-F150 HydrophobicContact CB-CD2 3.64Å; A130-F150 HydrophobicContact CB-CE2 4.03Å; L134-F150 HydrophobicContact CD1-CD2 3.59Å; L134-F150 HydrophobicContact CD1-CE2 3.64Å; L134-F150 HydrophobicContact CD1-CG 4.4Å; L134-F150 HydrophobicContact CD1-CZ 4.48Å; V146-F150 HydrophobicContact CG1-CE1 4.21Å; V146-F150 HydrophobicContact CG1-CZ 4.36Å; V146-F150 PolarHBondContact O-N 3.36Å; G147-F150 PolarHBondContact O-N 3.13Å; V148-F150 PolarHBondContact O-N 2.93Å; F150-I153 HydrophobicContact CD1-CD1 4.4Å; F150-S154 WeakPolarHBondContact O-CB 3.34Å; F150-S154 PolarHBondContact O-N 3.43Å |
| 151 | A | 91.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.6 | -44.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | A40 M44 S131 G147 V148 S154 S155 | A40-A151 HydrophobicContact CB-CB 4.07Å; M44-A151 HydrophobicContact CG-CB 4.01Å; S131-A151 WeakPolarHBondContact OG-CB 2.91Å; G147-A151 PolarHBondContact O-N 2.96Å; G147-A151 VanDerWaalsContact O-N 3.15Å; V148-A151 WeakPolarHBondContact O-CA 3.47Å; V148-A151 WeakPolarHBondContact O-CB 3.39Å; V148-A151 PolarHBondContact O-N 3.18Å; A151-S154 PolarHBondContact O-N 2.89Å; A151-S155 PolarHBondContact O-N 2.95Å; A151-S155 PolarHBondContact O-OG 2.61Å |
| 152 | S | 91 | Very high | 88.9 | Confident | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.3 | -45.3 | 177.5 | -35.8 | 0 | 0 | 0 | 0 | 112.1 | D97 T101 V148 I149 S154 S155 G156 | D97-S152 WeakPolarHBondContact O-CB 3.19Å; D97-S152 PolarHBondContact O-OG 3.07Å; D97-S152 PolarHBondContact OD1-OG 3.25Å; T101-S152 WeakPolarHBondContact OG1-CB 3.38Å; T101-S152 PolarHBondContact OG1-O 3.12Å; V148-S152 PolarHBondContact O-N 2.91Å; V148-S152 PolarHBondContact O-OG 2.99Å; I149-S152 WeakPolarHBondContact O-CB 3.25Å; I149-S152 PolarHBondContact O-N 3.04Å; S152-S154 VanDerWaalsContact C-N 3.33Å; S152-S154 PolarHBondContact O-N 2.97Å; S152-S155 PolarHBondContact O-N 2.97Å; S152-S155 PolarHBondContact O-OG 2.95Å; S152-S155 VanDerWaalsContact O-OG 3.12Å; S152-G156 PolarHBondContact O-N 3.29Å |
| 153 | I | 92.1 | Very high | 89.3 | Confident | 35 Ų | 35 | 18.2 Ų | 18.2 | 18% | 0.179 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -60 | -45.4 | 177 | -70.1 | 171.8 | 0 | 0 | 0 | 110.6 | P100 I104 F123 M127 I149 F150 L157 | P100-I153 HydrophobicContact CB-CG1 4.28Å; I104-I153 HydrophobicContact CD1-CB 3.82Å; I104-I153 HydrophobicContact CD1-CG1 3.65Å; I104-I153 HydrophobicContact CD1-CG2 3.67Å; F123-I153 HydrophobicContact CE1-CG2 3.96Å; M127-I153 HydrophobicContact CG-CG2 4.22Å; I149-I153 HydrophobicContact CG2-CD1 3.78Å; I149-I153 HydrophobicContact CG2-CG1 4.27Å; I149-I153 VanDerWaalsContact O-CG1 3.22Å; I149-I153 WeakPolarHBondContact O-CG1 3.27Å; I149-I153 PolarHBondContact O-N 3.49Å; F150-I153 HydrophobicContact CD1-CD1 4.4Å; I153-L157 VanDerWaalsContact O-CB 3.31Å; I153-L157 WeakPolarHBondContact O-CB 3.32Å; I153-L157 PolarHBondContact O-N 3.41Å; I153-L157 VanDerWaalsContact O-N 3.07Å |
| 154 | S | 93.9 | Very high | 89.5 | Confident | 2 Ų | 2 | 17.3 Ų | 17.3 | 1% | 0.014 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -61.9 | -51.3 | 177.8 | 176.8 | 0 | 0 | 0 | 0 | 112 | C124 F150 A151 S152 G158 | C124-S154 PolarHBondContact O-OG 3.27Å; F150-S154 WeakPolarHBondContact O-CB 3.34Å; F150-S154 PolarHBondContact O-N 3.43Å; A151-S154 PolarHBondContact O-N 2.89Å; S152-S154 VanDerWaalsContact C-N 3.33Å; S152-S154 PolarHBondContact O-N 2.97Å; S154-G158 PolarHBondContact O-N 3.02Å |
| 155 | S | 92.1 | Very high | 89.7 | Confident | 5 Ų | 5 | 17 Ų | 17 | 4% | 0.035 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -65.6 | -42.4 | -175.3 | 65.7 | 0 | 0 | 0 | 0 | 111.5 | N37 A151 S152 E159 | N37-S155 PolarHBondContact ND2-O 2.89Å; N37-S155 WeakPolarHBondContact O-CB 3.36Å; A151-S155 PolarHBondContact O-N 2.95Å; A151-S155 PolarHBondContact O-OG 2.61Å; S152-S155 PolarHBondContact O-N 2.97Å; S152-S155 PolarHBondContact O-OG 2.95Å; S152-S155 VanDerWaalsContact O-OG 3.12Å; S155-E159 WeakPolarHBondContact O-CB 2.97Å; S155-E159 PolarHBondContact O-N 3.25Å |
| 156 | G | 90.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65.5 | -50.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | T101 S152 G158 L160 | T101-G156 VanDerWaalsContact CG2-CA 3.45Å; S152-G156 PolarHBondContact O-N 3.29Å; G156-G158 VanDerWaalsContact C-N 3.33Å; G156-G158 PolarHBondContact O-N 3.45Å; G156-L160 WeakPolarHBondContact O-CG 3.15Å; G156-L160 PolarHBondContact O-N 3.42Å |
| 157 | L | 91.6 | Very high | 89.8 | Confident | 24 Ų | 24 | 11.8 Ų | 11.8 | 13% | 0.126 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -67.7 | -35.9 | 178.4 | -177.8 | 63.3 | 0 | 0 | 0 | 112.1 | I104 I112 F123 I153 S161 | I104-L157 HydrophobicContact CG2-CB 4.16Å; I104-L157 HydrophobicContact CG2-CD1 4.39Å; I112-L157 HydrophobicContact CD1-CD1 3.73Å; I112-L157 HydrophobicContact CG1-CD1 4.46Å; F123-L157 HydrophobicContact CD1-CD2 3.52Å; F123-L157 HydrophobicContact CE1-CD2 3.96Å; I153-L157 VanDerWaalsContact O-CB 3.31Å; I153-L157 WeakPolarHBondContact O-CB 3.32Å; I153-L157 PolarHBondContact O-N 3.41Å; I153-L157 VanDerWaalsContact O-N 3.07Å; L157-S161 VanDerWaalsContact O-CB 3.32Å; L157-S161 WeakPolarHBondContact O-CB 3.36Å; L157-S161 PolarHBondContact O-N 3.18Å; L157-S161 PolarHBondContact O-OG 3.34Å |
| 158 | G | 91.8 | Very high | 89.6 | Confident | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -70 | -42.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | N37 C124 S154 G156 L160 S161 F162 | N37-G158 WeakPolarHBondContact OD1-CA 3.27Å; C124-G158 VanDerWaalsContact SG-CA 3.58Å; C124-G158 PolarHBondContact SG-N 2.99Å; C124-G158 VanDerWaalsContact SG-N 3.38Å; S154-G158 PolarHBondContact O-N 3.02Å; G156-G158 VanDerWaalsContact C-N 3.33Å; G156-G158 PolarHBondContact O-N 3.45Å; G158-L160 PolarHBondContact O-N 3.39Å; G158-S161 PolarHBondContact O-N 3.04Å; G158-S161 VanDerWaalsContact O-N 3.13Å; G158-F162 VanDerWaalsContact C-CD2 3.48Å; G158-F162 WeakPolarHBondContact O-CB 3.22Å; G158-F162 WeakPolarHBondContact O-CD2 2.98Å; G158-F162 WeakPolarHBondContact O-CG 3.49Å; G158-F162 PolarHBondContact O-N 2.83Å |
| 159 | E | 91 | Very high | 89.5 | Confident | 19 Ų | 19 | 13.4 Ų | 13.4 | 9% | 0.089 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -58 | -47.7 | 174.5 | 177.2 | 168.3 | -157.7 | 0 | 0 | 111.7 | N37 K105 S155 S161 F162 L163 W177 Y397 | N37-E159 PolarHBondContact ND2-N 3.31Å; K105-E159 WeakPolarHBondContact CE-OE2 3.4Å; K105-E159 IonicContact NZ-OE2 2.8Å; K105-E159 PolarHBondContact NZ-OE2 3.23Å; S155-E159 WeakPolarHBondContact O-CB 2.97Å; S155-E159 PolarHBondContact O-N 3.25Å; E159-S161 VanDerWaalsContact C-N 3.32Å; E159-S161 PolarHBondContact O-N 3.46Å; E159-F162 PolarHBondContact O-N 2.76Å; E159-L163 HydrophobicContact CG-CD1 3.57Å; E159-L163 HydrophobicContact CG-CG 4.16Å; E159-L163 VanDerWaalsContact O-CB 3.24Å; E159-L163 WeakPolarHBondContact O-CB 3.16Å; E159-L163 VanDerWaalsContact O-CG 3.27Å; E159-L163 WeakPolarHBondContact O-CG 3.28Å; E159-L163 PolarHBondContact O-N 3.46Å; E159-W177 HydrophobicContact CB-CZ2 4.23Å; E159-W177 HydrophobicContact CG-CZ2 4.15Å; E159-Y397 PolarHBondContact OE1-OH 2.92Å |
| 160 | L | 88.9 | Confident | 89.3 | Confident | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -56.3 | -49 | 174.4 | -67.2 | 168.8 | 0 | 0 | 0 | 111.1 | I104 K105 A108 I112 G156 G158 S164 A418 S421 | I104-L160 HydrophobicContact CG2-CD1 4.01Å; K105-L160 HydrophobicContact CB-CD1 4.43Å; K105-L160 HydrophobicContact CB-CD2 4.42Å; K105-L160 HydrophobicContact CG-CD1 3.99Å; K105-L160 HydrophobicContact CG-CD2 4.03Å; K105-L160 HydrophobicContact CG-CG 4.02Å; A108-L160 HydrophobicContact CB-CD1 3.76Å; I112-L160 HydrophobicContact CD1-CB 4.27Å; G156-L160 WeakPolarHBondContact O-CG 3.15Å; G156-L160 PolarHBondContact O-N 3.42Å; G158-L160 PolarHBondContact O-N 3.39Å; L160-S164 WeakPolarHBondContact O-CB 3.37Å; L160-S164 PolarHBondContact O-N 2.72Å; L160-S164 PolarHBondContact O-OG 3.2Å; L160-A418 HydrophobicContact CD2-CB 3.94Å; L160-A418 WeakPolarHBondContact CD2-O 3.47Å; L160-S421 WeakPolarHBondContact CD2-OG 3.34Å |
| 161 | S | 90.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -65.5 | -43.8 | -176.1 | -60.9 | 0 | 0 | 0 | 0 | 112.1 | Y117 R120 L157 G158 E159 L165 | Y117-S161 VanDerWaalsContact CE1-O 3.29Å; Y117-S161 WeakPolarHBondContact CE1-O 3.48Å; R120-S161 WeakPolarHBondContact CD-OG 3.46Å; L157-S161 VanDerWaalsContact O-CB 3.32Å; L157-S161 WeakPolarHBondContact O-CB 3.36Å; L157-S161 PolarHBondContact O-N 3.18Å; L157-S161 PolarHBondContact O-OG 3.34Å; G158-S161 PolarHBondContact O-N 3.04Å; G158-S161 VanDerWaalsContact O-N 3.13Å; E159-S161 VanDerWaalsContact C-N 3.32Å; E159-S161 PolarHBondContact O-N 3.46Å; S161-L165 WeakPolarHBondContact O-CB 3.17Å; S161-L165 PolarHBondContact O-N 3.26Å |
| 162 | F | 91.2 | Very high | 88.3 | Confident | 1 Ų | 1 | 20.9 Ų | 20.9 | 0% | 0.004 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -77.4 | -36.2 | -177.3 | -61.7 | -53.2 | 0 | 0 | 0 | 112.3 | F30 L33 N37 V121 G158 E159 L165 S166 W177 M216 Y220 | F30-F162 WeakPolarHBondContact CE1-O 3.33Å; L33-F162 HydrophobicContact CB-CD1 4.42Å; L33-F162 HydrophobicContact CB-CE1 4.43Å; L33-F162 HydrophobicContact CD1-CD1 3.78Å; L33-F162 HydrophobicContact CD1-CE1 3.78Å; L33-F162 HydrophobicContact CD2-CD1 4.43Å; L33-F162 HydrophobicContact CD2-CE1 3.7Å; L33-F162 HydrophobicContact CD2-CZ 3.76Å; L33-F162 HydrophobicContact CG-CD1 4.43Å; L33-F162 HydrophobicContact CG-CE1 4.17Å; N37-F162 HydrophobicContact CB-CD2 4.37Å; N37-F162 HydrophobicContact CB-CE2 4.24Å; V121-F162 HydrophobicContact CG1-CZ 4.3Å; V121-F162 HydrophobicContact CG2-CE1 3.58Å; V121-F162 HydrophobicContact CG2-CZ 3.91Å; G158-F162 VanDerWaalsContact C-CD2 3.48Å; G158-F162 WeakPolarHBondContact O-CB 3.22Å; G158-F162 WeakPolarHBondContact O-CD2 2.98Å; G158-F162 WeakPolarHBondContact O-CG 3.49Å; G158-F162 PolarHBondContact O-N 2.83Å; E159-F162 PolarHBondContact O-N 2.76Å; F162-L165 HydrophobicContact CD1-CD2 4.38Å; F162-L165 PolarHBondContact O-N 3.42Å; F162-S166 PolarHBondContact O-N 2.85Å; F162-W177 HydrophobicContact CB-CD2 4.4Å; F162-W177 HydrophobicContact CB-CE3 3.76Å; F162-W177 HydrophobicContact CB-CH2 3.63Å; F162-W177 HydrophobicContact CB-CZ2 4.25Å; F162-W177 HydrophobicContact CB-CZ3 3.32Å; F162-W177 AromaticContact CD2-CH2 3.48Å; F162-W177 HydrophobicContact CD2-CH2 3.48Å; F162-W177 VanDerWaalsContact CD2-CH2 3.48Å; F162-W177 AromaticContact CD2-CZ3 3.38Å; F162-W177 HydrophobicContact CD2-CZ3 3.38Å; F162-W177 HydrophobicContact CE2-CZ3 4.38Å; F162-W177 HydrophobicContact CG-CE3 4.37Å; F162-W177 AromaticContact CG-CH2 3.96Å; F162-W177 HydrophobicContact CG-CH2 3.96Å; F162-W177 AromaticContact CG-CZ3 3.57Å; F162-W177 HydrophobicContact CG-CZ3 3.57Å; F162-M216 HydrophobicContact CE2-SD 4.08Å; F162-M216 HydrophobicContact CZ-CG 4.31Å; F162-M216 HydrophobicContact CZ-SD 4.2Å; F162-Y220 HydrophobicContact CE1-CD2 4.48Å |
| 163 | L | 88.1 | Confident | 88.1 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63.6 | -43.7 | 171.2 | -73.5 | 174.5 | 0 | 0 | 0 | 111.2 | E159 S166 L174 F401 M417 | E159-L163 HydrophobicContact CG-CD1 3.57Å; E159-L163 HydrophobicContact CG-CG 4.16Å; E159-L163 VanDerWaalsContact O-CB 3.24Å; E159-L163 WeakPolarHBondContact O-CB 3.16Å; E159-L163 VanDerWaalsContact O-CG 3.27Å; E159-L163 WeakPolarHBondContact O-CG 3.28Å; E159-L163 PolarHBondContact O-N 3.46Å; L163-S166 WeakPolarHBondContact O-CB 3.33Å; L163-S166 PolarHBondContact O-N 3.48Å; L163-S166 PolarHBondContact O-OG 2.81Å; L163-L174 HydrophobicContact CD2-CD1 3.82Å; L163-F401 HydrophobicContact CD1-CD1 4.26Å; L163-F401 HydrophobicContact CD1-CE1 3.65Å; L163-F401 HydrophobicContact CD1-CZ 3.9Å; L163-F401 HydrophobicContact CD2-CD1 4.24Å; L163-F401 HydrophobicContact CD2-CE1 4.45Å; L163-M417 HydrophobicContact CB-CB 4.46Å |
| 164 | S | 86.6 | Confident | 87.9 | Confident | 1 Ų | 1 | 19.8 Ų | 19.8 | 1% | 0.007 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -61.2 | -42.3 | 171.9 | -74.8 | 0 | 0 | 0 | 0 | 112 | Y117 L160 S166 V167 E414 | Y117-S164 WeakPolarHBondContact OH-CB 3.48Å; L160-S164 WeakPolarHBondContact O-CB 3.37Å; L160-S164 PolarHBondContact O-N 2.72Å; L160-S164 PolarHBondContact O-OG 3.2Å; S164-S166 VanDerWaalsContact C-N 3.3Å; S164-S166 PolarHBondContact O-N 3.03Å; S164-V167 VanDerWaalsContact O-CB 3.27Å; S164-V167 WeakPolarHBondContact O-CB 3.4Å; S164-V167 PolarHBondContact O-N 3.42Å; S164-E414 PolarHBondContact OG-O 3.22Å |
| 165 | L | 86.7 | Confident | 87.6 | Confident | 1 Ų | 1 | 20.7 Ų | 20.7 | 1% | 0.005 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64.1 | -34.2 | 177.9 | -173.7 | 67.1 | 0 | 0 | 0 | 112.3 | F30 Y117 S161 F162 V167 F168 F169 Y220 L224 L230 | F30-L165 HydrophobicContact CZ-CB 4.31Å; F30-L165 HydrophobicContact CZ-CD2 4.04Å; F30-L165 HydrophobicContact CZ-CG 3.97Å; Y117-L165 HydrophobicContact CD1-CB 4.12Å; Y117-L165 HydrophobicContact CD1-CD1 3.97Å; Y117-L165 HydrophobicContact CD2-CD1 4.21Å; Y117-L165 HydrophobicContact CE1-CB 3.85Å; Y117-L165 HydrophobicContact CE1-CD1 4.16Å; Y117-L165 HydrophobicContact CE2-CD1 4.4Å; Y117-L165 HydrophobicContact CG-CD1 3.99Å; S161-L165 WeakPolarHBondContact O-CB 3.17Å; S161-L165 PolarHBondContact O-N 3.26Å; F162-L165 HydrophobicContact CD1-CD2 4.38Å; F162-L165 PolarHBondContact O-N 3.42Å; L165-V167 PolarHBondContact O-N 3.06Å; L165-F168 HydrophobicContact CD1-CD2 4.39Å; L165-F168 WeakPolarHBondContact O-CD2 3.34Å; L165-F168 PolarHBondContact O-N 3.37Å; L165-F169 HydrophobicContact CD1-CE2 4.1Å; L165-F169 HydrophobicContact CD2-CE2 4.39Å; L165-F169 HydrophobicContact CG-CD2 4.41Å; L165-F169 HydrophobicContact CG-CE2 3.9Å; L165-F169 WeakPolarHBondContact O-CD2 3.34Å; L165-Y220 HydrophobicContact CD2-CD2 4.29Å; L165-Y220 HydrophobicContact CD2-CE2 3.82Å; L165-L224 HydrophobicContact CD2-CD2 3.84Å; L165-L230 HydrophobicContact CD1-CD2 3.46Å; L165-L230 VanDerWaalsContact CD1-CD2 3.46Å |
| 166 | S | 86.9 | Confident | 87.4 | Confident | 6 Ų | 6 | 20.4 Ų | 20.4 | 4% | 0.042 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -57.7 | -23.1 | -179.2 | 78.7 | 0 | 0 | 0 | 0 | 113.6 | F162 L163 S164 F168 F169 | F162-S166 PolarHBondContact O-N 2.85Å; L163-S166 WeakPolarHBondContact O-CB 3.33Å; L163-S166 PolarHBondContact O-N 3.48Å; L163-S166 PolarHBondContact O-OG 2.81Å; S164-S166 VanDerWaalsContact C-N 3.3Å; S164-S166 PolarHBondContact O-N 3.03Å; S166-F168 PolarHBondContact O-N 3.14Å; S166-F169 PolarHBondContact O-N 3.01Å; S166-F169 VanDerWaalsContact O-N 3.17Å |
| 167 | V | 85.4 | Confident | 87.5 | Confident | 13 Ų | 13 | 20.4 Ų | 20.4 | 8% | 0.079 | 10% | 0.098 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -29.3 | 176.6 | 163.5 | 0 | 0 | 0 | 0 | 112.7 | S164 L165 F169 R413 M417 | S164-V167 VanDerWaalsContact O-CB 3.27Å; S164-V167 WeakPolarHBondContact O-CB 3.4Å; S164-V167 PolarHBondContact O-N 3.42Å; L165-V167 PolarHBondContact O-N 3.06Å; V167-F169 VanDerWaalsContact C-N 3.32Å; V167-R413 HydrophobicContact CG1-CB 4.21Å; V167-R413 HydrophobicContact CG1-CG 4.35Å; V167-R413 VanDerWaalsContact CG1-NE 3.31Å; V167-R413 HydrophobicContact CG2-CB 4.21Å; V167-R413 HydrophobicContact CG2-CG 3.71Å; V167-R413 PolarHBondContact O-NH2 3.14Å; V167-M417 HydrophobicContact CG2-CG 4.11Å |
| 168 | F | 83.5 | Confident | 87.3 | Confident | 45 Ų | 45 | 19.3 Ų | 19.3 | 20% | 0.197 | 9% | 0.092 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -11.3 | -179.8 | -60.7 | -79.6 | 0 | 0 | 0 | 112.9 | Y117 L165 S166 L230 | Y117-F168 AromaticContact CE2-CE2 3.91Å; Y117-F168 HydrophobicContact CE2-CE2 3.91Å; L165-F168 HydrophobicContact CD1-CD2 4.39Å; L165-F168 WeakPolarHBondContact O-CD2 3.34Å; L165-F168 PolarHBondContact O-N 3.37Å; S166-F168 PolarHBondContact O-N 3.14Å; F168-L230 HydrophobicContact CB-CD2 3.77Å; F168-L230 HydrophobicContact CB-CG 4.36Å; F168-L230 HydrophobicContact CD1-CD2 4.24Å; F168-L230 HydrophobicContact CD2-CD2 3.61Å; F168-L230 HydrophobicContact CE2-CD2 4.29Å; F168-L230 HydrophobicContact CG-CD2 3.59Å; F168-L230 HydrophobicContact CG-CG 4.46Å |
| 169 | F | 85.4 | Confident | 87.3 | Confident | 15 Ų | 15 | 19.7 Ų | 19.7 | 7% | 0.066 | 10% | 0.095 | C | C | . | . | S | Bend | trans | -109.6 | 169.8 | -175.3 | -69.8 | -89.6 | 0 | 0 | 0 | 112 | N26 F30 L165 S166 V167 R171 V173 L224 V225 L230 | N26-F169 HydrophobicContact CB-CD1 4.15Å; N26-F169 HydrophobicContact CB-CE1 4.45Å; N26-F169 WeakPolarHBondContact ND2-CD1 3.22Å; F30-F169 HydrophobicContact CE2-CB 4.31Å; F30-F169 HydrophobicContact CE2-CD1 4.26Å; F30-F169 AromaticContact CE2-CD2 3.51Å; F30-F169 HydrophobicContact CE2-CD2 3.51Å; F30-F169 HydrophobicContact CE2-CE1 4.49Å; F30-F169 AromaticContact CE2-CE2 3.81Å; F30-F169 HydrophobicContact CE2-CE2 3.81Å; F30-F169 AromaticContact CE2-CG 3.77Å; F30-F169 HydrophobicContact CE2-CG 3.77Å; F30-F169 HydrophobicContact CE2-CZ 4.29Å; F30-F169 AromaticContact CZ-CD2 3.59Å; F30-F169 HydrophobicContact CZ-CD2 3.59Å; F30-F169 AromaticContact CZ-CE2 3.97Å; F30-F169 HydrophobicContact CZ-CE2 3.97Å; F30-F169 HydrophobicContact CZ-CG 4.21Å; L165-F169 HydrophobicContact CD1-CE2 4.1Å; L165-F169 HydrophobicContact CD2-CE2 4.39Å; L165-F169 HydrophobicContact CG-CD2 4.41Å; L165-F169 HydrophobicContact CG-CE2 3.9Å; L165-F169 WeakPolarHBondContact O-CD2 3.34Å; S166-F169 PolarHBondContact O-N 3.01Å; S166-F169 VanDerWaalsContact O-N 3.17Å; V167-F169 VanDerWaalsContact C-N 3.32Å; F169-R171 PolarHBondContact O-N 3.47Å; F169-V173 HydrophobicContact CB-CB 4.41Å; F169-V173 HydrophobicContact CB-CG1 3.92Å; F169-V173 HydrophobicContact CB-CG2 3.64Å; F169-L224 HydrophobicContact CE2-CD2 4.23Å; F169-L224 HydrophobicContact CZ-CD2 3.96Å; F169-L224 HydrophobicContact CZ-CG 4.49Å; F169-V225 VanDerWaalsContact CE1-O 3.26Å; F169-V225 WeakPolarHBondContact CE1-O 3.23Å; F169-L230 HydrophobicContact CE2-CD1 4.49Å; F169-L230 HydrophobicContact CZ-CD1 4.36Å |
| 170 | N | 83.9 | Confident | 87.4 | Confident | 73 Ų | 73 | 18.8 Ų | 18.8 | 39% | 0.39 | 9% | 0.091 | S | C | . | . | trans | -56.4 | 136.8 | 171.9 | -78.1 | -71.8 | 0 | 0 | 0 | 111.2 | N172 V173 | N170-N172 PolarHBondContact O-N 2.99Å; N170-V173 WeakPolarHBondContact O-CG1 3.21Å; N170-V173 VanDerWaalsContact O-CG2 3.31Å; N170-V173 WeakPolarHBondContact O-CG2 3.37Å; N170-V173 PolarHBondContact O-N 2.94Å | ||
| 171 | R | 78.9 | Confident | 87.5 | Confident | 109 Ų | 109 | 19.1 Ų | 19.1 | 41% | 0.411 | 9% | 0.093 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.3 | -22.4 | -176.2 | -63.4 | -179.2 | -178.7 | -176 | -2.2 | 115.1 | F169 V173 L174 | F169-R171 PolarHBondContact O-N 3.47Å; R171-V173 PolarHBondContact O-N 2.97Å; R171-L174 WeakPolarHBondContact O-CB 3.26Å; R171-L174 PolarHBondContact O-N 3.44Å |
| 172 | N | 83.5 | Confident | 87.3 | Confident | 89 Ų | 89 | 19.2 Ų | 19.2 | 48% | 0.476 | 9% | 0.093 | S | C | . | . | H | α-helix | trans | -62.2 | -24.7 | 175.3 | -58.9 | -2.8 | 0 | 0 | 0 | 112.5 | W27 N170 L174 E175 G176 | W27-N172 PolarHBondContact NE1-O 3.45Å; N170-N172 PolarHBondContact O-N 2.99Å; N172-L174 PolarHBondContact O-N 2.95Å; N172-E175 VanDerWaalsContact O-CB 3.28Å; N172-E175 WeakPolarHBondContact O-CB 3.41Å; N172-E175 PolarHBondContact O-N 3.27Å; N172-E175 VanDerWaalsContact O-N 3.14Å; N172-G176 PolarHBondContact O-N 3.32Å |
| 173 | V | 88.3 | Confident | 87.3 | Confident | 4 Ų | 4 | 19.7 Ų | 19.7 | 2% | 0.024 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -67 | -26.9 | 178.7 | -56.4 | 0 | 0 | 0 | 0 | 112.6 | N26 F30 F169 N170 R171 E175 G176 W177 | N26-V173 HydrophobicContact CB-CG1 4.1Å; F30-V173 HydrophobicContact CB-CB 4Å; F30-V173 HydrophobicContact CD1-CB 4.3Å; F30-V173 HydrophobicContact CD1-CG2 4.19Å; F30-V173 HydrophobicContact CD2-CB 3.63Å; F30-V173 HydrophobicContact CD2-CG1 3.91Å; F30-V173 HydrophobicContact CD2-CG2 3.96Å; F30-V173 HydrophobicContact CE1-CG2 4.21Å; F30-V173 HydrophobicContact CE2-CB 4.13Å; F30-V173 HydrophobicContact CE2-CG1 4.33Å; F30-V173 HydrophobicContact CE2-CG2 3.97Å; F30-V173 HydrophobicContact CG-CB 3.7Å; F30-V173 HydrophobicContact CG-CG1 4.46Å; F30-V173 HydrophobicContact CG-CG2 4.05Å; F30-V173 HydrophobicContact CZ-CG2 4.09Å; F169-V173 HydrophobicContact CB-CB 4.41Å; F169-V173 HydrophobicContact CB-CG1 3.92Å; F169-V173 HydrophobicContact CB-CG2 3.64Å; N170-V173 WeakPolarHBondContact O-CG1 3.21Å; N170-V173 VanDerWaalsContact O-CG2 3.31Å; N170-V173 WeakPolarHBondContact O-CG2 3.37Å; N170-V173 PolarHBondContact O-N 2.94Å; R171-V173 PolarHBondContact O-N 2.97Å; V173-E175 PolarHBondContact O-N 3.31Å; V173-G176 PolarHBondContact O-N 3.41Å; V173-G176 VanDerWaalsContact O-N 3.13Å; V173-W177 PolarHBondContact O-N 3.27Å |
| 174 | L | 87 | Confident | 87.5 | Confident | 9 Ų | 9 | 19.7 Ų | 19.7 | 5% | 0.047 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -65.5 | -31.6 | 175.2 | -172.8 | 64.6 | 0 | 0 | 0 | 111.2 | L163 R171 N172 G178 F401 M417 | L163-L174 HydrophobicContact CD2-CD1 3.82Å; R171-L174 WeakPolarHBondContact O-CB 3.26Å; R171-L174 PolarHBondContact O-N 3.44Å; N172-L174 PolarHBondContact O-N 2.95Å; L174-G178 PolarHBondContact O-N 3.28Å; L174-F401 HydrophobicContact CD1-CB 4.27Å; L174-F401 HydrophobicContact CD2-CB 3.99Å; L174-M417 HydrophobicContact CD1-CE 3.82Å; L174-M417 HydrophobicContact CD2-CE 3.99Å |
| 175 | E | 86.9 | Confident | 87.3 | Confident | 20 Ų | 20 | 19.7 Ų | 19.7 | 9% | 0.093 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -68.5 | -41.7 | 172.6 | -50.5 | 177.2 | 176.9 | 0 | 0 | 110.8 | N172 V173 G178 S179 L345 | N172-E175 VanDerWaalsContact O-CB 3.28Å; N172-E175 WeakPolarHBondContact O-CB 3.41Å; N172-E175 PolarHBondContact O-N 3.27Å; N172-E175 VanDerWaalsContact O-N 3.14Å; V173-E175 PolarHBondContact O-N 3.31Å; E175-G178 PolarHBondContact O-N 2.98Å; E175-S179 WeakPolarHBondContact O-CB 3.37Å; E175-S179 PolarHBondContact O-N 2.92Å; E175-L345 HydrophobicContact CB-CD2 4.41Å; E175-L345 HydrophobicContact CG-CB 4.27Å; E175-L345 HydrophobicContact CG-CD2 3.64Å; E175-L345 HydrophobicContact CG-CG 3.98Å |
| 176 | G | 89.4 | Confident | 87.3 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.8 | -50.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | W31 N172 V173 S179 G180 | W31-G176 WeakPolarHBondContact CA-O 3.29Å; N172-G176 PolarHBondContact O-N 3.32Å; V173-G176 PolarHBondContact O-N 3.41Å; V173-G176 VanDerWaalsContact O-N 3.13Å; G176-S179 PolarHBondContact O-N 2.97Å; G176-G180 PolarHBondContact O-N 2.96Å |
| 177 | W | 91.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -54.9 | -53.8 | 173.5 | 173.1 | -97.8 | 0 | 0 | 0 | 112 | F30 L33 G34 N37 E159 F162 V173 S179 G180 T181 Y397 | F30-W177 HydrophobicContact CB-CB 4.38Å; F30-W177 HydrophobicContact CD1-CB 4.27Å; L33-W177 HydrophobicContact CB-CE3 4.32Å; L33-W177 HydrophobicContact CB-CZ3 4.06Å; G34-W177 VanDerWaalsContact N-CZ3 3.33Å; N37-W177 HydrophobicContact CB-CH2 3.84Å; N37-W177 HydrophobicContact CB-CZ3 4.33Å; E159-W177 HydrophobicContact CB-CZ2 4.23Å; E159-W177 HydrophobicContact CG-CZ2 4.15Å; F162-W177 HydrophobicContact CB-CD2 4.4Å; F162-W177 HydrophobicContact CB-CE3 3.76Å; F162-W177 HydrophobicContact CB-CH2 3.63Å; F162-W177 HydrophobicContact CB-CZ2 4.25Å; F162-W177 HydrophobicContact CB-CZ3 3.32Å; F162-W177 AromaticContact CD2-CH2 3.48Å; F162-W177 HydrophobicContact CD2-CH2 3.48Å; F162-W177 VanDerWaalsContact CD2-CH2 3.48Å; F162-W177 AromaticContact CD2-CZ3 3.38Å; F162-W177 HydrophobicContact CD2-CZ3 3.38Å; F162-W177 HydrophobicContact CE2-CZ3 4.38Å; F162-W177 HydrophobicContact CG-CE3 4.37Å; F162-W177 AromaticContact CG-CH2 3.96Å; F162-W177 HydrophobicContact CG-CH2 3.96Å; F162-W177 AromaticContact CG-CZ3 3.57Å; F162-W177 HydrophobicContact CG-CZ3 3.57Å; V173-W177 PolarHBondContact O-N 3.27Å; W177-S179 VanDerWaalsContact C-N 3.34Å; W177-S179 PolarHBondContact O-N 3.32Å; W177-G180 PolarHBondContact O-N 3.26Å; W177-T181 HydrophobicContact CD2-CG2 3.98Å; W177-T181 HydrophobicContact CE3-CG2 4.5Å; W177-T181 HydrophobicContact CG-CG2 4.4Å; W177-T181 HydrophobicContact CH2-CG2 4.22Å; W177-T181 HydrophobicContact CZ2-CG2 3.68Å; W177-T181 VanDerWaalsContact O-CG2 3.28Å; W177-T181 WeakPolarHBondContact O-CG2 3.32Å; W177-T181 PolarHBondContact O-N 2.65Å; W177-T181 PolarHBondContact O-OG1 2.81Å; W177-T181 VanDerWaalsContact O-OG1 3.07Å; W177-Y397 PolarHBondContact NE1-OH 3.27Å |
| 178 | G | 88.3 | Confident | 87.4 | Confident | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.01 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -56.1 | -46 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L174 E175 T181 G182 R342 | L174-G178 PolarHBondContact O-N 3.28Å; E175-G178 PolarHBondContact O-N 2.98Å; G178-T181 PolarHBondContact O-OG1 3.33Å; G178-G182 PolarHBondContact O-N 2.99Å; G178-R342 VanDerWaalsContact O-CB 3.28Å; G178-R342 WeakPolarHBondContact O-CB 3.5Å; G178-R342 WeakPolarHBondContact O-CD 3.2Å |
| 179 | S | 91.9 | Very high | 87.1 | Confident | 8 Ų | 8 | 20.4 Ų | 20.4 | 6% | 0.056 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -65 | -44.9 | 176.8 | -179.7 | 0 | 0 | 0 | 0 | 112.3 | W31 E175 G176 W177 T181 G182 A183 S343 | W31-S179 PolarHBondContact NE1-OG 3.03Å; E175-S179 WeakPolarHBondContact O-CB 3.37Å; E175-S179 PolarHBondContact O-N 2.92Å; G176-S179 PolarHBondContact O-N 2.97Å; W177-S179 VanDerWaalsContact C-N 3.34Å; W177-S179 PolarHBondContact O-N 3.32Å; S179-T181 PolarHBondContact O-N 3.22Å; S179-G182 PolarHBondContact O-N 3.33Å; S179-A183 PolarHBondContact O-N 3.1Å; S179-S343 PolarHBondContact OG-OG 2.93Å |
| 180 | G | 92.1 | Very high | 87 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62 | -41.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113 | W31 L35 G176 W177 G182 A183 A184 | W31-G180 WeakPolarHBondContact O-CA 3.46Å; L35-G180 VanDerWaalsContact CA-O 3.25Å; L35-G180 WeakPolarHBondContact CA-O 3.3Å; L35-G180 PolarHBondContact N-O 3.43Å; G176-G180 PolarHBondContact O-N 2.96Å; W177-G180 PolarHBondContact O-N 3.26Å; G180-G182 VanDerWaalsContact C-N 3.33Å; G180-G182 PolarHBondContact O-N 3.44Å; G180-A183 CarbonylContact O-C 3.58Å; G180-A183 WeakPolarHBondContact O-CB 3.4Å; G180-A183 PolarHBondContact O-N 3.41Å; G180-A183 VanDerWaalsContact O-N 3.13Å; G180-A184 PolarHBondContact O-N 2.89Å |
| 181 | T | 91 | Very high | 87.1 | Confident | 7 Ų | 7 | 24.3 Ų | 24.3 | 4% | 0.043 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -64 | -35.5 | 175.7 | 55.1 | 0 | 0 | 0 | 0 | 112.7 | G34 N38 W177 G178 S179 A184 R342 | G34-T181 WeakPolarHBondContact O-CA 3.41Å; G34-T181 WeakPolarHBondContact O-CG2 3.4Å; N38-T181 WeakPolarHBondContact ND2-CB 3.25Å; N38-T181 WeakPolarHBondContact ND2-CG2 3.15Å; W177-T181 HydrophobicContact CD2-CG2 3.98Å; W177-T181 HydrophobicContact CE3-CG2 4.5Å; W177-T181 HydrophobicContact CG-CG2 4.4Å; W177-T181 HydrophobicContact CH2-CG2 4.22Å; W177-T181 HydrophobicContact CZ2-CG2 3.68Å; W177-T181 VanDerWaalsContact O-CG2 3.28Å; W177-T181 WeakPolarHBondContact O-CG2 3.32Å; W177-T181 PolarHBondContact O-N 2.65Å; W177-T181 PolarHBondContact O-OG1 2.81Å; W177-T181 VanDerWaalsContact O-OG1 3.07Å; G178-T181 PolarHBondContact O-OG1 3.33Å; S179-T181 PolarHBondContact O-N 3.22Å; T181-A184 WeakPolarHBondContact O-CB 3.31Å; T181-A184 PolarHBondContact O-N 2.85Å; T181-R342 VanDerWaalsContact CB-NH1 3.27Å; T181-R342 PolarHBondContact OG1-NH1 3.44Å |
| 182 | G | 87.4 | Confident | 87.3 | Confident | 1 Ų | 1 | 19.6 Ų | 19.6 | 1% | 0.01 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -69.2 | -38 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G178 S179 G180 A184 G185 | G178-G182 PolarHBondContact O-N 2.99Å; S179-G182 PolarHBondContact O-N 3.33Å; G180-G182 VanDerWaalsContact C-N 3.33Å; G180-G182 PolarHBondContact O-N 3.44Å; G182-A184 VanDerWaalsContact C-N 3.26Å; G182-A184 PolarHBondContact O-N 3.35Å; G182-G185 PolarHBondContact O-N 3.25Å |
| 183 | A | 91 | Very high | 87.1 | Confident | 11 Ų | 11 | 16.8 Ų | 16.8 | 9% | 0.091 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64 | -31.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | W31 L35 S179 G180 G185 V186 A187 F339 | W31-A183 HydrophobicContact CZ2-CB 3.99Å; L35-A183 HydrophobicContact CD1-CB 4.13Å; S179-A183 PolarHBondContact O-N 3.1Å; G180-A183 CarbonylContact O-C 3.58Å; G180-A183 WeakPolarHBondContact O-CB 3.4Å; G180-A183 PolarHBondContact O-N 3.41Å; G180-A183 VanDerWaalsContact O-N 3.13Å; A183-G185 VanDerWaalsContact C-N 3.27Å; A183-G185 PolarHBondContact O-N 3.3Å; A183-V186 PolarHBondContact O-N 3.4Å; A183-A187 WeakPolarHBondContact O-CB 3.22Å; A183-A187 PolarHBondContact O-N 3.39Å; A183-F339 HydrophobicContact CB-CD2 3.92Å; A183-F339 HydrophobicContact CB-CE2 3.82Å |
| 184 | A | 90.6 | Very high | 86.9 | Confident | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -57.4 | -40.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L35 N38 G180 T181 G182 G188 | L35-A184 WeakPolarHBondContact O-CB 3.48Å; N38-A184 HydrophobicContact CB-CB 3.82Å; G180-A184 PolarHBondContact O-N 2.89Å; T181-A184 WeakPolarHBondContact O-CB 3.31Å; T181-A184 PolarHBondContact O-N 2.85Å; G182-A184 VanDerWaalsContact C-N 3.26Å; G182-A184 PolarHBondContact O-N 3.35Å; A184-G188 WeakPolarHBondContact O-CA 3.49Å; A184-G188 PolarHBondContact O-N 3.28Å |
| 185 | G | 84.1 | Confident | 86.8 | Confident | 2 Ų | 2 | 19.3 Ų | 19.3 | 2% | 0.021 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.5 | -51.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | G182 A183 S189 | G182-G185 PolarHBondContact O-N 3.25Å; A183-G185 VanDerWaalsContact C-N 3.27Å; A183-G185 PolarHBondContact O-N 3.3Å; G185-S189 WeakPolarHBondContact O-CB 3.47Å; G185-S189 PolarHBondContact O-N 2.89Å; G185-S189 PolarHBondContact O-OG 2.86Å |
| 186 | V | 86.6 | Confident | 86.6 | Confident | 27 Ų | 27 | 20.8 Ų | 20.8 | 16% | 0.164 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.9 | -48.7 | 179 | 179.9 | 0 | 0 | 0 | 0 | 111 | A183 S189 L190 Q335 V336 F339 | A183-V186 PolarHBondContact O-N 3.4Å; V186-S189 PolarHBondContact O-OG 3.13Å; V186-S189 VanDerWaalsContact O-OG 3.14Å; V186-L190 HydrophobicContact CG1-CD1 3.57Å; V186-L190 HydrophobicContact CG1-CG 4.29Å; V186-L190 VanDerWaalsContact O-CB 3.23Å; V186-L190 WeakPolarHBondContact O-CB 3.45Å; V186-L190 VanDerWaalsContact O-CG 3.23Å; V186-L190 WeakPolarHBondContact O-CG 3.48Å; V186-L190 PolarHBondContact O-N 3.31Å; V186-Q335 HydrophobicContact CG2-CB 3.69Å; V186-Q335 WeakPolarHBondContact CG2-O 3.44Å; V186-V336 HydrophobicContact CG2-CG2 4.34Å; V186-F339 HydrophobicContact CG2-CB 4.14Å |
| 187 | A | 88.9 | Confident | 86.2 | Confident | 37 Ų | 37 | 27 Ų | 27 | 31% | 0.306 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -67.3 | -41.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | F39 A183 L191 | F39-A187 HydrophobicContact CE2-CB 4.42Å; A183-A187 WeakPolarHBondContact O-CB 3.22Å; A183-A187 PolarHBondContact O-N 3.39Å; A187-L191 WeakPolarHBondContact O-CB 3.41Å; A187-L191 PolarHBondContact O-N 3.29Å |
| 188 | G | 85 | Confident | 86 | Confident | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.9 | -50.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | F39 A184 Y192 | F39-G188 VanDerWaalsContact CE2-CA 3.43Å; A184-G188 WeakPolarHBondContact O-CA 3.49Å; A184-G188 PolarHBondContact O-N 3.28Å; G188-Y192 VanDerWaalsContact O-CB 3.28Å; G188-Y192 WeakPolarHBondContact O-CB 3.24Å; G188-Y192 PolarHBondContact O-N 3.35Å |
| 189 | S | 77.6 | Confident | 85.8 | Confident | 16 Ų | 16 | 38.6 Ų | 38.6 | 11% | 0.112 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.4 | -48.5 | 179.3 | 55.4 | 0 | 0 | 0 | 0 | 112.4 | G185 V186 A193 | G185-S189 WeakPolarHBondContact O-CB 3.47Å; G185-S189 PolarHBondContact O-N 2.89Å; G185-S189 PolarHBondContact O-OG 2.86Å; V186-S189 PolarHBondContact O-OG 3.13Å; V186-S189 VanDerWaalsContact O-OG 3.14Å; S189-A193 VanDerWaalsContact O-CB 3.25Å; S189-A193 WeakPolarHBondContact O-CB 3.36Å; S189-A193 PolarHBondContact O-N 2.87Å |
| 190 | L | 82.8 | Confident | 85.5 | Confident | 90 Ų | 90 | 41 Ų | 41 | 47% | 0.471 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -68.3 | -40.5 | -179.5 | -68.7 | 179.3 | 0 | 0 | 0 | 112.7 | V186 G194 T332 | V186-L190 HydrophobicContact CG1-CD1 3.57Å; V186-L190 HydrophobicContact CG1-CG 4.29Å; V186-L190 VanDerWaalsContact O-CB 3.23Å; V186-L190 WeakPolarHBondContact O-CB 3.45Å; V186-L190 VanDerWaalsContact O-CG 3.23Å; V186-L190 WeakPolarHBondContact O-CG 3.48Å; V186-L190 PolarHBondContact O-N 3.31Å; L190-G194 WeakPolarHBondContact O-CA 3.45Å; L190-G194 PolarHBondContact O-N 2.92Å; L190-T332 HydrophobicContact CD2-CG2 4.3Å |
| 191 | L | 86.9 | Confident | 85.2 | Confident | 79 Ų | 79 | 43.3 Ų | 43.3 | 41% | 0.414 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -68 | -42.1 | 179.6 | -172.5 | 63.4 | 0 | 0 | 0 | 110.7 | F39 A187 L195 M209 | F39-L191 HydrophobicContact CE2-CD2 4.44Å; F39-L191 HydrophobicContact CZ-CD2 3.93Å; A187-L191 WeakPolarHBondContact O-CB 3.41Å; A187-L191 PolarHBondContact O-N 3.29Å; L191-L195 HydrophobicContact CD1-CD1 4.06Å; L191-L195 HydrophobicContact CD1-CG 4.26Å; L191-L195 HydrophobicContact CG-CD1 3.91Å; L191-L195 HydrophobicContact CG-CG 4.49Å; L191-L195 WeakPolarHBondContact O-CB 3.33Å; L191-L195 WeakPolarHBondContact O-CD1 3.22Å; L191-L195 WeakPolarHBondContact O-CG 2.92Å; L191-L195 PolarHBondContact O-N 3.36Å; L191-M209 HydrophobicContact CB-CE 4.05Å; L191-M209 HydrophobicContact CD2-CE 4.1Å; L191-M209 HydrophobicContact CD2-CG 4.5Å; L191-M209 HydrophobicContact CG-CE 3.83Å |
| 192 | Y | 83.1 | Confident | 84.7 | Confident | 11 Ų | 11 | 44.3 Ų | 44.3 | 4% | 0.043 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.5 | -54.4 | 175.4 | -176.9 | -99.4 | 0 | 0 | 0 | 110.6 | V43 A47 D50 G188 G194 L195 I196 T205 M209 | V43-Y192 HydrophobicContact CG1-CD2 4.04Å; A47-Y192 HydrophobicContact CB-CE1 4.24Å; A47-Y192 HydrophobicContact CB-CE2 3.76Å; D50-Y192 VanDerWaalsContact OD2-CE1 3.27Å; D50-Y192 WeakPolarHBondContact OD2-CE1 3.38Å; D50-Y192 PolarHBondContact OD2-OH 3.09Å; G188-Y192 VanDerWaalsContact O-CB 3.28Å; G188-Y192 WeakPolarHBondContact O-CB 3.24Å; G188-Y192 PolarHBondContact O-N 3.35Å; Y192-G194 VanDerWaalsContact C-N 3.33Å; Y192-G194 PolarHBondContact O-N 2.89Å; Y192-L195 PolarHBondContact O-N 3.14Å; Y192-I196 HydrophobicContact CD1-CG1 4.28Å; Y192-I196 HydrophobicContact CE1-CG1 3.89Å; Y192-I196 HydrophobicContact CE2-CD1 4.33Å; Y192-I196 HydrophobicContact CE2-CG1 4.25Å; Y192-I196 WeakPolarHBondContact O-CG1 3.45Å; Y192-I196 PolarHBondContact O-N 3.39Å; Y192-T205 HydrophobicContact CD2-CG2 3.7Å; Y192-T205 HydrophobicContact CE2-CG2 4.06Å; Y192-M209 VanDerWaalsContact CA-CE 3.43Å; Y192-M209 HydrophobicContact CD2-CE 4.25Å; Y192-M209 VanDerWaalsContact N-CE 3.35Å |
| 193 | A | 77.9 | Confident | 84.7 | Confident | 29 Ų | 29 | 50.3 Ų | 50.3 | 24% | 0.24 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.7 | -40.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S189 I196 Q197 | S189-A193 VanDerWaalsContact O-CB 3.25Å; S189-A193 WeakPolarHBondContact O-CB 3.36Å; S189-A193 PolarHBondContact O-N 2.87Å; A193-I196 PolarHBondContact O-N 3.33Å; A193-Q197 WeakPolarHBondContact O-CB 3.49Å; A193-Q197 VanDerWaalsContact O-CG 3.27Å; A193-Q197 WeakPolarHBondContact O-CG 3.15Å; A193-Q197 PolarHBondContact O-N 3.33Å; A193-Q197 PolarHBondContact O-NE2 3.11Å |
| 194 | G | 83.7 | Confident | 84.5 | Confident | 36 Ų | 36 | 52.7 Ų | 52.7 | 37% | 0.371 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65.9 | -40.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L190 Y192 Q197 A198 | L190-G194 WeakPolarHBondContact O-CA 3.45Å; L190-G194 PolarHBondContact O-N 2.92Å; Y192-G194 VanDerWaalsContact C-N 3.33Å; Y192-G194 PolarHBondContact O-N 2.89Å; G194-Q197 PolarHBondContact O-N 2.98Å; G194-A198 WeakPolarHBondContact O-CB 3.44Å; G194-A198 PolarHBondContact O-N 3.22Å |
| 195 | L | 86.6 | Confident | 84.4 | Confident | 30 Ų | 30 | 52.7 Ų | 52.7 | 16% | 0.157 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -68.7 | -39.6 | 176.8 | -70 | 171 | 0 | 0 | 0 | 111.7 | L191 Y192 A198 L200 T205 M209 | L191-L195 HydrophobicContact CD1-CD1 4.06Å; L191-L195 HydrophobicContact CD1-CG 4.26Å; L191-L195 HydrophobicContact CG-CD1 3.91Å; L191-L195 HydrophobicContact CG-CG 4.49Å; L191-L195 WeakPolarHBondContact O-CB 3.33Å; L191-L195 WeakPolarHBondContact O-CD1 3.22Å; L191-L195 WeakPolarHBondContact O-CG 2.92Å; L191-L195 PolarHBondContact O-N 3.36Å; Y192-L195 PolarHBondContact O-N 3.14Å; L195-A198 WeakPolarHBondContact O-CB 3.47Å; L195-A198 PolarHBondContact O-N 3.19Å; L195-L200 HydrophobicContact CB-CD1 4.03Å; L195-L200 HydrophobicContact CD2-CD1 3.51Å; L195-L200 HydrophobicContact CG-CD1 4.34Å; L195-L200 WeakPolarHBondContact O-CB 3.36Å; L195-L200 PolarHBondContact O-N 2.93Å; L195-T205 HydrophobicContact CB-CG2 3.76Å; L195-T205 HydrophobicContact CD1-CG2 3.78Å; L195-T205 HydrophobicContact CG-CG2 4.42Å; L195-M209 HydrophobicContact CD1-CE 4.02Å |
| 196 | I | 81.1 | Confident | 84.6 | Confident | 51 Ų | 51 | 52.8 Ų | 52.8 | 26% | 0.262 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64 | -43.4 | 174 | -63.8 | -59.8 | 0 | 0 | 0 | 111.2 | Y192 A193 A198 H199 P202 | Y192-I196 HydrophobicContact CD1-CG1 4.28Å; Y192-I196 HydrophobicContact CE1-CG1 3.89Å; Y192-I196 HydrophobicContact CE2-CD1 4.33Å; Y192-I196 HydrophobicContact CE2-CG1 4.25Å; Y192-I196 WeakPolarHBondContact O-CG1 3.45Å; Y192-I196 PolarHBondContact O-N 3.39Å; A193-I196 PolarHBondContact O-N 3.33Å; I196-A198 PolarHBondContact O-N 3.07Å; I196-H199 WeakPolarHBondContact O-CA 3.43Å; I196-H199 PolarHBondContact O-N 2.94Å; I196-P202 HydrophobicContact CD1-CB 4.3Å; I196-P202 HydrophobicContact CD1-CG 3.87Å |
| 197 | Q | 81.8 | Confident | 84.8 | Confident | 131 Ų | 131 | 54.6 Ų | 54.6 | 61% | 0.612 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -63.5 | -29.7 | 175.5 | -75.2 | 173.2 | 55.9 | 0 | 0 | 113 | A193 G194 H199 | A193-Q197 WeakPolarHBondContact O-CB 3.49Å; A193-Q197 VanDerWaalsContact O-CG 3.27Å; A193-Q197 WeakPolarHBondContact O-CG 3.15Å; A193-Q197 PolarHBondContact O-N 3.33Å; A193-Q197 PolarHBondContact O-NE2 3.11Å; G194-Q197 PolarHBondContact O-N 2.98Å; Q197-H199 PolarHBondContact O-N 3.46Å; Q197-H199 PolarHBondContact O-ND1 3.12Å |
| 198 | A | 87.1 | Confident | 84.9 | Confident | 65 Ų | 65 | 56.8 Ų | 56.8 | 54% | 0.537 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | 13.2 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | G194 L195 I196 L200 | G194-A198 WeakPolarHBondContact O-CB 3.44Å; G194-A198 PolarHBondContact O-N 3.22Å; L195-A198 WeakPolarHBondContact O-CB 3.47Å; L195-A198 PolarHBondContact O-N 3.19Å; I196-A198 PolarHBondContact O-N 3.07Å; A198-L200 PolarHBondContact O-N 3.22Å |
| 199 | H | 85.4 | Confident | 85.2 | Confident | 180 Ų | 180 | 56.9 Ų | 56.9 | 83% | 0.833 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.7 | 23.6 | 179 | -60.9 | 62.7 | 0 | 0 | 0 | 114 | I196 Q197 | I196-H199 WeakPolarHBondContact O-CA 3.43Å; I196-H199 PolarHBondContact O-N 2.94Å; Q197-H199 PolarHBondContact O-N 3.46Å; Q197-H199 PolarHBondContact O-ND1 3.12Å |
| 200 | L | 85.9 | Confident | 86 | Confident | 58 Ų | 58 | 57.8 Ų | 57.8 | 30% | 0.304 | 31% | 0.314 | S | S | . | . | trans | -79.9 | 138 | 170.7 | -67.4 | 158.3 | 0 | 0 | 0 | 110.2 | L195 A198 T204 I208 | L195-L200 HydrophobicContact CB-CD1 4.03Å; L195-L200 HydrophobicContact CD2-CD1 3.51Å; L195-L200 HydrophobicContact CG-CD1 4.34Å; L195-L200 WeakPolarHBondContact O-CB 3.36Å; L195-L200 PolarHBondContact O-N 2.93Å; A198-L200 PolarHBondContact O-N 3.22Å; L200-T204 HydrophobicContact CD2-CG2 4.11Å; L200-I208 HydrophobicContact CD1-CD1 4.33Å | ||
| 201 | S | 84.8 | Confident | 86.5 | Confident | 48 Ų | 48 | 59.2 Ų | 59.2 | 34% | 0.336 | 32% | 0.321 | S | S | . | . | trans | -63.3 | 142.6 | 171.7 | 167.2 | 0 | 0 | 0 | 0 | 110.5 | R203 T204 T205 | S201-R203 PolarHBondContact O-N 3.44Å; S201-R203 PolarHBondContact OG-N 2.63Å; S201-T204 PolarHBondContact O-N 2.96Å; S201-T205 PolarHBondContact O-N 3.31Å; S201-T205 PolarHBondContact O-OG1 3.45Å | ||
| 202 | P | 80.8 | Confident | 86.8 | Confident | 29 Ų | 29 | 56.2 Ų | 56.2 | 19% | 0.188 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -49.6 | -35.6 | 175.2 | -28.3 | 33.1 | 0 | 0 | 0 | 113.3 | I196 T204 T205 L206 | I196-P202 HydrophobicContact CD1-CB 4.3Å; I196-P202 HydrophobicContact CD1-CG 3.87Å; P202-T204 PolarHBondContact O-N 2.72Å; P202-T205 PolarHBondContact O-N 3.39Å; P202-L206 VanDerWaalsContact O-CG 3.31Å; P202-L206 WeakPolarHBondContact O-CG 3.19Å; P202-L206 PolarHBondContact O-N 3.18Å |
| 203 | R | 86.3 | Confident | 87.3 | Confident | 127 Ų | 127 | 55.9 Ų | 55.9 | 48% | 0.479 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.6 | -49.3 | 175.9 | -177.5 | 173.6 | -174.4 | -172.6 | 0.2 | 112.1 | S136 S201 L207 | S136-R203 WeakPolarHBondContact O-CG 3.26Å; S136-R203 VanDerWaalsContact OG-CG 3.27Å; S136-R203 WeakPolarHBondContact OG-CG 3.24Å; S136-R203 PolarHBondContact OG-O 2.73Å; S201-R203 PolarHBondContact O-N 3.44Å; S201-R203 PolarHBondContact OG-N 2.63Å; R203-L207 HydrophobicContact CG-CD1 4.43Å; R203-L207 WeakPolarHBondContact O-CG 3.13Å; R203-L207 PolarHBondContact O-N 3.28Å |
| 204 | T | 87.8 | Confident | 88 | Confident | 61 Ų | 61 | 60 Ų | 60 | 37% | 0.374 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -69.3 | -40.7 | -179.1 | -51.6 | 0 | 0 | 0 | 0 | 110.4 | L200 S201 P202 L206 L207 I208 | L200-T204 HydrophobicContact CD2-CG2 4.11Å; S201-T204 PolarHBondContact O-N 2.96Å; P202-T204 PolarHBondContact O-N 2.72Å; T204-L206 PolarHBondContact O-N 2.8Å; T204-L207 PolarHBondContact O-N 3.28Å; T204-I208 HydrophobicContact CG2-CD1 4.09Å; T204-I208 WeakPolarHBondContact O-CG1 3.37Å; T204-I208 PolarHBondContact O-N 2.96Å |
| 205 | T | 88.3 | Confident | 88.4 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -56.1 | -49.6 | 175.7 | -60.5 | 0 | 0 | 0 | 0 | 111.8 | Y192 L195 S201 P202 L207 I208 M209 | Y192-T205 HydrophobicContact CD2-CG2 3.7Å; Y192-T205 HydrophobicContact CE2-CG2 4.06Å; L195-T205 HydrophobicContact CB-CG2 3.76Å; L195-T205 HydrophobicContact CD1-CG2 3.78Å; L195-T205 HydrophobicContact CG-CG2 4.42Å; S201-T205 PolarHBondContact O-N 3.31Å; S201-T205 PolarHBondContact O-OG1 3.45Å; P202-T205 PolarHBondContact O-N 3.39Å; T205-L207 VanDerWaalsContact C-N 3.33Å; T205-L207 PolarHBondContact O-N 3.23Å; T205-I208 PolarHBondContact O-N 3.06Å; T205-M209 HydrophobicContact CG2-CE 3.88Å; T205-M209 HydrophobicContact CG2-SD 4.26Å; T205-M209 WeakPolarHBondContact O-CG 3.29Å; T205-M209 PolarHBondContact O-N 2.85Å |
| 206 | L | 88.5 | Confident | 88.7 | Confident | 3 Ų | 3 | 58.4 Ų | 58.4 | 2% | 0.016 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.5 | -33.9 | 178.2 | -65.5 | 176.1 | 0 | 0 | 0 | 112.8 | V43 M44 F132 V135 P202 T204 M209 L210 | V43-L206 HydrophobicContact CG1-CD2 3.66Å; M44-L206 HydrophobicContact CE-CD2 3.96Å; F132-L206 HydrophobicContact CD1-CB 4.49Å; F132-L206 HydrophobicContact CD1-CD2 4.02Å; F132-L206 HydrophobicContact CE1-CD2 4.23Å; V135-L206 HydrophobicContact CB-CD1 4.06Å; V135-L206 HydrophobicContact CG1-CD1 3.54Å; P202-L206 VanDerWaalsContact O-CG 3.31Å; P202-L206 WeakPolarHBondContact O-CG 3.19Å; P202-L206 PolarHBondContact O-N 3.18Å; T204-L206 PolarHBondContact O-N 2.8Å; L206-M209 PolarHBondContact O-N 3.34Å; L206-L210 PolarHBondContact O-N 3.27Å |
| 207 | L | 90.8 | Very high | 89.2 | Confident | 66 Ų | 66 | 58.2 Ų | 58.2 | 35% | 0.346 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -68.1 | -38.6 | 174.9 | -70.8 | 170.1 | 0 | 0 | 0 | 112.2 | L133 S136 F137 R203 T204 T205 M209 L210 | L133-L207 HydrophobicContact CD2-CD2 4.16Å; S136-L207 WeakPolarHBondContact OG-CG 3.45Å; F137-L207 HydrophobicContact CE2-CD2 4.01Å; F137-L207 HydrophobicContact CZ-CD2 4.35Å; R203-L207 HydrophobicContact CG-CD1 4.43Å; R203-L207 WeakPolarHBondContact O-CG 3.13Å; R203-L207 PolarHBondContact O-N 3.28Å; T204-L207 PolarHBondContact O-N 3.28Å; T205-L207 VanDerWaalsContact C-N 3.33Å; T205-L207 PolarHBondContact O-N 3.23Å; L207-M209 VanDerWaalsContact C-N 3.3Å; L207-L210 WeakPolarHBondContact O-CB 3.32Å; L207-L210 PolarHBondContact O-N 3.04Å |
| 208 | I | 91.4 | Very high | 89.6 | Confident | 83 Ų | 83 | 54 Ų | 54 | 43% | 0.426 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 174.4 | -68.5 | 165.4 | 0 | 0 | 0 | 109.9 | L200 T204 T205 L210 I211 | L200-I208 HydrophobicContact CD1-CD1 4.33Å; T204-I208 HydrophobicContact CG2-CD1 4.09Å; T204-I208 WeakPolarHBondContact O-CG1 3.37Å; T204-I208 PolarHBondContact O-N 2.96Å; T205-I208 PolarHBondContact O-N 3.06Å; I208-L210 PolarHBondContact O-N 3.41Å; I208-I211 WeakPolarHBondContact O-CG2 3.32Å; I208-I211 PolarHBondContact O-N 2.85Å |
| 209 | M | 91.4 | Very high | 89.8 | Confident | 1 Ų | 1 | 50.9 Ų | 50.9 | 1% | 0.005 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.7 | -11.5 | 179.1 | -70.7 | 178.8 | 173.9 | 0 | 0 | 114.3 | F39 V43 F132 L191 Y192 L195 T205 L206 L207 I211 V212 | F39-M209 HydrophobicContact CE1-CB 4.07Å; F39-M209 HydrophobicContact CE1-CG 3.95Å; F39-M209 HydrophobicContact CE1-SD 3.86Å; F39-M209 HydrophobicContact CZ-CE 4.21Å; F39-M209 HydrophobicContact CZ-CG 4.27Å; F39-M209 HydrophobicContact CZ-SD 4.14Å; V43-M209 HydrophobicContact CB-SD 4.37Å; V43-M209 HydrophobicContact CG1-SD 3.68Å; V43-M209 HydrophobicContact CG2-CE 4.27Å; V43-M209 HydrophobicContact CG2-SD 3.79Å; F132-M209 HydrophobicContact CE1-CB 4.25Å; F132-M209 HydrophobicContact CZ-CB 4.35Å; L191-M209 HydrophobicContact CB-CE 4.05Å; L191-M209 HydrophobicContact CD2-CE 4.1Å; L191-M209 HydrophobicContact CD2-CG 4.5Å; L191-M209 HydrophobicContact CG-CE 3.83Å; Y192-M209 VanDerWaalsContact CA-CE 3.43Å; Y192-M209 HydrophobicContact CD2-CE 4.25Å; Y192-M209 VanDerWaalsContact N-CE 3.35Å; L195-M209 HydrophobicContact CD1-CE 4.02Å; T205-M209 HydrophobicContact CG2-CE 3.88Å; T205-M209 HydrophobicContact CG2-SD 4.26Å; T205-M209 WeakPolarHBondContact O-CG 3.29Å; T205-M209 PolarHBondContact O-N 2.85Å; L206-M209 PolarHBondContact O-N 3.34Å; L207-M209 VanDerWaalsContact C-N 3.3Å; M209-I211 PolarHBondContact O-N 2.69Å; M209-V212 WeakPolarHBondContact O-CB 3.25Å; M209-V212 WeakPolarHBondContact O-CG2 3.32Å; M209-V212 PolarHBondContact O-N 3.29Å |
| 210 | L | 92.7 | Very high | 90 | Very high | 35 Ų | 35 | 44.1 Ų | 44.1 | 18% | 0.183 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -17.4 | 173.2 | -168 | 65.9 | 0 | 0 | 0 | 112.9 | A129 F132 L133 L206 L207 I208 V212 P213 F214 | A129-L210 HydrophobicContact CB-CD1 3.89Å; F132-L210 HydrophobicContact CB-CD1 4.08Å; F132-L210 HydrophobicContact CD2-CD1 4.46Å; L133-L210 HydrophobicContact CD2-CD2 4.08Å; L133-L210 HydrophobicContact CG-CD1 4.36Å; L206-L210 PolarHBondContact O-N 3.27Å; L207-L210 WeakPolarHBondContact O-CB 3.32Å; L207-L210 PolarHBondContact O-N 3.04Å; I208-L210 PolarHBondContact O-N 3.41Å; L210-V212 PolarHBondContact O-N 3.07Å; L210-P213 WeakPolarHBondContact O-CD 3.31Å; L210-F214 HydrophobicContact CD2-CE2 4.36Å; L210-F214 HydrophobicContact CG-CE2 4.01Å; L210-F214 WeakPolarHBondContact O-CD2 3.36Å |
| 211 | I | 94.1 | Very high | 89.9 | Confident | 121 Ų | 121 | 46.6 Ų | 46.6 | 62% | 0.621 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -60.1 | -26.9 | 171.6 | -162.4 | 167 | 0 | 0 | 0 | 112.8 | I208 M209 F214 A215 | I208-I211 WeakPolarHBondContact O-CG2 3.32Å; I208-I211 PolarHBondContact O-N 2.85Å; M209-I211 PolarHBondContact O-N 2.69Å; I211-F214 PolarHBondContact O-N 3.4Å; I211-A215 PolarHBondContact O-N 3.37Å |
| 212 | V | 93.9 | Very high | 89.9 | Confident | 15 Ų | 15 | 52.5 Ų | 52.5 | 9% | 0.091 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -69.6 | -47.4 | -172.7 | 178.2 | 0 | 0 | 0 | 0 | 113 | C36 F39 M209 L210 F214 A215 M216 | C36-V212 HydrophobicContact CB-CG1 3.72Å; F39-V212 HydrophobicContact CB-CG1 3.73Å; F39-V212 HydrophobicContact CD1-CB 4Å; F39-V212 HydrophobicContact CD1-CG1 3.82Å; F39-V212 HydrophobicContact CD1-CG2 3.81Å; F39-V212 HydrophobicContact CE1-CB 4.44Å; F39-V212 HydrophobicContact CE1-CG2 3.81Å; F39-V212 HydrophobicContact CG-CB 4.4Å; F39-V212 HydrophobicContact CG-CG1 3.76Å; F39-V212 HydrophobicContact CG-CG2 4.23Å; F39-V212 HydrophobicContact CZ-CG2 4.23Å; M209-V212 WeakPolarHBondContact O-CB 3.25Å; M209-V212 WeakPolarHBondContact O-CG2 3.32Å; M209-V212 PolarHBondContact O-N 3.29Å; L210-V212 PolarHBondContact O-N 3.07Å; V212-F214 VanDerWaalsContact C-N 3.25Å; V212-F214 PolarHBondContact O-N 3.44Å; V212-A215 WeakPolarHBondContact O-CB 3.5Å; V212-A215 PolarHBondContact O-N 3.47Å; V212-A215 VanDerWaalsContact O-N 3.11Å; V212-M216 PolarHBondContact O-N 3.01Å |
| 213 | P | 92.9 | Very high | 89.9 | Confident | 5 Ų | 5 | 53.9 Ų | 53.9 | 3% | 0.032 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -54.8 | -38.5 | 170.5 | -27.9 | 31.8 | 0 | 0 | 0 | 113.7 | V125 A128 A129 F132 L210 M216 L217 | V125-P213 HydrophobicContact CG1-CB 4.1Å; A128-P213 HydrophobicContact CB-CB 4.16Å; A128-P213 HydrophobicContact CB-CG 3.83Å; A129-P213 HydrophobicContact CB-CB 4.38Å; F132-P213 HydrophobicContact CD2-CG 3.92Å; F132-P213 HydrophobicContact CE2-CG 3.92Å; L210-P213 WeakPolarHBondContact O-CD 3.31Å; P213-M216 VanDerWaalsContact O-CB 3.3Å; P213-M216 WeakPolarHBondContact O-CB 3.32Å; P213-M216 PolarHBondContact O-N 3.01Å; P213-L217 PolarHBondContact O-N 3.45Å; P213-L217 VanDerWaalsContact O-N 3.11Å |
| 214 | F | 92.6 | Very high | 89.6 | Confident | 114 Ų | 114 | 48.4 Ų | 48.4 | 50% | 0.5 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -71.4 | -34.3 | 176.4 | -65.7 | -66.7 | 0 | 0 | 0 | 112.4 | L210 I211 V212 M216 L217 A218 | L210-F214 HydrophobicContact CD2-CE2 4.36Å; L210-F214 HydrophobicContact CG-CE2 4.01Å; L210-F214 WeakPolarHBondContact O-CD2 3.36Å; I211-F214 PolarHBondContact O-N 3.4Å; V212-F214 VanDerWaalsContact C-N 3.25Å; V212-F214 PolarHBondContact O-N 3.44Å; F214-M216 VanDerWaalsContact C-N 3.3Å; F214-M216 PolarHBondContact O-N 3.42Å; F214-L217 WeakPolarHBondContact O-CB 3.41Å; F214-L217 PolarHBondContact O-N 2.87Å; F214-A218 WeakPolarHBondContact O-CB 3.47Å; F214-A218 PolarHBondContact O-N 3.37Å |
| 215 | A | 93.1 | Very high | 89 | Confident | 32 Ų | 32 | 47.2 Ų | 47.2 | 26% | 0.264 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.5 | -36.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | I211 V212 A218 S219 | I211-A215 PolarHBondContact O-N 3.37Å; V212-A215 WeakPolarHBondContact O-CB 3.5Å; V212-A215 PolarHBondContact O-N 3.47Å; V212-A215 VanDerWaalsContact O-N 3.11Å; A215-A218 PolarHBondContact O-N 2.71Å; A215-S219 WeakPolarHBondContact O-CB 3.49Å; A215-S219 PolarHBondContact O-N 3.29Å |
| 216 | M | 92.6 | Very high | 87.9 | Confident | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.01 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 172 | -167.5 | 168.6 | 67.3 | 0 | 0 | 111.4 | L33 C36 N37 C124 V125 F162 V212 P213 F214 S219 Y220 | L33-M216 HydrophobicContact CD2-CG 3.87Å; L33-M216 WeakPolarHBondContact CD2-O 3.31Å; C36-M216 HydrophobicContact CB-CB 3.6Å; C36-M216 HydrophobicContact CB-CG 4.02Å; C36-M216 HydrophobicContact CB-SD 4.3Å; N37-M216 HydrophobicContact CB-SD 4.41Å; C124-M216 HydrophobicContact CB-CE 3.94Å; V125-M216 HydrophobicContact CB-CE 4.14Å; V125-M216 HydrophobicContact CG2-CB 4.4Å; V125-M216 HydrophobicContact CG2-CE 3.36Å; F162-M216 HydrophobicContact CE2-SD 4.08Å; F162-M216 HydrophobicContact CZ-CG 4.31Å; F162-M216 HydrophobicContact CZ-SD 4.2Å; V212-M216 PolarHBondContact O-N 3.01Å; P213-M216 VanDerWaalsContact O-CB 3.3Å; P213-M216 WeakPolarHBondContact O-CB 3.32Å; P213-M216 PolarHBondContact O-N 3.01Å; F214-M216 VanDerWaalsContact C-N 3.3Å; F214-M216 PolarHBondContact O-N 3.42Å; M216-S219 WeakPolarHBondContact O-CB 3.46Å; M216-S219 PolarHBondContact O-N 2.93Å; M216-Y220 PolarHBondContact O-N 3.5Å; M216-Y220 VanDerWaalsContact O-N 3.14Å |
| 217 | L | 91.9 | Very high | 86.5 | Confident | 47 Ų | 47 | 54 Ų | 54 | 25% | 0.246 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.5 | -46.8 | 177 | -170.2 | 70.8 | 0 | 0 | 0 | 111.2 | L122 V125 P213 F214 S219 Y220 F221 | L122-L217 HydrophobicContact CD1-CD1 4.34Å; V125-L217 HydrophobicContact CG1-CB 4.41Å; V125-L217 HydrophobicContact CG2-CB 4.01Å; V125-L217 HydrophobicContact CG2-CD1 4.12Å; P213-L217 PolarHBondContact O-N 3.45Å; P213-L217 VanDerWaalsContact O-N 3.11Å; F214-L217 WeakPolarHBondContact O-CB 3.41Å; F214-L217 PolarHBondContact O-N 2.87Å; L217-S219 VanDerWaalsContact C-N 3.32Å; L217-S219 PolarHBondContact O-N 3.05Å; L217-Y220 PolarHBondContact O-N 3.36Å; L217-F221 HydrophobicContact CD1-CD2 3.63Å; L217-F221 HydrophobicContact CD1-CE2 3.44Å; L217-F221 VanDerWaalsContact CD1-CE2 3.44Å; L217-F221 HydrophobicContact CG-CD2 3.98Å; L217-F221 HydrophobicContact CG-CE2 4.28Å; L217-F221 WeakPolarHBondContact O-CD2 3.5Å; L217-F221 PolarHBondContact O-N 3.07Å |
| 218 | A | 90.4 | Very high | 84.5 | Confident | 41 Ų | 41 | 56.8 Ų | 56.8 | 34% | 0.339 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.5 | -38.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112 | F214 A215 Y220 F222 L223 | F214-A218 WeakPolarHBondContact O-CB 3.47Å; F214-A218 PolarHBondContact O-N 3.37Å; A215-A218 PolarHBondContact O-N 2.71Å; A218-Y220 PolarHBondContact O-N 3.06Å; A218-F222 HydrophobicContact CB-CD2 4.08Å; A218-F222 WeakPolarHBondContact O-CA 3.43Å; A218-F222 WeakPolarHBondContact O-CB 3.35Å; A218-F222 PolarHBondContact O-N 2.96Å; A218-L223 PolarHBondContact O-N 2.99Å |
| 219 | S | 90.3 | Very high | 82.6 | Confident | 1 Ų | 1 | 56.2 Ų | 56.2 | 1% | 0.007 | 30% | 0.304 | C | S | . | . | I | π-helix | trans | -59.3 | -47.4 | 175 | -166.2 | 0 | 0 | 0 | 0 | 111.7 | G29 A215 M216 L217 L223 L224 | G29-S219 WeakPolarHBondContact CA-OG 3.49Å; G29-S219 PolarHBondContact O-OG 2.92Å; A215-S219 WeakPolarHBondContact O-CB 3.49Å; A215-S219 PolarHBondContact O-N 3.29Å; M216-S219 WeakPolarHBondContact O-CB 3.46Å; M216-S219 PolarHBondContact O-N 2.93Å; L217-S219 VanDerWaalsContact C-N 3.32Å; L217-S219 PolarHBondContact O-N 3.05Å; S219-L223 CarbonylContact O-C 3.6Å; S219-L223 WeakPolarHBondContact O-CA 3.28Å; S219-L223 WeakPolarHBondContact O-CB 3.25Å; S219-L223 PolarHBondContact O-N 3.06Å; S219-L223 VanDerWaalsContact O-N 3.11Å; S219-L224 VanDerWaalsContact O-CD1 3.27Å; S219-L224 WeakPolarHBondContact O-CD1 3.23Å; S219-L224 PolarHBondContact O-N 2.95Å |
| 220 | Y | 88.7 | Confident | 81 | Confident | 38 Ų | 38 | 57.2 Ų | 57.2 | 15% | 0.149 | 31% | 0.31 | C | S | . | . | I | π-helix | trans | -66.7 | -45.9 | -178 | -176.3 | -101.3 | 0 | 0 | 0 | 113.1 | Y117 G118 V121 F162 L165 M216 L217 A218 L224 | Y117-Y220 VanDerWaalsContact CB-OH 3.29Å; Y117-Y220 WeakPolarHBondContact CB-OH 3.27Å; G118-Y220 PolarHBondContact N-OH 3.32Å; V121-Y220 HydrophobicContact CB-CD1 4.32Å; V121-Y220 HydrophobicContact CB-CG 4.33Å; V121-Y220 HydrophobicContact CG1-CD1 4.17Å; V121-Y220 HydrophobicContact CG1-CD2 4.46Å; V121-Y220 HydrophobicContact CG1-CG 3.94Å; V121-Y220 HydrophobicContact CG2-CD1 4.38Å; V121-Y220 HydrophobicContact CG2-CD2 3.83Å; V121-Y220 HydrophobicContact CG2-CE1 4.43Å; V121-Y220 HydrophobicContact CG2-CE2 3.89Å; V121-Y220 HydrophobicContact CG2-CG 4.08Å; F162-Y220 HydrophobicContact CE1-CD2 4.48Å; L165-Y220 HydrophobicContact CD2-CD2 4.29Å; L165-Y220 HydrophobicContact CD2-CE2 3.82Å; M216-Y220 PolarHBondContact O-N 3.5Å; M216-Y220 VanDerWaalsContact O-N 3.14Å; L217-Y220 PolarHBondContact O-N 3.36Å; A218-Y220 PolarHBondContact O-N 3.06Å; Y220-L224 HydrophobicContact CD2-CD2 4.43Å |
| 221 | F | 85.8 | Confident | 79.1 | Confident | 110 Ų | 110 | 60 Ų | 60 | 48% | 0.482 | 33% | 0.33 | S | S | . | . | I | π-helix | trans | -86.9 | -33.3 | -173.5 | -77.3 | -74.6 | 0 | 0 | 0 | 114.3 | L217 | L217-F221 HydrophobicContact CD1-CD2 3.63Å; L217-F221 HydrophobicContact CD1-CE2 3.44Å; L217-F221 VanDerWaalsContact CD1-CE2 3.44Å; L217-F221 HydrophobicContact CG-CD2 3.98Å; L217-F221 HydrophobicContact CG-CE2 4.28Å; L217-F221 WeakPolarHBondContact O-CD2 3.5Å; L217-F221 PolarHBondContact O-N 3.07Å |
| 222 | F | 84.4 | Confident | 76.9 | Confident | 171 Ų | 171 | 60.4 Ų | 60.4 | 75% | 0.75 | 33% | 0.329 | S | S | * | . | I | π-helix | trans | -107.9 | -28.7 | -174.2 | -58.3 | -67 | 0 | 0 | 0 | 113.6 | A218 | A218-F222 HydrophobicContact CB-CD2 4.08Å; A218-F222 WeakPolarHBondContact O-CA 3.43Å; A218-F222 WeakPolarHBondContact O-CB 3.35Å; A218-F222 PolarHBondContact O-N 2.96Å |
| 223 | L | 79.7 | Confident | 74.4 | Confident | 58 Ų | 58 | 68.9 Ų | 68.9 | 30% | 0.304 | 36% | 0.36 | S | S | . | . | I | π-helix | trans | -95.9 | -42.5 | -174.6 | -145.9 | 114.2 | 0 | 0 | 0 | 112.2 | R25 W28 A218 S219 | R25-L223 WeakPolarHBondContact CD-O 3.3Å; R25-L223 HydrophobicContact CG-CG 4.34Å; R25-L223 WeakPolarHBondContact CG-O 3.29Å; R25-L223 WeakPolarHBondContact O-CD2 3.41Å; W28-L223 HydrophobicContact CB-CD2 3.89Å; A218-L223 PolarHBondContact O-N 2.99Å; S219-L223 CarbonylContact O-C 3.6Å; S219-L223 WeakPolarHBondContact O-CA 3.28Å; S219-L223 WeakPolarHBondContact O-CB 3.25Å; S219-L223 PolarHBondContact O-N 3.06Å; S219-L223 VanDerWaalsContact O-N 3.11Å |
| 224 | L | 81.4 | Confident | 71.3 | Confident | 13 Ų | 13 | 73.1 Ų | 73.1 | 7% | 0.068 | 39% | 0.389 | C | S | . | . | S | Bend | trans | -70.1 | 134.4 | 175 | -87.7 | 74.7 | 0 | 0 | 0 | 110.8 | F30 L33 L165 F169 S219 Y220 P226 | F30-L224 HydrophobicContact CD2-CD2 4.22Å; F30-L224 HydrophobicContact CE2-CD2 3.7Å; F30-L224 HydrophobicContact CE2-CG 4.36Å; F30-L224 HydrophobicContact CZ-CD2 4.28Å; L33-L224 HydrophobicContact CD1-CD1 3.62Å; L33-L224 HydrophobicContact CD1-CD2 4Å; L33-L224 HydrophobicContact CD1-CG 4.5Å; L33-L224 HydrophobicContact CG-CD1 4.34Å; L165-L224 HydrophobicContact CD2-CD2 3.84Å; F169-L224 HydrophobicContact CE2-CD2 4.23Å; F169-L224 HydrophobicContact CZ-CD2 3.96Å; F169-L224 HydrophobicContact CZ-CG 4.49Å; S219-L224 VanDerWaalsContact O-CD1 3.27Å; S219-L224 WeakPolarHBondContact O-CD1 3.23Å; S219-L224 PolarHBondContact O-N 2.95Å; Y220-L224 HydrophobicContact CD2-CD2 4.43Å; L224-P226 WeakPolarHBondContact O-CD 3.41Å |
| 225 | V | 73.6 | Confident | 68.2 | Low | 35 Ų | 35 | 78.1 Ų | 78.1 | 21% | 0.212 | 41% | 0.405 | C | S | . | . | P | Polyproline II helix | trans | -89.9 | 116.6 | 170.8 | -163.2 | 0 | 0 | 0 | 0 | 107.6 | V22 N26 F169 E227 | V22-V225 HydrophobicContact CG1-CB 4.4Å; V22-V225 HydrophobicContact CG1-CG2 4.1Å; N26-V225 WeakPolarHBondContact OD1-CG2 3.13Å; N26-V225 PolarHBondContact OD1-N 3.33Å; F169-V225 VanDerWaalsContact CE1-O 3.26Å; F169-V225 WeakPolarHBondContact CE1-O 3.23Å; V225-E227 PolarHBondContact O-N 2.99Å; V225-E227 VanDerWaalsContact O-N 3.13Å |
| 226 | P | 65.8 | Low | 65 | Low | 79 Ų | 79 | 81.2 Ų | 81.2 | 51% | 0.513 | 43% | 0.425 | S | S | . | . | P | Polyproline II helix | trans | -61.3 | 119.5 | 177.5 | -19.7 | 31.4 | 0 | 0 | 0 | 110 | L224 L230 | L224-P226 WeakPolarHBondContact O-CD 3.41Å; P226-L230 HydrophobicContact CB-CD1 4.17Å |
| 227 | E | 58.5 | Low | 61.9 | Low | 67 Ų | 67 | 89 Ų | 89 | 31% | 0.313 | 46% | 0.461 | S | S | . | . | P | Polyproline II helix | trans | -70.4 | 141.5 | 170.7 | -156.2 | 92.7 | -137.5 | 0 | 0 | 108.3 | V225 S229 L230 | V225-E227 PolarHBondContact O-N 2.99Å; V225-E227 VanDerWaalsContact O-N 3.13Å; E227-S229 PolarHBondContact O-N 3.43Å; E227-L230 WeakPolarHBondContact O-CB 3.35Å; E227-L230 PolarHBondContact O-N 2.95Å |
| 228 | P | 49.7 | Very low | 59.1 | Low | 124 Ų | 124 | 92.1 Ų | 92.1 | 81% | 0.805 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -16.1 | -179.1 | -24.3 | 33.3 | 0 | 0 | 0 | 114.9 | ||
| 229 | S | 50.8 | Low | 55.9 | Low | 71 Ų | 71 | 98 Ų | 98 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | -7.4 | 178.9 | 56.5 | 0 | 0 | 0 | 0 | 114.1 | E227 | E227-S229 PolarHBondContact O-N 3.43Š|
| 230 | L | 57.3 | Low | 52.9 | Low | 22 Ų | 22 | 103.1 Ų | 103.1 | 12% | 0.115 | 54% | 0.537 | C | S | . | . | S | Bend | trans | -68.6 | 131.5 | 170.2 | -69.6 | 170 | 0 | 0 | 0 | 108.1 | L165 F168 F169 P226 E227 Q232 | L165-L230 HydrophobicContact CD1-CD2 3.46Å; L165-L230 VanDerWaalsContact CD1-CD2 3.46Å; F168-L230 HydrophobicContact CB-CD2 3.77Å; F168-L230 HydrophobicContact CB-CG 4.36Å; F168-L230 HydrophobicContact CD1-CD2 4.24Å; F168-L230 HydrophobicContact CD2-CD2 3.61Å; F168-L230 HydrophobicContact CE2-CD2 4.29Å; F168-L230 HydrophobicContact CG-CD2 3.59Å; F168-L230 HydrophobicContact CG-CG 4.46Å; F169-L230 HydrophobicContact CE2-CD1 4.49Å; F169-L230 HydrophobicContact CZ-CD1 4.36Å; P226-L230 HydrophobicContact CB-CD1 4.17Å; E227-L230 WeakPolarHBondContact O-CB 3.35Å; E227-L230 PolarHBondContact O-N 2.95Å; L230-Q232 PolarHBondContact O-N 3.47Å |
| 231 | P | 54.1 | Low | 50.1 | Low | 93 Ų | 93 | 106.2 Ų | 106.2 | 60% | 0.604 | 56% | 0.562 | S | S | * | * | trans | -62.2 | 90.8 | 164.6 | 24.1 | -29.6 | 0 | 0 | 0 | 107.2 | ||||
| 232 | Q | 47 | Very low | 47.4 | Very low | 131 Ų | 131 | 107 Ų | 107 | 61% | 0.612 | 58% | 0.578 | S | S | * | * | trans | -64.5 | 155 | 179.3 | -82.2 | -176.8 | -3.2 | 0 | 0 | 108.4 | L230 S234 | L230-Q232 PolarHBondContact O-N 3.47Å; Q232-S234 PolarHBondContact O-N 3.01Å | ||
| 233 | W | 41 | Very low | 45.1 | Very low | 193 Ų | 193 | 105 Ų | 105 | 73% | 0.731 | 58% | 0.579 | S | S | * | * | trans | -62.6 | 80.4 | 164 | -178.9 | -7.4 | 0 | 0 | 0 | 108.5 | ||||
| 234 | S | 28.9 | Very low | 42.7 | Very low | 94 Ų | 94 | 107.4 Ų | 107.4 | 66% | 0.657 | 59% | 0.593 | S | S | * | * | trans | -79.7 | 118.4 | 159.1 | -178.6 | 0 | 0 | 0 | 0 | 106.4 | Q232 S236 | Q232-S234 PolarHBondContact O-N 3.01Å; S234-S236 PolarHBondContact O-N 3.25Å; S234-S236 VanDerWaalsContact O-N 3.15Å | ||
| 235 | R | 26.7 | Very low | 40.6 | Very low | 218 Ų | 218 | 111.6 Ų | 111.6 | 82% | 0.823 | 62% | 0.623 | S | S | * | * | trans | -56.3 | 118 | 161.2 | -156.2 | -179.7 | -169.8 | 178.7 | 1.2 | 104.4 | E237 | R235-E237 VanDerWaalsContact C-N 3.31Å; R235-E237 PolarHBondContact O-N 3.03Å | ||
| 236 | S | 26.2 | Very low | 38.9 | Very low | 98 Ų | 98 | 115.9 Ų | 115.9 | 69% | 0.685 | 64% | 0.641 | S | S | * | * | trans | -45.6 | 94.5 | 178 | -179.9 | 0 | 0 | 0 | 0 | 110.5 | S234 T238 | S234-S236 PolarHBondContact O-N 3.25Å; S234-S236 VanDerWaalsContact O-N 3.15Å; S236-T238 VanDerWaalsContact C-N 3.28Å; S236-T238 PolarHBondContact O-N 3.38Å; S236-T238 PolarHBondContact OG-OG1 2.82Å | ||
| 237 | E | 28.7 | Very low | 37.4 | Very low | 165 Ų | 165 | 119.1 Ų | 119.1 | 77% | 0.771 | 65% | 0.649 | S | S | * | * | trans | -78.2 | 96.4 | 152.6 | -80.8 | -174.3 | 160.9 | 0 | 0 | 104.4 | R235 E239 | R235-E237 VanDerWaalsContact C-N 3.31Å; R235-E237 PolarHBondContact O-N 3.03Å; E237-E239 PolarHBondContact O-N 3.35Å | ||
| 238 | T | 31.7 | Very low | 36.2 | Very low | 112 Ų | 112 | 126.6 Ų | 126.6 | 69% | 0.687 | 67% | 0.674 | S | S | * | * | trans | -64.3 | 77 | 160.1 | -53.8 | 0 | 0 | 0 | 0 | 107.1 | S236 | S236-T238 VanDerWaalsContact C-N 3.28Å; S236-T238 PolarHBondContact O-N 3.38Å; S236-T238 PolarHBondContact OG-OG1 2.82Å | ||
| 239 | E | 24.7 | Very low | 35.4 | Very low | 165 Ų | 165 | 127.6 Ų | 127.6 | 77% | 0.771 | 67% | 0.669 | S | S | * | * | trans | -99.1 | 90.6 | 156.4 | -77.9 | -171.2 | 143.3 | 0 | 0 | 106.6 | E237 P241 | E237-E239 PolarHBondContact O-N 3.35Å; E239-P241 WeakPolarHBondContact O-CD 3.27Å | ||
| 240 | C | 26 | Very low | 34.6 | Very low | 108 Ų | 108 | 132.5 Ų | 132.5 | 73% | 0.73 | 68% | 0.676 | S | S | * | * | trans | -56.8 | 122 | 154.5 | -73 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 241 | P | 29.5 | Very low | 33.6 | Very low | 103 Ų | 103 | 137.7 Ų | 137.7 | 67% | 0.669 | 70% | 0.703 | S | S | * | * | trans | -61 | 140.6 | 167.3 | 25.9 | -30.2 | 0 | 0 | 0 | 107.6 | E239 V243 | E239-P241 WeakPolarHBondContact O-CD 3.27Å; P241-V243 PolarHBondContact O-N 3.06Å | ||
| 242 | P | 30.9 | Very low | 32.7 | Very low | 127 Ų | 127 | 140.7 Ų | 140.7 | 83% | 0.825 | 71% | 0.711 | S | S | * | * | trans | -64.9 | 109.2 | 174.5 | 27.6 | -29.7 | 0 | 0 | 0 | 106.6 | D244 | P242-D244 PolarHBondContact O-N 2.96Å; P242-D244 VanDerWaalsContact O-N 3.1Å | ||
| 243 | V | 34.8 | Very low | 32.2 | Very low | 128 Ų | 128 | 141.3 Ų | 141.3 | 78% | 0.776 | 72% | 0.719 | S | S | * | * | trans | -68.2 | 108.8 | 167.8 | 175.2 | 0 | 0 | 0 | 0 | 105.7 | P241 S245 | P241-V243 PolarHBondContact O-N 3.06Å; V243-S245 PolarHBondContact O-N 2.87Å | ||
| 244 | D | 29.6 | Very low | 31.9 | Very low | 109 Ų | 109 | 139.9 Ų | 139.9 | 58% | 0.583 | 72% | 0.72 | S | S | * | * | trans | -54.2 | 126.7 | 175.9 | -160.3 | 12.5 | 0 | 0 | 0 | 109.1 | P242 E246 | P242-D244 PolarHBondContact O-N 2.96Å; P242-D244 VanDerWaalsContact O-N 3.1Å; D244-E246 PolarHBondContact O-N 3Å; D244-E246 VanDerWaalsContact O-N 3.09Å | ||
| 245 | S | 37.2 | Very low | 32 | Very low | 101 Ų | 101 | 142.8 Ų | 142.8 | 71% | 0.706 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | 8.9 | -169.4 | -58.1 | 0 | 0 | 0 | 0 | 113 | V243 | V243-S245 PolarHBondContact O-N 2.87Š|
| 246 | E | 38.5 | Very low | 32.5 | Very low | 125 Ų | 125 | 141.4 Ų | 141.4 | 58% | 0.584 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -25 | -173.8 | -63.8 | -166.1 | 161.7 | 0 | 0 | 114.1 | D244 | D244-E246 PolarHBondContact O-N 3Å; D244-E246 VanDerWaalsContact O-N 3.09Å |
| 247 | E | 34.9 | Very low | 32.7 | Very low | 148 Ų | 148 | 143.7 Ų | 143.7 | 69% | 0.692 | 74% | 0.735 | S | S | * | * | H | α-helix | trans | -77 | -22.1 | -179.4 | -77.2 | -170.6 | 145.5 | 0 | 0 | 113.6 | ||
| 248 | R | 32 | Very low | 32.7 | Very low | 223 Ų | 223 | 142.9 Ų | 142.9 | 84% | 0.842 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -79.6 | -21.2 | -179.4 | -134.9 | 179.5 | -174.8 | 178.6 | 1.3 | 113.4 | ||
| 249 | Q | 32.4 | Very low | 32.7 | Very low | 146 Ų | 146 | 145.7 Ų | 145.7 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -81.5 | -33.7 | 178.9 | -153.6 | 96.3 | 6.6 | 0 | 0 | 111.5 | ||
| 250 | R | 34.3 | Very low | 33 | Very low | 174 Ų | 174 | 146.4 Ų | 146.4 | 66% | 0.657 | 75% | 0.749 | S | S | * | * | H | α-helix | trans | -71.1 | -29.8 | -178.2 | -70.8 | -173.5 | 179.6 | 155.8 | 6.1 | 113.9 | M252 | R250-M252 VanDerWaalsContact C-N 3.26Å; R250-M252 PolarHBondContact O-N 3.26Å |
| 251 | L | 36.2 | Very low | 32.9 | Very low | 130 Ų | 130 | 146.9 Ų | 146.9 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | H | α-helix | trans | -76.6 | -7.2 | -179.1 | -75.5 | 164.7 | 0 | 0 | 0 | 114.4 | ||
| 252 | M | 36.7 | Very low | 32.8 | Very low | 156 Ų | 156 | 147.4 Ų | 147.4 | 77% | 0.768 | 76% | 0.755 | S | S | * | * | H | α-helix | trans | -96.7 | -19.9 | 176.6 | -90.1 | -175.1 | 50 | 0 | 0 | 114 | R250 | R250-M252 VanDerWaalsContact C-N 3.26Å; R250-M252 PolarHBondContact O-N 3.26Å |
| 253 | D | 34.8 | Very low | 32.6 | Very low | 145 Ų | 145 | 145.9 Ų | 145.9 | 78% | 0.775 | 75% | 0.753 | S | S | * | * | H | α-helix | trans | -89.6 | -12.1 | -178 | -77.6 | -17.8 | 0 | 0 | 0 | 113.5 | ||
| 254 | E | 34.9 | Very low | 33.1 | Very low | 162 Ų | 162 | 145.6 Ų | 145.6 | 76% | 0.757 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -95.1 | 7.3 | -178.1 | -75 | -176.2 | 126.8 | 0 | 0 | 114.5 | ||
| 255 | L | 32.3 | Very low | 32.9 | Very low | 155 Ų | 155 | 144.9 Ų | 144.9 | 81% | 0.812 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -102.5 | 6.1 | -174.9 | -135.9 | 92.9 | 0 | 0 | 0 | 115.6 | ||
| 256 | E | 35.8 | Very low | 32.6 | Very low | 189 Ų | 189 | 148 Ų | 148 | 88% | 0.883 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -111.8 | -2.5 | -176.1 | -93.4 | -171.6 | 167.6 | 0 | 0 | 117 | ||
| 257 | D | 30.2 | Very low | 32 | Very low | 146 Ų | 146 | 148.3 Ų | 148.3 | 78% | 0.781 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -121.1 | 134 | 175.1 | -98.2 | -22 | 0 | 0 | 0 | 113.5 | ||
| 258 | D | 28.5 | Very low | 31.6 | Very low | 149 Ų | 149 | 147.8 Ų | 147.8 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | 91.9 | 86.7 | 160.4 | -58.4 | -25.1 | 0 | 0 | 0 | 120.1 | ||||
| 259 | L | 33 | Very low | 31.4 | Very low | 170 Ų | 170 | 143.4 Ų | 143.4 | 89% | 0.89 | 79% | 0.787 | S | S | * | * | trans | -55.8 | 138.9 | 140 | -78.4 | 146.3 | 0 | 0 | 0 | 111.4 | ||||
| 260 | E | 29.7 | Very low | 31.1 | Very low | 181 Ų | 181 | 143.3 Ų | 143.3 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | trans | 129.3 | 120 | 145.1 | -69.3 | -161.4 | 166.6 | 0 | 0 | 117.2 | ||||
| 261 | T | 24.9 | Very low | 30.8 | Very low | 117 Ų | 117 | 142 Ų | 142 | 72% | 0.718 | 79% | 0.792 | S | S | * | * | trans | 92.7 | 118.3 | 138.2 | -56.3 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 262 | S | 27 | Very low | 30.7 | Very low | 115 Ų | 115 | 145.6 Ų | 145.6 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | 79.1 | 124.7 | 147 | 59.6 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 263 | A | 27 | Very low | 30.7 | Very low | 94 Ų | 94 | 144.4 Ų | 144.4 | 78% | 0.777 | 80% | 0.798 | S | S | * | * | trans | -87.7 | -174.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 264 | P | 45.8 | Very low | 31 | Very low | 122 Ų | 122 | 146 Ų | 146 | 79% | 0.792 | 80% | 0.803 | S | S | * | * | cis | -131.4 | 158.5 | -28.9 | 31.1 | -13 | 0 | 0 | 0 | 113.4 | ||||
| 265 | A | 24.6 | Very low | 31.6 | Very low | 95 Ų | 95 | 139.9 Ų | 139.9 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | trans | -169.8 | 113.5 | 147.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 266 | L | 31.9 | Very low | 32.9 | Very low | 167 Ų | 167 | 138.3 Ų | 138.3 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | 7.6 | 115.7 | 144.3 | -74.3 | 139.4 | 0 | 0 | 0 | 118.7 | ||||
| 267 | T | 24.8 | Very low | 34.1 | Very low | 130 Ų | 130 | 131.1 Ų | 131.1 | 80% | 0.798 | 75% | 0.751 | S | S | * | * | -169.8 | 95.9 | 116 | 21.5 | 0 | 0 | 0 | 0 | 108.4 | T269 | T267-T269 VanDerWaalsContact C-N 3.31Å; T267-T269 PolarHBondContact O-N 2.82Å; T267-T269 VanDerWaalsContact O-N 3.07Å | |||
| 268 | V | 27.3 | Very low | 36.3 | Very low | 137 Ų | 137 | 127.7 Ų | 127.7 | 83% | 0.83 | 74% | 0.736 | S | S | * | * | trans | -75.7 | 90.4 | 166.1 | -179.9 | 0 | 0 | 0 | 0 | 106.6 | E270 | V268-E270 VanDerWaalsContact C-N 3.31Å; V268-E270 HydrophobicContact CG1-CG 3.85Å; V268-E270 PolarHBondContact O-N 2.78Å | ||
| 269 | T | 26.2 | Very low | 38.3 | Very low | 132 Ų | 132 | 126.5 Ų | 126.5 | 81% | 0.81 | 73% | 0.729 | S | S | * | * | trans | -76.3 | 91.5 | 158.8 | 3 | 0 | 0 | 0 | 0 | 106.7 | T267 D271 | T267-T269 VanDerWaalsContact C-N 3.31Å; T267-T269 PolarHBondContact O-N 2.82Å; T267-T269 VanDerWaalsContact O-N 3.07Å; T269-D271 VanDerWaalsContact C-N 3.29Å; T269-D271 PolarHBondContact O-N 3.14Å | ||
| 270 | E | 28 | Very low | 40.1 | Very low | 143 Ų | 143 | 126.3 Ų | 126.3 | 67% | 0.668 | 72% | 0.723 | S | S | * | * | trans | -63 | 94.1 | 164.1 | -77.7 | -167.9 | 128.9 | 0 | 0 | 108.4 | V268 R272 | V268-E270 VanDerWaalsContact C-N 3.31Å; V268-E270 HydrophobicContact CG1-CG 3.85Å; V268-E270 PolarHBondContact O-N 2.78Å; E270-R272 VanDerWaalsContact C-N 3.26Å; E270-R272 PolarHBondContact O-N 3.36Å | ||
| 271 | D | 26.2 | Very low | 42.4 | Very low | 148 Ų | 148 | 120.9 Ų | 120.9 | 79% | 0.791 | 70% | 0.698 | S | S | * | * | trans | -70.6 | 90.3 | 158.8 | -163.7 | 11 | 0 | 0 | 0 | 107.3 | T269 T273 | T269-D271 VanDerWaalsContact C-N 3.29Å; T269-D271 PolarHBondContact O-N 3.14Å; D271-T273 VanDerWaalsContact C-N 3.28Å; D271-T273 PolarHBondContact O-N 3.37Å; D271-T273 PolarHBondContact O-OG1 3.41Å | ||
| 272 | R | 34.8 | Very low | 44.9 | Very low | 205 Ų | 205 | 116.7 Ų | 116.7 | 77% | 0.774 | 67% | 0.67 | S | S | * | * | trans | -63.5 | 91.8 | 177.4 | -92.3 | -176.5 | 167.3 | 146.2 | 1.2 | 109.2 | E270 M274 | E270-R272 VanDerWaalsContact C-N 3.26Å; E270-R272 PolarHBondContact O-N 3.36Å; R272-M274 PolarHBondContact O-N 2.91Å | ||
| 273 | T | 36.3 | Very low | 47.4 | Very low | 130 Ų | 130 | 117.1 Ų | 117.1 | 80% | 0.798 | 66% | 0.663 | S | S | * | * | trans | -48.7 | 123 | 172.1 | -28.3 | 0 | 0 | 0 | 0 | 109.6 | D271 G275 | D271-T273 VanDerWaalsContact C-N 3.28Å; D271-T273 PolarHBondContact O-N 3.37Å; D271-T273 PolarHBondContact O-OG1 3.41Å; T273-G275 PolarHBondContact O-N 3.44Å | ||
| 274 | M | 42.8 | Very low | 50 | Low | 179 Ų | 179 | 115.8 Ų | 115.8 | 88% | 0.882 | 65% | 0.652 | S | S | * | * | trans | -72 | 71.2 | -176.2 | -158.6 | 156.4 | 77.5 | 0 | 0 | 110.7 | R272 | R272-M274 PolarHBondContact O-N 2.91Š| ||
| 275 | G | 47 | Very low | 51.6 | Low | 33 Ų | 33 | 111.4 Ų | 111.4 | 34% | 0.34 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -84.3 | 165.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | T273 V277 R411 | T273-G275 PolarHBondContact O-N 3.44Å; G275-V277 PolarHBondContact O-N 3.36Å; G275-R411 PolarHBondContact O-NH2 2.83Å |
| 276 | P | 58.8 | Low | 54.4 | Low | 122 Ų | 122 | 109.1 Ų | 109.1 | 79% | 0.792 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 135.2 | 173.9 | 25.1 | -32.1 | 0 | 0 | 0 | 110.8 | T278 | P276-T278 PolarHBondContact O-N 3.02Š|
| 277 | V | 62.1 | Low | 56.8 | Low | 38 Ų | 38 | 109 Ų | 109 | 23% | 0.23 | 59% | 0.591 | C | S | . | * | P | Polyproline II helix | trans | -59.5 | 123.1 | -175 | -176.1 | 0 | 0 | 0 | 0 | 110.8 | G275 E281 K282 Y412 | G275-V277 PolarHBondContact O-N 3.36Å; V277-E281 HydrophobicContact CG1-CB 3.71Å; V277-K282 HydrophobicContact CB-CG 4.45Å; V277-K282 HydrophobicContact CG1-CG 3.7Å; V277-K282 WeakPolarHBondContact O-CE 3.28Å; V277-Y412 HydrophobicContact CB-CE1 4.23Å; V277-Y412 HydrophobicContact CG1-CD1 4.06Å; V277-Y412 HydrophobicContact CG1-CE1 3.51Å; V277-Y412 HydrophobicContact CG2-CD1 4.06Å; V277-Y412 HydrophobicContact CG2-CE1 3.64Å |
| 278 | T | 74.8 | Confident | 59.7 | Low | 74 Ų | 74 | 105.3 Ų | 105.3 | 45% | 0.454 | 58% | 0.579 | S | S | . | * | P | Polyproline II helix | trans | -70.7 | 154.3 | 179.9 | 61.6 | 0 | 0 | 0 | 0 | 111.6 | P276 Q280 E281 K282 | P276-T278 PolarHBondContact O-N 3.02Å; T278-Q280 PolarHBondContact O-N 3.49Å; T278-E281 PolarHBondContact N-OE2 3.43Å; T278-E281 PolarHBondContact O-N 3.21Å; T278-E281 VanDerWaalsContact OG1-CG 3.23Å; T278-E281 WeakPolarHBondContact OG1-CG 3.43Å; T278-E281 PolarHBondContact OG1-N 3.49Å; T278-E281 PolarHBondContact OG1-OE2 3.21Å; T278-K282 WeakPolarHBondContact O-CG 3.48Å; T278-K282 PolarHBondContact O-N 3.38Å |
| 279 | L | 71.4 | Confident | 62.4 | Low | 125 Ų | 125 | 99.3 Ų | 99.3 | 65% | 0.654 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.9 | -31.1 | 179 | -74.3 | 169.9 | 0 | 0 | 0 | 112.8 | F110 K282 L283 | F110-L279 HydrophobicContact CD1-CD2 4.14Å; F110-L279 HydrophobicContact CE1-CD2 4.22Å; L279-K282 PolarHBondContact O-N 2.91Å; L279-L283 WeakPolarHBondContact O-CB 3.38Å; L279-L283 PolarHBondContact O-N 2.79Å |
| 280 | Q | 71.8 | Confident | 65.3 | Low | 166 Ų | 166 | 96.9 Ų | 96.9 | 78% | 0.776 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -68.6 | -42.2 | 176.4 | -71.1 | -174.1 | -13.4 | 0 | 0 | 111.9 | T278 L283 A284 | T278-Q280 PolarHBondContact O-N 3.49Å; Q280-L283 PolarHBondContact O-N 2.77Å; Q280-A284 WeakPolarHBondContact O-CB 3.05Å; Q280-A284 PolarHBondContact O-N 2.9Å |
| 281 | E | 77.3 | Confident | 68.2 | Low | 67 Ų | 67 | 94 Ų | 94 | 31% | 0.313 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.2 | -41.9 | 173.1 | -70.3 | 165.4 | 145.3 | 0 | 0 | 111.1 | V277 T278 L283 A284 V285 | V277-E281 HydrophobicContact CG1-CB 3.71Å; T278-E281 PolarHBondContact N-OE2 3.43Å; T278-E281 PolarHBondContact O-N 3.21Å; T278-E281 VanDerWaalsContact OG1-CG 3.23Å; T278-E281 WeakPolarHBondContact OG1-CG 3.43Å; T278-E281 PolarHBondContact OG1-N 3.49Å; T278-E281 PolarHBondContact OG1-OE2 3.21Å; E281-L283 VanDerWaalsContact C-N 3.33Å; E281-L283 PolarHBondContact O-N 3.07Å; E281-A284 PolarHBondContact O-N 3.13Å; E281-V285 VanDerWaalsContact O-CG2 3.31Å; E281-V285 WeakPolarHBondContact O-CG2 3.43Å; E281-V285 PolarHBondContact O-N 2.9Å |
| 282 | K | 77.6 | Confident | 71 | Confident | 28 Ų | 28 | 88.5 Ų | 88.5 | 12% | 0.122 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -60 | -42 | 174.9 | -68.3 | -174.7 | -175.9 | -176 | 0 | 112.3 | V277 T278 L279 V285 T286 F415 | V277-K282 HydrophobicContact CB-CG 4.45Å; V277-K282 HydrophobicContact CG1-CG 3.7Å; V277-K282 WeakPolarHBondContact O-CE 3.28Å; T278-K282 WeakPolarHBondContact O-CG 3.48Å; T278-K282 PolarHBondContact O-N 3.38Å; L279-K282 PolarHBondContact O-N 2.91Å; K282-V285 PolarHBondContact O-N 3.26Å; K282-T286 WeakPolarHBondContact O-CB 3.48Å; K282-T286 PolarHBondContact O-N 3.49Å; K282-T286 PolarHBondContact O-OG1 3.14Å; K282-F415 HydrophobicContact CB-CE1 3.86Å; K282-F415 HydrophobicContact CB-CE2 4.48Å; K282-F415 HydrophobicContact CB-CZ 3.76Å; K282-F415 HydrophobicContact CD-CD2 4.41Å; K282-F415 HydrophobicContact CD-CE2 3.96Å; K282-F415 HydrophobicContact CD-CZ 4.1Å; K282-F415 HydrophobicContact CG-CE1 4.14Å; K282-F415 HydrophobicContact CG-CE2 4.32Å; K282-F415 HydrophobicContact CG-CZ 4.04Å |
| 283 | L | 79.5 | Confident | 73.6 | Confident | 125 Ų | 125 | 80 Ų | 80 | 65% | 0.654 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -68.2 | -39.9 | 178.3 | -172.1 | 65.8 | 0 | 0 | 0 | 111.7 | L279 Q280 E281 T286 K287 | L279-L283 WeakPolarHBondContact O-CB 3.38Å; L279-L283 PolarHBondContact O-N 2.79Å; Q280-L283 PolarHBondContact O-N 2.77Å; E281-L283 VanDerWaalsContact C-N 3.33Å; E281-L283 PolarHBondContact O-N 3.07Å; L283-T286 PolarHBondContact O-N 2.9Å; L283-K287 PolarHBondContact O-N 3.45Å |
| 284 | A | 80.3 | Confident | 76.2 | Confident | 66 Ų | 66 | 78 Ų | 78 | 55% | 0.545 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q280 E281 K287 G288 | Q280-A284 WeakPolarHBondContact O-CB 3.05Å; Q280-A284 PolarHBondContact O-N 2.9Å; E281-A284 PolarHBondContact O-N 3.13Å; A284-K287 PolarHBondContact O-N 3.22Å; A284-G288 PolarHBondContact O-N 2.86Å |
| 285 | V | 81.2 | Confident | 78.6 | Confident | 29 Ų | 29 | 70 Ų | 70 | 18% | 0.176 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 173.9 | 172.5 | 0 | 0 | 0 | 0 | 110.7 | E281 K282 K287 G288 L289 Y412 F415 | E281-V285 VanDerWaalsContact O-CG2 3.31Å; E281-V285 WeakPolarHBondContact O-CG2 3.43Å; E281-V285 PolarHBondContact O-N 2.9Å; K282-V285 PolarHBondContact O-N 3.26Å; V285-K287 VanDerWaalsContact C-N 3.31Å; V285-K287 PolarHBondContact O-N 3.35Å; V285-G288 WeakPolarHBondContact O-CA 3.28Å; V285-G288 PolarHBondContact O-N 3.35Å; V285-G288 VanDerWaalsContact O-N 3.07Å; V285-L289 HydrophobicContact CG1-CD1 4Å; V285-L289 HydrophobicContact CG1-CG 4.47Å; V285-L289 WeakPolarHBondContact O-CG 3.28Å; V285-L289 PolarHBondContact O-N 2.93Å; V285-Y412 HydrophobicContact CG2-CD1 4.12Å; V285-Y412 HydrophobicContact CG2-CD2 4.11Å; V285-Y412 HydrophobicContact CG2-CG 3.87Å; V285-F415 HydrophobicContact CG1-CD1 4.35Å |
| 286 | T | 81.8 | Confident | 80.7 | Confident | 47 Ų | 47 | 68.5 Ų | 68.5 | 29% | 0.288 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 177.7 | -55.8 | 0 | 0 | 0 | 0 | 111.6 | K282 L283 G288 L289 L290 T419 | K282-T286 WeakPolarHBondContact O-CB 3.48Å; K282-T286 PolarHBondContact O-N 3.49Å; K282-T286 PolarHBondContact O-OG1 3.14Å; L283-T286 PolarHBondContact O-N 2.9Å; T286-G288 VanDerWaalsContact C-N 3.32Å; T286-G288 PolarHBondContact O-N 3.31Å; T286-L289 PolarHBondContact O-N 3.06Å; T286-L290 PolarHBondContact O-N 3.42Å; T286-T419 HydrophobicContact CG2-CG2 4Å |
| 287 | K | 84.1 | Confident | 82.3 | Confident | 165 Ų | 165 | 63.2 Ų | 63.2 | 72% | 0.717 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -63 | -38.3 | 175.4 | -171.4 | 179.2 | 179.4 | -178.9 | 0 | 112 | L283 A284 V285 L289 L290 | L283-K287 PolarHBondContact O-N 3.45Å; A284-K287 PolarHBondContact O-N 3.22Å; V285-K287 VanDerWaalsContact C-N 3.31Å; V285-K287 PolarHBondContact O-N 3.35Å; K287-L289 VanDerWaalsContact C-N 3.3Å; K287-L289 PolarHBondContact O-N 2.72Å; K287-L290 WeakPolarHBondContact O-CB 3.42Å; K287-L290 PolarHBondContact O-N 3.08Å |
| 288 | G | 83.8 | Confident | 83.8 | Confident | 53 Ų | 53 | 64.8 Ų | 64.8 | 55% | 0.546 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -66.3 | -28 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A284 V285 T286 P291 | A284-G288 PolarHBondContact O-N 2.86Å; V285-G288 WeakPolarHBondContact O-CA 3.28Å; V285-G288 PolarHBondContact O-N 3.35Å; V285-G288 VanDerWaalsContact O-N 3.07Å; T286-G288 VanDerWaalsContact C-N 3.32Å; T286-G288 PolarHBondContact O-N 3.31Å; G288-P291 VanDerWaalsContact O-CD 3.32Å; G288-P291 WeakPolarHBondContact O-CD 3.19Å |
| 289 | L | 85.8 | Confident | 84.8 | Confident | 10 Ų | 10 | 61.3 Ų | 61.3 | 5% | 0.052 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -83.9 | -15.2 | 178.6 | -65.7 | 168.1 | 0 | 0 | 0 | 113.5 | V285 T286 K287 P291 F292 V293 I404 A416 | V285-L289 HydrophobicContact CG1-CD1 4Å; V285-L289 HydrophobicContact CG1-CG 4.47Å; V285-L289 WeakPolarHBondContact O-CG 3.28Å; V285-L289 PolarHBondContact O-N 2.93Å; T286-L289 PolarHBondContact O-N 3.06Å; K287-L289 VanDerWaalsContact C-N 3.3Å; K287-L289 PolarHBondContact O-N 2.72Å; L289-P291 VanDerWaalsContact C-N 3.32Å; L289-F292 WeakPolarHBondContact O-CA 2.97Å; L289-F292 WeakPolarHBondContact O-CB 3.32Å; L289-F292 PolarHBondContact O-N 2.9Å; L289-V293 HydrophobicContact CB-CG2 4.25Å; L289-V293 WeakPolarHBondContact O-CG2 3.26Å; L289-V293 PolarHBondContact O-N 3.13Å; L289-I404 HydrophobicContact CD2-CG1 4.26Å; L289-I404 HydrophobicContact CD2-CG2 3.98Å; L289-A416 HydrophobicContact CD1-CB 3.59Å; L289-A416 HydrophobicContact CD2-CB 4.12Å; L289-A416 HydrophobicContact CG-CB 4.46Å |
| 290 | L | 86.3 | Confident | 85.8 | Confident | 81 Ų | 81 | 55.6 Ų | 55.6 | 42% | 0.424 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -53.9 | -37.4 | -175.8 | -161.2 | 67.9 | 0 | 0 | 0 | 114.6 | T286 K287 F292 V293 I294 | T286-L290 PolarHBondContact O-N 3.42Å; K287-L290 WeakPolarHBondContact O-CB 3.42Å; K287-L290 PolarHBondContact O-N 3.08Å; L290-F292 PolarHBondContact O-N 3.28Å; L290-F292 VanDerWaalsContact O-N 3.15Å; L290-V293 PolarHBondContact O-N 3.37Å; L290-I294 HydrophobicContact CD1-CD1 3.82Å; L290-I294 HydrophobicContact CD1-CG1 3.72Å; L290-I294 HydrophobicContact CD2-CD1 3.85Å; L290-I294 HydrophobicContact CG-CD1 3.49Å; L290-I294 VanDerWaalsContact CG-CD1 3.49Å; L290-I294 HydrophobicContact CG-CG1 3.81Å; L290-I294 PolarHBondContact O-N 3.2Å |
| 291 | P | 87.7 | Confident | 86.9 | Confident | 84 Ų | 84 | 50.2 Ų | 50.2 | 55% | 0.545 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.7 | -18.4 | 173.9 | -23.8 | 35.8 | 0 | 0 | 0 | 114.7 | G288 L289 P295 | G288-P291 VanDerWaalsContact O-CD 3.32Å; G288-P291 WeakPolarHBondContact O-CD 3.19Å; L289-P291 VanDerWaalsContact C-N 3.32Å; P291-P295 WeakPolarHBondContact O-CD 3.45Å; P291-P295 WeakPolarHBondContact O-CG 3.43Å |
| 292 | F | 86.4 | Confident | 87.7 | Confident | 32 Ų | 32 | 47 Ų | 47 | 14% | 0.14 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -96.4 | -40.8 | 173.6 | -65.2 | -75 | 0 | 0 | 0 | 111.8 | L289 L290 L296 T400 F403 I404 E407 | L289-F292 WeakPolarHBondContact O-CA 2.97Å; L289-F292 WeakPolarHBondContact O-CB 3.32Å; L289-F292 PolarHBondContact O-N 2.9Å; L290-F292 PolarHBondContact O-N 3.28Å; L290-F292 VanDerWaalsContact O-N 3.15Å; F292-L296 WeakPolarHBondContact O-CB 3.26Å; F292-L296 PolarHBondContact O-N 2.94Å; F292-T400 HydrophobicContact CB-CG2 3.98Å; F292-F403 HydrophobicContact CE1-CB 3.96Å; F292-F403 HydrophobicContact CZ-CB 4.41Å; F292-I404 HydrophobicContact CB-CD1 4.09Å; F292-I404 HydrophobicContact CB-CG1 4.16Å; F292-I404 HydrophobicContact CD2-CG1 4.33Å; F292-I404 HydrophobicContact CG-CG1 4.13Å; F292-E407 WeakPolarHBondContact CZ-OE2 3.44Å |
| 293 | V | 89 | Confident | 88.3 | Confident | 26 Ų | 26 | 45.7 Ų | 45.7 | 16% | 0.158 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -69 | -42.1 | -176.5 | 176.8 | 0 | 0 | 0 | 0 | 112.3 | L289 L290 L296 G297 | L289-V293 HydrophobicContact CB-CG2 4.25Å; L289-V293 WeakPolarHBondContact O-CG2 3.26Å; L289-V293 PolarHBondContact O-N 3.13Å; L290-V293 PolarHBondContact O-N 3.37Å; V293-L296 PolarHBondContact O-N 3.48Å; V293-G297 PolarHBondContact O-N 2.96Å |
| 294 | I | 91.3 | Very high | 88.8 | Confident | 88 Ų | 88 | 41.6 Ų | 41.6 | 45% | 0.451 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.2 | -52.7 | -179.7 | -69 | 177 | 0 | 0 | 0 | 111.6 | L290 L296 G297 L298 | L290-I294 HydrophobicContact CD1-CD1 3.82Å; L290-I294 HydrophobicContact CD1-CG1 3.72Å; L290-I294 HydrophobicContact CD2-CD1 3.85Å; L290-I294 HydrophobicContact CG-CD1 3.49Å; L290-I294 VanDerWaalsContact CG-CD1 3.49Å; L290-I294 HydrophobicContact CG-CG1 3.81Å; L290-I294 PolarHBondContact O-N 3.2Å; I294-L296 VanDerWaalsContact C-N 3.27Å; I294-L296 PolarHBondContact O-N 3.14Å; I294-G297 PolarHBondContact O-N 2.83Å; I294-L298 HydrophobicContact CG2-CD1 4.05Å; I294-L298 HydrophobicContact CG2-CG 4.45Å; I294-L298 WeakPolarHBondContact O-CG 3.36Å; I294-L298 PolarHBondContact O-N 3.25Å |
| 295 | P | 92.2 | Very high | 89.3 | Confident | 11 Ų | 11 | 39.2 Ų | 39.2 | 7% | 0.071 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -59.2 | -38.5 | 177.2 | -27.3 | 37.2 | 0 | 0 | 0 | 113 | P291 L298 V299 C354 | P291-P295 WeakPolarHBondContact O-CD 3.45Å; P291-P295 WeakPolarHBondContact O-CG 3.43Å; P295-L298 PolarHBondContact O-N 3.03Å; P295-V299 WeakPolarHBondContact O-CG2 3.25Å; P295-V299 PolarHBondContact O-N 3.4Å; P295-C354 VanDerWaalsContact CG-SG 3.57Å |
| 296 | L | 91.4 | Very high | 89.7 | Confident | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.005 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.1 | -49.7 | 176.1 | -173.8 | 67.9 | 0 | 0 | 0 | 110.9 | F292 V293 I294 L298 V299 Y300 T400 F401 D424 | F292-L296 WeakPolarHBondContact O-CB 3.26Å; F292-L296 PolarHBondContact O-N 2.94Å; V293-L296 PolarHBondContact O-N 3.48Å; I294-L296 VanDerWaalsContact C-N 3.27Å; I294-L296 PolarHBondContact O-N 3.14Å; L296-L298 VanDerWaalsContact C-N 3.29Å; L296-L298 PolarHBondContact O-N 3.12Å; L296-V299 PolarHBondContact O-N 3.28Å; L296-Y300 HydrophobicContact CD1-CD2 3.89Å; L296-Y300 HydrophobicContact CD1-CE2 3.64Å; L296-Y300 HydrophobicContact CG-CD2 4.04Å; L296-Y300 HydrophobicContact CG-CE2 4.16Å; L296-Y300 WeakPolarHBondContact O-CD2 3.38Å; L296-Y300 PolarHBondContact O-N 3.09Å; L296-T400 HydrophobicContact CB-CG2 4.34Å; L296-T400 HydrophobicContact CD1-CG2 4.5Å; L296-T400 HydrophobicContact CD2-CG2 4Å; L296-F401 HydrophobicContact CD2-CE2 4.18Å; L296-F401 HydrophobicContact CD2-CZ 4.5Å; L296-D424 HydrophobicContact CD2-CB 4.5Å |
| 297 | G | 92.7 | Very high | 89.9 | Confident | 11 Ų | 11 | 35.6 Ų | 35.6 | 11% | 0.113 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.6 | -38 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | V293 I294 Y300 F301 G423 G427 | V293-G297 PolarHBondContact O-N 2.96Å; I294-G297 PolarHBondContact O-N 2.83Å; G297-Y300 PolarHBondContact O-N 2.71Å; G297-F301 VanDerWaalsContact O-CB 3.27Å; G297-F301 WeakPolarHBondContact O-CB 3.38Å; G297-F301 PolarHBondContact O-N 3.38Å; G297-G423 VanDerWaalsContact CA-O 3.24Å; G297-G423 WeakPolarHBondContact CA-O 3.32Å; G297-G427 WeakPolarHBondContact O-CA 3.49Å |
| 298 | L | 94.1 | Very high | 89.6 | Confident | 71 Ų | 71 | 28.6 Ų | 28.6 | 37% | 0.372 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -67.5 | -39 | 175.2 | -73.9 | 173.8 | 0 | 0 | 0 | 113.1 | I294 P295 L296 F301 A302 S357 | I294-L298 HydrophobicContact CG2-CD1 4.05Å; I294-L298 HydrophobicContact CG2-CG 4.45Å; I294-L298 WeakPolarHBondContact O-CG 3.36Å; I294-L298 PolarHBondContact O-N 3.25Å; P295-L298 PolarHBondContact O-N 3.03Å; L296-L298 VanDerWaalsContact C-N 3.29Å; L296-L298 PolarHBondContact O-N 3.12Å; L298-F301 PolarHBondContact O-N 2.87Å; L298-A302 WeakPolarHBondContact O-CB 3.42Å; L298-A302 PolarHBondContact O-N 3.49Å; L298-S357 WeakPolarHBondContact CB-OG 3.17Å |
| 299 | V | 94.8 | Very high | 89.5 | Confident | 1 Ų | 1 | 26.2 Ų | 26.2 | 1% | 0.006 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.4 | -51.8 | 173.7 | 170.7 | 0 | 0 | 0 | 0 | 109.8 | P295 L296 F301 A302 E303 F356 S357 Q360 A396 | P295-V299 WeakPolarHBondContact O-CG2 3.25Å; P295-V299 PolarHBondContact O-N 3.4Å; L296-V299 PolarHBondContact O-N 3.28Å; V299-F301 VanDerWaalsContact C-N 3.31Å; V299-F301 PolarHBondContact O-N 3Å; V299-A302 PolarHBondContact O-N 3.37Å; V299-E303 WeakPolarHBondContact O-CB 3.34Å; V299-E303 PolarHBondContact O-N 2.96Å; V299-F356 HydrophobicContact CG2-CB 4.35Å; V299-S357 VanDerWaalsContact CG2-CA 3.42Å; V299-Q360 HydrophobicContact CG1-CG 4.36Å; V299-Q360 HydrophobicContact CG2-CB 4.5Å; V299-A396 HydrophobicContact CB-CB 4.34Å; V299-A396 HydrophobicContact CG1-CB 3.98Å; V299-A396 HydrophobicContact CG2-CB 3.95Å |
| 300 | Y | 92.9 | Very high | 89.4 | Confident | 5 Ų | 5 | 25.8 Ų | 25.8 | 2% | 0.02 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.4 | -35.2 | -179.9 | -87.5 | -87.7 | 0 | 0 | 0 | 112.7 | L296 G297 Y304 R342 Y397 D424 I428 | L296-Y300 HydrophobicContact CD1-CD2 3.89Å; L296-Y300 HydrophobicContact CD1-CE2 3.64Å; L296-Y300 HydrophobicContact CG-CD2 4.04Å; L296-Y300 HydrophobicContact CG-CE2 4.16Å; L296-Y300 WeakPolarHBondContact O-CD2 3.38Å; L296-Y300 PolarHBondContact O-N 3.09Å; G297-Y300 PolarHBondContact O-N 2.71Å; Y300-Y304 HydrophobicContact CD1-CD2 4.08Å; Y300-Y304 AromaticContact CD1-CE2 3.61Å; Y300-Y304 HydrophobicContact CD1-CE2 3.61Å; Y300-Y304 HydrophobicContact CE1-CE2 4.01Å; Y300-Y304 WeakPolarHBondContact O-CB 3.33Å; Y300-Y304 WeakPolarHBondContact O-CD2 3.47Å; Y300-Y304 PolarHBondContact O-N 3.09Å; Y300-R342 PolarHBondContact OH-NH2 3.15Å; Y300-Y397 AromaticContact CE2-CD2 3.97Å; Y300-Y397 HydrophobicContact CE2-CD2 3.97Å; Y300-Y397 AromaticContact CZ-CD2 3.81Å; Y300-Y397 WeakPolarHBondContact OH-CB 3.35Å; Y300-Y397 WeakPolarHBondContact OH-CD2 3.35Å; Y300-D424 HydrophobicContact CD1-CB 4.08Å; Y300-D424 HydrophobicContact CD2-CB 3.69Å; Y300-D424 HydrophobicContact CE1-CB 4.25Å; Y300-D424 HydrophobicContact CE2-CB 3.88Å; Y300-D424 HydrophobicContact CG-CB 3.81Å; Y300-I428 HydrophobicContact CD1-CD1 3.86Å; Y300-I428 HydrophobicContact CD1-CG1 3.89Å; Y300-I428 HydrophobicContact CE1-CD1 4.39Å |
| 301 | F | 94.2 | Very high | 89.1 | Confident | 53 Ų | 53 | 22.2 Ų | 22.2 | 23% | 0.232 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -59.3 | -55.5 | 171.9 | 170.2 | -96.4 | 0 | 0 | 0 | 111.4 | G297 L298 V299 E303 Y304 F305 M361 G427 L430 A431 A434 | G297-F301 VanDerWaalsContact O-CB 3.27Å; G297-F301 WeakPolarHBondContact O-CB 3.38Å; G297-F301 PolarHBondContact O-N 3.38Å; L298-F301 PolarHBondContact O-N 2.87Å; V299-F301 VanDerWaalsContact C-N 3.31Å; V299-F301 PolarHBondContact O-N 3Å; F301-E303 PolarHBondContact O-N 3.39Å; F301-Y304 PolarHBondContact O-N 3.43Å; F301-F305 WeakPolarHBondContact O-CB 3.32Å; F301-F305 PolarHBondContact O-N 3.48Å; F301-M361 HydrophobicContact CD1-SD 4.4Å; F301-G427 WeakPolarHBondContact CA-O 3.49Å; F301-L430 HydrophobicContact CD2-CB 3.77Å; F301-L430 HydrophobicContact CE2-CB 4.13Å; F301-A431 HydrophobicContact CD2-CB 3.99Å; F301-A431 HydrophobicContact CE2-CB 4.42Å; F301-A431 VanDerWaalsContact O-CB 3.28Å; F301-A431 WeakPolarHBondContact O-CB 3.38Å; F301-A434 HydrophobicContact CE2-CB 4.11Å; F301-A434 HydrophobicContact CZ-CB 4.3Å |
| 302 | A | 93.8 | Very high | 88.5 | Confident | 0 Ų | 0 | 19.1 Ų | 19.1 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66 | -40.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L298 V299 F305 I306 Q360 M361 A364 | L298-A302 WeakPolarHBondContact O-CB 3.42Å; L298-A302 PolarHBondContact O-N 3.49Å; V299-A302 PolarHBondContact O-N 3.37Å; A302-F305 PolarHBondContact O-N 3.1Å; A302-I306 WeakPolarHBondContact O-CD1 3.47Å; A302-I306 WeakPolarHBondContact O-CG1 3.35Å; A302-I306 PolarHBondContact O-N 3.16Å; A302-Q360 HydrophobicContact CB-CB 4.2Å; A302-Q360 HydrophobicContact CB-CG 3.51Å; A302-M361 HydrophobicContact CB-SD 3.79Å; A302-A364 HydrophobicContact CB-CB 4.11Å |
| 303 | E | 92 | Very high | 88 | Confident | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.005 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -56.5 | -54.9 | 173.8 | 179.9 | 178.4 | 103.4 | 0 | 0 | 112.8 | V299 F301 F305 I306 N307 Y334 E389 G393 | V299-E303 WeakPolarHBondContact O-CB 3.34Å; V299-E303 PolarHBondContact O-N 2.96Å; F301-E303 PolarHBondContact O-N 3.39Å; E303-F305 VanDerWaalsContact C-N 3.3Å; E303-F305 PolarHBondContact O-N 2.95Å; E303-I306 PolarHBondContact O-N 3.33Å; E303-N307 PolarHBondContact O-N 3.45Å; E303-N307 PolarHBondContact O-ND2 2.98Å; E303-Y334 HydrophobicContact CG-CE2 3.68Å; E303-Y334 WeakPolarHBondContact CG-OH 3.31Å; E303-Y334 PolarHBondContact OE1-OH 3.45Å; E303-E389 WeakPolarHBondContact CA-OE1 3.2Å; E303-G393 WeakPolarHBondContact OE2-CA 3.49Å |
| 304 | Y | 89.1 | Confident | 87.5 | Confident | 38 Ų | 38 | 17.4 Ų | 17.4 | 15% | 0.149 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -72.8 | -27.8 | -177.4 | -81.2 | -104.3 | 0 | 0 | 0 | 112.2 | L94 Y300 F301 N307 Q308 I428 | L94-Y304 HydrophobicContact CD1-CD1 3.84Å; L94-Y304 HydrophobicContact CD1-CE1 4Å; L94-Y304 HydrophobicContact CD2-CD1 3.93Å; Y300-Y304 HydrophobicContact CD1-CD2 4.08Å; Y300-Y304 AromaticContact CD1-CE2 3.61Å; Y300-Y304 HydrophobicContact CD1-CE2 3.61Å; Y300-Y304 HydrophobicContact CE1-CE2 4.01Å; Y300-Y304 WeakPolarHBondContact O-CB 3.33Å; Y300-Y304 WeakPolarHBondContact O-CD2 3.47Å; Y300-Y304 PolarHBondContact O-N 3.09Å; F301-Y304 PolarHBondContact O-N 3.43Å; Y304-N307 PolarHBondContact O-N 3.01Å; Y304-Q308 WeakPolarHBondContact O-CB 3.24Å; Y304-Q308 PolarHBondContact O-N 3Å; Y304-I428 HydrophobicContact CD1-CB 4.46Å; Y304-I428 HydrophobicContact CD1-CG1 4.17Å; Y304-I428 HydrophobicContact CD1-CG2 3.65Å; Y304-I428 HydrophobicContact CD2-CD1 4.28Å; Y304-I428 HydrophobicContact CD2-CG1 3.61Å; Y304-I428 HydrophobicContact CE1-CD1 4.2Å; Y304-I428 HydrophobicContact CE1-CG1 4.18Å; Y304-I428 HydrophobicContact CE1-CG2 3.91Å; Y304-I428 HydrophobicContact CE2-CD1 3.77Å; Y304-I428 HydrophobicContact CE2-CG1 3.63Å; Y304-I428 HydrophobicContact CG-CB 4.33Å; Y304-I428 HydrophobicContact CG-CG1 3.87Å; Y304-I428 HydrophobicContact CG-CG2 3.98Å |
| 305 | F | 90.6 | Very high | 86.9 | Confident | 16 Ų | 16 | 16 Ų | 16 | 7% | 0.07 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -67.6 | -38.6 | 173.6 | -178.5 | -101.9 | 0 | 0 | 0 | 111.4 | F301 A302 E303 G309 L310 I368 A431 A434 T438 | F301-F305 WeakPolarHBondContact O-CB 3.32Å; F301-F305 PolarHBondContact O-N 3.48Å; A302-F305 PolarHBondContact O-N 3.1Å; E303-F305 VanDerWaalsContact C-N 3.3Å; E303-F305 PolarHBondContact O-N 2.95Å; F305-G309 WeakPolarHBondContact O-CA 3.29Å; F305-G309 PolarHBondContact O-N 3.26Å; F305-L310 HydrophobicContact CD1-CD1 4.16Å; F305-L310 HydrophobicContact CD1-CG 4.31Å; F305-L310 HydrophobicContact CE1-CD1 3.95Å; F305-L310 HydrophobicContact CE1-CD2 4.04Å; F305-L310 HydrophobicContact CE1-CG 3.99Å; F305-L310 HydrophobicContact CZ-CD2 4.34Å; F305-L310 PolarHBondContact O-N 2.89Å; F305-I368 HydrophobicContact CE1-CD1 3.91Å; F305-I368 HydrophobicContact CE1-CG1 4.07Å; F305-A431 HydrophobicContact CB-CB 4.09Å; F305-A434 HydrophobicContact CD2-CB 3.87Å; F305-A434 HydrophobicContact CE2-CB 3.9Å; F305-T438 HydrophobicContact CE2-CG2 4.36Å; F305-T438 HydrophobicContact CZ-CG2 3.94Å |
| 306 | I | 90.1 | Very high | 86.4 | Confident | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 8% | 0.081 | C | C | . | . | I | π-helix | trans | -63.6 | -55.3 | 171.9 | -66 | 160.5 | 0 | 0 | 0 | 109.7 | A302 E303 Q308 L310 M311 A364 L367 E389 | A302-I306 WeakPolarHBondContact O-CD1 3.47Å; A302-I306 WeakPolarHBondContact O-CG1 3.35Å; A302-I306 PolarHBondContact O-N 3.16Å; E303-I306 PolarHBondContact O-N 3.33Å; I306-Q308 PolarHBondContact O-N 3.39Å; I306-L310 HydrophobicContact CG1-CD1 4.24Å; I306-L310 PolarHBondContact O-N 3.41Å; I306-L310 VanDerWaalsContact O-N 3.07Å; I306-M311 HydrophobicContact CG2-CE 3.66Å; I306-M311 HydrophobicContact CG2-CG 4.18Å; I306-M311 WeakPolarHBondContact O-CG 3.3Å; I306-M311 PolarHBondContact O-N 3.21Å; I306-A364 HydrophobicContact CD1-CB 3.97Å; I306-A364 HydrophobicContact CG1-CB 3.96Å; I306-L367 HydrophobicContact CB-CD1 4.36Å; I306-L367 HydrophobicContact CD1-CD1 4.12Å; I306-L367 HydrophobicContact CG1-CD1 4.05Å; I306-L367 HydrophobicContact CG2-CD1 3.35Å; I306-E389 HydrophobicContact CD1-CG 4.02Å; I306-E389 VanDerWaalsContact CG2-OE2 3.26Å; I306-E389 WeakPolarHBondContact CG2-OE2 2.98Å |
| 307 | N | 85.7 | Confident | 85.3 | Confident | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.005 | 11% | 0.112 | C | C | . | . | I | π-helix | trans | -59.8 | -43.5 | -174.8 | -79.6 | -66.6 | 0 | 0 | 0 | 114.2 | E303 Y304 M311 Y334 E389 | E303-N307 PolarHBondContact O-N 3.45Å; E303-N307 PolarHBondContact O-ND2 2.98Å; Y304-N307 PolarHBondContact O-N 3.01Å; N307-M311 HydrophobicContact CB-CE 4.35Å; N307-M311 WeakPolarHBondContact OD1-CE 3.48Å; N307-M311 PolarHBondContact OD1-SD 3.19Å; N307-M311 VanDerWaalsContact OD1-SD 3.41Å; N307-Y334 WeakPolarHBondContact ND2-CE2 3.38Å; N307-E389 PolarHBondContact ND2-OE1 3.38Å |
| 308 | Q | 78.8 | Confident | 84.1 | Confident | 18 Ų | 18 | 31.4 Ų | 31.4 | 8% | 0.084 | 15% | 0.152 | C | C | . | . | I | π-helix | trans | -106.2 | -14.6 | -173.1 | -55.9 | -57.2 | -26.5 | 0 | 0 | 113.9 | T90 L94 Y304 I306 Y327 | T90-Q308 PolarHBondContact OG1-O 2.89Å; L94-Q308 HydrophobicContact CB-CG 4.43Å; L94-Q308 HydrophobicContact CD2-CB 4.33Å; L94-Q308 HydrophobicContact CD2-CG 3.86Å; L94-Q308 HydrophobicContact CG-CG 4.49Å; Y304-Q308 WeakPolarHBondContact O-CB 3.24Å; Y304-Q308 PolarHBondContact O-N 3Å; I306-Q308 PolarHBondContact O-N 3.39Å; Q308-Y327 PolarHBondContact OE1-OH 3.32Å |
| 309 | G | 79.9 | Confident | 83.1 | Confident | 2 Ų | 2 | 29.5 Ų | 29.5 | 2% | 0.021 | 14% | 0.144 | C | C | . | . | I | π-helix | trans | -106.6 | -33 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | F305 L313 | F305-G309 WeakPolarHBondContact O-CA 3.29Å; F305-G309 PolarHBondContact O-N 3.26Å; G309-L313 WeakPolarHBondContact O-CD1 3.46Å |
| 310 | L | 83.9 | Confident | 82 | Confident | 1 Ų | 1 | 35.3 Ų | 35.3 | 1% | 0.005 | 19% | 0.185 | C | C | . | . | I | π-helix | trans | -114.1 | -37.7 | -170.6 | -57.1 | 178.3 | 0 | 0 | 0 | 113.7 | F305 I306 E312 L313 L314 L367 I368 V371 T438 | F305-L310 HydrophobicContact CD1-CD1 4.16Å; F305-L310 HydrophobicContact CD1-CG 4.31Å; F305-L310 HydrophobicContact CE1-CD1 3.95Å; F305-L310 HydrophobicContact CE1-CD2 4.04Å; F305-L310 HydrophobicContact CE1-CG 3.99Å; F305-L310 HydrophobicContact CZ-CD2 4.34Å; F305-L310 PolarHBondContact O-N 2.89Å; I306-L310 HydrophobicContact CG1-CD1 4.24Å; I306-L310 PolarHBondContact O-N 3.41Å; I306-L310 VanDerWaalsContact O-N 3.07Å; L310-E312 VanDerWaalsContact C-N 3.33Å; L310-E312 PolarHBondContact O-N 3.45Å; L310-L313 WeakPolarHBondContact O-CB 3.46Å; L310-L313 PolarHBondContact O-N 2.72Å; L310-L313 VanDerWaalsContact O-N 3.11Å; L310-L314 PolarHBondContact O-N 3.07Å; L310-L367 HydrophobicContact CD1-CB 3.92Å; L310-I368 HydrophobicContact CD1-CG1 3.74Å; L310-I368 HydrophobicContact CD2-CG1 4.02Å; L310-V371 HydrophobicContact CB-CG2 4.37Å; L310-T438 HydrophobicContact CD2-CG2 4.27Å |
| 311 | M | 80.7 | Confident | 81.1 | Confident | 7 Ų | 7 | 37.2 Ų | 37.2 | 3% | 0.034 | 20% | 0.195 | C | C | . | . | G | 310 helix | trans | -63.3 | -35.9 | -173.8 | -72.7 | -170.5 | -166.4 | 0 | 0 | 113.6 | I306 N307 L313 L314 Y330 I386 E389 | I306-M311 HydrophobicContact CG2-CE 3.66Å; I306-M311 HydrophobicContact CG2-CG 4.18Å; I306-M311 WeakPolarHBondContact O-CG 3.3Å; I306-M311 PolarHBondContact O-N 3.21Å; N307-M311 HydrophobicContact CB-CE 4.35Å; N307-M311 WeakPolarHBondContact OD1-CE 3.48Å; N307-M311 PolarHBondContact OD1-SD 3.19Å; N307-M311 VanDerWaalsContact OD1-SD 3.41Å; M311-L313 PolarHBondContact O-N 3.03Å; M311-L314 PolarHBondContact O-N 3.46Å; M311-Y330 HydrophobicContact CB-CD2 4.23Å; M311-Y330 HydrophobicContact SD-CG 4.49Å; M311-I386 HydrophobicContact CE-CB 4.29Å; M311-I386 HydrophobicContact CE-CD1 3.84Å; M311-I386 HydrophobicContact CE-CG1 3.67Å; M311-I386 HydrophobicContact CE-CG2 3.81Å; M311-I386 HydrophobicContact CG-CD1 4.3Å; M311-I386 HydrophobicContact SD-CD1 3.83Å; M311-I386 HydrophobicContact SD-CG1 4.34Å; M311-E389 WeakPolarHBondContact CE-OE2 3.38Å |
| 312 | E | 74.1 | Confident | 80.3 | Confident | 18 Ų | 18 | 37.4 Ų | 37.4 | 8% | 0.084 | 20% | 0.203 | C | C | . | . | G | 310 helix | trans | -62.4 | -32.4 | 176.5 | -172.4 | 174.9 | 175.4 | 0 | 0 | 112 | S86 T90 L310 L314 H323 Y327 | S86-E312 VanDerWaalsContact CB-OE1 3.32Å; S86-E312 WeakPolarHBondContact CB-OE1 3.42Å; S86-E312 PolarHBondContact OG-OE1 2.77Å; T90-E312 VanDerWaalsContact CG2-OE2 3.27Å; T90-E312 WeakPolarHBondContact CG2-OE2 3.35Å; T90-E312 PolarHBondContact OG1-OE2 2.91Å; L310-E312 VanDerWaalsContact C-N 3.33Å; L310-E312 PolarHBondContact O-N 3.45Å; E312-L314 VanDerWaalsContact C-N 3.34Å; E312-H323 PolarHBondContact O-NE2 3.42Å; E312-Y327 HydrophobicContact CB-CE2 4.49Å |
| 313 | L | 76.3 | Confident | 79.2 | Confident | 6 Ų | 6 | 39.7 Ų | 39.7 | 3% | 0.031 | 21% | 0.214 | C | C | . | . | G | 310 helix | trans | -82.1 | -14.2 | -179.9 | -57.6 | 173.4 | 0 | 0 | 0 | 112.9 | Y83 G309 L310 M311 F315 V371 F442 | Y83-L313 HydrophobicContact CD1-CB 4.2Å; Y83-L313 HydrophobicContact CD1-CD2 4.34Å; Y83-L313 HydrophobicContact CE1-CB 4.5Å; Y83-L313 HydrophobicContact CG-CD2 4.39Å; G309-L313 WeakPolarHBondContact O-CD1 3.46Å; L310-L313 WeakPolarHBondContact O-CB 3.46Å; L310-L313 PolarHBondContact O-N 2.72Å; L310-L313 VanDerWaalsContact O-N 3.11Å; M311-L313 PolarHBondContact O-N 3.03Å; L313-F315 PolarHBondContact O-N 3.29Å; L313-V371 HydrophobicContact CB-CG1 3.86Å; L313-V371 HydrophobicContact CD1-CG1 4.19Å; L313-F442 HydrophobicContact CD1-CB 3.69Å; L313-F442 HydrophobicContact CD1-CD2 3.48Å; L313-F442 VanDerWaalsContact CD1-CD2 3.48Å; L313-F442 HydrophobicContact CD1-CE2 4.25Å; L313-F442 HydrophobicContact CD1-CG 3.7Å; L313-F442 HydrophobicContact CD2-CB 4.17Å |
| 314 | L | 78.6 | Confident | 78 | Confident | 17 Ų | 17 | 42.4 Ų | 42.4 | 9% | 0.089 | 24% | 0.237 | C | C | . | . | trans | -95.7 | 75.8 | -171.1 | -145.4 | 159.6 | 0 | 0 | 0 | 110.7 | L310 M311 E312 F316 Y330 L367 V371 V382 | L310-L314 PolarHBondContact O-N 3.07Å; M311-L314 PolarHBondContact O-N 3.46Å; E312-L314 VanDerWaalsContact C-N 3.34Å; L314-F316 HydrophobicContact CD2-CD2 4.22Å; L314-F316 HydrophobicContact CD2-CE2 3.23Å; L314-F316 HydrophobicContact CD2-CZ 3.5Å; L314-Y330 PolarHBondContact O-OH 2.78Å; L314-Y330 VanDerWaalsContact O-OH 3.06Å; L314-L367 HydrophobicContact CD1-CD2 3.99Å; L314-V371 HydrophobicContact CB-CG2 4.29Å; L314-V371 HydrophobicContact CD1-CG2 3.91Å; L314-V371 HydrophobicContact CG-CG2 4.14Å; L314-V382 HydrophobicContact CD2-CB 4.49Å; L314-V382 HydrophobicContact CD2-CG1 4.17Å; L314-V382 HydrophobicContact CD2-CG2 3.67Å | ||
| 315 | F | 79.8 | Confident | 77.1 | Confident | 57 Ų | 57 | 44 Ų | 44 | 25% | 0.25 | 25% | 0.245 | C | C | . | . | trans | -105.1 | 133.1 | -175.9 | 178.1 | -124.2 | 0 | 0 | 0 | 113.8 | L313 H317 H323 | L313-F315 PolarHBondContact O-N 3.29Å; F315-H317 AromaticContact CD1-CE1 3.38Å; F315-H317 WeakPolarHBondContact CD1-CE1 3.43Å; F315-H317 AromaticContact CD1-ND1 3.54Å; F315-H317 AromaticContact CD1-NE2 3.79Å; F315-H317 HydrophobicContact CE1-CB 4.46Å; F315-H317 AromaticContact CE1-CD2 3.51Å; F315-H317 AromaticContact CE1-CE1 3.53Å; F315-H317 AromaticContact CE1-CG 3.62Å; F315-H317 AromaticContact CE1-ND1 3.63Å; F315-H317 AromaticContact CE1-NE2 3.46Å; F315-H317 WeakPolarHBondContact CE1-NE2 3.33Å; F315-H323 HydrophobicContact CD2-CB 3.85Å; F315-H323 AromaticContact CD2-CD2 3.39Å; F315-H323 WeakPolarHBondContact CD2-CD2 3.22Å; F315-H323 AromaticContact CD2-CG 3.94Å; F315-H323 HydrophobicContact CE2-CB 3.61Å; F315-H323 AromaticContact CG-CD2 3.47Å; F315-H323 VanDerWaalsContact CG-CD2 3.47Å; F315-H323 WeakPolarHBondContact CG-CD2 3.28Å; F315-H323 HydrophobicContact CZ-CB 4.2Å | ||
| 316 | F | 80.4 | Confident | 76.6 | Confident | 29 Ų | 29 | 43.3 Ų | 43.3 | 13% | 0.127 | 24% | 0.242 | C | C | . | . | trans | -108.4 | 108.5 | 175.6 | -64.6 | -86.4 | 0 | 0 | 0 | 112 | L314 N318 S319 Q326 Y330 L376 I379 V382 | L314-F316 HydrophobicContact CD2-CD2 4.22Å; L314-F316 HydrophobicContact CD2-CE2 3.23Å; L314-F316 HydrophobicContact CD2-CZ 3.5Å; F316-N318 VanDerWaalsContact C-N 3.31Å; F316-N318 PolarHBondContact O-N 3.38Å; F316-S319 PolarHBondContact O-OG 2.89Å; F316-Q326 VanDerWaalsContact N-OE1 3.07Å; F316-Q326 PolarHBondContact O-NE2 2.94Å; F316-Y330 WeakPolarHBondContact CD2-OH 3.32Å; F316-Y330 WeakPolarHBondContact CE2-OH 3.27Å; F316-L376 HydrophobicContact CE1-CB 4.16Å; F316-L376 WeakPolarHBondContact CE1-O 3.33Å; F316-L376 HydrophobicContact CZ-CB 4.04Å; F316-I379 HydrophobicContact CB-CB 4.44Å; F316-I379 HydrophobicContact CD2-CB 3.77Å; F316-I379 HydrophobicContact CD2-CD1 4.41Å; F316-I379 HydrophobicContact CD2-CG1 3.92Å; F316-I379 HydrophobicContact CE2-CB 4.19Å; F316-I379 HydrophobicContact CE2-CG1 4.3Å; F316-I379 HydrophobicContact CG-CB 4.1Å; F316-V382 HydrophobicContact CE2-CB 4.18Å; F316-V382 HydrophobicContact CE2-CG2 3.64Å; F316-V382 HydrophobicContact CZ-CG2 3.56Å | ||
| 317 | H | 69.2 | Low | 76 | Confident | 143 Ų | 143 | 46 Ų | 46 | 66% | 0.662 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | -28.7 | 177.9 | -68.8 | 79.8 | 0 | 0 | 0 | 113.6 | F315 S319 | F315-H317 AromaticContact CD1-CE1 3.38Å; F315-H317 WeakPolarHBondContact CD1-CE1 3.43Å; F315-H317 AromaticContact CD1-ND1 3.54Å; F315-H317 AromaticContact CD1-NE2 3.79Å; F315-H317 HydrophobicContact CE1-CB 4.46Å; F315-H317 AromaticContact CE1-CD2 3.51Å; F315-H317 AromaticContact CE1-CE1 3.53Å; F315-H317 AromaticContact CE1-CG 3.62Å; F315-H317 AromaticContact CE1-ND1 3.63Å; F315-H317 AromaticContact CE1-NE2 3.46Å; F315-H317 WeakPolarHBondContact CE1-NE2 3.33Å; H317-S319 VanDerWaalsContact C-N 3.25Å; H317-S319 PolarHBondContact O-N 3.44Å |
| 318 | N | 66.9 | Low | 75.4 | Confident | 175 Ų | 175 | 51.7 Ų | 51.7 | 94% | 0.936 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | 14.7 | -175.8 | -71.4 | -17.3 | 0 | 0 | 0 | 113.9 | F316 | F316-N318 VanDerWaalsContact C-N 3.31Å; F316-N318 PolarHBondContact O-N 3.38Å |
| 319 | S | 72.6 | Confident | 75.5 | Confident | 31 Ų | 31 | 57 Ų | 57 | 22% | 0.217 | 29% | 0.293 | C | S | . | . | S | Bend | trans | -106 | 155.2 | 179.9 | 82.4 | 0 | 0 | 0 | 0 | 111.4 | F316 H317 L321 Q326 | F316-S319 PolarHBondContact O-OG 2.89Å; H317-S319 VanDerWaalsContact C-N 3.25Å; H317-S319 PolarHBondContact O-N 3.44Å; S319-L321 PolarHBondContact O-N 2.89Å; S319-L321 PolarHBondContact OG-N 3.09Å; S319-L321 PolarHBondContact OG-O 3.13Å; S319-Q326 PolarHBondContact OG-NE2 3.44Å |
| 320 | S | 71.9 | Confident | 75.8 | Confident | 123 Ų | 123 | 57 Ų | 57 | 86% | 0.86 | 29% | 0.293 | S | S | * | . | S | Bend | trans | -71.8 | -1.6 | 176.8 | 60.6 | 0 | 0 | 0 | 0 | 113.8 | ||
| 321 | L | 75 | Confident | 75.6 | Confident | 45 Ų | 45 | 58.6 Ų | 58.6 | 24% | 0.236 | 30% | 0.3 | C | S | . | . | S | Bend | trans | -103.4 | 133.6 | -175.6 | -63.4 | 175.2 | 0 | 0 | 0 | 109.9 | S319 E325 Q326 I379 F383 | S319-L321 PolarHBondContact O-N 2.89Å; S319-L321 PolarHBondContact OG-N 3.09Å; S319-L321 PolarHBondContact OG-O 3.13Å; L321-E325 HydrophobicContact CB-CB 4.15Å; L321-E325 HydrophobicContact CD2-CB 4.28Å; L321-Q326 HydrophobicContact CB-CG 3.71Å; L321-Q326 HydrophobicContact CD1-CG 4.49Å; L321-Q326 PolarHBondContact O-NE2 3.37Å; L321-I379 HydrophobicContact CD1-CD1 4.33Å; L321-F383 HydrophobicContact CD1-CZ 4.26Å |
| 322 | S | 76.3 | Confident | 75.7 | Confident | 58 Ų | 58 | 59.6 Ų | 59.6 | 41% | 0.406 | 31% | 0.307 | S | S | . | . | trans | -64 | 161.2 | 170.9 | 61.8 | 0 | 0 | 0 | 0 | 111.8 | A324 E325 Q326 | S322-A324 VanDerWaalsContact C-N 3.32Å; S322-A324 PolarHBondContact O-N 3.49Å; S322-E325 WeakPolarHBondContact CB-OE2 3.34Å; S322-E325 PolarHBondContact N-OE2 3.48Å; S322-E325 WeakPolarHBondContact O-CB 3.25Å; S322-E325 PolarHBondContact O-N 3.41Å; S322-E325 WeakPolarHBondContact OG-CB 3.38Å; S322-E325 WeakPolarHBondContact OG-CG 3.39Å; S322-E325 PolarHBondContact OG-N 3.09Å; S322-E325 PolarHBondContact OG-OE2 3.03Å; S322-Q326 WeakPolarHBondContact O-CG 3.43Å; S322-Q326 PolarHBondContact O-N 3.33Å | ||
| 323 | H | 70.8 | Confident | 76.4 | Confident | 48 Ų | 48 | 60.5 Ų | 60.5 | 22% | 0.222 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -53.2 | -47.8 | 179.1 | -176.5 | -83.8 | 0 | 0 | 0 | 112.3 | E312 F315 E325 Q326 Y327 | E312-H323 PolarHBondContact O-NE2 3.42Å; F315-H323 HydrophobicContact CD2-CB 3.85Å; F315-H323 AromaticContact CD2-CD2 3.39Å; F315-H323 WeakPolarHBondContact CD2-CD2 3.22Å; F315-H323 AromaticContact CD2-CG 3.94Å; F315-H323 HydrophobicContact CE2-CB 3.61Å; F315-H323 AromaticContact CG-CD2 3.47Å; F315-H323 VanDerWaalsContact CG-CD2 3.47Å; F315-H323 WeakPolarHBondContact CG-CD2 3.28Å; F315-H323 HydrophobicContact CZ-CB 4.2Å; H323-E325 VanDerWaalsContact C-N 3.32Å; H323-E325 PolarHBondContact O-N 2.79Å; H323-Q326 PolarHBondContact O-N 3.14Å; H323-Y327 PolarHBondContact O-N 3.15Å; H323-Y327 VanDerWaalsContact O-N 3.09Å |
| 324 | A | 66.9 | Low | 77 | Confident | 58 Ų | 58 | 60.6 Ų | 60.6 | 48% | 0.479 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -65.5 | -30.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | S322 R328 | S322-A324 VanDerWaalsContact C-N 3.32Å; S322-A324 PolarHBondContact O-N 3.49Å; A324-R328 VanDerWaalsContact O-CG 3.28Å; A324-R328 WeakPolarHBondContact O-CG 3.34Å; A324-R328 PolarHBondContact O-N 3.16Å; A324-R328 PolarHBondContact O-NE 3.17Å; A324-R328 VanDerWaalsContact O-NE 3.14Å |
| 325 | E | 70.3 | Confident | 77.5 | Confident | 71 Ų | 71 | 61.2 Ų | 61.2 | 33% | 0.332 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -73 | -41.1 | 173.4 | -75.5 | 166.8 | 149 | 0 | 0 | 112 | L321 S322 H323 R328 W329 | L321-E325 HydrophobicContact CB-CB 4.15Å; L321-E325 HydrophobicContact CD2-CB 4.28Å; S322-E325 WeakPolarHBondContact CB-OE2 3.34Å; S322-E325 PolarHBondContact N-OE2 3.48Å; S322-E325 WeakPolarHBondContact O-CB 3.25Å; S322-E325 PolarHBondContact O-N 3.41Å; S322-E325 WeakPolarHBondContact OG-CB 3.38Å; S322-E325 WeakPolarHBondContact OG-CG 3.39Å; S322-E325 PolarHBondContact OG-N 3.09Å; S322-E325 PolarHBondContact OG-OE2 3.03Å; H323-E325 VanDerWaalsContact C-N 3.32Å; H323-E325 PolarHBondContact O-N 2.79Å; E325-R328 PolarHBondContact O-N 3.31Å; E325-W329 VanDerWaalsContact O-CD1 3.28Å; E325-W329 PolarHBondContact O-N 3.32Å |
| 326 | Q | 80.1 | Confident | 78 | Confident | 2 Ų | 2 | 61 Ų | 61 | 1% | 0.009 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.7 | -48.5 | 177.1 | -65.9 | -179.9 | 34.9 | 0 | 0 | 110.6 | F316 S319 L321 S322 H323 R328 W329 Y330 I379 | F316-Q326 VanDerWaalsContact N-OE1 3.07Å; F316-Q326 PolarHBondContact O-NE2 2.94Å; S319-Q326 PolarHBondContact OG-NE2 3.44Å; L321-Q326 HydrophobicContact CB-CG 3.71Å; L321-Q326 HydrophobicContact CD1-CG 4.49Å; L321-Q326 PolarHBondContact O-NE2 3.37Å; S322-Q326 WeakPolarHBondContact O-CG 3.43Å; S322-Q326 PolarHBondContact O-N 3.33Å; H323-Q326 PolarHBondContact O-N 3.14Å; Q326-R328 PolarHBondContact O-N 2.6Å; Q326-W329 PolarHBondContact O-N 3.28Å; Q326-Y330 HydrophobicContact CB-CE2 4.36Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.49Å; Q326-Y330 PolarHBondContact O-N 3.06Å; Q326-I379 HydrophobicContact CB-CD1 4.2Å; Q326-I379 HydrophobicContact CG-CD1 3.58Å |
| 327 | Y | 77.3 | Confident | 78.5 | Confident | 56 Ų | 56 | 59.7 Ų | 59.7 | 22% | 0.22 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60.4 | -42 | 177.9 | -176.7 | -101.3 | 0 | 0 | 0 | 112.9 | Q308 E312 H323 W329 Y330 Q331 | Q308-Y327 PolarHBondContact OE1-OH 3.32Å; E312-Y327 HydrophobicContact CB-CE2 4.49Å; H323-Y327 PolarHBondContact O-N 3.15Å; H323-Y327 VanDerWaalsContact O-N 3.09Å; Y327-W329 PolarHBondContact O-N 3.34Å; Y327-Y330 WeakPolarHBondContact O-CB 3.23Å; Y327-Y330 PolarHBondContact O-N 2.93Å; Y327-Q331 HydrophobicContact CD1-CG 4.47Å; Y327-Q331 HydrophobicContact CE1-CG 4.09Å; Y327-Q331 WeakPolarHBondContact O-CG 3.48Å; Y327-Q331 PolarHBondContact O-N 3.27Å; Y327-Q331 PolarHBondContact OH-NE2 3.05Å |
| 328 | R | 74.4 | Confident | 79.5 | Confident | 120 Ų | 120 | 53 Ų | 53 | 45% | 0.453 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.2 | -39.6 | 176 | -75.5 | -177.2 | -68.5 | 163.1 | -3 | 112.7 | A324 E325 Q326 T332 | A324-R328 VanDerWaalsContact O-CG 3.28Å; A324-R328 WeakPolarHBondContact O-CG 3.34Å; A324-R328 PolarHBondContact O-N 3.16Å; A324-R328 PolarHBondContact O-NE 3.17Å; A324-R328 VanDerWaalsContact O-NE 3.14Å; E325-R328 PolarHBondContact O-N 3.31Å; Q326-R328 PolarHBondContact O-N 2.6Å; R328-T332 PolarHBondContact O-N 2.71Å; R328-T332 PolarHBondContact O-OG1 2.98Å |
| 329 | W | 81.4 | Confident | 80.6 | Confident | 129 Ų | 129 | 48.1 Ų | 48.1 | 49% | 0.489 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -69.5 | -37.5 | 176.1 | -84.5 | 112.1 | 0 | 0 | 0 | 112.6 | E325 Q326 Y327 T332 L333 F383 | E325-W329 VanDerWaalsContact O-CD1 3.28Å; E325-W329 PolarHBondContact O-N 3.32Å; Q326-W329 PolarHBondContact O-N 3.28Å; Y327-W329 PolarHBondContact O-N 3.34Å; W329-T332 HydrophobicContact CE3-CG2 4.44Å; W329-T332 HydrophobicContact CZ3-CG2 4.38Å; W329-T332 PolarHBondContact O-N 2.66Å; W329-L333 WeakPolarHBondContact O-CB 3.5Å; W329-L333 WeakPolarHBondContact O-CG 3.44Å; W329-L333 PolarHBondContact O-N 3.19Å; W329-F383 HydrophobicContact CB-CE1 4.1Å; W329-F383 HydrophobicContact CB-CZ 3.85Å; W329-F383 HydrophobicContact CG-CZ 4.46Å |
| 330 | Y | 84.8 | Confident | 81.6 | Confident | 3 Ų | 3 | 50.4 Ų | 50.4 | 1% | 0.012 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -56 | -51.9 | 171.4 | -66.3 | -21.5 | 0 | 0 | 0 | 111.2 | M311 L314 F316 Q326 Y327 T332 L333 Y334 I379 V382 F383 I386 | M311-Y330 HydrophobicContact CB-CD2 4.23Å; M311-Y330 HydrophobicContact SD-CG 4.49Å; L314-Y330 PolarHBondContact O-OH 2.78Å; L314-Y330 VanDerWaalsContact O-OH 3.06Å; F316-Y330 WeakPolarHBondContact CD2-OH 3.32Å; F316-Y330 WeakPolarHBondContact CE2-OH 3.27Å; Q326-Y330 HydrophobicContact CB-CE2 4.36Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.49Å; Q326-Y330 PolarHBondContact O-N 3.06Å; Y327-Y330 WeakPolarHBondContact O-CB 3.23Å; Y327-Y330 PolarHBondContact O-N 2.93Å; Y330-T332 VanDerWaalsContact C-N 3.32Å; Y330-T332 PolarHBondContact O-N 3.4Å; Y330-L333 PolarHBondContact O-N 3.37Å; Y330-Y334 WeakPolarHBondContact O-CB 3.36Å; Y330-Y334 PolarHBondContact O-N 2.82Å; Y330-I379 HydrophobicContact CE1-CD1 4.39Å; Y330-I379 HydrophobicContact CE1-CG1 4.12Å; Y330-V382 HydrophobicContact CD1-CG1 4.36Å; Y330-V382 HydrophobicContact CE1-CB 4.4Å; Y330-V382 HydrophobicContact CE1-CG1 3.68Å; Y330-F383 AromaticContact CD1-CD1 3.55Å; Y330-F383 HydrophobicContact CD1-CD1 3.55Å; Y330-F383 AromaticContact CD1-CE1 3.4Å; Y330-F383 HydrophobicContact CD1-CE1 3.4Å; Y330-F383 VanDerWaalsContact CD1-CE1 3.4Å; Y330-F383 AromaticContact CE1-CD1 3.46Å; Y330-F383 HydrophobicContact CE1-CD1 3.46Å; Y330-F383 VanDerWaalsContact CE1-CD1 3.46Å; Y330-F383 AromaticContact CE1-CE1 3.29Å; Y330-F383 HydrophobicContact CE1-CE1 3.29Å; Y330-I386 HydrophobicContact CD1-CD1 3.3Å; Y330-I386 HydrophobicContact CD2-CD1 4.2Å; Y330-I386 HydrophobicContact CE1-CD1 3.92Å; Y330-I386 HydrophobicContact CG-CD1 3.47Å; Y330-I386 VanDerWaalsContact CG-CD1 3.47Å; Y330-I386 WeakPolarHBondContact O-CG2 3.32Å |
| 331 | Q | 81.1 | Confident | 82.4 | Confident | 34 Ų | 34 | 44.6 Ų | 44.6 | 16% | 0.159 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.5 | -41.4 | 176.7 | -68.3 | -62 | -28.9 | 0 | 0 | 112.2 | Y327 Q335 | Y327-Q331 HydrophobicContact CD1-CG 4.47Å; Y327-Q331 HydrophobicContact CE1-CG 4.09Å; Y327-Q331 WeakPolarHBondContact O-CG 3.48Å; Y327-Q331 PolarHBondContact O-N 3.27Å; Y327-Q331 PolarHBondContact OH-NE2 3.05Å; Q331-Q335 WeakPolarHBondContact O-CG 3.23Å; Q331-Q335 PolarHBondContact O-N 3.25Å |
| 332 | T | 82.6 | Confident | 83.1 | Confident | 28 Ų | 28 | 43.6 Ų | 43.6 | 17% | 0.172 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64.4 | -48.4 | 179.5 | -57.4 | 0 | 0 | 0 | 0 | 111.8 | L190 R328 W329 Y330 Y334 Q335 V336 | L190-T332 HydrophobicContact CD2-CG2 4.3Å; R328-T332 PolarHBondContact O-N 2.71Å; R328-T332 PolarHBondContact O-OG1 2.98Å; W329-T332 HydrophobicContact CE3-CG2 4.44Å; W329-T332 HydrophobicContact CZ3-CG2 4.38Å; W329-T332 PolarHBondContact O-N 2.66Å; Y330-T332 VanDerWaalsContact C-N 3.32Å; Y330-T332 PolarHBondContact O-N 3.4Å; T332-Y334 VanDerWaalsContact C-N 3.33Å; T332-Y334 PolarHBondContact O-N 3.2Å; T332-Q335 PolarHBondContact O-N 2.95Å; T332-V336 WeakPolarHBondContact O-CG2 3.28Å; T332-V336 PolarHBondContact O-N 3.09Å |
| 333 | L | 88.4 | Confident | 83.6 | Confident | 37 Ų | 37 | 42.9 Ų | 42.9 | 19% | 0.194 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.9 | -40.3 | 179.7 | -76 | 170 | 0 | 0 | 0 | 112 | W329 Y330 V336 G337 F383 I386 L387 | W329-L333 WeakPolarHBondContact O-CB 3.5Å; W329-L333 WeakPolarHBondContact O-CG 3.44Å; W329-L333 PolarHBondContact O-N 3.19Å; Y330-L333 PolarHBondContact O-N 3.37Å; L333-V336 PolarHBondContact O-N 3.47Å; L333-G337 PolarHBondContact O-N 3.4Å; L333-F383 HydrophobicContact CD1-CB 3.45Å; L333-F383 VanDerWaalsContact CD1-CB 3.45Å; L333-F383 HydrophobicContact CD1-CD1 3.57Å; L333-F383 HydrophobicContact CD1-CD2 3.76Å; L333-F383 HydrophobicContact CD1-CE1 4.19Å; L333-F383 HydrophobicContact CD1-CE2 4.37Å; L333-F383 HydrophobicContact CD1-CG 3.31Å; L333-I386 HydrophobicContact CB-CG2 4.34Å; L333-L387 WeakPolarHBondContact O-CD1 3.41Å |
| 334 | Y | 89.4 | Confident | 84.3 | Confident | 8 Ų | 8 | 41.7 Ų | 41.7 | 3% | 0.031 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -55.8 | -53 | 172.5 | 165.4 | -108.7 | 0 | 0 | 0 | 110.9 | E303 N307 Y330 T332 V336 G337 V338 | E303-Y334 HydrophobicContact CG-CE2 3.68Å; E303-Y334 WeakPolarHBondContact CG-OH 3.31Å; E303-Y334 PolarHBondContact OE1-OH 3.45Å; N307-Y334 WeakPolarHBondContact ND2-CE2 3.38Å; Y330-Y334 WeakPolarHBondContact O-CB 3.36Å; Y330-Y334 PolarHBondContact O-N 2.82Å; T332-Y334 VanDerWaalsContact C-N 3.33Å; T332-Y334 PolarHBondContact O-N 3.2Å; Y334-V336 VanDerWaalsContact C-N 3.32Å; Y334-V336 PolarHBondContact O-N 2.83Å; Y334-G337 WeakPolarHBondContact O-CA 3.39Å; Y334-G337 PolarHBondContact O-N 2.95Å; Y334-G337 VanDerWaalsContact O-N 3.08Å; Y334-V338 HydrophobicContact CD2-CG2 4.23Å; Y334-V338 HydrophobicContact CE1-CG2 4.29Å; Y334-V338 HydrophobicContact CE2-CG2 3.67Å; Y334-V338 WeakPolarHBondContact O-CG2 3.32Å; Y334-V338 PolarHBondContact O-N 3.23Å |
| 335 | Q | 88.1 | Confident | 84.7 | Confident | 31 Ų | 31 | 39 Ų | 39 | 15% | 0.145 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.2 | -36 | -179.8 | -65.9 | -67.5 | 4.3 | 0 | 0 | 112.8 | V186 Q331 T332 V338 F339 | V186-Q335 HydrophobicContact CG2-CB 3.69Å; V186-Q335 WeakPolarHBondContact CG2-O 3.44Å; Q331-Q335 WeakPolarHBondContact O-CG 3.23Å; Q331-Q335 PolarHBondContact O-N 3.25Å; T332-Q335 PolarHBondContact O-N 2.95Å; Q335-V338 PolarHBondContact O-N 3.37Å; Q335-F339 WeakPolarHBondContact O-CB 3.4Å; Q335-F339 PolarHBondContact O-N 3.41Å |
| 336 | V | 89.9 | Confident | 84.7 | Confident | 53 Ų | 53 | 43 Ų | 43 | 32% | 0.321 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -62.6 | -44.7 | 172.8 | 169.7 | 0 | 0 | 0 | 0 | 110.8 | V186 T332 L333 Y334 V338 F339 V340 L387 | V186-V336 HydrophobicContact CG2-CG2 4.34Å; T332-V336 WeakPolarHBondContact O-CG2 3.28Å; T332-V336 PolarHBondContact O-N 3.09Å; L333-V336 PolarHBondContact O-N 3.47Å; Y334-V336 VanDerWaalsContact C-N 3.32Å; Y334-V336 PolarHBondContact O-N 2.83Å; V336-V338 VanDerWaalsContact C-N 3.35Å; V336-V338 PolarHBondContact O-N 3.48Å; V336-F339 PolarHBondContact O-N 3.02Å; V336-V340 HydrophobicContact CG1-CG2 4.38Å; V336-V340 VanDerWaalsContact O-CG2 3.32Å; V336-V340 WeakPolarHBondContact O-CG2 3.06Å; V336-V340 PolarHBondContact O-N 3.34Å; V336-L387 HydrophobicContact CG1-CD1 4.24Å |
| 337 | G | 91.3 | Very high | 84.4 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.6 | -45.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | L333 Y334 V340 S341 G390 L391 | L333-G337 PolarHBondContact O-N 3.4Å; Y334-G337 WeakPolarHBondContact O-CA 3.39Å; Y334-G337 PolarHBondContact O-N 2.95Å; Y334-G337 VanDerWaalsContact O-N 3.08Å; G337-V340 PolarHBondContact O-N 3.48Å; G337-S341 WeakPolarHBondContact O-CB 3.34Å; G337-S341 PolarHBondContact O-N 3.41Å; G337-S341 PolarHBondContact O-OG 3.38Å; G337-G390 VanDerWaalsContact C-C 3.45Å; G337-G390 CarbonylContact C-O 3.46Å; G337-L391 WeakPolarHBondContact O-CD2 3.42Å |
| 338 | V | 90.9 | Very high | 84.4 | Confident | 4 Ų | 4 | 53.9 Ų | 53.9 | 2% | 0.024 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 175.7 | 176 | 0 | 0 | 0 | 0 | 111 | Y334 Q335 V336 V340 S341 R342 G390 | Y334-V338 HydrophobicContact CD2-CG2 4.23Å; Y334-V338 HydrophobicContact CE1-CG2 4.29Å; Y334-V338 HydrophobicContact CE2-CG2 3.67Å; Y334-V338 WeakPolarHBondContact O-CG2 3.32Å; Y334-V338 PolarHBondContact O-N 3.23Å; Q335-V338 PolarHBondContact O-N 3.37Å; V336-V338 VanDerWaalsContact C-N 3.35Å; V336-V338 PolarHBondContact O-N 3.48Å; V338-V340 PolarHBondContact O-N 2.93Å; V338-S341 WeakPolarHBondContact CA-OG 3.28Å; V338-S341 PolarHBondContact O-N 3.17Å; V338-S341 PolarHBondContact O-OG 3.24Å; V338-R342 HydrophobicContact CG1-CG 4.12Å; V338-R342 WeakPolarHBondContact O-CB 3.35Å; V338-R342 VanDerWaalsContact O-CG 3.25Å; V338-R342 WeakPolarHBondContact O-CG 3.07Å; V338-R342 PolarHBondContact O-N 3.43Å; V338-G390 WeakPolarHBondContact CA-O 3.46Å; V338-G390 WeakPolarHBondContact CG2-O 3.41Å; V338-G390 PolarHBondContact N-O 2.88Å |
| 339 | F | 90.4 | Very high | 84.6 | Confident | 71 Ų | 71 | 53.3 Ų | 53.3 | 31% | 0.311 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.7 | -45.7 | 179.9 | 175 | -115.7 | 0 | 0 | 0 | 112.7 | A183 V186 Q335 V336 S343 | A183-F339 HydrophobicContact CB-CD2 3.92Å; A183-F339 HydrophobicContact CB-CE2 3.82Å; V186-F339 HydrophobicContact CG2-CB 4.14Å; Q335-F339 WeakPolarHBondContact O-CB 3.4Å; Q335-F339 PolarHBondContact O-N 3.41Å; V336-F339 PolarHBondContact O-N 3.02Å; F339-S343 WeakPolarHBondContact O-CB 3.27Å; F339-S343 PolarHBondContact O-N 3.33Å; F339-S343 PolarHBondContact O-OG 3.39Å |
| 340 | V | 91.7 | Very high | 84.5 | Confident | 79 Ų | 79 | 50.6 Ų | 50.6 | 48% | 0.479 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62.3 | -46.9 | 178.3 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | V336 G337 V338 S343 S344 L391 | V336-V340 HydrophobicContact CG1-CG2 4.38Å; V336-V340 VanDerWaalsContact O-CG2 3.32Å; V336-V340 WeakPolarHBondContact O-CG2 3.06Å; V336-V340 PolarHBondContact O-N 3.34Å; G337-V340 PolarHBondContact O-N 3.48Å; V338-V340 PolarHBondContact O-N 2.93Å; V340-S343 PolarHBondContact O-N 3.14Å; V340-S344 PolarHBondContact O-N 3.27Å; V340-S344 VanDerWaalsContact O-N 3.13Å; V340-L391 HydrophobicContact CB-CD2 4.07Å; V340-L391 HydrophobicContact CG1-CD2 3.86Å |
| 341 | S | 90.6 | Very high | 83.9 | Confident | 2 Ų | 2 | 59.4 Ų | 59.4 | 1% | 0.014 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -68.3 | -40.9 | -179 | 51.9 | 0 | 0 | 0 | 0 | 113.2 | G337 V338 S343 S344 G390 L391 G394 | G337-S341 WeakPolarHBondContact O-CB 3.34Å; G337-S341 PolarHBondContact O-N 3.41Å; G337-S341 PolarHBondContact O-OG 3.38Å; V338-S341 WeakPolarHBondContact CA-OG 3.28Å; V338-S341 PolarHBondContact O-N 3.17Å; V338-S341 PolarHBondContact O-OG 3.24Å; S341-S343 VanDerWaalsContact C-N 3.25Å; S341-S343 PolarHBondContact O-N 2.83Å; S341-S344 VanDerWaalsContact O-CB 3.3Å; S341-S344 WeakPolarHBondContact O-CB 3.38Å; S341-S344 PolarHBondContact O-N 2.95Å; S341-S344 VanDerWaalsContact O-N 3.09Å; S341-S344 PolarHBondContact O-OG 3.5Å; S341-G390 PolarHBondContact OG-O 2.96Å; S341-L391 WeakPolarHBondContact CB-O 3.42Å; S341-L391 PolarHBondContact OG-O 3.27Å; S341-G394 WeakPolarHBondContact OG-CA 3.49Å |
| 342 | R | 88.2 | Confident | 83.8 | Confident | 23 Ų | 23 | 65 Ų | 65 | 9% | 0.087 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66.2 | -30.1 | 175.8 | -67 | -168.6 | -179.5 | -175.6 | 1.2 | 112.3 | G178 T181 Y300 V338 S344 V398 | G178-R342 VanDerWaalsContact O-CB 3.28Å; G178-R342 WeakPolarHBondContact O-CB 3.5Å; G178-R342 WeakPolarHBondContact O-CD 3.2Å; T181-R342 VanDerWaalsContact CB-NH1 3.27Å; T181-R342 PolarHBondContact OG1-NH1 3.44Å; Y300-R342 PolarHBondContact OH-NH2 3.15Å; V338-R342 HydrophobicContact CG1-CG 4.12Å; V338-R342 WeakPolarHBondContact O-CB 3.35Å; V338-R342 VanDerWaalsContact O-CG 3.25Å; V338-R342 WeakPolarHBondContact O-CG 3.07Å; V338-R342 PolarHBondContact O-N 3.43Å; R342-S344 VanDerWaalsContact C-N 3.3Å; R342-V398 HydrophobicContact CB-CG1 3.75Å; R342-V398 HydrophobicContact CG-CG1 3.81Å |
| 343 | S | 87.8 | Confident | 83.6 | Confident | 44 Ų | 44 | 64 Ų | 64 | 31% | 0.308 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -76.1 | -16.7 | 174.5 | -56.6 | 0 | 0 | 0 | 0 | 113.3 | S179 F339 V340 S341 L345 | S179-S343 PolarHBondContact OG-OG 2.93Å; F339-S343 WeakPolarHBondContact O-CB 3.27Å; F339-S343 PolarHBondContact O-N 3.33Å; F339-S343 PolarHBondContact O-OG 3.39Å; V340-S343 PolarHBondContact O-N 3.14Å; S341-S343 VanDerWaalsContact C-N 3.25Å; S341-S343 PolarHBondContact O-N 2.83Å; S343-L345 VanDerWaalsContact C-N 3.26Å; S343-L345 PolarHBondContact O-N 3.47Å |
| 344 | S | 85.1 | Confident | 83.5 | Confident | 23 Ų | 23 | 65.9 Ų | 65.9 | 16% | 0.161 | 31% | 0.313 | C | S | . | . | G | 310 helix | trans | -73.1 | -10.7 | -176.9 | 78.4 | 0 | 0 | 0 | 0 | 114.8 | V340 S341 R342 R346 L347 K348 | V340-S344 PolarHBondContact O-N 3.27Å; V340-S344 VanDerWaalsContact O-N 3.13Å; S341-S344 VanDerWaalsContact O-CB 3.3Å; S341-S344 WeakPolarHBondContact O-CB 3.38Å; S341-S344 PolarHBondContact O-N 2.95Å; S341-S344 VanDerWaalsContact O-N 3.09Å; S341-S344 PolarHBondContact O-OG 3.5Å; R342-S344 VanDerWaalsContact C-N 3.3Å; S344-R346 PolarHBondContact O-N 3.49Å; S344-R346 VanDerWaalsContact O-N 3.09Å; S344-L347 WeakPolarHBondContact O-CA 3.45Å; S344-L347 WeakPolarHBondContact O-CB 3.16Å; S344-L347 PolarHBondContact O-N 2.83Å; S344-K348 PolarHBondContact O-N 3.32Å |
| 345 | L | 75.8 | Confident | 83.6 | Confident | 1 Ų | 1 | 69.4 Ų | 69.4 | 1% | 0.005 | 33% | 0.331 | C | S | . | . | G | 310 helix | trans | -59 | -27.2 | -178.2 | -170.8 | 61.1 | 0 | 0 | 0 | 112.7 | E175 S343 L347 K349 V398 H402 | E175-L345 HydrophobicContact CB-CD2 4.41Å; E175-L345 HydrophobicContact CG-CB 4.27Å; E175-L345 HydrophobicContact CG-CD2 3.64Å; E175-L345 HydrophobicContact CG-CG 3.98Å; S343-L345 VanDerWaalsContact C-N 3.26Å; S343-L345 PolarHBondContact O-N 3.47Å; L345-L347 VanDerWaalsContact C-N 3.32Å; L345-K349 HydrophobicContact CD1-CG 4.16Å; L345-V398 HydrophobicContact CB-CB 4.25Å; L345-V398 HydrophobicContact CB-CG2 3.99Å; L345-V398 HydrophobicContact CD1-CB 4.47Å; L345-V398 HydrophobicContact CD1-CG2 4.21Å; L345-V398 HydrophobicContact CD2-CB 3.95Å; L345-V398 HydrophobicContact CD2-CG2 4.47Å; L345-V398 HydrophobicContact CG-CB 4.45Å; L345-V398 HydrophobicContact CG-CG2 4.44Å; L345-H402 HydrophobicContact CD1-CB 4.18Å; L345-H402 HydrophobicContact CD2-CB 4.16Å |
| 346 | R | 70.8 | Confident | 83.7 | Confident | 156 Ų | 156 | 69 Ų | 69 | 59% | 0.589 | 33% | 0.329 | S | S | * | . | G | 310 helix | trans | -70.4 | -27.4 | 174.3 | -156.1 | -170.1 | -66.7 | -176.3 | 0.7 | 112.9 | W27 S344 | W27-R346 VanDerWaalsContact CZ2-NH2 3.31Å; S344-R346 PolarHBondContact O-N 3.49Å; S344-R346 VanDerWaalsContact O-N 3.09Å |
| 347 | L | 73.6 | Confident | 83.7 | Confident | 155 Ų | 155 | 67 Ų | 67 | 81% | 0.812 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.8 | -47 | -174.3 | -61.6 | 173.8 | 0 | 0 | 0 | 112.3 | S344 L345 | S344-L347 WeakPolarHBondContact O-CA 3.45Å; S344-L347 WeakPolarHBondContact O-CB 3.16Å; S344-L347 PolarHBondContact O-N 2.83Å; L345-L347 VanDerWaalsContact C-N 3.32Å |
| 348 | K | 75.5 | Confident | 83.8 | Confident | 130 Ų | 130 | 72.4 Ų | 72.4 | 57% | 0.565 | 35% | 0.346 | S | S | * | . | trans | -150.3 | 137.7 | -174 | -165.1 | 168.7 | 177.2 | -176.8 | 0 | 112.6 | S344 F350 | S344-K348 PolarHBondContact O-N 3.32Å; K348-F350 HydrophobicContact CB-CE2 4.12Å; K348-F350 HydrophobicContact CB-CZ 4.48Å; K348-F350 HydrophobicContact CD-CE1 3.99Å; K348-F350 HydrophobicContact CD-CE2 3.89Å; K348-F350 HydrophobicContact CD-CZ 3.39Å; K348-F350 VanDerWaalsContact CE-CE1 3.43Å; K348-F350 HydrophobicContact CG-CD2 4.4Å; K348-F350 HydrophobicContact CG-CE1 4.31Å; K348-F350 HydrophobicContact CG-CE2 3.78Å; K348-F350 HydrophobicContact CG-CZ 3.75Å | ||
| 349 | K | 79.8 | Confident | 84 | Confident | 109 Ų | 109 | 75.4 Ų | 75.4 | 47% | 0.474 | 36% | 0.361 | S | S | . | . | trans | -115.4 | 134.6 | -178.3 | -60.2 | 175.7 | -177.4 | -176.3 | 0 | 110 | L345 N399 H402 | L345-K349 HydrophobicContact CD1-CG 4.16Å; K349-N399 WeakPolarHBondContact CA-OD1 3.44Å; K349-H402 PolarHBondContact NZ-NE2 3.34Å | ||
| 350 | F | 78.4 | Confident | 84.2 | Confident | 72 Ų | 72 | 72 Ų | 72 | 32% | 0.316 | 35% | 0.346 | S | S | . | . | trans | -125.5 | 112.5 | -176 | -65.3 | -84.5 | 0 | 0 | 0 | 110.7 | K348 F356 V395 N399 F403 | K348-F350 HydrophobicContact CB-CE2 4.12Å; K348-F350 HydrophobicContact CB-CZ 4.48Å; K348-F350 HydrophobicContact CD-CE1 3.99Å; K348-F350 HydrophobicContact CD-CE2 3.89Å; K348-F350 HydrophobicContact CD-CZ 3.39Å; K348-F350 VanDerWaalsContact CE-CE1 3.43Å; K348-F350 HydrophobicContact CG-CD2 4.4Å; K348-F350 HydrophobicContact CG-CE1 4.31Å; K348-F350 HydrophobicContact CG-CE2 3.78Å; K348-F350 HydrophobicContact CG-CZ 3.75Å; F350-F356 HydrophobicContact CB-CE2 3.8Å; F350-F356 HydrophobicContact CB-CZ 3.59Å; F350-F356 HydrophobicContact CD1-CZ 4.43Å; F350-F356 HydrophobicContact CD2-CZ 4.09Å; F350-F356 AromaticContact CG-CZ 3.83Å; F350-F356 HydrophobicContact CG-CZ 3.83Å; F350-V395 HydrophobicContact CD2-CG1 4.08Å; F350-N399 PolarHBondContact N-OD1 3.43Å; F350-N399 PolarHBondContact O-OD1 3.28Å; F350-F403 VanDerWaalsContact O-CE2 3.28Å; F350-F403 WeakPolarHBondContact O-CE2 3.26Å | ||
| 351 | R | 73.4 | Confident | 84.3 | Confident | 187 Ų | 187 | 71.3 Ų | 71.3 | 71% | 0.706 | 34% | 0.338 | S | S | * | . | S | Bend | trans | -74.3 | -26.8 | -175 | -160.6 | 175.5 | 89.1 | 162.1 | 5.3 | 114.3 | T353 F403 | R351-T353 PolarHBondContact O-N 3.29Å; R351-F403 HydrophobicContact CB-CE1 4.17Å; R351-F403 HydrophobicContact CB-CE2 4.26Å; R351-F403 HydrophobicContact CB-CZ 3.8Å; R351-F403 HydrophobicContact CG-CD1 4.21Å; R351-F403 HydrophobicContact CG-CE1 3.79Å; R351-F403 HydrophobicContact CG-CE2 4.4Å; R351-F403 HydrophobicContact CG-CZ 3.92Å |
| 352 | K | 78.4 | Confident | 84.5 | Confident | 152 Ų | 152 | 75.6 Ų | 75.6 | 66% | 0.661 | 36% | 0.364 | S | S | * | . | trans | -90.4 | 76.3 | -173.2 | -66.6 | -172 | 178 | -175.6 | 0 | 111.1 | C354 I355 | K352-C354 PolarHBondContact O-N 3.42Å; K352-I355 HydrophobicContact CB-CD1 3.63Å; K352-I355 HydrophobicContact CB-CG1 3.91Å; K352-I355 HydrophobicContact CD-CD1 3.64Å; K352-I355 HydrophobicContact CD-CG1 4.45Å; K352-I355 HydrophobicContact CG-CD1 4.28Å; K352-I355 WeakPolarHBondContact O-CB 3.2Å; K352-I355 PolarHBondContact O-N 3.09Å; K352-I355 VanDerWaalsContact O-N 3.14Å | ||
| 353 | T | 77.7 | Confident | 84.8 | Confident | 7 Ų | 7 | 75 Ų | 75 | 4% | 0.043 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.9 | -28.9 | 178.8 | 44 | 0 | 0 | 0 | 0 | 113.6 | R351 I355 F356 S357 T400 | R351-T353 PolarHBondContact O-N 3.29Å; T353-I355 PolarHBondContact O-N 3.03Å; T353-F356 PolarHBondContact O-N 3.01Å; T353-F356 VanDerWaalsContact O-N 3.17Å; T353-S357 PolarHBondContact O-N 3.36Å; T353-T400 VanDerWaalsContact CG2-OG1 3.31Å; T353-T400 WeakPolarHBondContact CG2-OG1 3.29Å |
| 354 | C | 87.1 | Confident | 85.1 | Confident | 77 Ų | 77 | 73.2 Ų | 73.2 | 52% | 0.52 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59.9 | -29 | 174.4 | -57.8 | 0 | 0 | 0 | 0 | 113.9 | P295 K352 S357 L358 | P295-C354 VanDerWaalsContact CG-SG 3.57Å; K352-C354 PolarHBondContact O-N 3.42Å; C354-S357 PolarHBondContact O-N 3.32Å; C354-L358 PolarHBondContact O-N 2.91Å |
| 355 | I | 90.7 | Very high | 85.5 | Confident | 81 Ų | 81 | 75.5 Ų | 75.5 | 42% | 0.415 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.1 | -47.4 | 177.7 | -68.6 | 179.5 | 0 | 0 | 0 | 108.9 | K352 T353 S357 L358 L359 | K352-I355 HydrophobicContact CB-CD1 3.63Å; K352-I355 HydrophobicContact CB-CG1 3.91Å; K352-I355 HydrophobicContact CD-CD1 3.64Å; K352-I355 HydrophobicContact CD-CG1 4.45Å; K352-I355 HydrophobicContact CG-CD1 4.28Å; K352-I355 WeakPolarHBondContact O-CB 3.2Å; K352-I355 PolarHBondContact O-N 3.09Å; K352-I355 VanDerWaalsContact O-N 3.14Å; T353-I355 PolarHBondContact O-N 3.03Å; I355-S357 VanDerWaalsContact C-N 3.29Å; I355-S357 PolarHBondContact O-N 2.92Å; I355-L358 PolarHBondContact O-N 3.27Å; I355-L358 VanDerWaalsContact O-N 3.12Å; I355-L359 HydrophobicContact CB-CD1 4.36Å; I355-L359 HydrophobicContact CG2-CD1 3.21Å; I355-L359 WeakPolarHBondContact O-CD1 3.42Å; I355-L359 PolarHBondContact O-N 3.46Å |
| 356 | F | 90.7 | Very high | 86.4 | Confident | 24 Ų | 24 | 79.2 Ų | 79.2 | 11% | 0.105 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60.6 | -39.5 | 178.8 | -55.1 | -56.6 | 0 | 0 | 0 | 112.4 | V299 F350 T353 L359 Q360 L392 V395 A396 | V299-F356 HydrophobicContact CG2-CB 4.35Å; F350-F356 HydrophobicContact CB-CE2 3.8Å; F350-F356 HydrophobicContact CB-CZ 3.59Å; F350-F356 HydrophobicContact CD1-CZ 4.43Å; F350-F356 HydrophobicContact CD2-CZ 4.09Å; F350-F356 AromaticContact CG-CZ 3.83Å; F350-F356 HydrophobicContact CG-CZ 3.83Å; T353-F356 PolarHBondContact O-N 3.01Å; T353-F356 VanDerWaalsContact O-N 3.17Å; F356-L359 PolarHBondContact O-N 3.06Å; F356-Q360 WeakPolarHBondContact O-CB 3.47Å; F356-Q360 PolarHBondContact O-N 3.27Å; F356-L392 HydrophobicContact CD1-CD2 3.89Å; F356-V395 HydrophobicContact CD1-CG1 4.38Å; F356-V395 HydrophobicContact CD2-CG1 4.28Å; F356-V395 HydrophobicContact CE1-CG1 3.74Å; F356-V395 HydrophobicContact CE2-CG1 3.64Å; F356-V395 HydrophobicContact CZ-CG1 3.33Å; F356-A396 HydrophobicContact CB-CB 3.96Å; F356-A396 HydrophobicContact CD2-CB 4.29Å; F356-A396 HydrophobicContact CG-CB 4.38Å |
| 357 | S | 91.1 | Very high | 87.4 | Confident | 9 Ų | 9 | 72 Ų | 72 | 6% | 0.063 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.7 | -46.8 | 173.5 | 176.7 | 0 | 0 | 0 | 0 | 112.4 | L298 V299 T353 C354 I355 Q360 M361 | L298-S357 WeakPolarHBondContact CB-OG 3.17Å; V299-S357 VanDerWaalsContact CG2-CA 3.42Å; T353-S357 PolarHBondContact O-N 3.36Å; C354-S357 PolarHBondContact O-N 3.32Å; I355-S357 VanDerWaalsContact C-N 3.29Å; I355-S357 PolarHBondContact O-N 2.92Å; S357-Q360 PolarHBondContact O-N 3.02Å; S357-M361 WeakPolarHBondContact O-CG 3.32Å; S357-M361 PolarHBondContact O-N 3.36Å |
| 358 | L | 93.4 | Very high | 88.2 | Confident | 115 Ų | 115 | 67.1 Ų | 67.1 | 60% | 0.602 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -61.7 | -47.5 | 177.3 | -178.7 | 67.3 | 0 | 0 | 0 | 111.8 | C354 I355 Q360 M361 V362 | C354-L358 PolarHBondContact O-N 2.91Å; I355-L358 PolarHBondContact O-N 3.27Å; I355-L358 VanDerWaalsContact O-N 3.12Å; L358-Q360 VanDerWaalsContact C-N 3.28Å; L358-Q360 PolarHBondContact O-N 3.47Å; L358-M361 PolarHBondContact O-N 2.94Å; L358-V362 WeakPolarHBondContact O-CG2 3.49Å; L358-V362 PolarHBondContact O-N 3.36Å |
| 359 | L | 94.1 | Very high | 88.9 | Confident | 66 Ų | 66 | 65.8 Ų | 65.8 | 35% | 0.346 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.3 | -36.2 | 178.9 | -77 | 104.1 | 0 | 0 | 0 | 111.8 | I355 F356 V362 N363 Y388 L392 | I355-L359 HydrophobicContact CB-CD1 4.36Å; I355-L359 HydrophobicContact CG2-CD1 3.21Å; I355-L359 WeakPolarHBondContact O-CD1 3.42Å; I355-L359 PolarHBondContact O-N 3.46Å; F356-L359 PolarHBondContact O-N 3.06Å; L359-V362 PolarHBondContact O-N 3.21Å; L359-N363 WeakPolarHBondContact O-CB 3.47Å; L359-N363 PolarHBondContact O-N 3Å; L359-Y388 WeakPolarHBondContact CD2-OH 3.38Å; L359-L392 HydrophobicContact CB-CD1 3.87Å; L359-L392 HydrophobicContact CB-CD2 4.33Å |
| 360 | Q | 94.5 | Very high | 89.3 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.1 | -42.3 | 176.7 | -161.8 | 72.8 | -1.4 | 0 | 0 | 111.9 | V299 A302 F356 S357 L358 N363 A364 L392 | V299-Q360 HydrophobicContact CG1-CG 4.36Å; V299-Q360 HydrophobicContact CG2-CB 4.5Å; A302-Q360 HydrophobicContact CB-CB 4.2Å; A302-Q360 HydrophobicContact CB-CG 3.51Å; F356-Q360 WeakPolarHBondContact O-CB 3.47Å; F356-Q360 PolarHBondContact O-N 3.27Å; S357-Q360 PolarHBondContact O-N 3.02Å; L358-Q360 VanDerWaalsContact C-N 3.28Å; L358-Q360 PolarHBondContact O-N 3.47Å; Q360-N363 WeakPolarHBondContact O-CB 3.44Å; Q360-N363 PolarHBondContact O-N 2.98Å; Q360-A364 PolarHBondContact O-N 3.08Å; Q360-L392 VanDerWaalsContact OE1-CB 3.24Å |
| 361 | M | 94.5 | Very high | 89.7 | Confident | 64 Ų | 64 | 57.4 Ų | 57.4 | 32% | 0.315 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 175.6 | -69.1 | -58 | -58.6 | 0 | 0 | 111.7 | F301 A302 S357 L358 N363 A364 V365 | F301-M361 HydrophobicContact CD1-SD 4.4Å; A302-M361 HydrophobicContact CB-SD 3.79Å; S357-M361 WeakPolarHBondContact O-CG 3.32Å; S357-M361 PolarHBondContact O-N 3.36Å; L358-M361 PolarHBondContact O-N 2.94Å; M361-N363 VanDerWaalsContact C-N 3.29Å; M361-N363 PolarHBondContact O-N 2.95Å; M361-A364 PolarHBondContact O-N 2.94Å; M361-V365 WeakPolarHBondContact O-CG2 3.33Å; M361-V365 PolarHBondContact O-N 3.35Å |
| 362 | V | 95.2 | Very high | 90.3 | Very high | 92 Ų | 92 | 51.3 Ų | 51.3 | 56% | 0.558 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -61 | -41.6 | 174.1 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | L358 L359 V365 F366 | L358-V362 WeakPolarHBondContact O-CG2 3.49Å; L358-V362 PolarHBondContact O-N 3.36Å; L359-V362 PolarHBondContact O-N 3.21Å; V362-V365 PolarHBondContact O-N 3.36Å; V362-F366 WeakPolarHBondContact O-CB 3.46Å; V362-F366 PolarHBondContact O-N 2.74Å |
| 363 | N | 94.4 | Very high | 90.7 | Very high | 12 Ų | 12 | 50.9 Ų | 50.9 | 6% | 0.064 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 176.9 | -163.9 | 42.1 | 0 | 0 | 0 | 112.1 | L359 Q360 M361 F366 L367 I385 | L359-N363 WeakPolarHBondContact O-CB 3.47Å; L359-N363 PolarHBondContact O-N 3Å; Q360-N363 WeakPolarHBondContact O-CB 3.44Å; Q360-N363 PolarHBondContact O-N 2.98Å; M361-N363 VanDerWaalsContact C-N 3.29Å; M361-N363 PolarHBondContact O-N 2.95Å; N363-F366 PolarHBondContact O-N 3.34Å; N363-L367 PolarHBondContact O-N 2.99Å; N363-I385 WeakPolarHBondContact OD1-CG2 2.98Å |
| 364 | A | 93.1 | Very high | 90.9 | Very high | 6 Ų | 6 | 54.8 Ų | 54.8 | 5% | 0.05 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.7 | -45.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A302 I306 Q360 M361 F366 L367 I368 | A302-A364 HydrophobicContact CB-CB 4.11Å; I306-A364 HydrophobicContact CD1-CB 3.97Å; I306-A364 HydrophobicContact CG1-CB 3.96Å; Q360-A364 PolarHBondContact O-N 3.08Å; M361-A364 PolarHBondContact O-N 2.94Å; A364-F366 PolarHBondContact O-N 3.38Å; A364-L367 PolarHBondContact O-N 2.6Å; A364-I368 VanDerWaalsContact O-CG1 3.29Å; A364-I368 WeakPolarHBondContact O-CG1 3.34Å; A364-I368 PolarHBondContact O-N 3.03Å |
| 365 | V | 93.9 | Very high | 90.9 | Very high | 70 Ų | 70 | 56 Ų | 56 | 42% | 0.424 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 176.4 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | M361 V362 L367 I368 F369 | M361-V365 WeakPolarHBondContact O-CG2 3.33Å; M361-V365 PolarHBondContact O-N 3.35Å; V362-V365 PolarHBondContact O-N 3.36Å; V365-L367 VanDerWaalsContact C-N 3.34Å; V365-L367 PolarHBondContact O-N 3.03Å; V365-I368 PolarHBondContact O-N 3.18Å; V365-F369 HydrophobicContact CG1-CD2 3.8Å; V365-F369 HydrophobicContact CG1-CE2 3.54Å; V365-F369 WeakPolarHBondContact O-CD2 3.47Å; V365-F369 PolarHBondContact O-N 3.3Å; V365-F369 VanDerWaalsContact O-N 3.11Å |
| 366 | F | 93.9 | Very high | 90.7 | Very high | 79 Ų | 79 | 53 Ų | 53 | 35% | 0.346 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -58.1 | -45.5 | 175.8 | 177.4 | -91.3 | 0 | 0 | 0 | 111.9 | V362 N363 A364 F369 A370 F375 L376 I385 | V362-F366 WeakPolarHBondContact O-CB 3.46Å; V362-F366 PolarHBondContact O-N 2.74Å; N363-F366 PolarHBondContact O-N 3.34Å; A364-F366 PolarHBondContact O-N 3.38Å; F366-F369 PolarHBondContact O-N 3.16Å; F366-A370 PolarHBondContact O-N 3.21Å; F366-F375 HydrophobicContact CE1-CZ 4.45Å; F366-F375 HydrophobicContact CE2-CE2 4.22Å; F366-F375 AromaticContact CE2-CZ 3.76Å; F366-F375 HydrophobicContact CE2-CZ 3.76Å; F366-F375 AromaticContact CZ-CE2 3.99Å; F366-F375 HydrophobicContact CZ-CE2 3.99Å; F366-F375 AromaticContact CZ-CZ 3.72Å; F366-F375 HydrophobicContact CZ-CZ 3.72Å; F366-L376 HydrophobicContact CE1-CD2 4.26Å; F366-L376 HydrophobicContact CZ-CD2 4.08Å; F366-I385 HydrophobicContact CD1-CD1 4.24Å; F366-I385 HydrophobicContact CE1-CD1 3.57Å; F366-I385 HydrophobicContact CZ-CD1 4.44Å |
| 367 | L | 91.3 | Very high | 90.4 | Very high | 4 Ų | 4 | 57.2 Ų | 57.2 | 2% | 0.021 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -70.4 | -33.3 | 179.6 | -73.1 | 175.3 | 0 | 0 | 0 | 113 | I306 L310 L314 N363 A364 V365 F369 A370 V371 I385 | I306-L367 HydrophobicContact CB-CD1 4.36Å; I306-L367 HydrophobicContact CD1-CD1 4.12Å; I306-L367 HydrophobicContact CG1-CD1 4.05Å; I306-L367 HydrophobicContact CG2-CD1 3.35Å; L310-L367 HydrophobicContact CD1-CB 3.92Å; L314-L367 HydrophobicContact CD1-CD2 3.99Å; N363-L367 PolarHBondContact O-N 2.99Å; A364-L367 PolarHBondContact O-N 2.6Å; V365-L367 VanDerWaalsContact C-N 3.34Å; V365-L367 PolarHBondContact O-N 3.03Å; L367-F369 VanDerWaalsContact C-N 3.32Å; L367-F369 PolarHBondContact O-N 2.95Å; L367-A370 HydrophobicContact CD2-CB 4.47Å; L367-A370 WeakPolarHBondContact O-CB 3.48Å; L367-A370 PolarHBondContact O-N 3.41Å; L367-V371 WeakPolarHBondContact O-CG2 3.46Å; L367-V371 PolarHBondContact O-N 3.47Å; L367-I385 HydrophobicContact CD1-CG2 3.99Å; L367-I385 HydrophobicContact CD2-CG2 4.09Å; L367-I385 HydrophobicContact CG-CG2 4.22Å |
| 368 | I | 90.6 | Very high | 90.1 | Very high | 53 Ų | 53 | 58.7 Ų | 58.7 | 27% | 0.272 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -57.7 | -48.1 | 170.1 | -70.1 | 163.4 | 0 | 0 | 0 | 110 | F305 L310 A364 V365 A370 V371 L372 | F305-I368 HydrophobicContact CE1-CD1 3.91Å; F305-I368 HydrophobicContact CE1-CG1 4.07Å; L310-I368 HydrophobicContact CD1-CG1 3.74Å; L310-I368 HydrophobicContact CD2-CG1 4.02Å; A364-I368 VanDerWaalsContact O-CG1 3.29Å; A364-I368 WeakPolarHBondContact O-CG1 3.34Å; A364-I368 PolarHBondContact O-N 3.03Å; V365-I368 PolarHBondContact O-N 3.18Å; I368-A370 VanDerWaalsContact C-N 3.32Å; I368-A370 PolarHBondContact O-N 3.1Å; I368-V371 PolarHBondContact O-N 3.11Å; I368-L372 HydrophobicContact CG2-CD1 3.78Å; I368-L372 HydrophobicContact CG2-CG 4.44Å; I368-L372 WeakPolarHBondContact O-CG 3.36Å; I368-L372 PolarHBondContact O-N 2.82Å |
| 369 | F | 90.7 | Very high | 89.8 | Confident | 102 Ų | 102 | 53.8 Ų | 53.8 | 45% | 0.447 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65 | -36.3 | 176.6 | -76.6 | -62.5 | 0 | 0 | 0 | 112.6 | V365 F366 L367 V371 L372 F373 F375 | V365-F369 HydrophobicContact CG1-CD2 3.8Å; V365-F369 HydrophobicContact CG1-CE2 3.54Å; V365-F369 WeakPolarHBondContact O-CD2 3.47Å; V365-F369 PolarHBondContact O-N 3.3Å; V365-F369 VanDerWaalsContact O-N 3.11Å; F366-F369 PolarHBondContact O-N 3.16Å; L367-F369 VanDerWaalsContact C-N 3.32Å; L367-F369 PolarHBondContact O-N 2.95Å; F369-V371 VanDerWaalsContact C-N 3.33Å; F369-L372 HydrophobicContact CD1-CD1 4.41Å; F369-L372 PolarHBondContact O-N 2.84Å; F369-F373 HydrophobicContact CB-CD2 4.39Å; F369-F373 AromaticContact CD1-CD2 3.96Å; F369-F373 HydrophobicContact CD1-CD2 3.96Å; F369-F373 AromaticContact CD1-CE2 3.55Å; F369-F373 HydrophobicContact CD1-CE2 3.55Å; F369-F373 HydrophobicContact CE1-CE2 4.08Å; F369-F373 WeakPolarHBondContact O-CB 3.45Å; F369-F373 PolarHBondContact O-N 3.5Å; F369-F375 HydrophobicContact CB-CE1 4.41Å |
| 370 | A | 88.4 | Confident | 89.5 | Confident | 3 Ų | 3 | 59.6 Ų | 59.6 | 3% | 0.025 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.7 | -40.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F366 L367 I368 Q374 F375 L376 | F366-A370 PolarHBondContact O-N 3.21Å; L367-A370 HydrophobicContact CD2-CB 4.47Å; L367-A370 WeakPolarHBondContact O-CB 3.48Å; L367-A370 PolarHBondContact O-N 3.41Å; I368-A370 VanDerWaalsContact C-N 3.32Å; I368-A370 PolarHBondContact O-N 3.1Å; A370-Q374 WeakPolarHBondContact O-CA 3.17Å; A370-Q374 PolarHBondContact O-N 3.36Å; A370-F375 VanDerWaalsContact CA-CE1 3.47Å; A370-F375 HydrophobicContact CB-CE1 4.02Å; A370-F375 HydrophobicContact CB-CZ 4.24Å; A370-L376 HydrophobicContact CB-CD1 3.57Å; A370-L376 HydrophobicContact CB-CG 3.89Å |
| 371 | V | 86.7 | Confident | 89.3 | Confident | 2 Ų | 2 | 63.3 Ų | 63.3 | 1% | 0.012 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -68.2 | -47.9 | 174.2 | 175.7 | 0 | 0 | 0 | 0 | 110.5 | Y83 L310 L313 L314 L367 I368 F369 F373 Q374 F442 | Y83-V371 HydrophobicContact CE1-CG1 4.05Å; Y83-V371 PolarHBondContact OH-O 3.21Å; L310-V371 HydrophobicContact CB-CG2 4.37Å; L313-V371 HydrophobicContact CB-CG1 3.86Å; L313-V371 HydrophobicContact CD1-CG1 4.19Å; L314-V371 HydrophobicContact CB-CG2 4.29Å; L314-V371 HydrophobicContact CD1-CG2 3.91Å; L314-V371 HydrophobicContact CG-CG2 4.14Å; L367-V371 WeakPolarHBondContact O-CG2 3.46Å; L367-V371 PolarHBondContact O-N 3.47Å; I368-V371 PolarHBondContact O-N 3.11Å; F369-V371 VanDerWaalsContact C-N 3.33Å; V371-F373 PolarHBondContact O-N 3.5Å; V371-Q374 WeakPolarHBondContact O-CG 3.37Å; V371-F442 HydrophobicContact CB-CZ 4.44Å; V371-F442 HydrophobicContact CG1-CD1 4Å; V371-F442 HydrophobicContact CG1-CE1 3.66Å; V371-F442 HydrophobicContact CG1-CE2 4.35Å; V371-F442 HydrophobicContact CG1-CG 4.47Å; V371-F442 HydrophobicContact CG1-CZ 3.88Å |
| 372 | L | 86.2 | Confident | 89.1 | Confident | 59 Ų | 59 | 60.4 Ų | 60.4 | 31% | 0.309 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.9 | -45.5 | -178.2 | -76.1 | 166.1 | 0 | 0 | 0 | 113.6 | I368 F369 F442 | I368-L372 HydrophobicContact CG2-CD1 3.78Å; I368-L372 HydrophobicContact CG2-CG 4.44Å; I368-L372 WeakPolarHBondContact O-CG 3.36Å; I368-L372 PolarHBondContact O-N 2.82Å; F369-L372 HydrophobicContact CD1-CD1 4.41Å; F369-L372 PolarHBondContact O-N 2.84Å; L372-F442 HydrophobicContact CD2-CE1 3.39Å; L372-F442 HydrophobicContact CD2-CZ 3.62Å; L372-F442 HydrophobicContact CG-CE1 3.83Å; L372-F442 HydrophobicContact CG-CZ 3.77Å |
| 373 | F | 85.6 | Confident | 88.9 | Confident | 143 Ų | 143 | 57 Ų | 57 | 63% | 0.627 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -102.6 | -9.4 | -172.2 | -66.6 | -62.4 | 0 | 0 | 0 | 113.8 | F369 V371 F375 | F369-F373 HydrophobicContact CB-CD2 4.39Å; F369-F373 AromaticContact CD1-CD2 3.96Å; F369-F373 HydrophobicContact CD1-CD2 3.96Å; F369-F373 AromaticContact CD1-CE2 3.55Å; F369-F373 HydrophobicContact CD1-CE2 3.55Å; F369-F373 HydrophobicContact CE1-CE2 4.08Å; F369-F373 WeakPolarHBondContact O-CB 3.45Å; F369-F373 PolarHBondContact O-N 3.5Å; V371-F373 PolarHBondContact O-N 3.5Å; F373-F375 HydrophobicContact CB-CD1 4.05Å; F373-F375 PolarHBondContact O-N 2.9Å; F373-F375 VanDerWaalsContact O-N 3.08Å |
| 374 | Q | 82.9 | Confident | 88.8 | Confident | 90 Ų | 90 | 58.4 Ų | 58.4 | 42% | 0.421 | 30% | 0.296 | S | S | . | . | trans | 47.7 | 36.8 | -178.4 | -62.8 | -171.6 | -30.7 | 0 | 0 | 113.6 | A370 V371 L376 | A370-Q374 WeakPolarHBondContact O-CA 3.17Å; A370-Q374 PolarHBondContact O-N 3.36Å; V371-Q374 WeakPolarHBondContact O-CG 3.37Å; Q374-L376 VanDerWaalsContact C-N 3.32Å; Q374-L376 PolarHBondContact O-N 3.41Å | ||
| 375 | F | 87.1 | Confident | 88.8 | Confident | 101 Ų | 101 | 59.3 Ų | 59.3 | 44% | 0.443 | 30% | 0.3 | S | S | . | . | trans | -81.6 | -10.3 | -174.4 | 71.1 | -96.6 | 0 | 0 | 0 | 113.7 | F366 F369 A370 F373 P377 | F366-F375 HydrophobicContact CE1-CZ 4.45Å; F366-F375 HydrophobicContact CE2-CE2 4.22Å; F366-F375 AromaticContact CE2-CZ 3.76Å; F366-F375 HydrophobicContact CE2-CZ 3.76Å; F366-F375 AromaticContact CZ-CE2 3.99Å; F366-F375 HydrophobicContact CZ-CE2 3.99Å; F366-F375 AromaticContact CZ-CZ 3.72Å; F366-F375 HydrophobicContact CZ-CZ 3.72Å; F369-F375 HydrophobicContact CB-CE1 4.41Å; A370-F375 VanDerWaalsContact CA-CE1 3.47Å; A370-F375 HydrophobicContact CB-CE1 4.02Å; A370-F375 HydrophobicContact CB-CZ 4.24Å; F373-F375 HydrophobicContact CB-CD1 4.05Å; F373-F375 PolarHBondContact O-N 2.9Å; F373-F375 VanDerWaalsContact O-N 3.08Å; F375-P377 WeakPolarHBondContact O-CD 3.07Å | ||
| 376 | L | 86.1 | Confident | 88.7 | Confident | 19 Ų | 19 | 56 Ų | 56 | 10% | 0.099 | 28% | 0.28 | C | S | . | . | trans | -70.5 | 124.3 | -178.8 | -69.3 | 179.8 | 0 | 0 | 0 | 109.8 | F316 F366 A370 Q374 I381 V382 | F316-L376 HydrophobicContact CE1-CB 4.16Å; F316-L376 WeakPolarHBondContact CE1-O 3.33Å; F316-L376 HydrophobicContact CZ-CB 4.04Å; F366-L376 HydrophobicContact CE1-CD2 4.26Å; F366-L376 HydrophobicContact CZ-CD2 4.08Å; A370-L376 HydrophobicContact CB-CD1 3.57Å; A370-L376 HydrophobicContact CB-CG 3.89Å; Q374-L376 VanDerWaalsContact C-N 3.32Å; Q374-L376 PolarHBondContact O-N 3.41Å; L376-I381 HydrophobicContact CD2-CG2 4.25Å; L376-V382 HydrophobicContact CD1-CG2 3.44Å; L376-V382 VanDerWaalsContact CD1-CG2 3.44Å | ||
| 377 | P | 83.8 | Confident | 88.7 | Confident | 112 Ų | 112 | 55.1 Ų | 55.1 | 73% | 0.727 | 28% | 0.279 | S | S | * | . | trans | -84.5 | -15.4 | -172.5 | 31.7 | -36 | 0 | 0 | 0 | 113.8 | F375 I381 | F375-P377 WeakPolarHBondContact O-CD 3.07Å; P377-I381 HydrophobicContact CG-CD1 3.79Å | ||
| 378 | S | 86.7 | Confident | 88.8 | Confident | 40 Ų | 40 | 59.1 Ų | 59.1 | 28% | 0.28 | 29% | 0.294 | S | S | . | . | trans | -152.3 | 138.9 | -169.6 | 177.4 | 0 | 0 | 0 | 0 | 112.7 | W380 I381 | S378-W380 PolarHBondContact O-N 3.49Å; S378-W380 PolarHBondContact OG-N 2.98Å; S378-I381 PolarHBondContact O-N 2.97Å | ||
| 379 | I | 85.9 | Confident | 89 | Confident | 13 Ų | 13 | 56.6 Ų | 56.6 | 7% | 0.067 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.1 | -31.5 | 174.8 | -170 | 170.1 | 0 | 0 | 0 | 112.8 | F316 L321 Q326 Y330 I381 V382 F383 | F316-I379 HydrophobicContact CB-CB 4.44Å; F316-I379 HydrophobicContact CD2-CB 3.77Å; F316-I379 HydrophobicContact CD2-CD1 4.41Å; F316-I379 HydrophobicContact CD2-CG1 3.92Å; F316-I379 HydrophobicContact CE2-CB 4.19Å; F316-I379 HydrophobicContact CE2-CG1 4.3Å; F316-I379 HydrophobicContact CG-CB 4.1Å; L321-I379 HydrophobicContact CD1-CD1 4.33Å; Q326-I379 HydrophobicContact CB-CD1 4.2Å; Q326-I379 HydrophobicContact CG-CD1 3.58Å; Y330-I379 HydrophobicContact CE1-CD1 4.39Å; Y330-I379 HydrophobicContact CE1-CG1 4.12Å; I379-I381 PolarHBondContact O-N 3.07Å; I379-V382 WeakPolarHBondContact O-CB 3.44Å; I379-V382 PolarHBondContact O-N 2.84Å; I379-F383 HydrophobicContact CD1-CE1 3.8Å; I379-F383 HydrophobicContact CD1-CZ 3.77Å; I379-F383 HydrophobicContact CG1-CD1 4.07Å; I379-F383 HydrophobicContact CG1-CE1 3.69Å; I379-F383 HydrophobicContact CG1-CZ 3.92Å; I379-F383 PolarHBondContact O-N 2.9Å |
| 380 | W | 88.4 | Confident | 89.1 | Confident | 187 Ų | 187 | 51.8 Ų | 51.8 | 71% | 0.708 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -64.2 | -30.3 | -179.1 | -61.4 | 108.3 | 0 | 0 | 0 | 112.7 | S378 F383 G384 | S378-W380 PolarHBondContact O-N 3.49Å; S378-W380 PolarHBondContact OG-N 2.98Å; W380-F383 HydrophobicContact CD2-CD2 4.49Å; W380-F383 AromaticContact CE3-CD2 3.63Å; W380-F383 HydrophobicContact CE3-CD2 3.63Å; W380-F383 HydrophobicContact CE3-CE2 4.1Å; W380-F383 AromaticContact CZ3-CD2 3.82Å; W380-F383 HydrophobicContact CZ3-CD2 3.82Å; W380-F383 AromaticContact CZ3-CE2 3.94Å; W380-F383 HydrophobicContact CZ3-CE2 3.94Å; W380-G384 PolarHBondContact O-N 3.01Å; W380-G384 VanDerWaalsContact O-N 3.12Å |
| 381 | I | 89.9 | Confident | 89.3 | Confident | 78 Ų | 78 | 54.4 Ų | 54.4 | 40% | 0.4 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -67.4 | -42.9 | 175.1 | -63.3 | 170.9 | 0 | 0 | 0 | 109.4 | L376 P377 S378 I379 G384 I385 | L376-I381 HydrophobicContact CD2-CG2 4.25Å; P377-I381 HydrophobicContact CG-CD1 3.79Å; S378-I381 PolarHBondContact O-N 2.97Å; I379-I381 PolarHBondContact O-N 3.07Å; I381-G384 PolarHBondContact O-N 3.42Å; I381-I385 HydrophobicContact CG2-CD1 3.97Å; I381-I385 WeakPolarHBondContact O-CG1 3.3Å; I381-I385 PolarHBondContact O-N 3.29Å |
| 382 | V | 90.3 | Very high | 89.6 | Confident | 3 Ų | 3 | 55 Ų | 55 | 2% | 0.018 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.9 | -42.8 | 177.3 | 176 | 0 | 0 | 0 | 0 | 111 | L314 F316 Y330 L376 I379 G384 I385 I386 | L314-V382 HydrophobicContact CD2-CB 4.49Å; L314-V382 HydrophobicContact CD2-CG1 4.17Å; L314-V382 HydrophobicContact CD2-CG2 3.67Å; F316-V382 HydrophobicContact CE2-CB 4.18Å; F316-V382 HydrophobicContact CE2-CG2 3.64Å; F316-V382 HydrophobicContact CZ-CG2 3.56Å; Y330-V382 HydrophobicContact CD1-CG1 4.36Å; Y330-V382 HydrophobicContact CE1-CB 4.4Å; Y330-V382 HydrophobicContact CE1-CG1 3.68Å; L376-V382 HydrophobicContact CD1-CG2 3.44Å; L376-V382 VanDerWaalsContact CD1-CG2 3.44Å; I379-V382 WeakPolarHBondContact O-CB 3.44Å; I379-V382 PolarHBondContact O-N 2.84Å; V382-G384 VanDerWaalsContact C-N 3.26Å; V382-G384 PolarHBondContact O-N 3.49Å; V382-I385 PolarHBondContact O-N 2.97Å; V382-I385 VanDerWaalsContact O-N 3.08Å; V382-I386 HydrophobicContact CG1-CD1 3.57Å; V382-I386 HydrophobicContact CG1-CG1 4.09Å; V382-I386 WeakPolarHBondContact O-CB 3.32Å; V382-I386 VanDerWaalsContact O-CG1 3.26Å; V382-I386 WeakPolarHBondContact O-CG1 3.3Å; V382-I386 PolarHBondContact O-N 2.88Å |
| 383 | F | 90.7 | Very high | 89.8 | Confident | 21 Ų | 21 | 52.1 Ų | 52.1 | 9% | 0.092 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -54.1 | -43.1 | 172.3 | -76.4 | 0.4 | 0 | 0 | 0 | 112.4 | L321 W329 Y330 L333 I379 W380 L387 | L321-F383 HydrophobicContact CD1-CZ 4.26Å; W329-F383 HydrophobicContact CB-CE1 4.1Å; W329-F383 HydrophobicContact CB-CZ 3.85Å; W329-F383 HydrophobicContact CG-CZ 4.46Å; Y330-F383 AromaticContact CD1-CD1 3.55Å; Y330-F383 HydrophobicContact CD1-CD1 3.55Å; Y330-F383 AromaticContact CD1-CE1 3.4Å; Y330-F383 HydrophobicContact CD1-CE1 3.4Å; Y330-F383 VanDerWaalsContact CD1-CE1 3.4Å; Y330-F383 AromaticContact CE1-CD1 3.46Å; Y330-F383 HydrophobicContact CE1-CD1 3.46Å; Y330-F383 VanDerWaalsContact CE1-CD1 3.46Å; Y330-F383 AromaticContact CE1-CE1 3.29Å; Y330-F383 HydrophobicContact CE1-CE1 3.29Å; L333-F383 HydrophobicContact CD1-CB 3.45Å; L333-F383 VanDerWaalsContact CD1-CB 3.45Å; L333-F383 HydrophobicContact CD1-CD1 3.57Å; L333-F383 HydrophobicContact CD1-CD2 3.76Å; L333-F383 HydrophobicContact CD1-CE1 4.19Å; L333-F383 HydrophobicContact CD1-CE2 4.37Å; L333-F383 HydrophobicContact CD1-CG 3.31Å; I379-F383 HydrophobicContact CD1-CE1 3.8Å; I379-F383 HydrophobicContact CD1-CZ 3.77Å; I379-F383 HydrophobicContact CG1-CD1 4.07Å; I379-F383 HydrophobicContact CG1-CE1 3.69Å; I379-F383 HydrophobicContact CG1-CZ 3.92Å; I379-F383 PolarHBondContact O-N 2.9Å; W380-F383 HydrophobicContact CD2-CD2 4.49Å; W380-F383 AromaticContact CE3-CD2 3.63Å; W380-F383 HydrophobicContact CE3-CD2 3.63Å; W380-F383 HydrophobicContact CE3-CE2 4.1Å; W380-F383 AromaticContact CZ3-CD2 3.82Å; W380-F383 HydrophobicContact CZ3-CD2 3.82Å; W380-F383 AromaticContact CZ3-CE2 3.94Å; W380-F383 HydrophobicContact CZ3-CE2 3.94Å; F383-L387 WeakPolarHBondContact O-CB 2.99Å; F383-L387 PolarHBondContact O-N 3.49Å |
| 384 | G | 92.8 | Very high | 90 | Very high | 42 Ų | 42 | 45.3 Ų | 45.3 | 43% | 0.433 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63.9 | -42.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | W380 I381 V382 Y388 | W380-G384 PolarHBondContact O-N 3.01Å; W380-G384 VanDerWaalsContact O-N 3.12Å; I381-G384 PolarHBondContact O-N 3.42Å; V382-G384 VanDerWaalsContact C-N 3.26Å; V382-G384 PolarHBondContact O-N 3.49Å; G384-Y388 WeakPolarHBondContact O-CB 3.01Å; G384-Y388 PolarHBondContact O-N 2.02Å |
| 385 | I | 93.1 | Very high | 90.4 | Very high | 24 Ų | 24 | 41.9 Ų | 41.9 | 12% | 0.123 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.3 | -41 | 178.1 | -67.8 | 164.8 | 0 | 0 | 0 | 111.4 | N363 F366 L367 I381 V382 Y388 E389 | N363-I385 WeakPolarHBondContact OD1-CG2 2.98Å; F366-I385 HydrophobicContact CD1-CD1 4.24Å; F366-I385 HydrophobicContact CE1-CD1 3.57Å; F366-I385 HydrophobicContact CZ-CD1 4.44Å; L367-I385 HydrophobicContact CD1-CG2 3.99Å; L367-I385 HydrophobicContact CD2-CG2 4.09Å; L367-I385 HydrophobicContact CG-CG2 4.22Å; I381-I385 HydrophobicContact CG2-CD1 3.97Å; I381-I385 WeakPolarHBondContact O-CG1 3.3Å; I381-I385 PolarHBondContact O-N 3.29Å; V382-I385 PolarHBondContact O-N 2.97Å; V382-I385 VanDerWaalsContact O-N 3.08Å; I385-Y388 WeakPolarHBondContact O-CB 3.41Å; I385-Y388 PolarHBondContact O-N 3.13Å; I385-E389 WeakPolarHBondContact O-CB 3.46Å; I385-E389 PolarHBondContact O-N 3.47Å |
| 386 | I | 91.8 | Very high | 90.6 | Very high | 1 Ų | 1 | 37.1 Ų | 37.1 | 1% | 0.005 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -69.7 | -40.3 | 179.7 | -68 | 176.3 | 0 | 0 | 0 | 111.2 | M311 Y330 L333 V382 Y388 E389 G390 | M311-I386 HydrophobicContact CE-CB 4.29Å; M311-I386 HydrophobicContact CE-CD1 3.84Å; M311-I386 HydrophobicContact CE-CG1 3.67Å; M311-I386 HydrophobicContact CE-CG2 3.81Å; M311-I386 HydrophobicContact CG-CD1 4.3Å; M311-I386 HydrophobicContact SD-CD1 3.83Å; M311-I386 HydrophobicContact SD-CG1 4.34Å; Y330-I386 HydrophobicContact CD1-CD1 3.3Å; Y330-I386 HydrophobicContact CD2-CD1 4.2Å; Y330-I386 HydrophobicContact CE1-CD1 3.92Å; Y330-I386 HydrophobicContact CG-CD1 3.47Å; Y330-I386 VanDerWaalsContact CG-CD1 3.47Å; Y330-I386 WeakPolarHBondContact O-CG2 3.32Å; L333-I386 HydrophobicContact CB-CG2 4.34Å; V382-I386 HydrophobicContact CG1-CD1 3.57Å; V382-I386 HydrophobicContact CG1-CG1 4.09Å; V382-I386 WeakPolarHBondContact O-CB 3.32Å; V382-I386 VanDerWaalsContact O-CG1 3.26Å; V382-I386 WeakPolarHBondContact O-CG1 3.3Å; V382-I386 PolarHBondContact O-N 2.88Å; I386-Y388 VanDerWaalsContact C-N 3.27Å; I386-Y388 PolarHBondContact O-N 2.86Å; I386-E389 WeakPolarHBondContact O-CB 3.5Å; I386-E389 PolarHBondContact O-N 2.93Å; I386-G390 PolarHBondContact O-N 3.23Å |
| 387 | L | 93.8 | Very high | 90.8 | Very high | 61 Ų | 61 | 36.4 Ų | 36.4 | 32% | 0.319 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -60.8 | -42.5 | 172.4 | -177.4 | 66.4 | 0 | 0 | 0 | 110.7 | L333 V336 F383 G390 L391 | L333-L387 WeakPolarHBondContact O-CD1 3.41Å; V336-L387 HydrophobicContact CG1-CD1 4.24Å; F383-L387 WeakPolarHBondContact O-CB 2.99Å; F383-L387 PolarHBondContact O-N 3.49Å; L387-G390 PolarHBondContact O-N 3.18Å; L387-L391 VanDerWaalsContact O-CG 3.29Å; L387-L391 WeakPolarHBondContact O-CG 3.43Å; L387-L391 PolarHBondContact O-N 3.3Å |
| 388 | Y | 94.4 | Very high | 91 | Very high | 88 Ų | 88 | 31.2 Ų | 31.2 | 35% | 0.345 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -62.8 | -41.9 | 175.9 | 168.7 | -104 | 0 | 0 | 0 | 112.9 | L359 G384 I385 I386 L391 L392 | L359-Y388 WeakPolarHBondContact CD2-OH 3.38Å; G384-Y388 WeakPolarHBondContact O-CB 3.01Å; G384-Y388 PolarHBondContact O-N 2.02Å; I385-Y388 WeakPolarHBondContact O-CB 3.41Å; I385-Y388 PolarHBondContact O-N 3.13Å; I386-Y388 VanDerWaalsContact C-N 3.27Å; I386-Y388 PolarHBondContact O-N 2.86Å; Y388-L391 WeakPolarHBondContact O-CB 3.34Å; Y388-L391 PolarHBondContact O-N 2.91Å; Y388-L392 HydrophobicContact CD1-CD1 4.21Å; Y388-L392 HydrophobicContact CE1-CD1 3.48Å; Y388-L392 VanDerWaalsContact CE1-CD1 3.48Å; Y388-L392 HydrophobicContact CE1-CG 4.19Å; Y388-L392 HydrophobicContact CE2-CD1 4.14Å; Y388-L392 HydrophobicContact CE2-CD2 4.12Å; Y388-L392 HydrophobicContact CE2-CG 4.03Å; Y388-L392 VanDerWaalsContact CZ-CD1 3.46Å; Y388-L392 PolarHBondContact O-N 3.05Å |
| 389 | E | 94.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -56.5 | -51.7 | 173.7 | -174.7 | -156.8 | 154.1 | 0 | 0 | 111.5 | E303 I306 N307 M311 I385 I386 L391 L392 G393 | E303-E389 WeakPolarHBondContact CA-OE1 3.2Å; I306-E389 HydrophobicContact CD1-CG 4.02Å; I306-E389 VanDerWaalsContact CG2-OE2 3.26Å; I306-E389 WeakPolarHBondContact CG2-OE2 2.98Å; N307-E389 PolarHBondContact ND2-OE1 3.38Å; M311-E389 WeakPolarHBondContact CE-OE2 3.38Å; I385-E389 WeakPolarHBondContact O-CB 3.46Å; I385-E389 PolarHBondContact O-N 3.47Å; I386-E389 WeakPolarHBondContact O-CB 3.5Å; I386-E389 PolarHBondContact O-N 2.93Å; E389-L391 PolarHBondContact O-N 3.27Å; E389-L392 PolarHBondContact O-N 3.03Å; E389-G393 PolarHBondContact O-N 3Å; E389-G393 VanDerWaalsContact O-N 3.1Å |
| 390 | G | 92 | Very high | 91.4 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.4 | -33.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G337 V338 S341 I386 L387 G394 | G337-G390 VanDerWaalsContact C-C 3.45Å; G337-G390 CarbonylContact C-O 3.46Å; V338-G390 WeakPolarHBondContact CA-O 3.46Å; V338-G390 WeakPolarHBondContact CG2-O 3.41Å; V338-G390 PolarHBondContact N-O 2.88Å; S341-G390 PolarHBondContact OG-O 2.96Å; I386-G390 PolarHBondContact O-N 3.23Å; L387-G390 PolarHBondContact O-N 3.18Å; G390-G394 PolarHBondContact O-N 3.38Å; G390-G394 VanDerWaalsContact O-N 3.16Å |
| 391 | L | 92.9 | Very high | 91.3 | Very high | 59 Ų | 59 | 19.9 Ų | 19.9 | 31% | 0.309 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -65.3 | -44.3 | 175.2 | -73 | 168.5 | 0 | 0 | 0 | 112.2 | G337 V340 S341 L387 Y388 E389 V395 | G337-L391 WeakPolarHBondContact O-CD2 3.42Å; V340-L391 HydrophobicContact CB-CD2 4.07Å; V340-L391 HydrophobicContact CG1-CD2 3.86Å; S341-L391 WeakPolarHBondContact CB-O 3.42Å; S341-L391 PolarHBondContact OG-O 3.27Å; L387-L391 VanDerWaalsContact O-CG 3.29Å; L387-L391 WeakPolarHBondContact O-CG 3.43Å; L387-L391 PolarHBondContact O-N 3.3Å; Y388-L391 WeakPolarHBondContact O-CB 3.34Å; Y388-L391 PolarHBondContact O-N 2.91Å; E389-L391 PolarHBondContact O-N 3.27Å; L391-V395 WeakPolarHBondContact O-CB 3.43Å; L391-V395 VanDerWaalsContact O-CG2 3.3Å; L391-V395 WeakPolarHBondContact O-CG2 3.14Å; L391-V395 PolarHBondContact O-N 3.45Å; L391-V395 VanDerWaalsContact O-N 3.11Å |
| 392 | L | 92.6 | Very high | 91.2 | Very high | 13 Ų | 13 | 16.8 Ų | 16.8 | 7% | 0.068 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63 | -45.7 | 178.5 | -71.7 | -179.9 | 0 | 0 | 0 | 111.7 | F356 L359 Q360 Y388 E389 V395 A396 | F356-L392 HydrophobicContact CD1-CD2 3.89Å; L359-L392 HydrophobicContact CB-CD1 3.87Å; L359-L392 HydrophobicContact CB-CD2 4.33Å; Q360-L392 VanDerWaalsContact OE1-CB 3.24Å; Y388-L392 HydrophobicContact CD1-CD1 4.21Å; Y388-L392 HydrophobicContact CE1-CD1 3.48Å; Y388-L392 VanDerWaalsContact CE1-CD1 3.48Å; Y388-L392 HydrophobicContact CE1-CG 4.19Å; Y388-L392 HydrophobicContact CE2-CD1 4.14Å; Y388-L392 HydrophobicContact CE2-CD2 4.12Å; Y388-L392 HydrophobicContact CE2-CG 4.03Å; Y388-L392 VanDerWaalsContact CZ-CD1 3.46Å; Y388-L392 PolarHBondContact O-N 3.05Å; E389-L392 PolarHBondContact O-N 3.03Å; L392-V395 PolarHBondContact O-N 3.46Å; L392-A396 WeakPolarHBondContact O-CB 3.15Å; L392-A396 PolarHBondContact O-N 3.49Å |
| 393 | G | 90.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -53.4 | -57.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | E303 E389 V395 A396 Y397 | E303-G393 WeakPolarHBondContact OE2-CA 3.49Å; E389-G393 PolarHBondContact O-N 3Å; E389-G393 VanDerWaalsContact O-N 3.1Å; G393-V395 PolarHBondContact O-N 2.85Å; G393-A396 PolarHBondContact O-N 3.47Å; G393-Y397 PolarHBondContact O-N 3.37Å |
| 394 | G | 89.6 | Confident | 90.9 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -68 | -36.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S341 G390 Y397 V398 | S341-G394 WeakPolarHBondContact OG-CA 3.49Å; G390-G394 PolarHBondContact O-N 3.38Å; G390-G394 VanDerWaalsContact O-N 3.16Å; G394-Y397 PolarHBondContact O-N 2.92Å; G394-V398 WeakPolarHBondContact O-CG2 3.21Å; G394-V398 PolarHBondContact O-N 2.87Å; G394-V398 VanDerWaalsContact O-N 3.14Å |
| 395 | V | 91.2 | Very high | 90.5 | Very high | 17 Ų | 17 | 15 Ų | 15 | 10% | 0.103 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -63.9 | -44.1 | 174.6 | 171 | 0 | 0 | 0 | 0 | 110.3 | F350 F356 L391 L392 G393 Y397 N399 | F350-V395 HydrophobicContact CD2-CG1 4.08Å; F356-V395 HydrophobicContact CD1-CG1 4.38Å; F356-V395 HydrophobicContact CD2-CG1 4.28Å; F356-V395 HydrophobicContact CE1-CG1 3.74Å; F356-V395 HydrophobicContact CE2-CG1 3.64Å; F356-V395 HydrophobicContact CZ-CG1 3.33Å; L391-V395 WeakPolarHBondContact O-CB 3.43Å; L391-V395 VanDerWaalsContact O-CG2 3.3Å; L391-V395 WeakPolarHBondContact O-CG2 3.14Å; L391-V395 PolarHBondContact O-N 3.45Å; L391-V395 VanDerWaalsContact O-N 3.11Å; L392-V395 PolarHBondContact O-N 3.46Å; G393-V395 PolarHBondContact O-N 2.85Å; V395-Y397 PolarHBondContact O-N 3.03Å; V395-N399 WeakPolarHBondContact CG1-ND2 3.18Å; V395-N399 WeakPolarHBondContact O-CB 3.28Å; V395-N399 PolarHBondContact O-N 3.24Å; V395-N399 VanDerWaalsContact O-N 3.15Å; V395-N399 PolarHBondContact O-ND2 2.73Å |
| 396 | A | 91.8 | Very high | 90 | Very high | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.008 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.5 | -44.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V299 F356 L392 G393 T400 | V299-A396 HydrophobicContact CB-CB 4.34Å; V299-A396 HydrophobicContact CG1-CB 3.98Å; V299-A396 HydrophobicContact CG2-CB 3.95Å; F356-A396 HydrophobicContact CB-CB 3.96Å; F356-A396 HydrophobicContact CD2-CB 4.29Å; F356-A396 HydrophobicContact CG-CB 4.38Å; L392-A396 WeakPolarHBondContact O-CB 3.15Å; L392-A396 PolarHBondContact O-N 3.49Å; G393-A396 PolarHBondContact O-N 3.47Å; A396-T400 VanDerWaalsContact O-CB 3.23Å; A396-T400 WeakPolarHBondContact O-CB 3.39Å; A396-T400 PolarHBondContact O-N 2.85Å; A396-T400 PolarHBondContact O-OG1 3.21Å |
| 397 | Y | 90.8 | Very high | 89.7 | Confident | 5 Ų | 5 | 24.6 Ų | 24.6 | 2% | 0.02 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59.3 | -60.6 | 178 | -178.8 | -95.1 | 0 | 0 | 0 | 111.9 | E159 W177 Y300 G393 G394 V395 N399 T400 F401 | E159-Y397 PolarHBondContact OE1-OH 2.92Å; W177-Y397 PolarHBondContact NE1-OH 3.27Å; Y300-Y397 AromaticContact CE2-CD2 3.97Å; Y300-Y397 HydrophobicContact CE2-CD2 3.97Å; Y300-Y397 AromaticContact CZ-CD2 3.81Å; Y300-Y397 WeakPolarHBondContact OH-CB 3.35Å; Y300-Y397 WeakPolarHBondContact OH-CD2 3.35Å; G393-Y397 PolarHBondContact O-N 3.37Å; G394-Y397 PolarHBondContact O-N 2.92Å; V395-Y397 PolarHBondContact O-N 3.03Å; Y397-N399 VanDerWaalsContact C-N 3.33Å; Y397-N399 PolarHBondContact O-N 3Å; Y397-T400 PolarHBondContact O-N 3.38Å; Y397-F401 HydrophobicContact CD1-CD2 4.2Å; Y397-F401 AromaticContact CD2-CD2 3.89Å; Y397-F401 HydrophobicContact CD2-CD2 3.89Å; Y397-F401 AromaticContact CD2-CE2 3.47Å; Y397-F401 HydrophobicContact CD2-CE2 3.47Å; Y397-F401 VanDerWaalsContact CD2-CE2 3.47Å; Y397-F401 HydrophobicContact CE1-CD2 4.04Å; Y397-F401 HydrophobicContact CE1-CE2 4.27Å; Y397-F401 AromaticContact CE2-CD2 3.79Å; Y397-F401 HydrophobicContact CE2-CD2 3.79Å; Y397-F401 AromaticContact CE2-CE2 3.19Å; Y397-F401 HydrophobicContact CE2-CE2 3.19Å; Y397-F401 HydrophobicContact CE2-CZ 4.08Å; Y397-F401 HydrophobicContact CG-CD2 4.12Å; Y397-F401 HydrophobicContact CG-CE2 4.18Å; Y397-F401 AromaticContact CZ-CD2 3.85Å; Y397-F401 AromaticContact CZ-CE2 3.62Å; Y397-F401 WeakPolarHBondContact O-CD2 3.39Å; Y397-F401 PolarHBondContact O-N 3.06Å; Y397-F401 VanDerWaalsContact O-N 3.14Å |
| 398 | V | 88 | Confident | 89.1 | Confident | 3 Ų | 3 | 22.9 Ų | 22.9 | 2% | 0.018 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -65.9 | -35.3 | -172.4 | -63.2 | 0 | 0 | 0 | 0 | 112.9 | R342 L345 G394 H402 | R342-V398 HydrophobicContact CB-CG1 3.75Å; R342-V398 HydrophobicContact CG-CG1 3.81Å; L345-V398 HydrophobicContact CB-CB 4.25Å; L345-V398 HydrophobicContact CB-CG2 3.99Å; L345-V398 HydrophobicContact CD1-CB 4.47Å; L345-V398 HydrophobicContact CD1-CG2 4.21Å; L345-V398 HydrophobicContact CD2-CB 3.95Å; L345-V398 HydrophobicContact CD2-CG2 4.47Å; L345-V398 HydrophobicContact CG-CB 4.45Å; L345-V398 HydrophobicContact CG-CG2 4.44Å; G394-V398 WeakPolarHBondContact O-CG2 3.21Å; G394-V398 PolarHBondContact O-N 2.87Å; G394-V398 VanDerWaalsContact O-N 3.14Å; V398-H402 VanDerWaalsContact O-CB 3.23Å; V398-H402 WeakPolarHBondContact O-CB 3.47Å; V398-H402 PolarHBondContact O-N 3.38Å |
| 399 | N | 90.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -69.2 | -42.8 | 176.3 | -77.4 | -83.1 | 0 | 0 | 0 | 111.1 | K349 F350 V395 Y397 F401 H402 F403 | K349-N399 WeakPolarHBondContact CA-OD1 3.44Å; F350-N399 PolarHBondContact N-OD1 3.43Å; F350-N399 PolarHBondContact O-OD1 3.28Å; V395-N399 WeakPolarHBondContact CG1-ND2 3.18Å; V395-N399 WeakPolarHBondContact O-CB 3.28Å; V395-N399 PolarHBondContact O-N 3.24Å; V395-N399 VanDerWaalsContact O-N 3.15Å; V395-N399 PolarHBondContact O-ND2 2.73Å; Y397-N399 VanDerWaalsContact C-N 3.33Å; Y397-N399 PolarHBondContact O-N 3Å; N399-F401 PolarHBondContact O-N 3.2Å; N399-H402 PolarHBondContact O-N 2.86Å; N399-F403 HydrophobicContact CB-CD2 4.34Å; N399-F403 HydrophobicContact CB-CE2 4.22Å; N399-F403 WeakPolarHBondContact O-CD2 3.42Å; N399-F403 PolarHBondContact O-N 3Å |
| 400 | T | 89.6 | Confident | 87.3 | Confident | 1 Ų | 1 | 28.9 Ų | 28.9 | 1% | 0.006 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -57.4 | -52.9 | 179.1 | -61.4 | 0 | 0 | 0 | 0 | 111.2 | F292 L296 T353 A396 Y397 H402 F403 I404 | F292-T400 HydrophobicContact CB-CG2 3.98Å; L296-T400 HydrophobicContact CB-CG2 4.34Å; L296-T400 HydrophobicContact CD1-CG2 4.5Å; L296-T400 HydrophobicContact CD2-CG2 4Å; T353-T400 VanDerWaalsContact CG2-OG1 3.31Å; T353-T400 WeakPolarHBondContact CG2-OG1 3.29Å; A396-T400 VanDerWaalsContact O-CB 3.23Å; A396-T400 WeakPolarHBondContact O-CB 3.39Å; A396-T400 PolarHBondContact O-N 2.85Å; A396-T400 PolarHBondContact O-OG1 3.21Å; Y397-T400 PolarHBondContact O-N 3.38Å; T400-H402 VanDerWaalsContact C-N 3.31Å; T400-H402 PolarHBondContact O-N 3.31Å; T400-F403 PolarHBondContact O-N 3.43Å; T400-I404 HydrophobicContact CG2-CD1 3.52Å; T400-I404 HydrophobicContact CG2-CG1 4.45Å; T400-I404 WeakPolarHBondContact O-CD1 3.41Å; T400-I404 VanDerWaalsContact O-CG1 3.26Å; T400-I404 WeakPolarHBondContact O-CG1 3.48Å; T400-I404 PolarHBondContact O-N 3.04Å |
| 401 | F | 87.8 | Confident | 86.5 | Confident | 1 Ų | 1 | 33.7 Ų | 33.7 | 0% | 0.004 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64.8 | -33.9 | 178.1 | -75.2 | -75.3 | 0 | 0 | 0 | 112.9 | L163 L174 L296 Y397 N399 S405 M417 | L163-F401 HydrophobicContact CD1-CD1 4.26Å; L163-F401 HydrophobicContact CD1-CE1 3.65Å; L163-F401 HydrophobicContact CD1-CZ 3.9Å; L163-F401 HydrophobicContact CD2-CD1 4.24Å; L163-F401 HydrophobicContact CD2-CE1 4.45Å; L174-F401 HydrophobicContact CD1-CB 4.27Å; L174-F401 HydrophobicContact CD2-CB 3.99Å; L296-F401 HydrophobicContact CD2-CE2 4.18Å; L296-F401 HydrophobicContact CD2-CZ 4.5Å; Y397-F401 HydrophobicContact CD1-CD2 4.2Å; Y397-F401 AromaticContact CD2-CD2 3.89Å; Y397-F401 HydrophobicContact CD2-CD2 3.89Å; Y397-F401 AromaticContact CD2-CE2 3.47Å; Y397-F401 HydrophobicContact CD2-CE2 3.47Å; Y397-F401 VanDerWaalsContact CD2-CE2 3.47Å; Y397-F401 HydrophobicContact CE1-CD2 4.04Å; Y397-F401 HydrophobicContact CE1-CE2 4.27Å; Y397-F401 AromaticContact CE2-CD2 3.79Å; Y397-F401 HydrophobicContact CE2-CD2 3.79Å; Y397-F401 AromaticContact CE2-CE2 3.19Å; Y397-F401 HydrophobicContact CE2-CE2 3.19Å; Y397-F401 HydrophobicContact CE2-CZ 4.08Å; Y397-F401 HydrophobicContact CG-CD2 4.12Å; Y397-F401 HydrophobicContact CG-CE2 4.18Å; Y397-F401 AromaticContact CZ-CD2 3.85Å; Y397-F401 AromaticContact CZ-CE2 3.62Å; Y397-F401 WeakPolarHBondContact O-CD2 3.39Å; Y397-F401 PolarHBondContact O-N 3.06Å; Y397-F401 VanDerWaalsContact O-N 3.14Å; N399-F401 PolarHBondContact O-N 3.2Å; F401-S405 VanDerWaalsContact O-CB 3.26Å; F401-S405 WeakPolarHBondContact O-CB 3.43Å; F401-S405 PolarHBondContact O-N 3.36Å; F401-M417 HydrophobicContact CB-CE 4.42Å; F401-M417 HydrophobicContact CD1-CE 4.25Å; F401-M417 HydrophobicContact CD1-SD 4.03Å |
| 402 | H | 87.7 | Confident | 85.8 | Confident | 13 Ų | 13 | 32.2 Ų | 32.2 | 6% | 0.06 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.5 | -45.2 | 175.2 | -174.8 | 74.2 | 0 | 0 | 0 | 112.5 | L345 K349 V398 N399 T400 K406 | L345-H402 HydrophobicContact CD1-CB 4.18Å; L345-H402 HydrophobicContact CD2-CB 4.16Å; K349-H402 PolarHBondContact NZ-NE2 3.34Å; V398-H402 VanDerWaalsContact O-CB 3.23Å; V398-H402 WeakPolarHBondContact O-CB 3.47Å; V398-H402 PolarHBondContact O-N 3.38Å; N399-H402 PolarHBondContact O-N 2.86Å; T400-H402 VanDerWaalsContact C-N 3.31Å; T400-H402 PolarHBondContact O-N 3.31Å; H402-K406 WeakPolarHBondContact O-CB 3.37Å; H402-K406 PolarHBondContact O-N 3.45Å; H402-K406 VanDerWaalsContact O-N 3.12Å |
| 403 | F | 87.1 | Confident | 85.3 | Confident | 18 Ų | 18 | 34 Ų | 34 | 8% | 0.079 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -70.6 | -41.1 | 179 | -74.2 | -69 | 0 | 0 | 0 | 111.7 | F292 F350 R351 N399 T400 S405 K406 E407 | F292-F403 HydrophobicContact CE1-CB 3.96Å; F292-F403 HydrophobicContact CZ-CB 4.41Å; F350-F403 VanDerWaalsContact O-CE2 3.28Å; F350-F403 WeakPolarHBondContact O-CE2 3.26Å; R351-F403 HydrophobicContact CB-CE1 4.17Å; R351-F403 HydrophobicContact CB-CE2 4.26Å; R351-F403 HydrophobicContact CB-CZ 3.8Å; R351-F403 HydrophobicContact CG-CD1 4.21Å; R351-F403 HydrophobicContact CG-CE1 3.79Å; R351-F403 HydrophobicContact CG-CE2 4.4Å; R351-F403 HydrophobicContact CG-CZ 3.92Å; N399-F403 HydrophobicContact CB-CD2 4.34Å; N399-F403 HydrophobicContact CB-CE2 4.22Å; N399-F403 WeakPolarHBondContact O-CD2 3.42Å; N399-F403 PolarHBondContact O-N 3Å; T400-F403 PolarHBondContact O-N 3.43Å; F403-S405 VanDerWaalsContact C-N 3.32Å; F403-S405 PolarHBondContact O-N 2.73Å; F403-K406 PolarHBondContact O-N 3.31Å; F403-E407 WeakPolarHBondContact O-CB 3.4Å; F403-E407 WeakPolarHBondContact O-CG 3.26Å; F403-E407 PolarHBondContact O-N 3.33Å |
| 404 | I | 86.3 | Confident | 85 | Confident | 1 Ų | 1 | 36.1 Ų | 36.1 | 1% | 0.005 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -58.4 | -46.1 | 173.8 | -67.3 | 158.8 | 0 | 0 | 0 | 110.7 | L289 F292 T400 K406 T408 A416 M417 S420 | L289-I404 HydrophobicContact CD2-CG1 4.26Å; L289-I404 HydrophobicContact CD2-CG2 3.98Å; F292-I404 HydrophobicContact CB-CD1 4.09Å; F292-I404 HydrophobicContact CB-CG1 4.16Å; F292-I404 HydrophobicContact CD2-CG1 4.33Å; F292-I404 HydrophobicContact CG-CG1 4.13Å; T400-I404 HydrophobicContact CG2-CD1 3.52Å; T400-I404 HydrophobicContact CG2-CG1 4.45Å; T400-I404 WeakPolarHBondContact O-CD1 3.41Å; T400-I404 VanDerWaalsContact O-CG1 3.26Å; T400-I404 WeakPolarHBondContact O-CG1 3.48Å; T400-I404 PolarHBondContact O-N 3.04Å; I404-K406 PolarHBondContact O-N 3.11Å; I404-T408 VanDerWaalsContact O-CB 3.25Å; I404-T408 WeakPolarHBondContact O-CB 3.48Å; I404-T408 PolarHBondContact O-N 2.83Å; I404-T408 VanDerWaalsContact O-N 3.09Å; I404-T408 PolarHBondContact O-OG1 3.04Å; I404-A416 HydrophobicContact CG2-CB 4.06Å; I404-M417 HydrophobicContact CB-SD 4.33Å; I404-M417 HydrophobicContact CG2-SD 3.93Å; I404-S420 VanDerWaalsContact CD1-CB 3.49Å; I404-S420 VanDerWaalsContact CD1-OG 3.29Å; I404-S420 WeakPolarHBondContact CD1-OG 3.49Å |
| 405 | S | 84.1 | Confident | 84.7 | Confident | 8 Ų | 8 | 37.5 Ų | 37.5 | 6% | 0.056 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.1 | -24.8 | 177.1 | 176.7 | 0 | 0 | 0 | 0 | 113.6 | F401 F403 R413 | F401-S405 VanDerWaalsContact O-CB 3.26Å; F401-S405 WeakPolarHBondContact O-CB 3.43Å; F401-S405 PolarHBondContact O-N 3.36Å; F403-S405 VanDerWaalsContact C-N 3.32Å; F403-S405 PolarHBondContact O-N 2.73Å; S405-R413 VanDerWaalsContact O-CD 3.26Å; S405-R413 WeakPolarHBondContact O-CD 3.48Å |
| 406 | K | 84.4 | Confident | 84.4 | Confident | 120 Ų | 120 | 36.7 Ų | 36.7 | 52% | 0.522 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -90.6 | -38.2 | -177.9 | 178.6 | 173.7 | 179.4 | -174.6 | 0 | 112.7 | H402 F403 I404 | H402-K406 WeakPolarHBondContact O-CB 3.37Å; H402-K406 PolarHBondContact O-N 3.45Å; H402-K406 VanDerWaalsContact O-N 3.12Å; F403-K406 PolarHBondContact O-N 3.31Å; I404-K406 PolarHBondContact O-N 3.11Å |
| 407 | E | 83.8 | Confident | 84.1 | Confident | 107 Ų | 107 | 36.6 Ų | 36.6 | 50% | 0.5 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -93.9 | -19.9 | -171.1 | -64.7 | -178.8 | -169 | 0 | 0 | 112.9 | F292 F403 | F292-E407 WeakPolarHBondContact CZ-OE2 3.44Å; F403-E407 WeakPolarHBondContact O-CB 3.4Å; F403-E407 WeakPolarHBondContact O-CG 3.26Å; F403-E407 PolarHBondContact O-N 3.33Å |
| 408 | T | 82.9 | Confident | 83.7 | Confident | 26 Ų | 26 | 36.5 Ų | 36.5 | 16% | 0.16 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -82.2 | 135.9 | 177 | -47 | 0 | 0 | 0 | 0 | 111.5 | I404 A416 | I404-T408 VanDerWaalsContact O-CB 3.25Å; I404-T408 WeakPolarHBondContact O-CB 3.48Å; I404-T408 PolarHBondContact O-N 2.83Å; I404-T408 VanDerWaalsContact O-N 3.09Å; I404-T408 PolarHBondContact O-OG1 3.04Å; T408-A416 HydrophobicContact CG2-CB 3.69Å |
| 409 | E | 78.5 | Confident | 83.6 | Confident | 124 Ų | 124 | 37.2 Ų | 37.2 | 58% | 0.579 | 18% | 0.178 | S | C | * | . | trans | -56.8 | 144.8 | 171.7 | -169.4 | 177.1 | -169.9 | 0 | 0 | 111.9 | R411 Y412 R413 | E409-R411 PolarHBondContact O-N 2.9Å; E409-R411 VanDerWaalsContact O-N 3.14Å; E409-Y412 HydrophobicContact CB-CD2 4.32Å; E409-Y412 PolarHBondContact O-N 3.4Å; E409-R413 PolarHBondContact O-N 3.17Å | ||
| 410 | S | 72 | Confident | 83.3 | Confident | 89 Ų | 89 | 37.2 Ų | 37.2 | 62% | 0.622 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -53.3 | -38 | -175.3 | 49.4 | 0 | 0 | 0 | 0 | 113.3 | Y412 R413 | S410-Y412 VanDerWaalsContact C-N 3.34Å; S410-Y412 PolarHBondContact O-N 3.31Å; S410-R413 PolarHBondContact O-N 3.3Å |
| 411 | R | 73.8 | Confident | 83.2 | Confident | 101 Ų | 101 | 37.2 Ų | 37.2 | 38% | 0.381 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -61.9 | -36.8 | 179.3 | -173.5 | 176.3 | -177 | -170.4 | -1.8 | 113.6 | G275 E409 | G275-R411 PolarHBondContact O-NH2 2.83Å; E409-R411 PolarHBondContact O-N 2.9Å; E409-R411 VanDerWaalsContact O-N 3.14Å |
| 412 | Y | 80.2 | Confident | 83.2 | Confident | 29 Ų | 29 | 38.6 Ų | 38.6 | 11% | 0.114 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -103.7 | -3.6 | -175.8 | -55.1 | -64.2 | 0 | 0 | 0 | 113.1 | V277 V285 E409 S410 E414 F415 A416 | V277-Y412 HydrophobicContact CB-CE1 4.23Å; V277-Y412 HydrophobicContact CG1-CD1 4.06Å; V277-Y412 HydrophobicContact CG1-CE1 3.51Å; V277-Y412 HydrophobicContact CG2-CD1 4.06Å; V277-Y412 HydrophobicContact CG2-CE1 3.64Å; V285-Y412 HydrophobicContact CG2-CD1 4.12Å; V285-Y412 HydrophobicContact CG2-CD2 4.11Å; V285-Y412 HydrophobicContact CG2-CG 3.87Å; E409-Y412 HydrophobicContact CB-CD2 4.32Å; E409-Y412 PolarHBondContact O-N 3.4Å; S410-Y412 VanDerWaalsContact C-N 3.34Å; S410-Y412 PolarHBondContact O-N 3.31Å; Y412-E414 PolarHBondContact O-N 2.92Å; Y412-F415 PolarHBondContact O-N 2.92Å; Y412-A416 WeakPolarHBondContact O-CB 3.37Å; Y412-A416 PolarHBondContact O-N 3.4Å |
| 413 | R | 81.7 | Confident | 83.2 | Confident | 49 Ų | 49 | 38.2 Ų | 38.2 | 19% | 0.185 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.6 | -41 | -172.2 | -164.5 | 170.2 | 62.8 | -161.6 | 0.8 | 113 | V167 S405 E409 S410 A416 M417 | V167-R413 HydrophobicContact CG1-CB 4.21Å; V167-R413 HydrophobicContact CG1-CG 4.35Å; V167-R413 VanDerWaalsContact CG1-NE 3.31Å; V167-R413 HydrophobicContact CG2-CB 4.21Å; V167-R413 HydrophobicContact CG2-CG 3.71Å; V167-R413 PolarHBondContact O-NH2 3.14Å; S405-R413 VanDerWaalsContact O-CD 3.26Å; S405-R413 WeakPolarHBondContact O-CD 3.48Å; E409-R413 PolarHBondContact O-N 3.17Å; S410-R413 PolarHBondContact O-N 3.3Å; R413-A416 PolarHBondContact O-N 3.3Å; R413-M417 HydrophobicContact CG-CG 4.43Å; R413-M417 WeakPolarHBondContact O-CG 3.03Å; R413-M417 PolarHBondContact O-N 3.12Å |
| 414 | E | 82.6 | Confident | 83.3 | Confident | 46 Ų | 46 | 37.5 Ų | 37.5 | 22% | 0.215 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -59.7 | -48.1 | 176.2 | -179 | 175.1 | 164.8 | 0 | 0 | 111.5 | Y117 R120 S164 Y412 A418 | Y117-E414 PolarHBondContact OH-OE1 3.21Å; Y117-E414 PolarHBondContact OH-OE2 3.34Å; R120-E414 IonicContact NH1-OE1 3.76Å; R120-E414 IonicContact NH2-OE1 3.93Å; S164-E414 PolarHBondContact OG-O 3.22Å; Y412-E414 PolarHBondContact O-N 2.92Å; E414-A418 PolarHBondContact O-N 2.88Å |
| 415 | F | 83.3 | Confident | 83.4 | Confident | 28 Ų | 28 | 37.6 Ų | 37.6 | 12% | 0.123 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -67.4 | -39.7 | 179.2 | 176.5 | -102.5 | 0 | 0 | 0 | 112.2 | P109 K282 V285 Y412 A418 T419 | P109-F415 HydrophobicContact CB-CD2 4.21Å; P109-F415 HydrophobicContact CB-CE2 3.94Å; K282-F415 HydrophobicContact CB-CE1 3.86Å; K282-F415 HydrophobicContact CB-CE2 4.48Å; K282-F415 HydrophobicContact CB-CZ 3.76Å; K282-F415 HydrophobicContact CD-CD2 4.41Å; K282-F415 HydrophobicContact CD-CE2 3.96Å; K282-F415 HydrophobicContact CD-CZ 4.1Å; K282-F415 HydrophobicContact CG-CE1 4.14Å; K282-F415 HydrophobicContact CG-CE2 4.32Å; K282-F415 HydrophobicContact CG-CZ 4.04Å; V285-F415 HydrophobicContact CG1-CD1 4.35Å; Y412-F415 PolarHBondContact O-N 2.92Å; F415-A418 PolarHBondContact O-N 3.31Å; F415-T419 WeakPolarHBondContact CE2-OG1 3.37Å; F415-T419 VanDerWaalsContact CZ-OG1 3.28Å; F415-T419 WeakPolarHBondContact CZ-OG1 3.33Å; F415-T419 VanDerWaalsContact O-CB 3.25Å; F415-T419 WeakPolarHBondContact O-CB 3.17Å; F415-T419 PolarHBondContact O-N 3.21Å; F415-T419 PolarHBondContact O-OG1 2.97Å |
| 416 | A | 85 | Confident | 83.8 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.2 | -45.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L289 I404 T408 Y412 R413 A418 T419 S420 | L289-A416 HydrophobicContact CD1-CB 3.59Å; L289-A416 HydrophobicContact CD2-CB 4.12Å; L289-A416 HydrophobicContact CG-CB 4.46Å; I404-A416 HydrophobicContact CG2-CB 4.06Å; T408-A416 HydrophobicContact CG2-CB 3.69Å; Y412-A416 WeakPolarHBondContact O-CB 3.37Å; Y412-A416 PolarHBondContact O-N 3.4Å; R413-A416 PolarHBondContact O-N 3.3Å; A416-A418 PolarHBondContact O-N 3.03Å; A416-T419 PolarHBondContact O-N 3.32Å; A416-S420 WeakPolarHBondContact O-CB 3.41Å; A416-S420 PolarHBondContact O-N 3.38Å; A416-S420 PolarHBondContact O-OG 2.95Å |
| 417 | M | 85.3 | Confident | 84.2 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.8 | -44.6 | 177.7 | -66.3 | -71.5 | -90.4 | 0 | 0 | 111.2 | L163 V167 L174 F401 I404 R413 S421 | L163-M417 HydrophobicContact CB-CB 4.46Å; V167-M417 HydrophobicContact CG2-CG 4.11Å; L174-M417 HydrophobicContact CD1-CE 3.82Å; L174-M417 HydrophobicContact CD2-CE 3.99Å; F401-M417 HydrophobicContact CB-CE 4.42Å; F401-M417 HydrophobicContact CD1-CE 4.25Å; F401-M417 HydrophobicContact CD1-SD 4.03Å; I404-M417 HydrophobicContact CB-SD 4.33Å; I404-M417 HydrophobicContact CG2-SD 3.93Å; R413-M417 HydrophobicContact CG-CG 4.43Å; R413-M417 WeakPolarHBondContact O-CG 3.03Å; R413-M417 PolarHBondContact O-N 3.12Å; M417-S421 PolarHBondContact O-N 3.47Å |
| 418 | A | 83.8 | Confident | 84.5 | Confident | 2 Ų | 2 | 30.9 Ų | 30.9 | 2% | 0.017 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.9 | -48.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | P109 L160 E414 F415 A416 S420 S421 | P109-A418 HydrophobicContact CG-CB 4.31Å; L160-A418 HydrophobicContact CD2-CB 3.94Å; L160-A418 WeakPolarHBondContact CD2-O 3.47Å; E414-A418 PolarHBondContact O-N 2.88Å; F415-A418 PolarHBondContact O-N 3.31Å; A416-A418 PolarHBondContact O-N 3.03Å; A418-S420 PolarHBondContact O-N 2.69Å; A418-S421 PolarHBondContact O-N 3.18Å; A418-S421 PolarHBondContact O-OG 3.26Å |
| 419 | T | 84.5 | Confident | 84.8 | Confident | 19 Ų | 19 | 30 Ų | 30 | 12% | 0.117 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.2 | -37 | -177.2 | -56.1 | 0 | 0 | 0 | 0 | 112 | T286 F415 A416 S421 V422 | T286-T419 HydrophobicContact CG2-CG2 4Å; F415-T419 WeakPolarHBondContact CE2-OG1 3.37Å; F415-T419 VanDerWaalsContact CZ-OG1 3.28Å; F415-T419 WeakPolarHBondContact CZ-OG1 3.33Å; F415-T419 VanDerWaalsContact O-CB 3.25Å; F415-T419 WeakPolarHBondContact O-CB 3.17Å; F415-T419 PolarHBondContact O-N 3.21Å; F415-T419 PolarHBondContact O-OG1 2.97Å; A416-T419 PolarHBondContact O-N 3.32Å; T419-S421 VanDerWaalsContact C-N 3.28Å; T419-S421 PolarHBondContact O-N 3.19Å; T419-V422 VanDerWaalsContact O-CB 3.25Å; T419-V422 WeakPolarHBondContact O-CB 3.38Å; T419-V422 VanDerWaalsContact O-CG2 3.31Å; T419-V422 WeakPolarHBondContact O-CG2 3.24Å; T419-V422 PolarHBondContact O-N 3.31Å; T419-V422 VanDerWaalsContact O-N 3.07Å |
| 420 | S | 85.6 | Confident | 85.4 | Confident | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -67.2 | -28.5 | 179 | -66.4 | 0 | 0 | 0 | 0 | 113.5 | I404 A416 A418 V422 G423 | I404-S420 VanDerWaalsContact CD1-CB 3.49Å; I404-S420 VanDerWaalsContact CD1-OG 3.29Å; I404-S420 WeakPolarHBondContact CD1-OG 3.49Å; A416-S420 WeakPolarHBondContact O-CB 3.41Å; A416-S420 PolarHBondContact O-N 3.38Å; A416-S420 PolarHBondContact O-OG 2.95Å; A418-S420 PolarHBondContact O-N 2.69Å; S420-V422 PolarHBondContact O-N 3.01Å; S420-G423 PolarHBondContact O-N 3.24Å; S420-G423 VanDerWaalsContact O-N 3.16Å |
| 421 | S | 86.1 | Confident | 86.3 | Confident | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -67.7 | -13.7 | 172.5 | 79.1 | 0 | 0 | 0 | 0 | 113.5 | K105 L160 M417 A418 T419 G423 | K105-S421 VanDerWaalsContact CD-O 3.32Å; K105-S421 WeakPolarHBondContact CD-O 3.22Å; K105-S421 PolarHBondContact NZ-O 3.45Å; L160-S421 WeakPolarHBondContact CD2-OG 3.34Å; M417-S421 PolarHBondContact O-N 3.47Å; A418-S421 PolarHBondContact O-N 3.18Å; A418-S421 PolarHBondContact O-OG 3.26Å; T419-S421 VanDerWaalsContact C-N 3.28Å; T419-S421 PolarHBondContact O-N 3.19Å; S421-G423 PolarHBondContact O-N 3.48Å |
| 422 | V | 88.2 | Confident | 86.8 | Confident | 30 Ų | 30 | 19.6 Ų | 19.6 | 18% | 0.182 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64.8 | -32.7 | 171.8 | -179.3 | 0 | 0 | 0 | 0 | 110.7 | L102 K105 I106 T419 S420 D424 S425 L426 | L102-V422 HydrophobicContact CD1-CG1 4.41Å; K105-V422 HydrophobicContact CB-CG2 3.98Å; K105-V422 WeakPolarHBondContact O-CG2 3.21Å; I106-V422 HydrophobicContact CG1-CG1 3.84Å; T419-V422 VanDerWaalsContact O-CB 3.25Å; T419-V422 WeakPolarHBondContact O-CB 3.38Å; T419-V422 VanDerWaalsContact O-CG2 3.31Å; T419-V422 WeakPolarHBondContact O-CG2 3.24Å; T419-V422 PolarHBondContact O-N 3.31Å; T419-V422 VanDerWaalsContact O-N 3.07Å; S420-V422 PolarHBondContact O-N 3.01Å; V422-D424 PolarHBondContact O-N 3.49Å; V422-S425 PolarHBondContact O-N 2.88Å; V422-L426 WeakPolarHBondContact O-CB 3.35Å; V422-L426 PolarHBondContact O-N 3.35Å |
| 423 | G | 87.3 | Confident | 87.2 | Confident | 5 Ų | 5 | 20.7 Ų | 20.7 | 5% | 0.052 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.6 | -43.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | G297 S420 S421 G427 | G297-G423 VanDerWaalsContact CA-O 3.24Å; G297-G423 WeakPolarHBondContact CA-O 3.32Å; S420-G423 PolarHBondContact O-N 3.24Å; S420-G423 VanDerWaalsContact O-N 3.16Å; S421-G423 PolarHBondContact O-N 3.48Å; G423-G427 PolarHBondContact O-N 3.19Å; G423-G427 VanDerWaalsContact O-N 3.1Å |
| 424 | D | 89.4 | Confident | 87.5 | Confident | 4 Ų | 4 | 19.7 Ų | 19.7 | 2% | 0.021 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.3 | -47.2 | 178.3 | 59 | 46.8 | 0 | 0 | 0 | 111.3 | K105 L296 Y300 V422 L426 G427 I428 | K105-D424 IonicContact NZ-OD1 3.67Å; K105-D424 PolarHBondContact NZ-OD1 3.49Å; K105-D424 IonicContact NZ-OD2 2.72Å; L296-D424 HydrophobicContact CD2-CB 4.5Å; Y300-D424 HydrophobicContact CD1-CB 4.08Å; Y300-D424 HydrophobicContact CD2-CB 3.69Å; Y300-D424 HydrophobicContact CE1-CB 4.25Å; Y300-D424 HydrophobicContact CE2-CB 3.88Å; Y300-D424 HydrophobicContact CG-CB 3.81Å; V422-D424 PolarHBondContact O-N 3.49Å; D424-L426 VanDerWaalsContact C-N 3.34Å; D424-L426 PolarHBondContact O-N 3.41Å; D424-G427 WeakPolarHBondContact O-CA 3.39Å; D424-G427 PolarHBondContact O-N 2.92Å; D424-G427 VanDerWaalsContact O-N 3.09Å; D424-I428 VanDerWaalsContact O-CG1 3.32Å; D424-I428 WeakPolarHBondContact O-CG1 3.21Å; D424-I428 PolarHBondContact O-N 3.27Å |
| 425 | S | 89.8 | Confident | 87.6 | Confident | 2 Ų | 2 | 17.5 Ų | 17.5 | 1% | 0.014 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -72.8 | -32.1 | -173.2 | -59.8 | 0 | 0 | 0 | 0 | 111.6 | K105 V422 A429 | K105-S425 VanDerWaalsContact CD-OG 3.29Å; K105-S425 WeakPolarHBondContact CD-OG 3.36Å; K105-S425 WeakPolarHBondContact CE-OG 3.44Å; K105-S425 PolarHBondContact NZ-OG 2.83Å; V422-S425 PolarHBondContact O-N 2.88Å; S425-A429 WeakPolarHBondContact O-CB 3.43Å; S425-A429 PolarHBondContact O-N 3.21Å |
| 426 | L | 92.2 | Very high | 87.3 | Confident | 83 Ų | 83 | 21.6 Ų | 21.6 | 44% | 0.435 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -64.2 | -43.8 | 169.8 | -178.9 | 62.5 | 0 | 0 | 0 | 111 | L102 V422 D424 A429 L430 | L102-L426 HydrophobicContact CD1-CB 4.22Å; L102-L426 HydrophobicContact CD2-CD1 4.43Å; V422-L426 WeakPolarHBondContact O-CB 3.35Å; V422-L426 PolarHBondContact O-N 3.35Å; D424-L426 VanDerWaalsContact C-N 3.34Å; D424-L426 PolarHBondContact O-N 3.41Å; L426-A429 PolarHBondContact O-N 3.12Å; L426-L430 HydrophobicContact CD1-CD1 4.35Å; L426-L430 HydrophobicContact CD1-CG 4.36Å; L426-L430 HydrophobicContact CG-CD1 4.17Å; L426-L430 WeakPolarHBondContact O-CB 3.46Å; L426-L430 VanDerWaalsContact O-CG 3.3Å; L426-L430 WeakPolarHBondContact O-CG 3.38Å; L426-L430 PolarHBondContact O-N 3.31Å |
| 427 | G | 91.9 | Very high | 87.2 | Confident | 2 Ų | 2 | 25 Ų | 25 | 2% | 0.021 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -57.9 | -48.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | G297 F301 G423 D424 A429 L430 A431 | G297-G427 WeakPolarHBondContact O-CA 3.49Å; F301-G427 WeakPolarHBondContact CA-O 3.49Å; G423-G427 PolarHBondContact O-N 3.19Å; G423-G427 VanDerWaalsContact O-N 3.1Å; D424-G427 WeakPolarHBondContact O-CA 3.39Å; D424-G427 PolarHBondContact O-N 2.92Å; D424-G427 VanDerWaalsContact O-N 3.09Å; G427-A429 PolarHBondContact O-N 3.29Å; G427-L430 PolarHBondContact O-N 3.28Å; G427-A431 WeakPolarHBondContact O-CB 3.4Å; G427-A431 PolarHBondContact O-N 2.92Å |
| 428 | I | 90.2 | Very high | 87 | Confident | 9 Ų | 9 | 26.4 Ų | 26.4 | 5% | 0.046 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61.1 | -44.5 | 177.8 | -62.1 | 167.9 | 0 | 0 | 0 | 111.3 | L94 I98 Y300 Y304 D424 A431 G432 | L94-I428 HydrophobicContact CD1-CG2 3.95Å; L94-I428 HydrophobicContact CD2-CG2 3.97Å; L94-I428 HydrophobicContact CG-CG2 4.15Å; I98-I428 HydrophobicContact CB-CG2 3.99Å; I98-I428 HydrophobicContact CD1-CB 4.08Å; I98-I428 HydrophobicContact CD1-CD1 3.97Å; I98-I428 HydrophobicContact CD1-CG2 3.84Å; I98-I428 HydrophobicContact CG1-CB 3.87Å; I98-I428 HydrophobicContact CG1-CG2 3.59Å; I98-I428 HydrophobicContact CG2-CG2 4.28Å; Y300-I428 HydrophobicContact CD1-CD1 3.86Å; Y300-I428 HydrophobicContact CD1-CG1 3.89Å; Y300-I428 HydrophobicContact CE1-CD1 4.39Å; Y304-I428 HydrophobicContact CD1-CB 4.46Å; Y304-I428 HydrophobicContact CD1-CG1 4.17Å; Y304-I428 HydrophobicContact CD1-CG2 3.65Å; Y304-I428 HydrophobicContact CD2-CD1 4.28Å; Y304-I428 HydrophobicContact CD2-CG1 3.61Å; Y304-I428 HydrophobicContact CE1-CD1 4.2Å; Y304-I428 HydrophobicContact CE1-CG1 4.18Å; Y304-I428 HydrophobicContact CE1-CG2 3.91Å; Y304-I428 HydrophobicContact CE2-CD1 3.77Å; Y304-I428 HydrophobicContact CE2-CG1 3.63Å; Y304-I428 HydrophobicContact CG-CB 4.33Å; Y304-I428 HydrophobicContact CG-CG1 3.87Å; Y304-I428 HydrophobicContact CG-CG2 3.98Å; D424-I428 VanDerWaalsContact O-CG1 3.32Å; D424-I428 WeakPolarHBondContact O-CG1 3.21Å; D424-I428 PolarHBondContact O-N 3.27Å; I428-A431 WeakPolarHBondContact O-CB 3.44Å; I428-A431 PolarHBondContact O-N 3.06Å; I428-G432 PolarHBondContact O-N 2.91Å |
| 429 | A | 90.1 | Very high | 86.7 | Confident | 9 Ų | 9 | 27.1 Ų | 27.1 | 7% | 0.074 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -63.7 | -43.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L95 I98 L102 S425 L426 G427 A431 G432 A433 | L95-A429 WeakPolarHBondContact CD2-O 3.34Å; I98-A429 HydrophobicContact CG2-CB 3.94Å; L102-A429 HydrophobicContact CD2-CB 3.8Å; S425-A429 WeakPolarHBondContact O-CB 3.43Å; S425-A429 PolarHBondContact O-N 3.21Å; L426-A429 PolarHBondContact O-N 3.12Å; G427-A429 PolarHBondContact O-N 3.29Å; A429-A431 VanDerWaalsContact C-N 3.29Å; A429-A431 PolarHBondContact O-N 3Å; A429-G432 PolarHBondContact O-N 3.44Å; A429-A433 PolarHBondContact O-N 3.25Å |
| 430 | L | 91.4 | Very high | 86.4 | Confident | 94 Ų | 94 | 29 Ų | 29 | 49% | 0.492 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -63.7 | -36.5 | 175.2 | -70.6 | 173.3 | 0 | 0 | 0 | 111.8 | F301 L426 G427 A433 A434 | F301-L430 HydrophobicContact CD2-CB 3.77Å; F301-L430 HydrophobicContact CE2-CB 4.13Å; L426-L430 HydrophobicContact CD1-CD1 4.35Å; L426-L430 HydrophobicContact CD1-CG 4.36Å; L426-L430 HydrophobicContact CG-CD1 4.17Å; L426-L430 WeakPolarHBondContact O-CB 3.46Å; L426-L430 VanDerWaalsContact O-CG 3.3Å; L426-L430 WeakPolarHBondContact O-CG 3.38Å; L426-L430 PolarHBondContact O-N 3.31Å; G427-L430 PolarHBondContact O-N 3.28Å; L430-A433 PolarHBondContact O-N 2.95Å; L430-A434 WeakPolarHBondContact O-CB 3.38Å; L430-A434 PolarHBondContact O-N 3.32Å |
| 431 | A | 90 | Very high | 86.2 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.8 | -45.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | F301 F305 G427 I428 A429 A433 A434 A435 | F301-A431 HydrophobicContact CD2-CB 3.99Å; F301-A431 HydrophobicContact CE2-CB 4.42Å; F301-A431 VanDerWaalsContact O-CB 3.28Å; F301-A431 WeakPolarHBondContact O-CB 3.38Å; F305-A431 HydrophobicContact CB-CB 4.09Å; G427-A431 WeakPolarHBondContact O-CB 3.4Å; G427-A431 PolarHBondContact O-N 2.92Å; I428-A431 WeakPolarHBondContact O-CB 3.44Å; I428-A431 PolarHBondContact O-N 3.06Å; A429-A431 VanDerWaalsContact C-N 3.29Å; A429-A431 PolarHBondContact O-N 3Å; A431-A433 VanDerWaalsContact C-N 3.32Å; A431-A433 PolarHBondContact O-N 3.08Å; A431-A434 PolarHBondContact O-N 3.1Å; A431-A435 WeakPolarHBondContact O-CB 2.95Å; A431-A435 PolarHBondContact O-N 3.31Å |
| 432 | G | 85.3 | Confident | 85.8 | Confident | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.6 | -40.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | I428 A429 A434 A435 | I428-G432 PolarHBondContact O-N 2.91Å; A429-G432 PolarHBondContact O-N 3.44Å; G432-A434 VanDerWaalsContact C-N 3.34Å; G432-A434 PolarHBondContact O-N 3.44Å; G432-A435 PolarHBondContact O-N 3.27Å |
| 433 | A | 87.8 | Confident | 85.1 | Confident | 53 Ų | 53 | 36 Ų | 36 | 44% | 0.438 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -65.2 | -35.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L95 A429 L430 A431 P437 | L95-A433 HydrophobicContact CD2-CB 4.5Å; A429-A433 PolarHBondContact O-N 3.25Å; L430-A433 PolarHBondContact O-N 2.95Å; A431-A433 VanDerWaalsContact C-N 3.32Å; A431-A433 PolarHBondContact O-N 3.08Å; A433-P437 WeakPolarHBondContact O-CD 2.97Å |
| 434 | A | 87.9 | Confident | 84.5 | Confident | 27 Ų | 27 | 40.1 Ų | 40.1 | 22% | 0.223 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -76.9 | -31.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | F301 F305 L430 A431 G432 F436 P437 T438 | F301-A434 HydrophobicContact CE2-CB 4.11Å; F301-A434 HydrophobicContact CZ-CB 4.3Å; F305-A434 HydrophobicContact CD2-CB 3.87Å; F305-A434 HydrophobicContact CE2-CB 3.9Å; L430-A434 WeakPolarHBondContact O-CB 3.38Å; L430-A434 PolarHBondContact O-N 3.32Å; A431-A434 PolarHBondContact O-N 3.1Å; G432-A434 VanDerWaalsContact C-N 3.34Å; G432-A434 PolarHBondContact O-N 3.44Å; A434-F436 VanDerWaalsContact C-N 3.31Å; A434-F436 PolarHBondContact O-N 2.87Å; A434-P437 WeakPolarHBondContact O-CD 3.15Å; A434-P437 VanDerWaalsContact O-CG 3.28Å; A434-P437 WeakPolarHBondContact O-CG 3.36Å; A434-T438 PolarHBondContact O-N 3.03Å; A434-T438 PolarHBondContact O-OG1 2.95Å |
| 435 | A | 84.1 | Confident | 83.6 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.9 | -36.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A431 G432 T438 H439 | A431-A435 WeakPolarHBondContact O-CB 2.95Å; A431-A435 PolarHBondContact O-N 3.31Å; G432-A435 PolarHBondContact O-N 3.27Å; A435-T438 PolarHBondContact O-N 3.43Å; A435-H439 WeakPolarHBondContact O-CB 3.35Å; A435-H439 PolarHBondContact O-N 3.39Å |
| 436 | F | 78.4 | Confident | 83.3 | Confident | 114 Ų | 114 | 47.3 Ų | 47.3 | 50% | 0.5 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -59.5 | -55.4 | -179.3 | -176.1 | -93 | 0 | 0 | 0 | 114.7 | A434 T438 H439 S440 | A434-F436 VanDerWaalsContact C-N 3.31Å; A434-F436 PolarHBondContact O-N 2.87Å; F436-T438 VanDerWaalsContact C-N 3.31Å; F436-T438 PolarHBondContact O-N 2.93Å; F436-H439 PolarHBondContact O-N 3.47Å; F436-S440 PolarHBondContact O-N 3.47Å; F436-S440 PolarHBondContact O-OG 2.91Å |
| 437 | P | 82.9 | Confident | 82.8 | Confident | 73 Ų | 73 | 45.4 Ų | 45.4 | 47% | 0.474 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -66.4 | -33.5 | 176.7 | 26.2 | -34.9 | 0 | 0 | 0 | 112.1 | A433 A434 S440 Y441 | A433-P437 WeakPolarHBondContact O-CD 2.97Å; A434-P437 WeakPolarHBondContact O-CD 3.15Å; A434-P437 VanDerWaalsContact O-CG 3.28Å; A434-P437 WeakPolarHBondContact O-CG 3.36Å; P437-S440 PolarHBondContact O-N 3.2Å; P437-Y441 WeakPolarHBondContact O-CB 3.29Å; P437-Y441 PolarHBondContact O-N 3.48Å |
| 438 | T | 81.3 | Confident | 82.3 | Confident | 29 Ų | 29 | 47.8 Ų | 47.8 | 18% | 0.178 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.6 | -50 | 176.1 | -62.9 | 0 | 0 | 0 | 0 | 111.4 | F305 L310 A434 A435 F436 S440 Y441 F442 | F305-T438 HydrophobicContact CE2-CG2 4.36Å; F305-T438 HydrophobicContact CZ-CG2 3.94Å; L310-T438 HydrophobicContact CD2-CG2 4.27Å; A434-T438 PolarHBondContact O-N 3.03Å; A434-T438 PolarHBondContact O-OG1 2.95Å; A435-T438 PolarHBondContact O-N 3.43Å; F436-T438 VanDerWaalsContact C-N 3.31Å; F436-T438 PolarHBondContact O-N 2.93Å; T438-S440 PolarHBondContact O-N 3.33Å; T438-Y441 PolarHBondContact O-N 2.89Å; T438-F442 HydrophobicContact CG2-CD2 3.66Å; T438-F442 HydrophobicContact CG2-CE2 3.58Å; T438-F442 WeakPolarHBondContact O-CD2 3.49Å; T438-F442 PolarHBondContact O-N 2.91Å |
| 439 | H | 77 | Confident | 81.8 | Confident | 16 Ų | 16 | 50.1 Ų | 50.1 | 7% | 0.074 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.5 | -47.8 | 176.1 | -176.2 | -91.8 | 0 | 0 | 0 | 111.1 | A435 F436 Y441 F442 C443 | A435-H439 WeakPolarHBondContact O-CB 3.35Å; A435-H439 PolarHBondContact O-N 3.39Å; F436-H439 PolarHBondContact O-N 3.47Å; H439-Y441 VanDerWaalsContact C-N 3.29Å; H439-Y441 PolarHBondContact O-N 3.28Å; H439-F442 PolarHBondContact O-N 3.11Å; H439-C443 PolarHBondContact CE1-SG 3.26Å; H439-C443 WeakPolarHBondContact O-CB 3.46Å; H439-C443 PolarHBondContact O-N 3.46Å; H439-C443 PolarHBondContact O-SG 3.3Å |
| 440 | S | 77.4 | Confident | 81.3 | Confident | 58 Ų | 58 | 52.6 Ų | 52.6 | 41% | 0.406 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -58.9 | -39.6 | 178.3 | -57 | 0 | 0 | 0 | 0 | 112.7 | F436 P437 T438 S444 | F436-S440 PolarHBondContact O-N 3.47Å; F436-S440 PolarHBondContact O-OG 2.91Å; P437-S440 PolarHBondContact O-N 3.2Å; T438-S440 PolarHBondContact O-N 3.33Å; S440-S444 WeakPolarHBondContact O-CB 3.41Å; S440-S444 PolarHBondContact O-N 3.47Å; S440-S444 PolarHBondContact O-OG 3.08Å |
| 441 | Y | 81.8 | Confident | 80.7 | Confident | 136 Ų | 136 | 49.9 Ų | 49.9 | 53% | 0.533 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -65.6 | -49.7 | 176.6 | 176.9 | -102.6 | 0 | 0 | 0 | 111.9 | P437 T438 H439 S444 L445 | P437-Y441 WeakPolarHBondContact O-CB 3.29Å; P437-Y441 PolarHBondContact O-N 3.48Å; T438-Y441 PolarHBondContact O-N 2.89Å; H439-Y441 VanDerWaalsContact C-N 3.29Å; H439-Y441 PolarHBondContact O-N 3.28Å; Y441-S444 PolarHBondContact O-N 2.92Å; Y441-S444 PolarHBondContact O-OG 2.96Å; Y441-L445 HydrophobicContact CD1-CD1 4.1Å; Y441-L445 HydrophobicContact CE1-CD1 3.64Å; Y441-L445 PolarHBondContact O-N 3.47Å |
| 442 | F | 78.6 | Confident | 80 | Confident | 8 Ų | 8 | 53.4 Ų | 53.4 | 4% | 0.035 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -66.5 | -38 | 179.9 | -78.8 | -72.3 | 0 | 0 | 0 | 113.2 | Y83 L313 V371 L372 T438 H439 S444 L445 | Y83-F442 HydrophobicContact CD2-CB 4.43Å; Y83-F442 VanDerWaalsContact CD2-O 3.24Å; Y83-F442 WeakPolarHBondContact CD2-O 3.34Å; Y83-F442 HydrophobicContact CE2-CB 4.45Å; Y83-F442 HydrophobicContact CE2-CD1 4.08Å; L313-F442 HydrophobicContact CD1-CB 3.69Å; L313-F442 HydrophobicContact CD1-CD2 3.48Å; L313-F442 VanDerWaalsContact CD1-CD2 3.48Å; L313-F442 HydrophobicContact CD1-CE2 4.25Å; L313-F442 HydrophobicContact CD1-CG 3.7Å; L313-F442 HydrophobicContact CD2-CB 4.17Å; V371-F442 HydrophobicContact CB-CZ 4.44Å; V371-F442 HydrophobicContact CG1-CD1 4Å; V371-F442 HydrophobicContact CG1-CE1 3.66Å; V371-F442 HydrophobicContact CG1-CE2 4.35Å; V371-F442 HydrophobicContact CG1-CG 4.47Å; V371-F442 HydrophobicContact CG1-CZ 3.88Å; L372-F442 HydrophobicContact CD2-CE1 3.39Å; L372-F442 HydrophobicContact CD2-CZ 3.62Å; L372-F442 HydrophobicContact CG-CE1 3.83Å; L372-F442 HydrophobicContact CG-CZ 3.77Å; T438-F442 HydrophobicContact CG2-CD2 3.66Å; T438-F442 HydrophobicContact CG2-CE2 3.58Å; T438-F442 WeakPolarHBondContact O-CD2 3.49Å; T438-F442 PolarHBondContact O-N 2.91Å; H439-F442 PolarHBondContact O-N 3.11Å; F442-S444 PolarHBondContact O-N 3.41Å; F442-L445 HydrophobicContact CD1-CD1 4.25Å; F442-L445 WeakPolarHBondContact O-CB 3.4Å; F442-L445 PolarHBondContact O-N 2.98Å |
| 443 | C | 72.7 | Confident | 79.6 | Confident | 33 Ų | 33 | 57.5 Ų | 57.5 | 22% | 0.223 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -71.5 | -16.1 | 175.9 | -59.6 | 0 | 0 | 0 | 0 | 113.5 | C85 H439 | C85-C443 HydrophobicContact CB-CB 3.88Å; C85-C443 WeakPolarHBondContact CB-SG 3.48Å; C85-C443 VanDerWaalsContact SG-CA 3.56Å; C85-C443 WeakPolarHBondContact SG-CB 3.19Å; C85-C443 CovalentContact SG-SG 2.02Å; C85-C443 PolarHBondContact SG-SG 2.98Å; H439-C443 PolarHBondContact CE1-SG 3.26Å; H439-C443 WeakPolarHBondContact O-CB 3.46Å; H439-C443 PolarHBondContact O-N 3.46Å; H439-C443 PolarHBondContact O-SG 3.3Å |
| 444 | S | 73.6 | Confident | 78.9 | Confident | 93 Ų | 93 | 57.9 Ų | 57.9 | 65% | 0.65 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | -10.5 | 173.5 | 75.3 | 0 | 0 | 0 | 0 | 113.9 | S440 Y441 F442 | S440-S444 WeakPolarHBondContact O-CB 3.41Å; S440-S444 PolarHBondContact O-N 3.47Å; S440-S444 PolarHBondContact O-OG 3.08Å; Y441-S444 PolarHBondContact O-N 2.92Å; Y441-S444 PolarHBondContact O-OG 2.96Å; F442-S444 PolarHBondContact O-N 3.41Å |
| 445 | L | 71.1 | Confident | 78.1 | Confident | 108 Ų | 108 | 60.7 Ų | 60.7 | 57% | 0.565 | 33% | 0.331 | S | S | * | . | trans | -90.9 | 0 | 175.7 | -72.5 | 162.8 | 0 | 0 | 0 | 111.2 | Y441 F442 | Y441-L445 HydrophobicContact CD1-CD1 4.1Å; Y441-L445 HydrophobicContact CE1-CD1 3.64Å; Y441-L445 PolarHBondContact O-N 3.47Å; F442-L445 HydrophobicContact CD1-CD1 4.25Å; F442-L445 WeakPolarHBondContact O-CB 3.4Å; F442-L445 PolarHBondContact O-N 2.98Å |
Retrieved 445 of 445 residues in 113.5 ms
(Link to these results)