| 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 | 40.6 | Very low | 53.4 | Low | 251 Ų | 251 | 136.5 Ų | 136.5 | 100% | 1.236 | 78% | 0.779 | S | S | * | * | 0 | 78.6 | 0 | -156.6 | 178.4 | -167.4 | 0 | 0 | 108 | |||||
| 2 | A | 52.5 | Low | 54 | Low | 96 Ų | 96 | 134.1 Ų | 134.1 | 79% | 0.793 | 77% | 0.772 | S | S | * | * | trans | -94.4 | 114.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | V4 | A2-V4 PolarHBondContact O-N 2.86Š| ||
| 3 | A | 55.7 | Low | 54.5 | Low | 90 Ų | 90 | 127.8 Ų | 127.8 | 74% | 0.744 | 73% | 0.731 | S | S | * | * | trans | -51 | 115.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | V5 | A3-V5 VanDerWaalsContact C-N 3.29Å; A3-V5 PolarHBondContact O-N 3.04Å | ||
| 4 | V | 59.8 | Low | 55.1 | Low | 138 Ų | 138 | 128.8 Ų | 128.8 | 84% | 0.836 | 73% | 0.73 | S | S | * | * | trans | -55.3 | 105.2 | 162.4 | 172.1 | 0 | 0 | 0 | 0 | 104.7 | A2 A6 | A2-V4 PolarHBondContact O-N 2.86Å; V4-A6 PolarHBondContact O-N 2.76Å | ||
| 5 | V | 58.5 | Low | 56.5 | Low | 130 Ų | 130 | 124.1 Ų | 124.1 | 79% | 0.788 | 71% | 0.709 | S | S | * | * | trans | -55.7 | 100.5 | 172.3 | 171.4 | 0 | 0 | 0 | 0 | 105 | A3 K7 | A3-V5 VanDerWaalsContact C-N 3.29Å; A3-V5 PolarHBondContact O-N 3.04Å; V5-K7 VanDerWaalsContact C-N 3.29Å; V5-K7 PolarHBondContact O-N 2.82Å | ||
| 6 | A | 56.8 | Low | 57.8 | Low | 81 Ų | 81 | 125.4 Ų | 125.4 | 67% | 0.669 | 71% | 0.707 | S | S | * | * | trans | -55 | 104.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 104.8 | V4 R8 | V4-A6 PolarHBondContact O-N 2.76Å; A6-R8 VanDerWaalsContact C-N 3.29Å; A6-R8 PolarHBondContact O-N 2.79Å | ||
| 7 | K | 54.9 | Low | 59.4 | Low | 165 Ų | 165 | 122.8 Ų | 122.8 | 72% | 0.717 | 70% | 0.704 | S | S | * | * | trans | -52.7 | 103.6 | 171.6 | 178.4 | -175.1 | 175.1 | -155.5 | 0 | 104.6 | V5 E9 | V5-K7 VanDerWaalsContact C-N 3.29Å; V5-K7 PolarHBondContact O-N 2.82Å; K7-E9 VanDerWaalsContact C-N 3.32Å; K7-E9 PolarHBondContact O-N 2.77Å | ||
| 8 | R | 50 | Low | 60.7 | Low | 241 Ų | 241 | 118.4 Ų | 118.4 | 91% | 0.909 | 69% | 0.686 | S | S | * | * | trans | -56.5 | 106.9 | 172.9 | -77.2 | -169.9 | 176.2 | -158.7 | -0.1 | 104.7 | A6 G10 | A6-R8 VanDerWaalsContact C-N 3.29Å; A6-R8 PolarHBondContact O-N 2.79Å; R8-G10 PolarHBondContact O-N 2.83Å | ||
| 9 | E | 50.8 | Low | 61.8 | Low | 166 Ų | 166 | 113.6 Ų | 113.6 | 78% | 0.776 | 66% | 0.658 | S | S | * | * | trans | -71.3 | 70.6 | 167.1 | -59.2 | -132.6 | 139.9 | 0 | 0 | 105.8 | K7 | K7-E9 VanDerWaalsContact C-N 3.32Å; K7-E9 PolarHBondContact O-N 2.77Å | ||
| 10 | G | 52.8 | Low | 63 | Low | 44 Ų | 44 | 117.8 Ų | 117.8 | 45% | 0.454 | 66% | 0.663 | S | S | . | * | trans | -53.6 | 152.8 | 155.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | R8 | R8-G10 PolarHBondContact O-N 2.83Š| ||
| 11 | P | 55.4 | Low | 64.2 | Low | 100 Ų | 100 | 113.8 Ų | 113.8 | 65% | 0.649 | 65% | 0.647 | S | S | * | * | trans | -44.1 | 130.2 | -174.7 | 15.4 | -29 | 0 | 0 | 0 | 109.4 | F13 | P11-F13 CarbonylContact O-C 3.41Å; P11-F13 PolarHBondContact O-N 3.45Å | ||
| 12 | P | 59.9 | Low | 66.4 | Low | 107 Ų | 107 | 104.6 Ų | 104.6 | 70% | 0.695 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -55.6 | -18.3 | -167.7 | 16.1 | -29.4 | 0 | 0 | 0 | 113.3 | ||
| 13 | F | 60.9 | Low | 68 | Low | 53 Ų | 53 | 101.9 Ų | 101.9 | 23% | 0.232 | 58% | 0.581 | C | S | . | * | trans | -115.5 | 113.4 | 171.7 | -54.9 | -72.5 | 0 | 0 | 0 | 110.1 | P11 S15 V19 K79 | P11-F13 CarbonylContact O-C 3.41Å; P11-F13 PolarHBondContact O-N 3.45Å; F13-S15 VanDerWaalsContact C-N 3.3Å; F13-S15 PolarHBondContact O-N 2.8Å; F13-V19 HydrophobicContact CB-CG2 4.45Å; F13-V19 HydrophobicContact CD1-CG2 3.83Å; F13-V19 HydrophobicContact CG-CG2 4.5Å; F13-K79 HydrophobicContact CE1-CB 3.83Å; F13-K79 HydrophobicContact CE1-CG 4.13Å; F13-K79 HydrophobicContact CE2-CD 4.11Å; F13-K79 HydrophobicContact CE2-CG 3.98Å; F13-K79 HydrophobicContact CZ-CB 3.74Å; F13-K79 HydrophobicContact CZ-CD 4.1Å; F13-K79 HydrophobicContact CZ-CG 3.52Å | ||
| 14 | I | 62.3 | Low | 69.5 | Low | 141 Ų | 141 | 100.4 Ų | 100.4 | 72% | 0.723 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -67.9 | -31.4 | -179.1 | -62 | 169.6 | 0 | 0 | 0 | 111.2 | ||
| 15 | S | 76.4 | Confident | 71 | Confident | 58 Ų | 58 | 98.1 Ų | 98.1 | 41% | 0.406 | 56% | 0.555 | S | S | . | * | trans | -155 | 116.9 | 175.8 | 53.9 | 0 | 0 | 0 | 0 | 111.3 | F13 A17 A18 V19 | F13-S15 VanDerWaalsContact C-N 3.3Å; F13-S15 PolarHBondContact O-N 2.8Å; S15-A17 PolarHBondContact O-N 3.39Å; S15-A18 PolarHBondContact O-N 2.96Å; S15-A18 WeakPolarHBondContact OG-CB 3.37Å; S15-V19 PolarHBondContact O-N 2.95Å | ||
| 16 | E | 78 | Confident | 72.5 | Confident | 145 Ų | 145 | 92.2 Ų | 92.2 | 68% | 0.678 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.2 | -33.9 | 177.6 | -61.5 | -167 | 157.9 | 0 | 0 | 111.9 | A18 V19 R20 | E16-A18 PolarHBondContact O-N 3.06Å; E16-V19 PolarHBondContact O-N 3.21Å; E16-R20 WeakPolarHBondContact O-CG 3.12Å; E16-R20 PolarHBondContact O-N 3.05Å |
| 17 | A | 84.1 | Confident | 74 | Confident | 81 Ų | 81 | 92.1 Ų | 92.1 | 67% | 0.669 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59.4 | -42.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | S15 R20 G21 | S15-A17 PolarHBondContact O-N 3.39Å; A17-R20 PolarHBondContact O-N 3.31Å; A17-G21 PolarHBondContact O-N 3.46Å |
| 18 | A | 82.4 | Confident | 75.8 | Confident | 45 Ų | 45 | 92.2 Ų | 92.2 | 37% | 0.372 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -70.6 | -37.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | S15 E16 R20 G21 N22 | S15-A18 PolarHBondContact O-N 2.96Å; S15-A18 WeakPolarHBondContact OG-CB 3.37Å; E16-A18 PolarHBondContact O-N 3.06Å; A18-R20 VanDerWaalsContact C-N 3.35Å; A18-G21 PolarHBondContact O-N 3.29Å; A18-N22 PolarHBondContact O-N 3.44Å; A18-N22 PolarHBondContact O-ND2 3.05Å |
| 19 | V | 82.7 | Confident | 77.7 | Confident | 27 Ų | 27 | 82.8 Ų | 82.8 | 16% | 0.164 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 175.5 | 178.8 | 0 | 0 | 0 | 0 | 110.7 | F13 S15 E16 N22 A23 K79 | F13-V19 HydrophobicContact CB-CG2 4.45Å; F13-V19 HydrophobicContact CD1-CG2 3.83Å; F13-V19 HydrophobicContact CG-CG2 4.5Å; S15-V19 PolarHBondContact O-N 2.95Å; E16-V19 PolarHBondContact O-N 3.21Å; V19-N22 PolarHBondContact O-N 3.36Å; V19-A23 PolarHBondContact O-N 2.91Å; V19-A23 VanDerWaalsContact O-N 3.11Å; V19-K79 HydrophobicContact CG1-CB 4.46Å |
| 20 | R | 84.8 | Confident | 79.6 | Confident | 197 Ų | 197 | 75.3 Ų | 75.3 | 74% | 0.743 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -64.5 | -41.6 | 174.5 | -71 | 178.1 | 70.8 | 173.4 | 1.6 | 112 | E16 A17 A18 A23 A24 | E16-R20 WeakPolarHBondContact O-CG 3.12Å; E16-R20 PolarHBondContact O-N 3.05Å; A17-R20 PolarHBondContact O-N 3.31Å; A18-R20 VanDerWaalsContact C-N 3.35Å; R20-A23 WeakPolarHBondContact O-CB 3.38Å; R20-A23 PolarHBondContact O-N 3.29Å; R20-A24 PolarHBondContact O-N 3.17Å |
| 21 | G | 88.4 | Confident | 81.5 | Confident | 33 Ų | 33 | 76.5 Ų | 76.5 | 34% | 0.34 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -59.6 | -45.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A17 A18 A23 A24 V25 | A17-G21 PolarHBondContact O-N 3.46Å; A18-G21 PolarHBondContact O-N 3.29Å; G21-A23 VanDerWaalsContact C-N 3.3Å; G21-A23 PolarHBondContact O-N 3.14Å; G21-A24 PolarHBondContact O-N 2.99Å; G21-V25 WeakPolarHBondContact O-CG2 3.31Å; G21-V25 PolarHBondContact O-N 2.88Å |
| 22 | N | 87 | Confident | 83.4 | Confident | 58 Ų | 58 | 73.5 Ų | 73.5 | 31% | 0.31 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.4 | -37.8 | 176.3 | -67.4 | -20.2 | 0 | 0 | 0 | 112.4 | A18 V19 L26 Y77 F78 | A18-N22 PolarHBondContact O-N 3.44Å; A18-N22 PolarHBondContact O-ND2 3.05Å; V19-N22 PolarHBondContact O-N 3.36Å; N22-L26 WeakPolarHBondContact O-CB 3.31Å; N22-L26 PolarHBondContact O-N 3.41Å; N22-Y77 PolarHBondContact ND2-O 3.41Å; N22-F78 HydrophobicContact CB-CE1 4.12Å; N22-F78 HydrophobicContact CB-CZ 4.07Å |
| 23 | A | 85.5 | Confident | 85 | Confident | 39 Ų | 39 | 70.6 Ų | 70.6 | 32% | 0.322 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.2 | -45.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | V19 R20 G21 V25 L26 D27 | V19-A23 PolarHBondContact O-N 2.91Å; V19-A23 VanDerWaalsContact O-N 3.11Å; R20-A23 WeakPolarHBondContact O-CB 3.38Å; R20-A23 PolarHBondContact O-N 3.29Å; G21-A23 VanDerWaalsContact C-N 3.3Å; G21-A23 PolarHBondContact O-N 3.14Å; A23-V25 PolarHBondContact O-N 3.21Å; A23-L26 WeakPolarHBondContact O-CB 3.28Å; A23-L26 PolarHBondContact O-N 3.41Å; A23-D27 PolarHBondContact O-N 2.98Å |
| 24 | A | 89.2 | Confident | 86.7 | Confident | 60 Ų | 60 | 68.3 Ų | 68.3 | 50% | 0.496 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.5 | -42.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | R20 G21 L26 D27 Y28 | R20-A24 PolarHBondContact O-N 3.17Å; G21-A24 PolarHBondContact O-N 2.99Å; A24-L26 VanDerWaalsContact C-N 3.31Å; A24-L26 PolarHBondContact O-N 2.83Å; A24-D27 PolarHBondContact O-N 3.44Å; A24-Y28 WeakPolarHBondContact O-CB 3.23Å; A24-Y28 PolarHBondContact O-N 3.44Å |
| 25 | V | 90.2 | Very high | 88.3 | Confident | 89 Ų | 89 | 62.6 Ų | 62.6 | 54% | 0.539 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -62.3 | -40.4 | 175.2 | 173.4 | 0 | 0 | 0 | 0 | 111 | G21 A23 Y28 C29 | G21-V25 WeakPolarHBondContact O-CG2 3.31Å; G21-V25 PolarHBondContact O-N 2.88Å; A23-V25 PolarHBondContact O-N 3.21Å; V25-Y28 PolarHBondContact O-N 2.91Å; V25-C29 PolarHBondContact O-N 3.22Å; V25-C29 PolarHBondContact O-SG 2.89Å |
| 26 | L | 89.1 | Confident | 89.3 | Confident | 6 Ų | 6 | 65.4 Ų | 65.4 | 3% | 0.031 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 177.1 | 178.2 | 148.9 | 0 | 0 | 0 | 111.9 | N22 A23 A24 Y28 C29 R30 L66 F78 L84 | N22-L26 WeakPolarHBondContact O-CB 3.31Å; N22-L26 PolarHBondContact O-N 3.41Å; A23-L26 WeakPolarHBondContact O-CB 3.28Å; A23-L26 PolarHBondContact O-N 3.41Å; A24-L26 VanDerWaalsContact C-N 3.31Å; A24-L26 PolarHBondContact O-N 2.83Å; L26-Y28 VanDerWaalsContact C-N 3.32Å; L26-Y28 PolarHBondContact O-N 2.98Å; L26-C29 PolarHBondContact O-N 3.37Å; L26-R30 VanDerWaalsContact CD2-NE 3.32Å; L26-R30 WeakPolarHBondContact O-CG 3.39Å; L26-R30 PolarHBondContact O-N 3.44Å; L26-L66 HydrophobicContact CD1-CD1 4.18Å; L26-L66 HydrophobicContact CG-CD1 4.29Å; L26-F78 HydrophobicContact CB-CE1 4.31Å; L26-F78 HydrophobicContact CB-CZ 4.3Å; L26-F78 HydrophobicContact CD1-CE1 3.77Å; L26-F78 HydrophobicContact CD1-CZ 3.68Å; L26-L84 HydrophobicContact CD1-CD2 3.68Å |
| 27 | D | 89.4 | Confident | 90.2 | Very high | 80 Ų | 80 | 59 Ų | 59 | 43% | 0.428 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.3 | -38.4 | 176.9 | -70.9 | -28.1 | 0 | 0 | 0 | 111.8 | A23 A24 R30 T31 | A23-D27 PolarHBondContact O-N 2.98Å; A24-D27 PolarHBondContact O-N 3.44Å; D27-R30 PolarHBondContact O-N 2.96Å; D27-T31 PolarHBondContact O-N 3.02Å; D27-T31 PolarHBondContact O-OG1 3.22Å |
| 28 | Y | 91.6 | Very high | 90.8 | Very high | 167 Ų | 167 | 55.1 Ų | 55.1 | 66% | 0.655 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -61.8 | -50.8 | 173.4 | -177.7 | -101.3 | 0 | 0 | 0 | 111.7 | A24 V25 L26 R30 T31 S32 | A24-Y28 WeakPolarHBondContact O-CB 3.23Å; A24-Y28 PolarHBondContact O-N 3.44Å; V25-Y28 PolarHBondContact O-N 2.91Å; L26-Y28 VanDerWaalsContact C-N 3.32Å; L26-Y28 PolarHBondContact O-N 2.98Å; Y28-R30 VanDerWaalsContact C-N 3.25Å; Y28-R30 PolarHBondContact O-N 3.33Å; Y28-T31 PolarHBondContact O-N 2.87Å; Y28-T31 VanDerWaalsContact O-N 3.16Å; Y28-S32 PolarHBondContact O-N 2.92Å; Y28-S32 PolarHBondContact O-OG 3.04Å; Y28-S32 VanDerWaalsContact O-OG 3.12Å |
| 29 | C | 91.4 | Very high | 91.5 | Very high | 43 Ų | 43 | 53.9 Ų | 53.9 | 29% | 0.291 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -55.2 | -41.8 | 177.1 | -71.5 | 0 | 0 | 0 | 0 | 112.1 | V25 L26 V33 | V25-C29 PolarHBondContact O-N 3.22Å; V25-C29 PolarHBondContact O-SG 2.89Å; L26-C29 PolarHBondContact O-N 3.37Å; C29-V33 WeakPolarHBondContact O-CB 3.39Å; C29-V33 WeakPolarHBondContact O-CG2 3.37Å; C29-V33 PolarHBondContact O-N 3.32Å |
| 30 | R | 90.2 | Very high | 92.2 | Very high | 9 Ų | 9 | 55.8 Ų | 55.8 | 3% | 0.034 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.6 | -49.3 | 177.4 | -72.9 | -179 | -176.3 | -78.3 | 6.8 | 111.9 | L26 D27 Y28 S32 V33 S34 L62 P83 L84 G87 | L26-R30 VanDerWaalsContact CD2-NE 3.32Å; L26-R30 WeakPolarHBondContact O-CG 3.39Å; L26-R30 PolarHBondContact O-N 3.44Å; D27-R30 PolarHBondContact O-N 2.96Å; Y28-R30 VanDerWaalsContact C-N 3.25Å; Y28-R30 PolarHBondContact O-N 3.33Å; R30-S32 VanDerWaalsContact C-N 3.34Å; R30-S32 PolarHBondContact O-N 3.39Å; R30-V33 PolarHBondContact O-N 3.11Å; R30-S34 WeakPolarHBondContact O-CB 3.45Å; R30-S34 PolarHBondContact O-N 3.42Å; R30-S34 PolarHBondContact O-OG 2.92Å; R30-L62 HydrophobicContact CB-CD2 4.31Å; R30-L62 HydrophobicContact CG-CD2 3.74Å; R30-P83 PolarHBondContact NH2-O 3.44Å; R30-L84 VanDerWaalsContact NH2-C 3.31Å; R30-L84 PolarHBondContact NH2-O 3.11Å; R30-G87 WeakPolarHBondContact CD-O 3.35Å; R30-G87 PolarHBondContact NE-O 3.37Å |
| 31 | T | 92.9 | Very high | 92.8 | Very high | 69 Ų | 69 | 46.4 Ų | 46.4 | 42% | 0.423 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | -179.5 | -52.6 | 0 | 0 | 0 | 0 | 111.2 | D27 Y28 S34 A35 T95 | D27-T31 PolarHBondContact O-N 3.02Å; D27-T31 PolarHBondContact O-OG1 3.22Å; Y28-T31 PolarHBondContact O-N 2.87Å; Y28-T31 VanDerWaalsContact O-N 3.16Å; T31-S34 PolarHBondContact O-N 3.39Å; T31-A35 PolarHBondContact O-N 3.24Å; T31-T95 HydrophobicContact CG2-CG2 4.27Å |
| 32 | S | 94.7 | Very high | 93.1 | Very high | 36 Ų | 36 | 44.8 Ų | 44.8 | 25% | 0.252 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.7 | -45.5 | 177.1 | -58.6 | 0 | 0 | 0 | 0 | 112.5 | Y28 R30 S34 A35 L36 | Y28-S32 PolarHBondContact O-N 2.92Å; Y28-S32 PolarHBondContact O-OG 3.04Å; Y28-S32 VanDerWaalsContact O-OG 3.12Å; R30-S32 VanDerWaalsContact C-N 3.34Å; R30-S32 PolarHBondContact O-N 3.39Å; S32-S34 VanDerWaalsContact C-N 3.35Å; S32-A35 PolarHBondContact O-N 3.25Å; S32-L36 WeakPolarHBondContact O-CG 3.42Å; S32-L36 PolarHBondContact O-N 3.43Å |
| 33 | V | 95 | Very high | 93.5 | Very high | 46 Ų | 46 | 46.6 Ų | 46.6 | 28% | 0.279 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66.8 | -38.1 | 178.6 | 170.9 | 0 | 0 | 0 | 0 | 111 | C29 R30 L36 S37 L62 | C29-V33 WeakPolarHBondContact O-CB 3.39Å; C29-V33 WeakPolarHBondContact O-CG2 3.37Å; C29-V33 PolarHBondContact O-N 3.32Å; R30-V33 PolarHBondContact O-N 3.11Å; V33-L36 PolarHBondContact O-N 2.87Å; V33-S37 VanDerWaalsContact O-CB 3.25Å; V33-S37 WeakPolarHBondContact O-CB 3.42Å; V33-S37 PolarHBondContact O-N 3.25Å; V33-S37 PolarHBondContact O-OG 3.26Å; V33-L62 HydrophobicContact CB-CD2 3.98Å; V33-L62 HydrophobicContact CG1-CB 4.34Å; V33-L62 HydrophobicContact CG1-CD2 4.16Å; V33-L62 HydrophobicContact CG2-CD1 3.96Å; V33-L62 HydrophobicContact CG2-CD2 4.07Å |
| 34 | S | 95.8 | Very high | 94 | Very high | 6 Ų | 6 | 49.9 Ų | 49.9 | 4% | 0.042 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59.4 | -44.7 | 172.5 | -77.1 | 0 | 0 | 0 | 0 | 112.2 | R30 T31 S32 S37 G38 G92 Y96 | R30-S34 WeakPolarHBondContact O-CB 3.45Å; R30-S34 PolarHBondContact O-N 3.42Å; R30-S34 PolarHBondContact O-OG 2.92Å; T31-S34 PolarHBondContact O-N 3.39Å; S32-S34 VanDerWaalsContact C-N 3.35Å; S34-S37 PolarHBondContact O-OG 2.97Å; S34-G38 PolarHBondContact O-N 3.05Å; S34-G92 WeakPolarHBondContact CB-O 3.32Å; S34-G92 WeakPolarHBondContact OG-CA 3.3Å; S34-G92 PolarHBondContact OG-O 3.45Å; S34-Y96 WeakPolarHBondContact O-CA 3.33Å |
| 35 | A | 96.1 | Very high | 94.2 | Very high | 20 Ų | 20 | 48 Ų | 48 | 17% | 0.165 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.2 | -48 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | T31 S32 G38 A39 T95 F99 | T31-A35 PolarHBondContact O-N 3.24Å; S32-A35 PolarHBondContact O-N 3.25Å; A35-G38 PolarHBondContact O-N 3.24Å; A35-A39 WeakPolarHBondContact O-CB 3.45Å; A35-A39 PolarHBondContact O-N 2.85Å; A35-T95 HydrophobicContact CB-CG2 3.93Å; A35-F99 HydrophobicContact CB-CD2 3.61Å; A35-F99 HydrophobicContact CB-CE2 3.56Å; A35-F99 HydrophobicContact CB-CG 4.35Å; A35-F99 HydrophobicContact CB-CZ 4.26Å |
| 36 | L | 96.9 | Very high | 94.3 | Very high | 118 Ų | 118 | 46 Ų | 46 | 62% | 0.618 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -66.5 | -43.1 | -179 | -69.7 | 172.4 | 0 | 0 | 0 | 112.8 | S32 V33 A39 T40 | S32-L36 WeakPolarHBondContact O-CG 3.42Å; S32-L36 PolarHBondContact O-N 3.43Å; V33-L36 PolarHBondContact O-N 2.87Å; L36-A39 PolarHBondContact O-N 3.46Å; L36-T40 WeakPolarHBondContact O-CB 3.5Å; L36-T40 PolarHBondContact O-N 3.17Å; L36-T40 PolarHBondContact O-OG1 3.4Å |
| 37 | S | 96.6 | Very high | 94.5 | Very high | 10 Ų | 10 | 49.2 Ų | 49.2 | 7% | 0.07 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -67.6 | -38.1 | 175.9 | 57.4 | 0 | 0 | 0 | 0 | 111.5 | V33 S34 T40 A41 F54 | V33-S37 VanDerWaalsContact O-CB 3.25Å; V33-S37 WeakPolarHBondContact O-CB 3.42Å; V33-S37 PolarHBondContact O-N 3.25Å; V33-S37 PolarHBondContact O-OG 3.26Å; S34-S37 PolarHBondContact O-OG 2.97Å; S37-T40 PolarHBondContact O-N 3.47Å; S37-A41 WeakPolarHBondContact O-CB 3.24Å; S37-A41 PolarHBondContact O-N 3.03Å; S37-F54 WeakPolarHBondContact O-CE1 3.37Å |
| 38 | G | 97.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.6 | -48.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111 | S34 A35 T40 A41 G42 W100 | S34-G38 PolarHBondContact O-N 3.05Å; A35-G38 PolarHBondContact O-N 3.24Å; G38-T40 VanDerWaalsContact C-N 3.32Å; G38-T40 PolarHBondContact O-N 3.25Å; G38-A41 PolarHBondContact O-N 3.28Å; G38-G42 PolarHBondContact O-N 3.36Å; G38-W100 WeakPolarHBondContact O-CA 3.48Å |
| 39 | A | 97.1 | Very high | 94.7 | Very high | 19 Ų | 19 | 46.3 Ų | 46.3 | 16% | 0.157 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -57.9 | -44.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A35 L36 G42 I43 L103 | A35-A39 WeakPolarHBondContact O-CB 3.45Å; A35-A39 PolarHBondContact O-N 2.85Å; L36-A39 PolarHBondContact O-N 3.46Å; A39-G42 PolarHBondContact O-N 2.9Å; A39-I43 VanDerWaalsContact O-CG1 3.3Å; A39-I43 WeakPolarHBondContact O-CG1 3.4Å; A39-I43 PolarHBondContact O-N 2.98Å; A39-L103 HydrophobicContact CB-CD1 3.24Å |
| 40 | T | 96.7 | Very high | 94.8 | Very high | 66 Ų | 66 | 52.3 Ų | 52.3 | 41% | 0.405 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -62 | -45.3 | 177.7 | -53.1 | 0 | 0 | 0 | 0 | 111.3 | L36 S37 G38 G42 I43 L44 F54 | L36-T40 WeakPolarHBondContact O-CB 3.5Å; L36-T40 PolarHBondContact O-N 3.17Å; L36-T40 PolarHBondContact O-OG1 3.4Å; S37-T40 PolarHBondContact O-N 3.47Å; G38-T40 VanDerWaalsContact C-N 3.32Å; G38-T40 PolarHBondContact O-N 3.25Å; T40-G42 VanDerWaalsContact C-N 3.33Å; T40-G42 PolarHBondContact O-N 3.49Å; T40-I43 PolarHBondContact O-N 3.34Å; T40-L44 HydrophobicContact CG2-CD1 4.03Å; T40-L44 HydrophobicContact CG2-CG 4.48Å; T40-L44 WeakPolarHBondContact O-CB 3.49Å; T40-L44 VanDerWaalsContact O-CG 3.26Å; T40-L44 WeakPolarHBondContact O-CG 3.48Å; T40-L44 PolarHBondContact O-N 3.19Å; T40-F54 HydrophobicContact CG2-CE1 4.48Å; T40-F54 HydrophobicContact CG2-CZ 4.03Å |
| 41 | A | 97 | Very high | 95.1 | Very high | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64.5 | -36.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | S37 G38 G45 L46 F54 Y96 W100 | S37-A41 WeakPolarHBondContact O-CB 3.24Å; S37-A41 PolarHBondContact O-N 3.03Å; G38-A41 PolarHBondContact O-N 3.28Å; A41-G45 PolarHBondContact O-N 2.87Å; A41-L46 HydrophobicContact CB-CD1 4.11Å; A41-L46 PolarHBondContact O-N 3.16Å; A41-L46 VanDerWaalsContact O-N 3.12Å; A41-F54 HydrophobicContact CB-CD1 3.76Å; A41-F54 HydrophobicContact CB-CE1 4.16Å; A41-F54 HydrophobicContact CB-CG 4.45Å; A41-Y96 HydrophobicContact CB-CE2 4.13Å; A41-Y96 WeakPolarHBondContact CB-OH 3.14Å; A41-W100 HydrophobicContact CB-CG 4.25Å |
| 42 | G | 96.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.6 | -49.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G38 A39 T40 L44 G45 W100 Y104 | G38-G42 PolarHBondContact O-N 3.36Å; A39-G42 PolarHBondContact O-N 2.9Å; T40-G42 VanDerWaalsContact C-N 3.33Å; T40-G42 PolarHBondContact O-N 3.49Å; G42-L44 VanDerWaalsContact C-N 3.35Å; G42-L44 PolarHBondContact O-N 2.76Å; G42-G45 PolarHBondContact O-N 3.35Å; G42-G45 VanDerWaalsContact O-N 3.08Å; G42-W100 VanDerWaalsContact CA-O 3.3Å; G42-W100 WeakPolarHBondContact CA-O 3.36Å; G42-Y104 WeakPolarHBondContact O-CA 3.42Å |
| 43 | I | 95.5 | Very high | 95.2 | Very high | 96 Ų | 96 | 55.4 Ų | 55.4 | 49% | 0.492 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 177.5 | -65.1 | 165.9 | 0 | 0 | 0 | 110.7 | A39 T40 G45 V107 H108 | A39-I43 VanDerWaalsContact O-CG1 3.3Å; A39-I43 WeakPolarHBondContact O-CG1 3.4Å; A39-I43 PolarHBondContact O-N 2.98Å; T40-I43 PolarHBondContact O-N 3.34Å; I43-G45 PolarHBondContact O-N 2.99Å; I43-G45 VanDerWaalsContact O-N 3.12Å; I43-V107 HydrophobicContact CG1-CG2 4.47Å; I43-H108 PolarHBondContact O-NE2 3.46Å |
| 44 | L | 95.2 | Very high | 95.2 | Very high | 108 Ų | 108 | 56 Ų | 56 | 57% | 0.565 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -11.2 | 177.2 | -72.8 | 176.1 | 0 | 0 | 0 | 113.9 | T40 G42 L46 | T40-L44 HydrophobicContact CG2-CD1 4.03Å; T40-L44 HydrophobicContact CG2-CG 4.48Å; T40-L44 WeakPolarHBondContact O-CB 3.49Å; T40-L44 VanDerWaalsContact O-CG 3.26Å; T40-L44 WeakPolarHBondContact O-CG 3.48Å; T40-L44 PolarHBondContact O-N 3.19Å; G42-L44 VanDerWaalsContact C-N 3.35Å; G42-L44 PolarHBondContact O-N 2.76Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L46 HydrophobicContact CB-CG 4.15Å; L44-L46 PolarHBondContact O-N 2.9Å |
| 45 | G | 93.2 | Very high | 95.2 | Very high | 20 Ų | 20 | 56.3 Ų | 56.3 | 21% | 0.206 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73.8 | 24.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A41 G42 I43 T47 H108 | A41-G45 PolarHBondContact O-N 2.87Å; G42-G45 PolarHBondContact O-N 3.35Å; G42-G45 VanDerWaalsContact O-N 3.08Å; I43-G45 PolarHBondContact O-N 2.99Å; I43-G45 VanDerWaalsContact O-N 3.12Å; G45-T47 PolarHBondContact O-N 3.09Å; G45-H108 WeakPolarHBondContact CA-NE2 3.25Å; G45-H108 PolarHBondContact N-NE2 3.15Å |
| 46 | L | 93 | Very high | 95 | Very high | 47 Ų | 47 | 60.6 Ų | 60.6 | 25% | 0.246 | 33% | 0.325 | C | S | . | . | trans | -67.7 | 129.7 | 179.5 | -63.2 | 177.5 | 0 | 0 | 0 | 109.7 | A41 L44 F54 W100 | A41-L46 HydrophobicContact CB-CD1 4.11Å; A41-L46 PolarHBondContact O-N 3.16Å; A41-L46 VanDerWaalsContact O-N 3.12Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L46 HydrophobicContact CB-CG 4.15Å; L44-L46 PolarHBondContact O-N 2.9Å; L46-F54 HydrophobicContact CD1-CB 3.75Å; L46-F54 HydrophobicContact CD1-CD1 4.5Å; L46-F54 HydrophobicContact CD1-CD2 3.98Å; L46-F54 HydrophobicContact CD1-CG 3.83Å; L46-W100 VanDerWaalsContact O-CE2 3.27Å; L46-W100 VanDerWaalsContact O-CZ2 3.24Å; L46-W100 WeakPolarHBondContact O-CZ2 3.03Å; L46-W100 PolarHBondContact O-NE1 2.99Å | ||
| 47 | T | 92.9 | Very high | 94.9 | Very high | 73 Ų | 73 | 60.2 Ų | 60.2 | 45% | 0.448 | 32% | 0.323 | S | S | . | . | trans | -119.1 | 154.4 | -179 | 57.3 | 0 | 0 | 0 | 0 | 112.1 | G45 L49 Y50 Y104 | G45-T47 PolarHBondContact O-N 3.09Å; T47-L49 PolarHBondContact O-N 2.92Å; T47-Y50 PolarHBondContact O-N 3.35Å; T47-Y104 HydrophobicContact CG2-CD2 4.44Å; T47-Y104 HydrophobicContact CG2-CE2 3.47Å; T47-Y104 VanDerWaalsContact CG2-CE2 3.47Å; T47-Y104 WeakPolarHBondContact CG2-OH 3.38Å | ||
| 48 | G | 91.7 | Very high | 94.8 | Very high | 49 Ų | 49 | 60.5 Ų | 60.5 | 51% | 0.505 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | 56.1 | -131.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y50 G51 F52 W100 | G48-Y50 VanDerWaalsContact C-N 3.29Å; G48-Y50 PolarHBondContact O-N 3.43Å; G48-G51 PolarHBondContact O-N 3.46Å; G48-F52 WeakPolarHBondContact O-CD2 3.42Å; G48-W100 WeakPolarHBondContact O-CH2 3.49Å |
| 49 | L | 93.6 | Very high | 94.6 | Very high | 138 Ų | 138 | 61 Ų | 61 | 72% | 0.723 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -64.2 | -30.5 | -176.2 | -66.4 | 175.7 | 0 | 0 | 0 | 113.3 | T47 G51 F52 I53 | T47-L49 PolarHBondContact O-N 2.92Å; L49-G51 VanDerWaalsContact C-N 3.31Å; L49-G51 PolarHBondContact O-N 3.34Å; L49-F52 PolarHBondContact O-N 2.89Å; L49-F52 VanDerWaalsContact O-N 3.13Å; L49-I53 WeakPolarHBondContact O-CG1 3.31Å; L49-I53 PolarHBondContact O-N 2.79Å |
| 50 | Y | 93.9 | Very high | 94.3 | Very high | 168 Ų | 168 | 64.2 Ų | 64.2 | 66% | 0.659 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -64 | -36.9 | -179.5 | -66.3 | -69.5 | 0 | 0 | 0 | 112.3 | T47 G48 I53 F54 | T47-Y50 PolarHBondContact O-N 3.35Å; G48-Y50 VanDerWaalsContact C-N 3.29Å; G48-Y50 PolarHBondContact O-N 3.43Å; Y50-I53 HydrophobicContact CD1-CD1 4.47Å; Y50-I53 PolarHBondContact O-N 3.34Å; Y50-F54 PolarHBondContact O-N 2.89Å |
| 51 | G | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.2 | -38.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | G48 L49 F54 Y55 Y96 | G48-G51 PolarHBondContact O-N 3.46Å; L49-G51 VanDerWaalsContact C-N 3.31Å; L49-G51 PolarHBondContact O-N 3.34Å; G51-F54 PolarHBondContact O-N 2.95Å; G51-Y55 PolarHBondContact O-N 3.12Å; G51-Y55 VanDerWaalsContact O-N 3.17Å; G51-Y96 PolarHBondContact O-OH 3.35Å |
| 52 | F | 94.5 | Very high | 93.9 | Very high | 93 Ų | 93 | 67 Ų | 67 | 41% | 0.408 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -69.8 | -36.2 | 175 | -71.8 | -72.4 | 0 | 0 | 0 | 113 | G48 L49 F54 Y55 L56 L93 V97 W100 | G48-F52 WeakPolarHBondContact O-CD2 3.42Å; L49-F52 PolarHBondContact O-N 2.89Å; L49-F52 VanDerWaalsContact O-N 3.13Å; F52-F54 VanDerWaalsContact C-N 3.29Å; F52-F54 PolarHBondContact O-N 3.18Å; F52-Y55 WeakPolarHBondContact O-CB 3.27Å; F52-Y55 PolarHBondContact O-N 3.41Å; F52-L56 PolarHBondContact O-N 3.29Å; F52-L56 VanDerWaalsContact O-N 3.1Å; F52-L93 HydrophobicContact CD1-CD1 4.17Å; F52-L93 HydrophobicContact CE1-CD1 4.17Å; F52-V97 HydrophobicContact CE1-CG2 4.12Å; F52-W100 HydrophobicContact CD1-CZ3 4.44Å; F52-W100 HydrophobicContact CD2-CH2 4.14Å; F52-W100 HydrophobicContact CD2-CZ3 4.14Å; F52-W100 HydrophobicContact CE1-CZ3 4.21Å; F52-W100 HydrophobicContact CE2-CH2 4.07Å; F52-W100 AromaticContact CE2-CZ3 3.9Å; F52-W100 HydrophobicContact CE2-CZ3 3.9Å; F52-W100 HydrophobicContact CG-CZ3 4.41Å; F52-W100 AromaticContact CZ-CZ3 3.94Å; F52-W100 HydrophobicContact CZ-CZ3 3.94Å |
| 53 | I | 95.6 | Very high | 93.6 | Very high | 87 Ų | 87 | 67.4 Ų | 67.4 | 45% | 0.446 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 173.4 | -67.9 | 166.3 | 0 | 0 | 0 | 109.9 | L49 Y50 Y55 L56 L57 | L49-I53 WeakPolarHBondContact O-CG1 3.31Å; L49-I53 PolarHBondContact O-N 2.79Å; Y50-I53 HydrophobicContact CD1-CD1 4.47Å; Y50-I53 PolarHBondContact O-N 3.34Å; I53-Y55 VanDerWaalsContact C-N 3.31Å; I53-Y55 PolarHBondContact O-N 2.96Å; I53-L56 PolarHBondContact O-N 2.99Å; I53-L57 HydrophobicContact CG2-CD1 4.11Å; I53-L57 HydrophobicContact CG2-CG 4.37Å; I53-L57 WeakPolarHBondContact O-CG 3.33Å; I53-L57 PolarHBondContact O-N 3.33Å |
| 54 | F | 95.3 | Very high | 93.3 | Very high | 58 Ų | 58 | 67.3 Ų | 67.3 | 25% | 0.254 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -59.9 | -40.4 | 176.9 | -170.7 | -96.9 | 0 | 0 | 0 | 112.5 | S37 T40 A41 L46 Y50 G51 F52 L56 L57 A58 Y96 | S37-F54 WeakPolarHBondContact O-CE1 3.37Å; T40-F54 HydrophobicContact CG2-CE1 4.48Å; T40-F54 HydrophobicContact CG2-CZ 4.03Å; A41-F54 HydrophobicContact CB-CD1 3.76Å; A41-F54 HydrophobicContact CB-CE1 4.16Å; A41-F54 HydrophobicContact CB-CG 4.45Å; L46-F54 HydrophobicContact CD1-CB 3.75Å; L46-F54 HydrophobicContact CD1-CD1 4.5Å; L46-F54 HydrophobicContact CD1-CD2 3.98Å; L46-F54 HydrophobicContact CD1-CG 3.83Å; Y50-F54 PolarHBondContact O-N 2.89Å; G51-F54 PolarHBondContact O-N 2.95Å; F52-F54 VanDerWaalsContact C-N 3.29Å; F52-F54 PolarHBondContact O-N 3.18Å; F54-L56 PolarHBondContact O-N 2.87Å; F54-L57 PolarHBondContact O-N 3.43Å; F54-A58 WeakPolarHBondContact O-CB 3.26Å; F54-A58 PolarHBondContact O-N 2.89Å; F54-Y96 HydrophobicContact CD1-CE2 4.23Å |
| 55 | Y | 95.2 | Very high | 93.1 | Very high | 13 Ų | 13 | 66.9 Ų | 66.9 | 5% | 0.051 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.1 | -45.8 | 173.7 | 177.6 | -110.1 | 0 | 0 | 0 | 113.1 | G51 F52 I53 L57 A58 S59 L89 G92 L93 Y96 | G51-Y55 PolarHBondContact O-N 3.12Å; G51-Y55 VanDerWaalsContact O-N 3.17Å; F52-Y55 WeakPolarHBondContact O-CB 3.27Å; F52-Y55 PolarHBondContact O-N 3.41Å; I53-Y55 VanDerWaalsContact C-N 3.31Å; I53-Y55 PolarHBondContact O-N 2.96Å; Y55-L57 VanDerWaalsContact C-N 3.34Å; Y55-A58 PolarHBondContact O-N 3.16Å; Y55-S59 WeakPolarHBondContact CE2-OG 3.39Å; Y55-S59 VanDerWaalsContact O-CB 3.31Å; Y55-S59 WeakPolarHBondContact O-CB 3.47Å; Y55-S59 PolarHBondContact O-N 3.02Å; Y55-S59 PolarHBondContact O-OG 3.21Å; Y55-L89 PolarHBondContact OH-O 3.24Å; Y55-G92 VanDerWaalsContact OH-C 3.23Å; Y55-L93 HydrophobicContact CD1-CD1 3.45Å; Y55-L93 VanDerWaalsContact CD1-CD1 3.45Å; Y55-L93 HydrophobicContact CE1-CB 3.91Å; Y55-L93 HydrophobicContact CE1-CD1 3.56Å; Y55-L93 HydrophobicContact CE1-CG 4.33Å; Y55-L93 HydrophobicContact CG-CD1 3.98Å; Y55-L93 PolarHBondContact OH-N 3.49Å; Y55-Y96 AromaticContact CD2-CD1 3.87Å; Y55-Y96 HydrophobicContact CD2-CD1 3.87Å; Y55-Y96 AromaticContact CD2-CD2 3.53Å; Y55-Y96 HydrophobicContact CD2-CD2 3.53Å; Y55-Y96 HydrophobicContact CD2-CE1 4.45Å; Y55-Y96 HydrophobicContact CD2-CE2 4.14Å; Y55-Y96 AromaticContact CD2-CG 3.38Å; Y55-Y96 HydrophobicContact CD2-CG 3.38Å; Y55-Y96 HydrophobicContact CE2-CD2 4.38Å; Y55-Y96 HydrophobicContact CE2-CG 4.07Å; Y55-Y96 HydrophobicContact CG-CD1 4.03Å; Y55-Y96 HydrophobicContact CG-CD2 4.29Å; Y55-Y96 HydrophobicContact CG-CE1 4.33Å; Y55-Y96 HydrophobicContact CG-CG 4.02Å |
| 56 | L | 93.5 | Very high | 92.9 | Very high | 109 Ų | 109 | 67.5 Ų | 67.5 | 57% | 0.571 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -62.6 | -43.2 | 178 | -68.9 | 178.5 | 0 | 0 | 0 | 111 | F52 I53 F54 S59 V60 | F52-L56 PolarHBondContact O-N 3.29Å; F52-L56 VanDerWaalsContact O-N 3.1Å; I53-L56 PolarHBondContact O-N 2.99Å; F54-L56 PolarHBondContact O-N 2.87Å; L56-S59 PolarHBondContact O-N 2.75Å; L56-V60 WeakPolarHBondContact O-CB 3.44Å; L56-V60 VanDerWaalsContact O-CG2 3.27Å; L56-V60 WeakPolarHBondContact O-CG2 3.38Å; L56-V60 PolarHBondContact O-N 2.88Å |
| 57 | L | 94.8 | Very high | 92.5 | Very high | 111 Ų | 111 | 66.9 Ų | 66.9 | 58% | 0.581 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.2 | -47.2 | 175.7 | -69.7 | 175.2 | 0 | 0 | 0 | 111.7 | I53 F54 Y55 S59 V60 L61 | I53-L57 HydrophobicContact CG2-CD1 4.11Å; I53-L57 HydrophobicContact CG2-CG 4.37Å; I53-L57 WeakPolarHBondContact O-CG 3.33Å; I53-L57 PolarHBondContact O-N 3.33Å; F54-L57 PolarHBondContact O-N 3.43Å; Y55-L57 VanDerWaalsContact C-N 3.34Å; L57-S59 VanDerWaalsContact C-N 3.35Å; L57-S59 PolarHBondContact O-N 2.91Å; L57-V60 PolarHBondContact O-N 3.42Å; L57-L61 VanDerWaalsContact O-CB 3.24Å; L57-L61 WeakPolarHBondContact O-CB 3.21Å; L57-L61 PolarHBondContact O-N 3.28Å |
| 58 | A | 94 | Very high | 92.2 | Very high | 16 Ų | 16 | 69.9 Ų | 69.9 | 13% | 0.132 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F54 Y55 L61 L62 | F54-A58 WeakPolarHBondContact O-CB 3.26Å; F54-A58 PolarHBondContact O-N 2.89Å; Y55-A58 PolarHBondContact O-N 3.16Å; A58-L61 PolarHBondContact O-N 2.81Å; A58-L62 WeakPolarHBondContact O-CB 3.34Å; A58-L62 PolarHBondContact O-N 2.92Å |
| 59 | S | 92.6 | Very high | 91.9 | Very high | 11 Ų | 11 | 76.2 Ų | 76.2 | 8% | 0.077 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -66.8 | -42.1 | 178.8 | -66.7 | 0 | 0 | 0 | 0 | 112.9 | Y55 L56 L57 S63 | Y55-S59 WeakPolarHBondContact CE2-OG 3.39Å; Y55-S59 VanDerWaalsContact O-CB 3.31Å; Y55-S59 WeakPolarHBondContact O-CB 3.47Å; Y55-S59 PolarHBondContact O-N 3.02Å; Y55-S59 PolarHBondContact O-OG 3.21Å; L56-S59 PolarHBondContact O-N 2.75Å; L57-S59 VanDerWaalsContact C-N 3.35Å; L57-S59 PolarHBondContact O-N 2.91Å; S59-S63 WeakPolarHBondContact O-CB 3.45Å; S59-S63 PolarHBondContact O-N 2.86Å; S59-S63 PolarHBondContact O-OG 2.69Å |
| 60 | V | 91.8 | Very high | 91.3 | Very high | 85 Ų | 85 | 70.5 Ų | 70.5 | 52% | 0.515 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.1 | -44.8 | 174.8 | 170.2 | 0 | 0 | 0 | 0 | 109.9 | L56 L57 L62 S63 L64 | L56-V60 WeakPolarHBondContact O-CB 3.44Å; L56-V60 VanDerWaalsContact O-CG2 3.27Å; L56-V60 WeakPolarHBondContact O-CG2 3.38Å; L56-V60 PolarHBondContact O-N 2.88Å; L57-V60 PolarHBondContact O-N 3.42Å; V60-L62 PolarHBondContact O-N 3.17Å; V60-S63 WeakPolarHBondContact O-CB 3.25Å; V60-S63 PolarHBondContact O-N 2.83Å; V60-S63 VanDerWaalsContact O-N 3.11Å; V60-L64 HydrophobicContact CG1-CD1 4.09Å; V60-L64 HydrophobicContact CG1-CG 4.33Å; V60-L64 WeakPolarHBondContact O-CG 3.47Å; V60-L64 PolarHBondContact O-N 3.26Å |
| 61 | L | 93.2 | Very high | 90.5 | Very high | 103 Ų | 103 | 64 Ų | 64 | 54% | 0.539 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.8 | -47.5 | 177.7 | -178.7 | 61.8 | 0 | 0 | 0 | 111.5 | L57 A58 S63 L64 L65 | L57-L61 VanDerWaalsContact O-CB 3.24Å; L57-L61 WeakPolarHBondContact O-CB 3.21Å; L57-L61 PolarHBondContact O-N 3.28Å; A58-L61 PolarHBondContact O-N 2.81Å; L61-S63 VanDerWaalsContact C-N 3.3Å; L61-S63 PolarHBondContact O-N 3.32Å; L61-L64 PolarHBondContact O-N 3.41Å; L61-L65 HydrophobicContact CG-CD1 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.42Å; L61-L65 PolarHBondContact O-N 3.24Å |
| 62 | L | 91.5 | Very high | 89.4 | Confident | 21 Ų | 21 | 75.3 Ų | 75.3 | 11% | 0.11 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -57.5 | -45.4 | 174.2 | 177.8 | 61.2 | 0 | 0 | 0 | 111.5 | R30 V33 A58 V60 L64 L65 L66 | R30-L62 HydrophobicContact CB-CD2 4.31Å; R30-L62 HydrophobicContact CG-CD2 3.74Å; V33-L62 HydrophobicContact CB-CD2 3.98Å; V33-L62 HydrophobicContact CG1-CB 4.34Å; V33-L62 HydrophobicContact CG1-CD2 4.16Å; V33-L62 HydrophobicContact CG2-CD1 3.96Å; V33-L62 HydrophobicContact CG2-CD2 4.07Å; A58-L62 WeakPolarHBondContact O-CB 3.34Å; A58-L62 PolarHBondContact O-N 2.92Å; V60-L62 PolarHBondContact O-N 3.17Å; L62-L64 VanDerWaalsContact C-N 3.32Å; L62-L64 PolarHBondContact O-N 2.98Å; L62-L65 PolarHBondContact O-N 3.5Å; L62-L66 HydrophobicContact CD1-CD1 4.33Å; L62-L66 HydrophobicContact CD1-CG 4.2Å; L62-L66 HydrophobicContact CG-CD1 4.08Å; L62-L66 HydrophobicContact CG-CG 4.38Å; L62-L66 VanDerWaalsContact O-CG 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.15Å; L62-L66 PolarHBondContact O-N 3.1Å |
| 63 | S | 89.5 | Confident | 88.3 | Confident | 10 Ų | 10 | 79.4 Ų | 79.4 | 7% | 0.07 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 180 | -56.9 | 0 | 0 | 0 | 0 | 111.6 | S59 V60 L61 L66 I67 | S59-S63 WeakPolarHBondContact O-CB 3.45Å; S59-S63 PolarHBondContact O-N 2.86Å; S59-S63 PolarHBondContact O-OG 2.69Å; V60-S63 WeakPolarHBondContact O-CB 3.25Å; V60-S63 PolarHBondContact O-N 2.83Å; V60-S63 VanDerWaalsContact O-N 3.11Å; L61-S63 VanDerWaalsContact C-N 3.3Å; L61-S63 PolarHBondContact O-N 3.32Å; S63-L66 PolarHBondContact O-N 3.18Å; S63-I67 WeakPolarHBondContact O-CD1 3.3Å; S63-I67 VanDerWaalsContact O-CG1 3.23Å; S63-I67 WeakPolarHBondContact O-CG1 3.36Å; S63-I67 PolarHBondContact O-N 2.58Å |
| 64 | L | 90 | Very high | 86.9 | Confident | 94 Ų | 94 | 78.4 Ų | 78.4 | 49% | 0.492 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.6 | -46.3 | 173.3 | -70 | 173.8 | 0 | 0 | 0 | 111.7 | V60 L61 L62 L66 I67 L68 | V60-L64 HydrophobicContact CG1-CD1 4.09Å; V60-L64 HydrophobicContact CG1-CG 4.33Å; V60-L64 WeakPolarHBondContact O-CG 3.47Å; V60-L64 PolarHBondContact O-N 3.26Å; L61-L64 PolarHBondContact O-N 3.41Å; L62-L64 VanDerWaalsContact C-N 3.32Å; L62-L64 PolarHBondContact O-N 2.98Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.3Å; L64-I67 PolarHBondContact O-N 3.17Å; L64-L68 VanDerWaalsContact O-CG 3.31Å; L64-L68 WeakPolarHBondContact O-CG 3.4Å; L64-L68 PolarHBondContact O-N 3.38Å |
| 65 | L | 90.6 | Very high | 85.7 | Confident | 98 Ų | 98 | 81.6 Ų | 81.6 | 51% | 0.513 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.2 | -40 | 176.9 | -67.8 | 172.4 | 0 | 0 | 0 | 111.9 | L61 L62 L68 K69 | L61-L65 HydrophobicContact CG-CD1 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.42Å; L61-L65 PolarHBondContact O-N 3.24Å; L62-L65 PolarHBondContact O-N 3.5Å; L65-L68 PolarHBondContact O-N 2.92Å; L65-K69 VanDerWaalsContact O-CB 3.31Å; L65-K69 WeakPolarHBondContact O-CB 3.34Å; L65-K69 PolarHBondContact O-N 3.46Å |
| 66 | L | 88.2 | Confident | 84.4 | Confident | 34 Ų | 34 | 86.8 Ų | 86.8 | 18% | 0.178 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -65.6 | -39.7 | 175.7 | -70.9 | 174.9 | 0 | 0 | 0 | 112.1 | L26 L62 S63 L64 K69 A70 | L26-L66 HydrophobicContact CD1-CD1 4.18Å; L26-L66 HydrophobicContact CG-CD1 4.29Å; L62-L66 HydrophobicContact CD1-CD1 4.33Å; L62-L66 HydrophobicContact CD1-CG 4.2Å; L62-L66 HydrophobicContact CG-CD1 4.08Å; L62-L66 HydrophobicContact CG-CG 4.38Å; L62-L66 VanDerWaalsContact O-CG 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.15Å; L62-L66 PolarHBondContact O-N 3.1Å; S63-L66 PolarHBondContact O-N 3.18Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.3Å; L66-K69 PolarHBondContact O-N 2.9Å; L66-A70 VanDerWaalsContact O-CB 3.28Å; L66-A70 WeakPolarHBondContact O-CB 3.3Å; L66-A70 PolarHBondContact O-N 2.96Å |
| 67 | I | 85.3 | Confident | 83.3 | Confident | 33 Ų | 33 | 85.9 Ų | 85.9 | 17% | 0.169 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 175.5 | -68.6 | 160.7 | 0 | 0 | 0 | 110.6 | S63 L64 K69 A70 G71 W74 F85 | S63-I67 WeakPolarHBondContact O-CD1 3.3Å; S63-I67 VanDerWaalsContact O-CG1 3.23Å; S63-I67 WeakPolarHBondContact O-CG1 3.36Å; S63-I67 PolarHBondContact O-N 2.58Å; L64-I67 PolarHBondContact O-N 3.17Å; I67-K69 VanDerWaalsContact C-N 3.31Å; I67-K69 PolarHBondContact O-N 3.38Å; I67-A70 PolarHBondContact O-N 3.03Å; I67-G71 PolarHBondContact O-N 3.12Å; I67-W74 HydrophobicContact CG1-CZ3 4.47Å; I67-W74 HydrophobicContact CG2-CH2 4.21Å; I67-W74 HydrophobicContact CG2-CZ3 3.99Å; I67-F85 HydrophobicContact CD1-CD1 4.36Å; I67-F85 HydrophobicContact CD1-CE1 3.53Å; I67-F85 HydrophobicContact CD1-CE2 4.04Å; I67-F85 HydrophobicContact CD1-CZ 3.35Å; I67-F85 HydrophobicContact CG1-CZ 4.35Å |
| 68 | L | 86.8 | Confident | 82 | Confident | 136 Ų | 136 | 82.1 Ų | 82.1 | 71% | 0.712 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -59.7 | -42.7 | 175.1 | -70.7 | 171.4 | 0 | 0 | 0 | 111.2 | L64 L65 G71 | L64-L68 VanDerWaalsContact O-CG 3.31Å; L64-L68 WeakPolarHBondContact O-CG 3.4Å; L64-L68 PolarHBondContact O-N 3.38Å; L65-L68 PolarHBondContact O-N 2.92Å; L68-G71 PolarHBondContact O-N 3.03Å |
| 69 | K | 85.9 | Confident | 80.7 | Confident | 183 Ų | 183 | 88.6 Ų | 88.6 | 80% | 0.796 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -69 | -41.6 | 178.7 | -176.2 | 62.1 | 174.5 | 175.9 | 0 | 113.1 | L65 L66 I67 G71 | L65-K69 VanDerWaalsContact O-CB 3.31Å; L65-K69 WeakPolarHBondContact O-CB 3.34Å; L65-K69 PolarHBondContact O-N 3.46Å; L66-K69 PolarHBondContact O-N 2.9Å; I67-K69 VanDerWaalsContact C-N 3.31Å; I67-K69 PolarHBondContact O-N 3.38Å; K69-G71 PolarHBondContact O-N 3.47Å |
| 70 | A | 80.5 | Confident | 79.4 | Confident | 17 Ų | 17 | 90.7 Ų | 90.7 | 14% | 0.14 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -67.8 | -27.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | L66 I67 | L66-A70 VanDerWaalsContact O-CB 3.28Å; L66-A70 WeakPolarHBondContact O-CB 3.3Å; L66-A70 PolarHBondContact O-N 2.96Å; I67-A70 PolarHBondContact O-N 3.03Å |
| 71 | G | 77.2 | Confident | 78.1 | Confident | 31 Ų | 31 | 94.2 Ų | 94.2 | 32% | 0.32 | 44% | 0.438 | S | S | . | . | G | 310 helix | trans | 59.4 | -160.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | I67 L68 K69 R73 | I67-G71 PolarHBondContact O-N 3.12Å; L68-G71 PolarHBondContact O-N 3.03Å; K69-G71 PolarHBondContact O-N 3.47Å; G71-R73 PolarHBondContact O-N 2.97Å |
| 72 | R | 70.7 | Confident | 77 | Confident | 238 Ų | 238 | 98.7 Ų | 98.7 | 90% | 0.898 | 45% | 0.448 | S | S | * | . | G | 310 helix | trans | -67.8 | -7.1 | -177.6 | -158.5 | 157.8 | 78 | 155.7 | 1.5 | 114.2 | W74 | R72-W74 PolarHBondContact O-NE1 3.44Š|
| 73 | R | 71.5 | Confident | 75.9 | Confident | 179 Ų | 179 | 100.3 Ų | 100.3 | 68% | 0.675 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -109.7 | 23.9 | -175 | -69.7 | -171.5 | -79.4 | -173.7 | -4.5 | 114.4 | G71 N75 K76 Y77 | G71-R73 PolarHBondContact O-N 2.97Å; R73-N75 PolarHBondContact O-N 3.46Å; R73-K76 WeakPolarHBondContact O-CB 3.36Å; R73-K76 PolarHBondContact O-N 3.29Å; R73-Y77 HydrophobicContact CB-CE2 4.36Å; R73-Y77 WeakPolarHBondContact O-CD2 3.16Å |
| 74 | W | 67.5 | Low | 75 | Confident | 66 Ų | 66 | 99.9 Ų | 99.9 | 25% | 0.25 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -34 | -45.6 | 166.9 | 11.8 | 28 | 0 | 0 | 0 | 116 | I67 R72 K76 Y77 F78 | I67-W74 HydrophobicContact CG1-CZ3 4.47Å; I67-W74 HydrophobicContact CG2-CH2 4.21Å; I67-W74 HydrophobicContact CG2-CZ3 3.99Å; R72-W74 PolarHBondContact O-NE1 3.44Å; W74-K76 PolarHBondContact O-N 2.9Å; W74-Y77 PolarHBondContact O-N 3.23Å; W74-F78 PolarHBondContact O-N 3.37Å; W74-F78 VanDerWaalsContact O-N 3.14Å |
| 75 | N | 69 | Low | 73.8 | Confident | 126 Ų | 126 | 100.1 Ų | 100.1 | 67% | 0.674 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -62.2 | -16.1 | -177.5 | -158.9 | 46.3 | 0 | 0 | 0 | 114.1 | R73 | R73-N75 PolarHBondContact O-N 3.46Å |
| 76 | K | 68.9 | Low | 73 | Confident | 122 Ų | 122 | 99.9 Ų | 99.9 | 53% | 0.53 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -83.4 | -27.6 | 175.5 | -169 | 178 | 179.9 | -175.9 | 0 | 112.5 | R73 W74 | R73-K76 WeakPolarHBondContact O-CB 3.36Å; R73-K76 PolarHBondContact O-N 3.29Å; W74-K76 PolarHBondContact O-N 2.9Å |
| 77 | Y | 69.2 | Low | 72.3 | Confident | 90 Ų | 90 | 99.1 Ų | 99.1 | 35% | 0.353 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -99.4 | -32.6 | -170.7 | -58.5 | -70.1 | 0 | 0 | 0 | 113 | N22 R73 W74 | N22-Y77 PolarHBondContact ND2-O 3.41Å; R73-Y77 HydrophobicContact CB-CE2 4.36Å; R73-Y77 WeakPolarHBondContact O-CD2 3.16Å; W74-Y77 PolarHBondContact O-N 3.23Å |
| 78 | F | 68.8 | Low | 71.8 | Confident | 31 Ų | 31 | 99.2 Ų | 99.2 | 14% | 0.136 | 47% | 0.466 | C | S | . | . | trans | -131.5 | 138.9 | -176.2 | -67 | -83.3 | 0 | 0 | 0 | 111.5 | N22 L26 W74 S80 L84 | N22-F78 HydrophobicContact CB-CE1 4.12Å; N22-F78 HydrophobicContact CB-CZ 4.07Å; L26-F78 HydrophobicContact CB-CE1 4.31Å; L26-F78 HydrophobicContact CB-CZ 4.3Å; L26-F78 HydrophobicContact CD1-CE1 3.77Å; L26-F78 HydrophobicContact CD1-CZ 3.68Å; W74-F78 PolarHBondContact O-N 3.37Å; W74-F78 VanDerWaalsContact O-N 3.14Å; F78-S80 VanDerWaalsContact C-N 3.29Å; F78-S80 PolarHBondContact O-N 2.83Å; F78-L84 HydrophobicContact CB-CD1 4.48Å; F78-L84 HydrophobicContact CD2-CD1 4.12Å; F78-L84 HydrophobicContact CD2-CD2 3.67Å; F78-L84 HydrophobicContact CD2-CG 4.14Å; F78-L84 HydrophobicContact CE1-CD2 4.45Å; F78-L84 HydrophobicContact CE2-CD2 3.6Å; F78-L84 HydrophobicContact CG-CD1 4.42Å; F78-L84 HydrophobicContact CG-CD2 4.15Å; F78-L84 HydrophobicContact CG-CG 4.27Å; F78-L84 HydrophobicContact CZ-CD2 4.01Å | ||
| 79 | K | 65.7 | Low | 71.5 | Confident | 152 Ų | 152 | 95.4 Ų | 95.4 | 66% | 0.661 | 45% | 0.446 | S | S | * | . | S | Bend | trans | -70.5 | -21.9 | 178.5 | -174.2 | 162.6 | -173.6 | 172.6 | 0 | 113.5 | F13 V19 | F13-K79 HydrophobicContact CE1-CB 3.83Å; F13-K79 HydrophobicContact CE1-CG 4.13Å; F13-K79 HydrophobicContact CE2-CD 4.11Å; F13-K79 HydrophobicContact CE2-CG 3.98Å; F13-K79 HydrophobicContact CZ-CB 3.74Å; F13-K79 HydrophobicContact CZ-CD 4.1Å; F13-K79 HydrophobicContact CZ-CG 3.52Å; V19-K79 HydrophobicContact CG1-CB 4.46Å |
| 80 | S | 66.4 | Low | 71.5 | Confident | 55 Ų | 55 | 92.8 Ų | 92.8 | 39% | 0.385 | 44% | 0.44 | S | S | . | . | trans | -146.4 | 150.7 | 179 | 178.7 | 0 | 0 | 0 | 0 | 110.9 | F78 R82 P83 | F78-S80 VanDerWaalsContact C-N 3.29Å; F78-S80 PolarHBondContact O-N 2.83Å; S80-R82 VanDerWaalsContact C-N 3.35Å; S80-R82 PolarHBondContact OG-N 3.28Å; S80-P83 WeakPolarHBondContact O-CD 3.19Å | ||
| 81 | R | 64.2 | Low | 71.8 | Confident | 159 Ų | 159 | 94 Ų | 94 | 60% | 0.6 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -76.5 | -20.8 | 172.7 | -63.4 | -172.5 | -173.2 | -170.8 | 3.2 | 112.9 | L84 F85 | R81-L84 WeakPolarHBondContact O-CB 3.43Å; R81-L84 PolarHBondContact O-N 2.91Å; R81-F85 PolarHBondContact O-N 3.4Å |
| 82 | R | 69.1 | Low | 72.5 | Confident | 197 Ų | 197 | 92.7 Ų | 92.7 | 74% | 0.743 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -61.3 | -45.9 | -174.3 | -63.5 | -173.4 | -179.5 | -178.5 | -0.1 | 113 | S80 L84 F85 T86 | S80-R82 VanDerWaalsContact C-N 3.35Å; S80-R82 PolarHBondContact OG-N 3.28Å; R82-L84 PolarHBondContact O-N 2.88Å; R82-F85 PolarHBondContact O-N 3.29Å; R82-F85 VanDerWaalsContact O-N 3.17Å; R82-T86 PolarHBondContact O-N 2.93Å; R82-T86 PolarHBondContact O-OG1 3.44Å |
| 83 | P | 68.6 | Low | 73.6 | Confident | 55 Ų | 55 | 83.8 Ų | 83.8 | 36% | 0.357 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.1 | -28.2 | 178.2 | -22.1 | 34.3 | 0 | 0 | 0 | 114 | R30 S80 G87 | R30-P83 PolarHBondContact NH2-O 3.44Å; S80-P83 WeakPolarHBondContact O-CD 3.19Å; P83-G87 WeakPolarHBondContact O-CA 3.29Å; P83-G87 PolarHBondContact O-N 3.34Å; P83-G87 VanDerWaalsContact O-N 3.16Å |
| 84 | L | 70.2 | Confident | 74.7 | Confident | 2 Ų | 2 | 82.2 Ų | 82.2 | 1% | 0.01 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -67.4 | -35.9 | 176.9 | -70.3 | 171.2 | 0 | 0 | 0 | 112.2 | L26 R30 F78 R81 R82 | L26-L84 HydrophobicContact CD1-CD2 3.68Å; R30-L84 VanDerWaalsContact NH2-C 3.31Å; R30-L84 PolarHBondContact NH2-O 3.11Å; F78-L84 HydrophobicContact CB-CD1 4.48Å; F78-L84 HydrophobicContact CD2-CD1 4.12Å; F78-L84 HydrophobicContact CD2-CD2 3.67Å; F78-L84 HydrophobicContact CD2-CG 4.14Å; F78-L84 HydrophobicContact CE1-CD2 4.45Å; F78-L84 HydrophobicContact CE2-CD2 3.6Å; F78-L84 HydrophobicContact CG-CD1 4.42Å; F78-L84 HydrophobicContact CG-CD2 4.15Å; F78-L84 HydrophobicContact CG-CG 4.27Å; F78-L84 HydrophobicContact CZ-CD2 4.01Å; R81-L84 WeakPolarHBondContact O-CB 3.43Å; R81-L84 PolarHBondContact O-N 2.91Å; R82-L84 PolarHBondContact O-N 2.88Å |
| 85 | F | 65.9 | Low | 76 | Confident | 99 Ų | 99 | 80.8 Ų | 80.8 | 43% | 0.434 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -92.6 | -48.8 | -179.4 | -79.9 | -84.2 | 0 | 0 | 0 | 112.8 | I67 R81 R82 | I67-F85 HydrophobicContact CD1-CD1 4.36Å; I67-F85 HydrophobicContact CD1-CE1 3.53Å; I67-F85 HydrophobicContact CD1-CE2 4.04Å; I67-F85 HydrophobicContact CD1-CZ 3.35Å; I67-F85 HydrophobicContact CG1-CZ 4.35Å; R81-F85 PolarHBondContact O-N 3.4Å; R82-F85 PolarHBondContact O-N 3.29Å; R82-F85 VanDerWaalsContact O-N 3.17Å |
| 86 | T | 72.7 | Confident | 77.3 | Confident | 93 Ų | 93 | 74.8 Ų | 74.8 | 57% | 0.571 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -119.5 | -4.4 | -169 | 59.3 | 0 | 0 | 0 | 0 | 114.5 | R82 G88 L89 | R82-T86 PolarHBondContact O-N 2.93Å; R82-T86 PolarHBondContact O-OG1 3.44Å; T86-G88 PolarHBondContact O-N 3.18Å; T86-L89 HydrophobicContact CG2-CD1 4.46Å |
| 87 | G | 73.6 | Confident | 78.6 | Confident | 17 Ų | 17 | 71.2 Ų | 71.2 | 18% | 0.175 | 36% | 0.363 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | 128.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | R30 P83 L89 | R30-G87 WeakPolarHBondContact CD-O 3.35Å; R30-G87 PolarHBondContact NE-O 3.37Å; P83-G87 WeakPolarHBondContact O-CA 3.29Å; P83-G87 PolarHBondContact O-N 3.34Å; P83-G87 VanDerWaalsContact O-N 3.16Å; G87-L89 PolarHBondContact O-N 3.46Å; G87-L89 VanDerWaalsContact O-N 3.09Å |
| 88 | G | 75.9 | Confident | 79.8 | Confident | 36 Ų | 36 | 71.9 Ų | 71.9 | 37% | 0.371 | 37% | 0.372 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.9 | 5.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | T86 I90 G91 G92 | T86-G88 PolarHBondContact O-N 3.18Å; G88-I90 VanDerWaalsContact C-N 3.27Å; G88-I90 PolarHBondContact O-N 3.3Å; G88-G91 PolarHBondContact O-N 3.31Å; G88-G92 PolarHBondContact O-N 3.16Å |
| 89 | L | 80.7 | Confident | 81.2 | Confident | 55 Ų | 55 | 74 Ų | 74 | 29% | 0.288 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.1 | -35.2 | 178.7 | -69.8 | -179.5 | 0 | 0 | 0 | 113 | Y55 T86 G87 L93 | Y55-L89 PolarHBondContact OH-O 3.24Å; T86-L89 HydrophobicContact CG2-CD1 4.46Å; G87-L89 PolarHBondContact O-N 3.46Å; G87-L89 VanDerWaalsContact O-N 3.09Å; L89-L93 PolarHBondContact O-N 3.22Å |
| 90 | I | 86.3 | Confident | 82.7 | Confident | 129 Ų | 129 | 67.7 Ų | 67.7 | 66% | 0.662 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -75.7 | -42.4 | 177.5 | -60.8 | 172 | 0 | 0 | 0 | 110.1 | G88 G92 L93 F94 | G88-I90 VanDerWaalsContact C-N 3.27Å; G88-I90 PolarHBondContact O-N 3.3Å; I90-G92 PolarHBondContact O-N 3.05Å; I90-L93 WeakPolarHBondContact O-CB 3.48Å; I90-L93 PolarHBondContact O-N 3.49Å; I90-L93 VanDerWaalsContact O-N 3.16Å; I90-F94 HydrophobicContact CG2-CE2 3.97Å; I90-F94 VanDerWaalsContact O-CD2 3.28Å; I90-F94 WeakPolarHBondContact O-CD2 3.3Å |
| 91 | G | 86 | Confident | 84.1 | Confident | 43 Ų | 43 | 68.8 Ų | 68.8 | 44% | 0.443 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.2 | -45.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G88 L93 F94 | G88-G91 PolarHBondContact O-N 3.31Å; G91-L93 PolarHBondContact O-N 3.12Å; G91-F94 PolarHBondContact O-N 2.62Å |
| 92 | G | 91.5 | Very high | 85.6 | Confident | 3 Ų | 3 | 67.4 Ų | 67.4 | 3% | 0.031 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64.9 | -24 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | S34 Y55 G88 I90 Y96 | S34-G92 WeakPolarHBondContact CB-O 3.32Å; S34-G92 WeakPolarHBondContact OG-CA 3.3Å; S34-G92 PolarHBondContact OG-O 3.45Å; Y55-G92 VanDerWaalsContact OH-C 3.23Å; G88-G92 PolarHBondContact O-N 3.16Å; I90-G92 PolarHBondContact O-N 3.05Å; G92-Y96 VanDerWaalsContact O-CB 3.29Å; G92-Y96 WeakPolarHBondContact O-CB 3.1Å; G92-Y96 PolarHBondContact O-N 2.93Å |
| 93 | L | 93.5 | Very high | 86.9 | Confident | 50 Ų | 50 | 59.2 Ų | 59.2 | 26% | 0.262 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -66.9 | -40.6 | 177.4 | -179 | 70 | 0 | 0 | 0 | 110.8 | F52 Y55 L89 I90 G91 Y96 V97 | F52-L93 HydrophobicContact CD1-CD1 4.17Å; F52-L93 HydrophobicContact CE1-CD1 4.17Å; Y55-L93 HydrophobicContact CD1-CD1 3.45Å; Y55-L93 VanDerWaalsContact CD1-CD1 3.45Å; Y55-L93 HydrophobicContact CE1-CB 3.91Å; Y55-L93 HydrophobicContact CE1-CD1 3.56Å; Y55-L93 HydrophobicContact CE1-CG 4.33Å; Y55-L93 HydrophobicContact CG-CD1 3.98Å; Y55-L93 PolarHBondContact OH-N 3.49Å; L89-L93 PolarHBondContact O-N 3.22Å; I90-L93 WeakPolarHBondContact O-CB 3.48Å; I90-L93 PolarHBondContact O-N 3.49Å; I90-L93 VanDerWaalsContact O-N 3.16Å; G91-L93 PolarHBondContact O-N 3.12Å; L93-Y96 WeakPolarHBondContact O-CB 3.36Å; L93-Y96 PolarHBondContact O-N 3.13Å; L93-V97 HydrophobicContact CD1-CG2 4.28Å; L93-V97 HydrophobicContact CG-CG2 4.36Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.28Å; L93-V97 PolarHBondContact O-N 3.45Å |
| 94 | F | 94.2 | Very high | 88.1 | Confident | 147 Ų | 147 | 60 Ų | 60 | 65% | 0.645 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -64.3 | -45.8 | 178 | -67.4 | -68 | 0 | 0 | 0 | 111.8 | I90 G91 Y96 V97 L98 | I90-F94 HydrophobicContact CG2-CE2 3.97Å; I90-F94 VanDerWaalsContact O-CD2 3.28Å; I90-F94 WeakPolarHBondContact O-CD2 3.3Å; G91-F94 PolarHBondContact O-N 2.62Å; F94-Y96 VanDerWaalsContact C-N 3.3Å; F94-Y96 PolarHBondContact O-N 3.4Å; F94-V97 PolarHBondContact O-N 3.36Å; F94-L98 WeakPolarHBondContact O-CB 3.47Å; F94-L98 PolarHBondContact O-N 2.93Å |
| 95 | T | 95.3 | Very high | 89.3 | Confident | 36 Ų | 36 | 60.6 Ų | 60.6 | 22% | 0.221 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 174.3 | -53 | 0 | 0 | 0 | 0 | 111.1 | T31 A35 L98 F99 | T31-T95 HydrophobicContact CG2-CG2 4.27Å; A35-T95 HydrophobicContact CB-CG2 3.93Å; T95-L98 PolarHBondContact O-N 3.36Å; T95-F99 HydrophobicContact CG2-CD2 3.99Å; T95-F99 HydrophobicContact CG2-CE2 4Å; T95-F99 WeakPolarHBondContact O-CD2 3.14Å; T95-F99 PolarHBondContact O-N 3.38Å |
| 96 | Y | 96.5 | Very high | 90.7 | Very high | 0 Ų | 0 | 60.8 Ų | 60.8 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -58.9 | -53.2 | 176.5 | 172.3 | -92.7 | 0 | 0 | 0 | 112.4 | S34 A41 G51 F54 Y55 G92 L93 F94 L98 F99 W100 | S34-Y96 WeakPolarHBondContact O-CA 3.33Å; A41-Y96 HydrophobicContact CB-CE2 4.13Å; A41-Y96 WeakPolarHBondContact CB-OH 3.14Å; G51-Y96 PolarHBondContact O-OH 3.35Å; F54-Y96 HydrophobicContact CD1-CE2 4.23Å; Y55-Y96 AromaticContact CD2-CD1 3.87Å; Y55-Y96 HydrophobicContact CD2-CD1 3.87Å; Y55-Y96 AromaticContact CD2-CD2 3.53Å; Y55-Y96 HydrophobicContact CD2-CD2 3.53Å; Y55-Y96 HydrophobicContact CD2-CE1 4.45Å; Y55-Y96 HydrophobicContact CD2-CE2 4.14Å; Y55-Y96 AromaticContact CD2-CG 3.38Å; Y55-Y96 HydrophobicContact CD2-CG 3.38Å; Y55-Y96 HydrophobicContact CE2-CD2 4.38Å; Y55-Y96 HydrophobicContact CE2-CG 4.07Å; Y55-Y96 HydrophobicContact CG-CD1 4.03Å; Y55-Y96 HydrophobicContact CG-CD2 4.29Å; Y55-Y96 HydrophobicContact CG-CE1 4.33Å; Y55-Y96 HydrophobicContact CG-CG 4.02Å; G92-Y96 VanDerWaalsContact O-CB 3.29Å; G92-Y96 WeakPolarHBondContact O-CB 3.1Å; G92-Y96 PolarHBondContact O-N 2.93Å; L93-Y96 WeakPolarHBondContact O-CB 3.36Å; L93-Y96 PolarHBondContact O-N 3.13Å; F94-Y96 VanDerWaalsContact C-N 3.3Å; F94-Y96 PolarHBondContact O-N 3.4Å; Y96-L98 VanDerWaalsContact C-N 3.27Å; Y96-L98 PolarHBondContact O-N 3.37Å; Y96-F99 PolarHBondContact O-N 3.34Å; Y96-W100 HydrophobicContact CD1-CE3 4.16Å; Y96-W100 HydrophobicContact CE1-CB 4.21Å; Y96-W100 AromaticContact CE1-CD2 3.95Å; Y96-W100 HydrophobicContact CE1-CD2 3.95Å; Y96-W100 AromaticContact CE1-CE3 3.48Å; Y96-W100 HydrophobicContact CE1-CE3 3.48Å; Y96-W100 VanDerWaalsContact CE1-CE3 3.48Å; Y96-W100 HydrophobicContact CE1-CG 4.27Å; Y96-W100 HydrophobicContact CE1-CZ3 4.18Å; Y96-W100 WeakPolarHBondContact O-CB 3.38Å; Y96-W100 PolarHBondContact O-N 3.33Å |
| 97 | V | 96.1 | Very high | 91.7 | Very high | 46 Ų | 46 | 59.4 Ų | 59.4 | 28% | 0.279 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.4 | -38.1 | -177.7 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | F52 L93 F94 W100 T101 | F52-V97 HydrophobicContact CE1-CG2 4.12Å; L93-V97 HydrophobicContact CD1-CG2 4.28Å; L93-V97 HydrophobicContact CG-CG2 4.36Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.28Å; L93-V97 PolarHBondContact O-N 3.45Å; F94-V97 PolarHBondContact O-N 3.36Å; V97-W100 HydrophobicContact CG2-CE3 4.36Å; V97-T101 HydrophobicContact CG1-CG2 4.26Å; V97-T101 WeakPolarHBondContact O-CB 3.06Å; V97-T101 WeakPolarHBondContact O-CG2 3.23Å; V97-T101 PolarHBondContact O-N 2.97Å; V97-T101 PolarHBondContact O-OG1 3Å |
| 98 | L | 95.6 | Very high | 92.6 | Very high | 104 Ų | 104 | 63.1 Ų | 63.1 | 55% | 0.545 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -57.9 | -57.7 | 175.1 | -171.5 | 166.7 | 0 | 0 | 0 | 110.7 | F94 T95 Y96 W100 T101 F102 | F94-L98 WeakPolarHBondContact O-CB 3.47Å; F94-L98 PolarHBondContact O-N 2.93Å; T95-L98 PolarHBondContact O-N 3.36Å; Y96-L98 VanDerWaalsContact C-N 3.27Å; Y96-L98 PolarHBondContact O-N 3.37Å; L98-W100 VanDerWaalsContact C-N 3.34Å; L98-W100 PolarHBondContact O-N 3.08Å; L98-T101 PolarHBondContact O-OG1 3.02Å; L98-F102 WeakPolarHBondContact O-CB 3.46Å; L98-F102 PolarHBondContact O-N 3.44Å |
| 99 | F | 97.2 | Very high | 93.2 | Very high | 76 Ų | 76 | 66.2 Ų | 66.2 | 33% | 0.333 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.3 | -34.8 | -178.6 | -80.3 | -77.7 | 0 | 0 | 0 | 113 | A35 T95 Y96 L103 | A35-F99 HydrophobicContact CB-CD2 3.61Å; A35-F99 HydrophobicContact CB-CE2 3.56Å; A35-F99 HydrophobicContact CB-CG 4.35Å; A35-F99 HydrophobicContact CB-CZ 4.26Å; T95-F99 HydrophobicContact CG2-CD2 3.99Å; T95-F99 HydrophobicContact CG2-CE2 4Å; T95-F99 WeakPolarHBondContact O-CD2 3.14Å; T95-F99 PolarHBondContact O-N 3.38Å; Y96-F99 PolarHBondContact O-N 3.34Å; F99-L103 WeakPolarHBondContact O-CB 3.43Å; F99-L103 PolarHBondContact O-N 2.76Å |
| 100 | W | 96.9 | Very high | 93.3 | Very high | 20 Ų | 20 | 74.9 Ų | 74.9 | 8% | 0.076 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60.9 | -56.5 | 177.4 | 172.4 | 26.7 | 0 | 0 | 0 | 111.6 | G38 A41 G42 L46 G48 F52 Y96 V97 L98 Y104 | G38-W100 WeakPolarHBondContact O-CA 3.48Å; A41-W100 HydrophobicContact CB-CG 4.25Å; G42-W100 VanDerWaalsContact CA-O 3.3Å; G42-W100 WeakPolarHBondContact CA-O 3.36Å; L46-W100 VanDerWaalsContact O-CE2 3.27Å; L46-W100 VanDerWaalsContact O-CZ2 3.24Å; L46-W100 WeakPolarHBondContact O-CZ2 3.03Å; L46-W100 PolarHBondContact O-NE1 2.99Å; G48-W100 WeakPolarHBondContact O-CH2 3.49Å; F52-W100 HydrophobicContact CD1-CZ3 4.44Å; F52-W100 HydrophobicContact CD2-CH2 4.14Å; F52-W100 HydrophobicContact CD2-CZ3 4.14Å; F52-W100 HydrophobicContact CE1-CZ3 4.21Å; F52-W100 HydrophobicContact CE2-CH2 4.07Å; F52-W100 AromaticContact CE2-CZ3 3.9Å; F52-W100 HydrophobicContact CE2-CZ3 3.9Å; F52-W100 HydrophobicContact CG-CZ3 4.41Å; F52-W100 AromaticContact CZ-CZ3 3.94Å; F52-W100 HydrophobicContact CZ-CZ3 3.94Å; Y96-W100 HydrophobicContact CD1-CE3 4.16Å; Y96-W100 HydrophobicContact CE1-CB 4.21Å; Y96-W100 AromaticContact CE1-CD2 3.95Å; Y96-W100 HydrophobicContact CE1-CD2 3.95Å; Y96-W100 AromaticContact CE1-CE3 3.48Å; Y96-W100 HydrophobicContact CE1-CE3 3.48Å; Y96-W100 VanDerWaalsContact CE1-CE3 3.48Å; Y96-W100 HydrophobicContact CE1-CG 4.27Å; Y96-W100 HydrophobicContact CE1-CZ3 4.18Å; Y96-W100 WeakPolarHBondContact O-CB 3.38Å; Y96-W100 PolarHBondContact O-N 3.33Å; V97-W100 HydrophobicContact CG2-CE3 4.36Å; L98-W100 VanDerWaalsContact C-N 3.34Å; L98-W100 PolarHBondContact O-N 3.08Å; W100-Y104 WeakPolarHBondContact O-CB 3.33Å; W100-Y104 PolarHBondContact O-N 3.03Å |
| 101 | T | 95.4 | Very high | 93.6 | Very high | 78 Ų | 78 | 72.2 Ų | 72.2 | 48% | 0.479 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -69.7 | -37.6 | -178.2 | 55.7 | 0 | 0 | 0 | 0 | 112.3 | V97 L98 G105 | V97-T101 HydrophobicContact CG1-CG2 4.26Å; V97-T101 WeakPolarHBondContact O-CB 3.06Å; V97-T101 WeakPolarHBondContact O-CG2 3.23Å; V97-T101 PolarHBondContact O-N 2.97Å; V97-T101 PolarHBondContact O-OG1 3Å; L98-T101 PolarHBondContact O-OG1 3.02Å; T101-G105 PolarHBondContact O-N 3.38Å |
| 102 | F | 95.7 | Very high | 94 | Very high | 130 Ų | 130 | 73.7 Ų | 73.7 | 57% | 0.57 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -60.7 | -52 | 177.4 | 177.4 | -108.2 | 0 | 0 | 0 | 111.9 | L98 G105 M106 | L98-F102 WeakPolarHBondContact O-CB 3.46Å; L98-F102 PolarHBondContact O-N 3.44Å; F102-G105 PolarHBondContact O-N 3.34Å; F102-M106 PolarHBondContact O-N 2.76Å |
| 103 | L | 96.1 | Very high | 94.2 | Very high | 24 Ų | 24 | 77.6 Ų | 77.6 | 13% | 0.126 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -75.2 | -30.4 | -179.7 | -76.6 | 167.1 | 0 | 0 | 0 | 112.8 | A39 F99 G105 M106 V107 | A39-L103 HydrophobicContact CB-CD1 3.24Å; F99-L103 WeakPolarHBondContact O-CB 3.43Å; F99-L103 PolarHBondContact O-N 2.76Å; L103-G105 VanDerWaalsContact C-N 3.33Å; L103-M106 HydrophobicContact CD2-CE 3.32Å; L103-M106 HydrophobicContact CD2-SD 4.15Å; L103-M106 PolarHBondContact O-N 3.43Å; L103-V107 WeakPolarHBondContact O-CB 3.24Å; L103-V107 WeakPolarHBondContact O-CG2 3.38Å; L103-V107 PolarHBondContact O-N 3.42Å |
| 104 | Y | 95.8 | Very high | 94.2 | Very high | 73 Ų | 73 | 79.2 Ų | 79.2 | 29% | 0.286 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -58.6 | -48.4 | 169.5 | -177.2 | -83.8 | 0 | 0 | 0 | 110.8 | G42 T47 W100 M106 V107 H108 V109 | G42-Y104 WeakPolarHBondContact O-CA 3.42Å; T47-Y104 HydrophobicContact CG2-CD2 4.44Å; T47-Y104 HydrophobicContact CG2-CE2 3.47Å; T47-Y104 VanDerWaalsContact CG2-CE2 3.47Å; T47-Y104 WeakPolarHBondContact CG2-OH 3.38Å; W100-Y104 WeakPolarHBondContact O-CB 3.33Å; W100-Y104 PolarHBondContact O-N 3.03Å; Y104-M106 VanDerWaalsContact C-N 3.31Å; Y104-M106 PolarHBondContact O-N 3.03Å; Y104-V107 PolarHBondContact O-N 3.29Å; Y104-H108 HydrophobicContact CD1-CB 4.49Å; Y104-H108 AromaticContact CD2-CD2 3.84Å; Y104-H108 HydrophobicContact CE1-CB 4.18Å; Y104-H108 HydrophobicContact CE2-CB 4.35Å; Y104-H108 AromaticContact CE2-CD2 4Å; Y104-H108 WeakPolarHBondContact O-CB 3.38Å; Y104-H108 PolarHBondContact O-N 3.09Å; Y104-V109 HydrophobicContact CE1-CG2 4.39Å |
| 105 | G | 95.2 | Very high | 94.2 | Very high | 14 Ų | 14 | 75 Ų | 75 | 14% | 0.144 | 37% | 0.371 | C | S | . | . | I | π-helix | trans | -58.3 | -43.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | T101 F102 L103 V107 V109 Y110 | T101-G105 PolarHBondContact O-N 3.38Å; F102-G105 PolarHBondContact O-N 3.34Å; L103-G105 VanDerWaalsContact C-N 3.33Å; G105-V107 PolarHBondContact O-N 3.38Å; G105-V109 WeakPolarHBondContact O-CA 3.5Å; G105-V109 VanDerWaalsContact O-CB 3.25Å; G105-V109 WeakPolarHBondContact O-CB 3.41Å; G105-V109 PolarHBondContact O-N 2.91Å; G105-V109 VanDerWaalsContact O-N 3.15Å; G105-Y110 VanDerWaalsContact O-CD2 3.23Å; G105-Y110 WeakPolarHBondContact O-CD2 3.23Å; G105-Y110 PolarHBondContact O-N 2.92Å; G105-Y110 VanDerWaalsContact O-N 3.09Å |
| 106 | M | 94.3 | Very high | 94.1 | Very high | 103 Ų | 103 | 77.6 Ų | 77.6 | 51% | 0.507 | 38% | 0.381 | S | S | . | . | I | π-helix | trans | -68 | -30.9 | -178.9 | -167.7 | 179.7 | 82.1 | 0 | 0 | 114.7 | F102 L103 Y104 | F102-M106 PolarHBondContact O-N 2.76Å; L103-M106 HydrophobicContact CD2-CE 3.32Å; L103-M106 HydrophobicContact CD2-SD 4.15Å; L103-M106 PolarHBondContact O-N 3.43Å; Y104-M106 VanDerWaalsContact C-N 3.31Å; Y104-M106 PolarHBondContact O-N 3.03Å |
| 107 | V | 94.5 | Very high | 94 | Very high | 64 Ų | 64 | 83.1 Ų | 83.1 | 39% | 0.388 | 41% | 0.408 | S | S | . | . | I | π-helix | trans | -99.6 | -33.3 | -173.8 | 175.7 | 0 | 0 | 0 | 0 | 112.6 | I43 L103 Y104 G105 | I43-V107 HydrophobicContact CG1-CG2 4.47Å; L103-V107 WeakPolarHBondContact O-CB 3.24Å; L103-V107 WeakPolarHBondContact O-CG2 3.38Å; L103-V107 PolarHBondContact O-N 3.42Å; Y104-V107 PolarHBondContact O-N 3.29Å; G105-V107 PolarHBondContact O-N 3.38Å |
| 108 | H | 91 | Very high | 93.8 | Very high | 94 Ų | 94 | 86 Ų | 86 | 44% | 0.435 | 42% | 0.418 | S | S | . | . | I | π-helix | trans | -112.3 | -16.4 | -171.3 | -63.7 | -77.9 | 0 | 0 | 0 | 113.8 | I43 G45 Y104 | I43-H108 PolarHBondContact O-NE2 3.46Å; G45-H108 WeakPolarHBondContact CA-NE2 3.25Å; G45-H108 PolarHBondContact N-NE2 3.15Å; Y104-H108 HydrophobicContact CD1-CB 4.49Å; Y104-H108 AromaticContact CD2-CD2 3.84Å; Y104-H108 HydrophobicContact CE1-CB 4.18Å; Y104-H108 HydrophobicContact CE2-CB 4.35Å; Y104-H108 AromaticContact CE2-CD2 4Å; Y104-H108 WeakPolarHBondContact O-CB 3.38Å; Y104-H108 PolarHBondContact O-N 3.09Å |
| 109 | V | 88.5 | Confident | 93.7 | Very high | 101 Ų | 101 | 84.5 Ų | 84.5 | 61% | 0.612 | 41% | 0.407 | S | S | * | . | I | π-helix | trans | -105.2 | -45.9 | 178.9 | -177.5 | 0 | 0 | 0 | 0 | 111.6 | Y104 G105 | Y104-V109 HydrophobicContact CE1-CG2 4.39Å; G105-V109 WeakPolarHBondContact O-CA 3.5Å; G105-V109 VanDerWaalsContact O-CB 3.25Å; G105-V109 WeakPolarHBondContact O-CB 3.41Å; G105-V109 PolarHBondContact O-N 2.91Å; G105-V109 VanDerWaalsContact O-N 3.15Å |
| 110 | Y | 83.5 | Confident | 93.3 | Very high | 237 Ų | 237 | 85.3 Ų | 85.3 | 93% | 0.929 | 41% | 0.414 | S | S | * | . | trans | -94.7 | 0 | 175.3 | -59.4 | -67.8 | 0 | 0 | 0 | 111.1 | G105 | G105-Y110 VanDerWaalsContact O-CD2 3.23Å; G105-Y110 WeakPolarHBondContact O-CD2 3.23Å; G105-Y110 PolarHBondContact O-N 2.92Å; G105-Y110 VanDerWaalsContact O-N 3.09Å |
Retrieved 110 of 110 residues in 281.4 ms
(Link to these results)