| 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 | 37.9 | Very low | 43 | Very low | 246 Ų | 246 | 111.1 Ų | 111.1 | 100% | 1.212 | 62% | 0.619 | S | S | * | * | 0 | 115.5 | 0 | -76.1 | 169.9 | 156 | 0 | 0 | 108.2 | |||||
| 2 | T | 40.3 | Very low | 43.4 | Very low | 120 Ų | 120 | 110.7 Ų | 110.7 | 74% | 0.736 | 61% | 0.614 | S | S | * | * | trans | -68.8 | 125.5 | -163 | 30.8 | 0 | 0 | 0 | 0 | 113.3 | L4 | T2-L4 VanDerWaalsContact C-N 3.31Å; T2-L4 PolarHBondContact O-N 3.31Å; T2-L4 WeakPolarHBondContact OG1-CD1 3.41Å | ||
| 3 | N | 41.8 | Very low | 43.9 | Very low | 147 Ų | 147 | 109 Ų | 109 | 79% | 0.786 | 61% | 0.608 | S | S | * | * | trans | -79.4 | 73.4 | 178.4 | -148.7 | -18.2 | 0 | 0 | 0 | 109.4 | ||||
| 4 | L | 41.3 | Very low | 44.3 | Very low | 121 Ų | 121 | 107.1 Ų | 107.1 | 63% | 0.634 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | 2.1 | -166.6 | -93.9 | 150.4 | 0 | 0 | 0 | 115.7 | T2 T8 | T2-L4 VanDerWaalsContact C-N 3.31Å; T2-L4 PolarHBondContact O-N 3.31Å; T2-L4 WeakPolarHBondContact OG1-CD1 3.41Å; L4-T8 PolarHBondContact O-OG1 2.86Å |
| 5 | G | 43.3 | Very low | 44.7 | Very low | 61 Ų | 61 | 110.2 Ų | 110.2 | 63% | 0.629 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -53.3 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 6 | H | 42 | Very low | 45 | Very low | 102 Ų | 102 | 108.8 Ų | 108.8 | 47% | 0.472 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -83.2 | -35.5 | -171.9 | -119.6 | -47.7 | 0 | 0 | 0 | 113.3 | T8 C9 I10 Q165 | H6-T8 PolarHBondContact O-N 3.19Å; H6-C9 PolarHBondContact O-N 3.23Å; H6-I10 WeakPolarHBondContact O-CG1 3.3Å; H6-I10 PolarHBondContact O-N 3.25Å; H6-Q165 PolarHBondContact CE1-NE2 2.96Å; H6-Q165 PolarHBondContact NE2-NE2 3.3Å |
| 7 | S | 46 | Very low | 45.2 | Very low | 56 Ų | 56 | 104.2 Ų | 104.2 | 39% | 0.392 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65 | -28.5 | -179.9 | -163.5 | 0 | 0 | 0 | 0 | 112.4 | K11 | S7-K11 WeakPolarHBondContact O-CB 3.5Å; S7-K11 WeakPolarHBondContact O-CG 3.42Å; S7-K11 PolarHBondContact O-N 3.44Å |
| 8 | T | 43.7 | Very low | 45.2 | Very low | 67 Ų | 67 | 106.6 Ų | 106.6 | 41% | 0.411 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -73.5 | -39.1 | -178 | -41.3 | 0 | 0 | 0 | 0 | 112.2 | L4 H6 L12 | L4-T8 PolarHBondContact O-OG1 2.86Å; H6-T8 PolarHBondContact O-N 3.19Å; T8-L12 HydrophobicContact CG2-CD1 4.41Å; T8-L12 WeakPolarHBondContact O-CB 3.34Å; T8-L12 WeakPolarHBondContact O-CD1 3.35Å; T8-L12 VanDerWaalsContact O-CG 3.3Å; T8-L12 WeakPolarHBondContact O-CG 3.45Å; T8-L12 PolarHBondContact O-N 3.31Å; T8-L12 VanDerWaalsContact O-N 3.09Å |
| 9 | C | 44.1 | Very low | 45.2 | Very low | 60 Ų | 60 | 105.4 Ų | 105.4 | 41% | 0.405 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -68.7 | -43.5 | 175.4 | -166.7 | 0 | 0 | 0 | 0 | 110.9 | H6 L12 V13 | H6-C9 PolarHBondContact O-N 3.23Å; C9-L12 PolarHBondContact O-N 3.18Å; C9-V13 WeakPolarHBondContact O-CG2 3.23Å; C9-V13 PolarHBondContact O-N 3.32Å; C9-V13 VanDerWaalsContact O-N 3.11Å |
| 10 | I | 49.8 | Very low | 45.3 | Very low | 108 Ų | 108 | 105.9 Ų | 105.9 | 55% | 0.554 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.3 | -43.4 | 177.1 | -62.9 | 173.4 | 0 | 0 | 0 | 111 | H6 L12 V13 D14 | H6-I10 WeakPolarHBondContact O-CG1 3.3Å; H6-I10 PolarHBondContact O-N 3.25Å; I10-L12 VanDerWaalsContact C-N 3.35Å; I10-L12 PolarHBondContact O-N 3.08Å; I10-V13 PolarHBondContact O-N 3.37Å; I10-D14 VanDerWaalsContact O-CB 3.31Å; I10-D14 WeakPolarHBondContact O-CB 3.3Å; I10-D14 PolarHBondContact O-N 2.83Å |
| 11 | K | 42.6 | Very low | 45.5 | Very low | 134 Ų | 134 | 107 Ų | 107 | 58% | 0.583 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.2 | -36 | 177.5 | -79 | -177.9 | 178.6 | -174 | 0 | 113.1 | S7 Q15 | S7-K11 WeakPolarHBondContact O-CB 3.5Å; S7-K11 WeakPolarHBondContact O-CG 3.42Å; S7-K11 PolarHBondContact O-N 3.44Å; K11-Q15 PolarHBondContact O-N 3.18Å; K11-Q15 VanDerWaalsContact O-N 3.14Å |
| 12 | L | 47.6 | Very low | 46 | Very low | 106 Ų | 106 | 103.4 Ų | 103.4 | 56% | 0.555 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -69.6 | -35.8 | 176.6 | -77.6 | 166.9 | 0 | 0 | 0 | 112.2 | T8 C9 I10 T16 | T8-L12 HydrophobicContact CG2-CD1 4.41Å; T8-L12 WeakPolarHBondContact O-CB 3.34Å; T8-L12 WeakPolarHBondContact O-CD1 3.35Å; T8-L12 VanDerWaalsContact O-CG 3.3Å; T8-L12 WeakPolarHBondContact O-CG 3.45Å; T8-L12 PolarHBondContact O-N 3.31Å; T8-L12 VanDerWaalsContact O-N 3.09Å; C9-L12 PolarHBondContact O-N 3.18Å; I10-L12 VanDerWaalsContact C-N 3.35Å; I10-L12 PolarHBondContact O-N 3.08Å; L12-T16 PolarHBondContact O-OG1 3.44Å |
| 13 | V | 50.6 | Low | 46.3 | Very low | 89 Ų | 89 | 106 Ų | 106 | 54% | 0.539 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -72.3 | -41.1 | 173.6 | 175.9 | 0 | 0 | 0 | 0 | 111 | C9 I10 T16 A17 | C9-V13 WeakPolarHBondContact O-CG2 3.23Å; C9-V13 PolarHBondContact O-N 3.32Å; C9-V13 VanDerWaalsContact O-N 3.11Å; I10-V13 PolarHBondContact O-N 3.37Å; V13-T16 PolarHBondContact O-N 2.94Å; V13-T16 PolarHBondContact O-OG1 3.25Å; V13-T16 VanDerWaalsContact O-OG1 3.09Å; V13-A17 WeakPolarHBondContact O-CB 3.34Å; V13-A17 PolarHBondContact O-N 3.33Å |
| 14 | D | 49.3 | Very low | 46.4 | Very low | 82 Ų | 82 | 104 Ų | 104 | 44% | 0.439 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.9 | -39 | -176.9 | -170.1 | 48 | 0 | 0 | 0 | 113.1 | I10 T16 A17 K18 | I10-D14 VanDerWaalsContact O-CB 3.31Å; I10-D14 WeakPolarHBondContact O-CB 3.3Å; I10-D14 PolarHBondContact O-N 2.83Å; D14-T16 VanDerWaalsContact C-N 3.3Å; D14-T16 PolarHBondContact O-N 3.4Å; D14-A17 PolarHBondContact O-N 3.29Å; D14-K18 PolarHBondContact O-N 3.27Å |
| 15 | Q | 50.8 | Low | 46.6 | Very low | 154 Ų | 154 | 106.4 Ų | 106.4 | 72% | 0.72 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.7 | -28.3 | 177 | -75.9 | -175 | -17.3 | 0 | 0 | 113.5 | K11 | K11-Q15 PolarHBondContact O-N 3.18Å; K11-Q15 VanDerWaalsContact O-N 3.14Å |
| 16 | T | 49.7 | Very low | 46.5 | Very low | 87 Ų | 87 | 108.3 Ų | 108.3 | 53% | 0.534 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -90.3 | -25.2 | 177.2 | 48.3 | 0 | 0 | 0 | 0 | 112.6 | L12 V13 D14 | L12-T16 PolarHBondContact O-OG1 3.44Å; V13-T16 PolarHBondContact O-N 2.94Å; V13-T16 PolarHBondContact O-OG1 3.25Å; V13-T16 VanDerWaalsContact O-OG1 3.09Å; D14-T16 VanDerWaalsContact C-N 3.3Å; D14-T16 PolarHBondContact O-N 3.4Å |
| 17 | A | 48 | Very low | 46.3 | Very low | 31 Ų | 31 | 108.8 Ų | 108.8 | 26% | 0.256 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -76.7 | -38 | -177 | 0 | 0 | 0 | 0 | 0 | 113.7 | V13 D14 M20 F21 | V13-A17 WeakPolarHBondContact O-CB 3.34Å; V13-A17 PolarHBondContact O-N 3.33Å; D14-A17 PolarHBondContact O-N 3.29Å; A17-M20 PolarHBondContact O-N 2.83Å; A17-M20 VanDerWaalsContact O-N 3.07Å; A17-F21 PolarHBondContact O-N 2.92Å |
| 18 | K | 44.1 | Very low | 46.2 | Very low | 148 Ų | 148 | 111.7 Ų | 111.7 | 64% | 0.643 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -55.7 | -50.1 | -176.7 | -87.1 | -177.8 | 176.6 | 177.7 | 0 | 114.6 | D14 M20 | D14-K18 PolarHBondContact O-N 3.27Å; K18-M20 VanDerWaalsContact C-N 3.29Å; K18-M20 PolarHBondContact O-N 2.89Å |
| 19 | P | 46.9 | Very low | 45.9 | Very low | 83 Ų | 83 | 115.3 Ų | 115.3 | 54% | 0.539 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -76.9 | -15 | 177.2 | 28.8 | -33.1 | 0 | 0 | 0 | 113.5 | ||
| 20 | M | 46 | Very low | 45.6 | Very low | 115 Ų | 115 | 118.6 Ų | 118.6 | 57% | 0.567 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -82.2 | -34.5 | 177 | -162.2 | -175.3 | -66.9 | 0 | 0 | 111.5 | A17 K18 E22 K23 I24 | A17-M20 PolarHBondContact O-N 2.83Å; A17-M20 VanDerWaalsContact O-N 3.07Å; K18-M20 VanDerWaalsContact C-N 3.29Å; K18-M20 PolarHBondContact O-N 2.89Å; M20-E22 PolarHBondContact O-N 3.13Å; M20-K23 PolarHBondContact O-N 3.42Å; M20-I24 HydrophobicContact CG-CD1 3.97Å; M20-I24 WeakPolarHBondContact O-CD1 3.4Å; M20-I24 VanDerWaalsContact O-CG1 3.32Å; M20-I24 WeakPolarHBondContact O-CG1 3.37Å; M20-I24 PolarHBondContact O-N 2.98Å; M20-I24 HydrophobicContact SD-CD1 4.46Å |
| 21 | F | 49.7 | Very low | 45.1 | Very low | 129 Ų | 129 | 118.9 Ų | 118.9 | 57% | 0.566 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -65.1 | -37 | -178.8 | -124.7 | -92.7 | 0 | 0 | 0 | 112.6 | A17 K23 I24 F25 | A17-F21 PolarHBondContact O-N 2.92Å; F21-K23 VanDerWaalsContact C-N 3.3Å; F21-K23 PolarHBondContact O-N 3.4Å; F21-I24 PolarHBondContact O-N 2.82Å; F21-F25 HydrophobicContact CD1-CD2 4.35Å; F21-F25 AromaticContact CD1-CE2 3.77Å; F21-F25 HydrophobicContact CD1-CE2 3.77Å; F21-F25 AromaticContact CE1-CE2 3.76Å; F21-F25 HydrophobicContact CE1-CE2 3.76Å; F21-F25 HydrophobicContact CE1-CZ 4.47Å |
| 22 | E | 48.3 | Very low | 45.1 | Very low | 171 Ų | 171 | 117.4 Ų | 117.4 | 80% | 0.799 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -66.2 | -29.7 | 175.4 | -88.7 | -176.9 | 152.7 | 0 | 0 | 113.1 | M20 | M20-E22 PolarHBondContact O-N 3.13Å |
| 23 | K | 45.7 | Very low | 44.9 | Very low | 176 Ų | 176 | 117 Ų | 117 | 77% | 0.765 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -83.4 | -18.1 | 178.1 | -79.9 | -175.2 | 175.2 | -179.1 | 0 | 114.1 | M20 F21 | M20-K23 PolarHBondContact O-N 3.42Å; F21-K23 VanDerWaalsContact C-N 3.3Å; F21-K23 PolarHBondContact O-N 3.4Å |
| 24 | I | 45.4 | Very low | 44.7 | Very low | 103 Ų | 103 | 121.2 Ų | 121.2 | 53% | 0.528 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -79.5 | -28.2 | -177.1 | -70.9 | 164.9 | 0 | 0 | 0 | 112.1 | M20 F21 S26 | M20-I24 HydrophobicContact CG-CD1 3.97Å; M20-I24 WeakPolarHBondContact O-CD1 3.4Å; M20-I24 VanDerWaalsContact O-CG1 3.32Å; M20-I24 WeakPolarHBondContact O-CG1 3.37Å; M20-I24 PolarHBondContact O-N 2.98Å; M20-I24 HydrophobicContact SD-CD1 4.46Å; F21-I24 PolarHBondContact O-N 2.82Å; I24-S26 PolarHBondContact O-N 3.41Å; I24-S26 VanDerWaalsContact O-N 3.14Å |
| 25 | F | 45.8 | Very low | 44.8 | Very low | 172 Ų | 172 | 121.8 Ų | 121.8 | 75% | 0.754 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | 0.4 | -176.4 | -87.5 | -78.2 | 0 | 0 | 0 | 115.7 | F21 | F21-F25 HydrophobicContact CD1-CD2 4.35Å; F21-F25 AromaticContact CD1-CE2 3.77Å; F21-F25 HydrophobicContact CD1-CE2 3.77Å; F21-F25 AromaticContact CE1-CE2 3.76Å; F21-F25 HydrophobicContact CE1-CE2 3.76Å; F21-F25 HydrophobicContact CE1-CZ 4.47Å |
| 26 | S | 39.6 | Very low | 44.9 | Very low | 101 Ų | 101 | 118.8 Ų | 118.8 | 71% | 0.706 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | -8.1 | -178.6 | 155.1 | 0 | 0 | 0 | 0 | 115.1 | I24 | I24-S26 PolarHBondContact O-N 3.41Å; I24-S26 VanDerWaalsContact O-N 3.14Å |
| 27 | C | 38.5 | Very low | 45.2 | Very low | 112 Ų | 112 | 121.9 Ų | 121.9 | 76% | 0.757 | 68% | 0.684 | S | S | * | * | trans | -105.9 | 93.1 | -179.6 | -78.7 | 0 | 0 | 0 | 0 | 112.5 | N29 | C27-N29 PolarHBondContact O-N 2.93Š| ||
| 28 | S | 44 | Very low | 46.3 | Very low | 118 Ų | 118 | 128.6 Ų | 128.6 | 83% | 0.825 | 70% | 0.703 | S | S | * | * | trans | -77.5 | 25.2 | 176.1 | 178.5 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 29 | N | 38 | Very low | 47.8 | Very low | 143 Ų | 143 | 127.9 Ų | 127.9 | 77% | 0.765 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -113.5 | 118.2 | 175.1 | -82.3 | -12.1 | 0 | 0 | 0 | 110.4 | C27 C31 | C27-N29 PolarHBondContact O-N 2.93Å; N29-C31 PolarHBondContact O-N 3.16Å |
| 30 | S | 37.3 | Very low | 49.4 | Very low | 129 Ų | 129 | 125.9 Ų | 125.9 | 90% | 0.902 | 69% | 0.689 | S | S | * | * | trans | -65.6 | 76.8 | 180 | -153.3 | 0 | 0 | 0 | 0 | 110.4 | A32 | S30-A32 VanDerWaalsContact C-N 3.33Å; S30-A32 PolarHBondContact O-N 3.32Å | ||
| 31 | C | 39.6 | Very low | 51.3 | Low | 113 Ų | 113 | 123.5 Ų | 123.5 | 76% | 0.764 | 68% | 0.684 | S | S | * | * | trans | -70.7 | 96.5 | 162.9 | -78.4 | 0 | 0 | 0 | 0 | 107.1 | N29 S33 | N29-C31 PolarHBondContact O-N 3.16Å; C31-S33 PolarHBondContact O-N 3Å | ||
| 32 | A | 42.8 | Very low | 52.9 | Low | 103 Ų | 103 | 121.1 Ų | 121.1 | 85% | 0.851 | 69% | 0.688 | S | S | * | * | trans | -64.5 | 72.4 | 161.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | S30 | S30-A32 VanDerWaalsContact C-N 3.33Å; S30-A32 PolarHBondContact O-N 3.32Å | ||
| 33 | S | 43.2 | Very low | 54.7 | Low | 97 Ų | 97 | 116.3 Ų | 116.3 | 68% | 0.678 | 68% | 0.678 | S | S | * | * | trans | -129.6 | 56.5 | 163.4 | -160.9 | 0 | 0 | 0 | 0 | 107.9 | C31 S35 | C31-S33 PolarHBondContact O-N 3Å; S33-S35 PolarHBondContact O-N 2.88Å | ||
| 34 | H | 45.6 | Very low | 56.7 | Low | 178 Ų | 178 | 110.9 Ų | 110.9 | 82% | 0.824 | 66% | 0.655 | S | S | * | * | trans | -68.1 | 79.1 | 147.7 | -91.3 | -83.1 | 0 | 0 | 0 | 106.4 | V36 | H34-V36 HydrophobicContact CB-CG2 4.37Å; H34-V36 PolarHBondContact O-N 2.82Å | ||
| 35 | S | 51.6 | Low | 58.7 | Low | 95 Ų | 95 | 108.7 Ų | 108.7 | 66% | 0.664 | 64% | 0.641 | S | S | * | * | trans | -58.7 | 81.2 | 143.9 | 176.8 | 0 | 0 | 0 | 0 | 105.3 | S33 K37 | S33-S35 PolarHBondContact O-N 2.88Å; S35-K37 VanDerWaalsContact C-N 3.3Å; S35-K37 PolarHBondContact O-N 3.37Å | ||
| 36 | V | 53.2 | Low | 60.7 | Low | 90 Ų | 90 | 108.7 Ų | 108.7 | 55% | 0.545 | 64% | 0.636 | S | S | . | * | trans | -50.7 | 111 | 157.4 | 177 | 0 | 0 | 0 | 0 | 102.3 | H34 R38 | H34-V36 HydrophobicContact CB-CG2 4.37Å; H34-V36 PolarHBondContact O-N 2.82Å; V36-R38 PolarHBondContact O-N 2.83Å | ||
| 37 | K | 56.8 | Low | 63 | Low | 153 Ų | 153 | 107.2 Ų | 107.2 | 67% | 0.665 | 63% | 0.626 | S | S | * | * | trans | -55.1 | 93 | 173 | -84.5 | -176.3 | 177.7 | 179.9 | 0 | 105.8 | S35 I39 S88 | S35-K37 VanDerWaalsContact C-N 3.3Å; S35-K37 PolarHBondContact O-N 3.37Å; K37-I39 PolarHBondContact O-N 3.22Å; K37-S88 PolarHBondContact NZ-O 3.38Å; K37-S88 VanDerWaalsContact NZ-O 3.12Å | ||
| 38 | R | 71.3 | Confident | 65.4 | Low | 172 Ų | 172 | 105.9 Ų | 105.9 | 65% | 0.649 | 61% | 0.605 | S | S | * | * | trans | -62.7 | 115.4 | -176.4 | -178.6 | 178.2 | 178.2 | -124.1 | -10.9 | 105.9 | V36 L40 E44 | V36-R38 PolarHBondContact O-N 2.83Å; R38-L40 PolarHBondContact O-N 3.16Å; R38-E44 IonicContact CZ-OE1 3.17Å; R38-E44 IonicContact CZ-OE2 3.97Å; R38-E44 IonicContact NH1-OE1 2.8Å; R38-E44 PolarHBondContact NH1-OE1 2.88Å; R38-E44 IonicContact NH1-OE2 3.99Å; R38-E44 IonicContact NH2-OE1 2.79Å; R38-E44 PolarHBondContact NH2-OE1 2.79Å; R38-E44 IonicContact NH2-OE2 3.67Å | ||
| 39 | I | 74.8 | Confident | 67.5 | Low | 133 Ų | 133 | 102.1 Ų | 102.1 | 68% | 0.682 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 117.4 | 173.2 | -59.9 | 176 | 0 | 0 | 0 | 106.1 | K37 | K37-I39 PolarHBondContact O-N 3.22Š|
| 40 | L | 80.6 | Confident | 70 | Confident | 40 Ų | 40 | 99.9 Ų | 99.9 | 21% | 0.209 | 56% | 0.557 | C | S | . | * | P | Polyproline II helix | trans | -72.2 | 137.9 | -179.7 | -63.5 | 168.3 | 0 | 0 | 0 | 109.9 | R38 E44 K45 R48 | R38-L40 PolarHBondContact O-N 3.16Å; L40-E44 WeakPolarHBondContact CA-OE2 3.5Å; L40-E44 HydrophobicContact CB-CB 4.25Å; L40-E44 HydrophobicContact CD2-CB 4.28Å; L40-K45 HydrophobicContact CB-CG 3.91Å; L40-R48 VanDerWaalsContact CD1-CZ 3.48Å |
| 41 | S | 85 | Confident | 72.5 | Confident | 66 Ų | 66 | 100.5 Ų | 100.5 | 46% | 0.462 | 54% | 0.539 | S | S | . | . | P | Polyproline II helix | trans | -63.9 | 154.7 | 169.6 | 173.9 | 0 | 0 | 0 | 0 | 111 | A43 E44 K45 | S41-A43 PolarHBondContact O-N 3.17Å; S41-E44 PolarHBondContact N-OE2 3.43Å; S41-E44 WeakPolarHBondContact O-CB 3.43Å; S41-E44 PolarHBondContact O-N 2.86Å; S41-K45 WeakPolarHBondContact O-CG 3.49Å; S41-K45 PolarHBondContact O-N 3.17Å |
| 42 | A | 84.4 | Confident | 74.8 | Confident | 79 Ų | 79 | 99.3 Ų | 99.3 | 65% | 0.653 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -54.2 | -36.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | K45 R46 | A42-K45 PolarHBondContact O-N 3.44Å; A42-R46 WeakPolarHBondContact O-CB 3.3Å; A42-R46 PolarHBondContact O-N 3.24Å |
| 43 | A | 86.2 | Confident | 76.9 | Confident | 70 Ų | 70 | 96.7 Ų | 96.7 | 58% | 0.579 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.1 | -41 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | S41 R46 S47 | S41-A43 PolarHBondContact O-N 3.17Å; A43-R46 PolarHBondContact O-N 3.19Å; A43-S47 WeakPolarHBondContact O-CB 3.44Å; A43-S47 PolarHBondContact O-N 3.34Å |
| 44 | E | 87 | Confident | 79.1 | Confident | 61 Ų | 61 | 100 Ų | 100 | 29% | 0.285 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 176.5 | -65.3 | 175.6 | 132 | 0 | 0 | 111.3 | R38 L40 S41 R48 | R38-E44 IonicContact CZ-OE1 3.17Å; R38-E44 IonicContact CZ-OE2 3.97Å; R38-E44 IonicContact NH1-OE1 2.8Å; R38-E44 PolarHBondContact NH1-OE1 2.88Å; R38-E44 IonicContact NH1-OE2 3.99Å; R38-E44 IonicContact NH2-OE1 2.79Å; R38-E44 PolarHBondContact NH2-OE1 2.79Å; R38-E44 IonicContact NH2-OE2 3.67Å; L40-E44 WeakPolarHBondContact CA-OE2 3.5Å; L40-E44 HydrophobicContact CB-CB 4.25Å; L40-E44 HydrophobicContact CD2-CB 4.28Å; S41-E44 PolarHBondContact N-OE2 3.43Å; S41-E44 WeakPolarHBondContact O-CB 3.43Å; S41-E44 PolarHBondContact O-N 2.86Å; E44-R48 VanDerWaalsContact O-CB 3.29Å; E44-R48 WeakPolarHBondContact O-CB 3.32Å; E44-R48 PolarHBondContact O-N 3.15Å |
| 45 | K | 87.6 | Confident | 81.1 | Confident | 57 Ų | 57 | 96.3 Ų | 96.3 | 25% | 0.248 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -61.2 | -48 | 173.1 | -69.5 | -178.4 | 179.1 | -177.2 | 0 | 111 | L40 S41 A42 R48 Y49 Q91 E180 | L40-K45 HydrophobicContact CB-CG 3.91Å; S41-K45 WeakPolarHBondContact O-CG 3.49Å; S41-K45 PolarHBondContact O-N 3.17Å; A42-K45 PolarHBondContact O-N 3.44Å; K45-R48 PolarHBondContact O-N 2.93Å; K45-Y49 PolarHBondContact O-N 3.43Å; K45-Q91 VanDerWaalsContact CE-OE1 3.32Å; K45-E180 IonicContact NZ-OE2 3.78Å |
| 46 | R | 88.2 | Confident | 82.6 | Confident | 173 Ų | 173 | 95.6 Ų | 95.6 | 65% | 0.653 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -58.3 | -52.2 | 176.2 | -177.8 | -179.5 | 175.7 | -177.7 | 2.3 | 111.3 | A42 A43 R48 Y49 F50 | A42-R46 WeakPolarHBondContact O-CB 3.3Å; A42-R46 PolarHBondContact O-N 3.24Å; A43-R46 PolarHBondContact O-N 3.19Å; R46-R48 VanDerWaalsContact C-N 3.31Å; R46-R48 PolarHBondContact O-N 3.1Å; R46-Y49 WeakPolarHBondContact O-CB 3.48Å; R46-Y49 PolarHBondContact O-N 2.6Å; R46-Y49 VanDerWaalsContact O-N 3.11Å; R46-F50 HydrophobicContact CG-CD2 3.67Å; R46-F50 HydrophobicContact CG-CE2 3.57Å; R46-F50 VanDerWaalsContact O-CD2 3.29Å; R46-F50 WeakPolarHBondContact O-CD2 3.27Å; R46-F50 PolarHBondContact O-N 3.26Å |
| 47 | S | 88.2 | Confident | 84.1 | Confident | 69 Ų | 69 | 102.9 Ų | 102.9 | 48% | 0.483 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.5 | -43.2 | 178.7 | 175.2 | 0 | 0 | 0 | 0 | 112 | A43 Y49 F50 R51 | A43-S47 WeakPolarHBondContact O-CB 3.44Å; A43-S47 PolarHBondContact O-N 3.34Å; S47-Y49 PolarHBondContact O-N 3.44Å; S47-F50 PolarHBondContact O-N 2.91Å; S47-R51 WeakPolarHBondContact O-CB 3.23Å; S47-R51 PolarHBondContact O-N 2.86Å |
| 48 | R | 87.7 | Confident | 85.6 | Confident | 84 Ų | 84 | 103.1 Ų | 103.1 | 32% | 0.317 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 174.6 | -178.6 | -174.2 | -60.7 | -126.4 | -4.8 | 112.3 | L40 E44 K45 R46 R51 R52 | L40-R48 VanDerWaalsContact CD1-CZ 3.48Å; E44-R48 VanDerWaalsContact O-CB 3.29Å; E44-R48 WeakPolarHBondContact O-CB 3.32Å; E44-R48 PolarHBondContact O-N 3.15Å; K45-R48 PolarHBondContact O-N 2.93Å; R46-R48 VanDerWaalsContact C-N 3.31Å; R46-R48 PolarHBondContact O-N 3.1Å; R48-R51 PolarHBondContact O-N 3.37Å; R48-R52 WeakPolarHBondContact O-CG 3.36Å; R48-R52 PolarHBondContact O-N 2.91Å |
| 49 | Y | 88.4 | Confident | 86.6 | Confident | 40 Ų | 40 | 95.6 Ų | 95.6 | 16% | 0.157 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -62.4 | -49.6 | 179 | -173 | -88.4 | 0 | 0 | 0 | 111.3 | K45 R46 S47 R51 R52 L53 P97 L100 | K45-Y49 PolarHBondContact O-N 3.43Å; R46-Y49 WeakPolarHBondContact O-CB 3.48Å; R46-Y49 PolarHBondContact O-N 2.6Å; R46-Y49 VanDerWaalsContact O-N 3.11Å; S47-Y49 PolarHBondContact O-N 3.44Å; Y49-R51 PolarHBondContact O-N 2.99Å; Y49-R52 PolarHBondContact O-N 2.94Å; Y49-L53 PolarHBondContact O-N 3.29Å; Y49-P97 HydrophobicContact CE1-CB 4.18Å; Y49-P97 HydrophobicContact CE2-CB 4.11Å; Y49-L100 HydrophobicContact CE1-CD2 4.3Å; Y49-L100 WeakPolarHBondContact OH-CD2 3.4Å |
| 50 | F | 89.9 | Confident | 87.5 | Confident | 96 Ų | 96 | 93 Ų | 93 | 42% | 0.421 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62.8 | -41.3 | 176.8 | -80.4 | -75.5 | 0 | 0 | 0 | 112.5 | R46 S47 R52 L53 F54 | R46-F50 HydrophobicContact CG-CD2 3.67Å; R46-F50 HydrophobicContact CG-CE2 3.57Å; R46-F50 VanDerWaalsContact O-CD2 3.29Å; R46-F50 WeakPolarHBondContact O-CD2 3.27Å; R46-F50 PolarHBondContact O-N 3.26Å; S47-F50 PolarHBondContact O-N 2.91Å; F50-R52 VanDerWaalsContact C-N 3.25Å; F50-R52 PolarHBondContact O-N 3.18Å; F50-L53 HydrophobicContact CD1-CD2 4.45Å; F50-L53 VanDerWaalsContact O-CB 3.3Å; F50-L53 WeakPolarHBondContact O-CB 3.46Å; F50-L53 PolarHBondContact O-N 3.21Å; F50-L53 VanDerWaalsContact O-N 3.11Å; F50-F54 WeakPolarHBondContact O-CD2 3.33Å |
| 51 | R | 89.5 | Confident | 88.3 | Confident | 142 Ų | 142 | 94.1 Ų | 94.1 | 54% | 0.536 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -58.6 | -39.2 | 175.1 | -175.6 | 174.3 | 66 | -141.2 | 3.7 | 111.9 | S47 R48 Y49 H55 | S47-R51 WeakPolarHBondContact O-CB 3.23Å; S47-R51 PolarHBondContact O-N 2.86Å; R48-R51 PolarHBondContact O-N 3.37Å; Y49-R51 PolarHBondContact O-N 2.99Å; R51-H55 PolarHBondContact O-ND1 3.2Å |
| 52 | R | 88.7 | Confident | 88.8 | Confident | 87 Ų | 87 | 98.9 Ų | 98.9 | 33% | 0.328 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -70.7 | -31.6 | 176.8 | -73.9 | 176 | 176 | -162.2 | -4.9 | 112.8 | R48 Y49 F50 F54 H55 M59 D95 P97 | R48-R52 WeakPolarHBondContact O-CG 3.36Å; R48-R52 PolarHBondContact O-N 2.91Å; Y49-R52 PolarHBondContact O-N 2.94Å; F50-R52 VanDerWaalsContact C-N 3.25Å; F50-R52 PolarHBondContact O-N 3.18Å; R52-F54 PolarHBondContact O-N 3.31Å; R52-H55 CarbonylContact O-C 3Å; R52-H55 PolarHBondContact O-N 3.01Å; R52-M59 WeakPolarHBondContact O-CE 3.21Å; R52-D95 VanDerWaalsContact CD-O 3.24Å; R52-D95 WeakPolarHBondContact CD-O 3.36Å; R52-D95 PolarHBondContact NH1-O 2.98Å; R52-P97 HydrophobicContact CB-CG 4.16Å |
| 53 | L | 87.8 | Confident | 89.3 | Confident | 48 Ų | 48 | 98.4 Ų | 98.4 | 25% | 0.251 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.2 | -35.9 | 176.2 | -168.8 | 67.1 | 0 | 0 | 0 | 112 | Y49 F50 M59 P97 V101 | Y49-L53 PolarHBondContact O-N 3.29Å; F50-L53 HydrophobicContact CD1-CD2 4.45Å; F50-L53 VanDerWaalsContact O-CB 3.3Å; F50-L53 WeakPolarHBondContact O-CB 3.46Å; F50-L53 PolarHBondContact O-N 3.21Å; F50-L53 VanDerWaalsContact O-N 3.11Å; L53-M59 HydrophobicContact CD1-CE 4.45Å; L53-M59 WeakPolarHBondContact O-CE 3.23Å; L53-P97 HydrophobicContact CD1-CB 3.69Å; L53-P97 HydrophobicContact CD1-CG 4.31Å; L53-V101 HydrophobicContact CD1-CG2 3.74Å |
| 54 | F | 87.9 | Confident | 89.9 | Confident | 167 Ų | 167 | 95.2 Ų | 95.2 | 73% | 0.732 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -11.9 | 175.6 | -65.1 | -73.2 | 0 | 0 | 0 | 114.3 | F50 R52 | F50-F54 WeakPolarHBondContact O-CD2 3.33Å; R52-F54 PolarHBondContact O-N 3.31Å |
| 55 | H | 88 | Confident | 90.4 | Very high | 101 Ų | 101 | 97 Ų | 97 | 47% | 0.468 | 43% | 0.432 | S | S | . | . | trans | -107.3 | 70.2 | -179.2 | -71.4 | 81.1 | 0 | 0 | 0 | 111.4 | R51 R52 R57 H58 | R51-H55 PolarHBondContact O-ND1 3.2Å; R52-H55 CarbonylContact O-C 3Å; R52-H55 PolarHBondContact O-N 3.01Å; H55-R57 VanDerWaalsContact C-N 3.25Å; H55-R57 PolarHBondContact O-N 3.23Å; H55-R57 VanDerWaalsContact O-N 3.15Å; H55-H58 PolarHBondContact O-N 3.08Å; H55-H58 VanDerWaalsContact O-N 3.17Å | ||
| 56 | V | 83.4 | Confident | 90.8 | Very high | 80 Ų | 80 | 98.7 Ų | 98.7 | 49% | 0.485 | 44% | 0.437 | S | S | . | . | G | 310 helix | trans | -54.7 | -35 | -175.1 | -177.4 | 0 | 0 | 0 | 0 | 113.7 | H58 M59 F61 | V56-H58 PolarHBondContact O-N 2.95Å; V56-H58 VanDerWaalsContact O-N 3.11Å; V56-M59 HydrophobicContact CG2-CE 4.17Å; V56-M59 WeakPolarHBondContact O-CB 3.14Å; V56-M59 PolarHBondContact O-N 3.19Å; V56-F61 HydrophobicContact CG1-CE2 4Å; V56-F61 HydrophobicContact CG1-CZ 3.95Å |
| 57 | R | 85.7 | Confident | 91.3 | Very high | 243 Ų | 243 | 90.5 Ų | 90.5 | 92% | 0.917 | 41% | 0.406 | S | S | * | . | G | 310 helix | trans | -65.5 | -15.6 | -177.3 | -61.6 | -171.2 | 81.5 | 164.8 | 5.4 | 114.6 | H55 | H55-R57 VanDerWaalsContact C-N 3.25Å; H55-R57 PolarHBondContact O-N 3.23Å; H55-R57 VanDerWaalsContact O-N 3.15Å |
| 58 | H | 86.8 | Confident | 91.7 | Very high | 157 Ų | 157 | 87.8 Ų | 87.8 | 73% | 0.727 | 39% | 0.386 | S | S | * | . | G | 310 helix | trans | -104.6 | 6.8 | -179.5 | -64.2 | -60.2 | 0 | 0 | 0 | 113.4 | H55 V56 | H55-H58 PolarHBondContact O-N 3.08Å; H55-H58 VanDerWaalsContact O-N 3.17Å; V56-H58 PolarHBondContact O-N 2.95Å; V56-H58 VanDerWaalsContact O-N 3.11Å |
| 59 | M | 93.2 | Very high | 92.2 | Very high | 14 Ų | 14 | 91.6 Ų | 91.6 | 7% | 0.069 | 40% | 0.401 | C | S | . | . | trans | -81.7 | 131.3 | 177.7 | -65.4 | -175.6 | -170.3 | 0 | 0 | 110.4 | R52 L53 V56 F61 P97 A98 V101 | R52-M59 WeakPolarHBondContact O-CE 3.21Å; L53-M59 HydrophobicContact CD1-CE 4.45Å; L53-M59 WeakPolarHBondContact O-CE 3.23Å; V56-M59 HydrophobicContact CG2-CE 4.17Å; V56-M59 WeakPolarHBondContact O-CB 3.14Å; V56-M59 PolarHBondContact O-N 3.19Å; M59-F61 HydrophobicContact CB-CD2 4.15Å; M59-F61 HydrophobicContact CB-CE1 4.39Å; M59-F61 HydrophobicContact CB-CE2 3.7Å; M59-F61 HydrophobicContact CB-CZ 3.84Å; M59-F61 HydrophobicContact CG-CZ 4.45Å; M59-F61 PolarHBondContact O-N 3.44Å; M59-F61 VanDerWaalsContact O-N 3.1Å; M59-F61 HydrophobicContact SD-CE1 4.37Å; M59-F61 HydrophobicContact SD-CZ 3.83Å; M59-P97 HydrophobicContact CE-CB 4.4Å; M59-P97 HydrophobicContact CE-CG 3.58Å; M59-P97 HydrophobicContact CG-CG 4.08Å; M59-P97 HydrophobicContact SD-CG 3.99Å; M59-A98 HydrophobicContact CB-CB 3.98Å; M59-V101 HydrophobicContact CE-CG2 4.12Å; M59-V101 HydrophobicContact SD-CB 4.45Å; M59-V101 HydrophobicContact SD-CG2 3.91Å | ||
| 60 | D | 94.2 | Very high | 92.7 | Very high | 78 Ų | 78 | 90.4 Ų | 90.4 | 42% | 0.417 | 40% | 0.396 | S | S | . | . | trans | -84.6 | 78.5 | 177.8 | -169.4 | -14.9 | 0 | 0 | 0 | 110.3 | E62 Y63 A64 D96 | D60-E62 VanDerWaalsContact C-N 3.3Å; D60-E62 PolarHBondContact O-N 3.21Å; D60-Y63 PolarHBondContact O-N 3.34Å; D60-Y63 VanDerWaalsContact OD1-CB 3.27Å; D60-Y63 WeakPolarHBondContact OD1-CB 3.5Å; D60-Y63 PolarHBondContact OD1-N 2.94Å; D60-Y63 WeakPolarHBondContact OD2-CB 3.46Å; D60-A64 PolarHBondContact O-N 3.44Å; D60-A64 VanDerWaalsContact O-N 3.09Å; D60-D96 WeakPolarHBondContact CA-OD2 3.44Å; D60-D96 WeakPolarHBondContact CB-OD2 3.5Å; D60-D96 PolarHBondContact N-OD2 2.91Å | ||
| 61 | F | 96.2 | Very high | 93 | Very high | 65 Ų | 65 | 85.8 Ų | 85.8 | 29% | 0.285 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.2 | -31.5 | 179.4 | -70.2 | -68.7 | 0 | 0 | 0 | 113.1 | V56 M59 A64 L65 A98 V101 L102 | V56-F61 HydrophobicContact CG1-CE2 4Å; V56-F61 HydrophobicContact CG1-CZ 3.95Å; M59-F61 HydrophobicContact CB-CD2 4.15Å; M59-F61 HydrophobicContact CB-CE1 4.39Å; M59-F61 HydrophobicContact CB-CE2 3.7Å; M59-F61 HydrophobicContact CB-CZ 3.84Å; M59-F61 HydrophobicContact CG-CZ 4.45Å; M59-F61 PolarHBondContact O-N 3.44Å; M59-F61 VanDerWaalsContact O-N 3.1Å; M59-F61 HydrophobicContact SD-CE1 4.37Å; M59-F61 HydrophobicContact SD-CZ 3.83Å; F61-A64 PolarHBondContact O-N 3.3Å; F61-L65 WeakPolarHBondContact O-CB 3.34Å; F61-L65 WeakPolarHBondContact O-CG 3.44Å; F61-L65 PolarHBondContact O-N 2.95Å; F61-A98 HydrophobicContact CD1-CB 4.14Å; F61-A98 HydrophobicContact CE1-CB 4.38Å; F61-V101 HydrophobicContact CE1-CB 4.42Å; F61-V101 HydrophobicContact CE1-CG1 4.17Å; F61-V101 HydrophobicContact CZ-CG1 4.43Å; F61-L102 HydrophobicContact CD1-CD1 3.97Å; F61-L102 HydrophobicContact CD1-CD2 3.89Å; F61-L102 HydrophobicContact CD1-CG 3.72Å; F61-L102 HydrophobicContact CE1-CD2 4.31Å; F61-L102 HydrophobicContact CE1-CG 4.13Å |
| 62 | E | 96.5 | Very high | 93.4 | Very high | 165 Ų | 165 | 83.2 Ų | 83.2 | 77% | 0.771 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -63.8 | -48.7 | 177.4 | -174.9 | -178.5 | 160.4 | 0 | 0 | 110.4 | D60 A64 L65 W66 | D60-E62 VanDerWaalsContact C-N 3.3Å; D60-E62 PolarHBondContact O-N 3.21Å; E62-A64 VanDerWaalsContact C-N 3.33Å; E62-A64 PolarHBondContact O-N 3.38Å; E62-L65 PolarHBondContact O-N 3.15Å; E62-W66 WeakPolarHBondContact O-CB 3.4Å; E62-W66 PolarHBondContact O-N 2.75Å |
| 63 | Y | 95.1 | Very high | 93.8 | Very high | 70 Ų | 70 | 83 Ų | 83 | 28% | 0.275 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.2 | -39.2 | 175.6 | -178.6 | -113.7 | 0 | 0 | 0 | 112.3 | D60 W66 Q67 N81 | D60-Y63 PolarHBondContact O-N 3.34Å; D60-Y63 VanDerWaalsContact OD1-CB 3.27Å; D60-Y63 WeakPolarHBondContact OD1-CB 3.5Å; D60-Y63 PolarHBondContact OD1-N 2.94Å; D60-Y63 WeakPolarHBondContact OD2-CB 3.46Å; Y63-W66 HydrophobicContact CE2-CE3 4.48Å; Y63-W66 PolarHBondContact O-N 3.39Å; Y63-Q67 HydrophobicContact CE1-CG 4.23Å; Y63-Q67 HydrophobicContact CE2-CG 4.46Å; Y63-Q67 WeakPolarHBondContact O-CG 3.27Å; Y63-Q67 PolarHBondContact O-N 2.94Å; Y63-Q67 PolarHBondContact OH-NE2 3.48Å; Y63-Q67 VanDerWaalsContact OH-NE2 3.08Å; Y63-N81 WeakPolarHBondContact OH-CB 3.38Å; Y63-N81 PolarHBondContact OH-ND2 3.49Å |
| 64 | A | 97.1 | Very high | 94.2 | Very high | 2 Ų | 2 | 81.5 Ų | 81.5 | 2% | 0.017 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -65.5 | -43.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | D60 F61 E62 W66 Q67 M68 A98 F99 L102 | D60-A64 PolarHBondContact O-N 3.44Å; D60-A64 VanDerWaalsContact O-N 3.09Å; F61-A64 PolarHBondContact O-N 3.3Å; E62-A64 VanDerWaalsContact C-N 3.33Å; E62-A64 PolarHBondContact O-N 3.38Å; A64-W66 VanDerWaalsContact C-N 3.34Å; A64-Q67 WeakPolarHBondContact O-CB 3.42Å; A64-Q67 PolarHBondContact O-N 3.27Å; A64-M68 WeakPolarHBondContact O-CG 3.22Å; A64-M68 PolarHBondContact O-N 3.34Å; A64-A98 HydrophobicContact CB-CB 3.66Å; A64-F99 HydrophobicContact CB-CB 4.28Å; A64-L102 HydrophobicContact CB-CD1 3.67Å |
| 65 | L | 97.5 | Very high | 94.6 | Very high | 99 Ų | 99 | 74.1 Ų | 74.1 | 52% | 0.518 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 173.8 | -75.8 | 170 | 0 | 0 | 0 | 111.6 | F61 E62 Q67 M68 W69 L102 | F61-L65 WeakPolarHBondContact O-CB 3.34Å; F61-L65 WeakPolarHBondContact O-CG 3.44Å; F61-L65 PolarHBondContact O-N 2.95Å; E62-L65 PolarHBondContact O-N 3.15Å; L65-Q67 VanDerWaalsContact C-N 3.31Å; L65-Q67 PolarHBondContact O-N 2.87Å; L65-M68 WeakPolarHBondContact O-CB 3.31Å; L65-M68 PolarHBondContact O-N 3.38Å; L65-W69 WeakPolarHBondContact O-CB 3.19Å; L65-W69 PolarHBondContact O-N 3.5Å; L65-L102 HydrophobicContact CD2-CD1 3.93Å; L65-L102 HydrophobicContact CD2-CD2 4.5Å; L65-L102 HydrophobicContact CG-CD1 3.78Å |
| 66 | W | 97.2 | Very high | 95 | Very high | 92 Ų | 92 | 75.4 Ų | 75.4 | 35% | 0.348 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.9 | -44.1 | 173.5 | -178.8 | 95.8 | 0 | 0 | 0 | 111.2 | E62 Y63 A64 W69 Q70 R77 N81 | E62-W66 WeakPolarHBondContact O-CB 3.4Å; E62-W66 PolarHBondContact O-N 2.75Å; Y63-W66 HydrophobicContact CE2-CE3 4.48Å; Y63-W66 PolarHBondContact O-N 3.39Å; A64-W66 VanDerWaalsContact C-N 3.34Å; W66-W69 PolarHBondContact O-N 3.12Å; W66-Q70 HydrophobicContact CD2-CG 3.72Å; W66-Q70 HydrophobicContact CE3-CG 3.89Å; W66-Q70 HydrophobicContact CG-CG 4.41Å; W66-Q70 HydrophobicContact CH2-CG 3.75Å; W66-Q70 HydrophobicContact CZ2-CG 3.59Å; W66-Q70 HydrophobicContact CZ3-CB 4.43Å; W66-Q70 HydrophobicContact CZ3-CG 3.87Å; W66-Q70 WeakPolarHBondContact O-CB 3.19Å; W66-Q70 VanDerWaalsContact O-CG 3.24Å; W66-Q70 WeakPolarHBondContact O-CG 3.42Å; W66-Q70 PolarHBondContact O-N 2.8Å; W66-R77 HydrophobicContact CH2-CB 4.16Å; W66-N81 VanDerWaalsContact CH2-ND2 3.34Å; W66-N81 WeakPolarHBondContact CH2-ND2 3.34Å; W66-N81 WeakPolarHBondContact CZ3-ND2 3.37Å |
| 67 | Q | 97.6 | Very high | 95.5 | Very high | 2 Ų | 2 | 77 Ų | 77 | 1% | 0.009 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.3 | -47 | 176.8 | -73.4 | -179 | -18.6 | 0 | 0 | 111.5 | Y63 A64 L65 W69 Q70 L71 V78 R94 F99 | Y63-Q67 HydrophobicContact CE1-CG 4.23Å; Y63-Q67 HydrophobicContact CE2-CG 4.46Å; Y63-Q67 WeakPolarHBondContact O-CG 3.27Å; Y63-Q67 PolarHBondContact O-N 2.94Å; Y63-Q67 PolarHBondContact OH-NE2 3.48Å; Y63-Q67 VanDerWaalsContact OH-NE2 3.08Å; A64-Q67 WeakPolarHBondContact O-CB 3.42Å; A64-Q67 PolarHBondContact O-N 3.27Å; L65-Q67 VanDerWaalsContact C-N 3.31Å; L65-Q67 PolarHBondContact O-N 2.87Å; Q67-W69 VanDerWaalsContact C-N 3.34Å; Q67-W69 PolarHBondContact O-N 2.98Å; Q67-Q70 PolarHBondContact O-N 2.91Å; Q67-L71 WeakPolarHBondContact O-CG 3.35Å; Q67-L71 PolarHBondContact O-N 3.41Å; Q67-V78 HydrophobicContact CB-CG1 4.46Å; Q67-V78 HydrophobicContact CG-CG1 4.34Å; Q67-R94 VanDerWaalsContact OE1-CZ 3.31Å; Q67-F99 HydrophobicContact CB-CD2 4.14Å; Q67-F99 HydrophobicContact CB-CE2 4.18Å |
| 68 | M | 97.9 | Very high | 95.9 | Very high | 11 Ų | 11 | 65.4 Ų | 65.4 | 5% | 0.054 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -56.1 | -46.9 | 176.7 | -76.7 | -179.9 | 169.6 | 0 | 0 | 111.9 | A64 L65 L71 F72 F99 L102 M103 F193 | A64-M68 WeakPolarHBondContact O-CG 3.22Å; A64-M68 PolarHBondContact O-N 3.34Å; L65-M68 WeakPolarHBondContact O-CB 3.31Å; L65-M68 PolarHBondContact O-N 3.38Å; M68-L71 WeakPolarHBondContact O-CB 3.47Å; M68-L71 PolarHBondContact O-N 2.7Å; M68-F72 WeakPolarHBondContact O-CD2 3.42Å; M68-F99 HydrophobicContact CB-CE2 4.49Å; M68-F99 HydrophobicContact CE-CD1 4.25Å; M68-F99 HydrophobicContact CE-CD2 4.06Å; M68-F99 HydrophobicContact CE-CE1 4.24Å; M68-F99 HydrophobicContact CE-CE2 4.08Å; M68-F99 HydrophobicContact CE-CG 4.15Å; M68-F99 HydrophobicContact CE-CZ 4.17Å; M68-F99 VanDerWaalsContact CE-O 3.25Å; M68-F99 WeakPolarHBondContact CE-O 3.31Å; M68-F99 HydrophobicContact CG-CD2 3.91Å; M68-F99 HydrophobicContact CG-CE2 3.45Å; M68-F99 VanDerWaalsContact CG-CE2 3.45Å; M68-F99 HydrophobicContact CG-CZ 4.04Å; M68-L102 HydrophobicContact CE-CB 3.58Å; M68-L102 HydrophobicContact SD-CB 3.96Å; M68-L102 HydrophobicContact SD-CD1 4.2Å; M68-M103 HydrophobicContact CE-CB 4Å; M68-F193 HydrophobicContact CB-CD1 4.09Å; M68-F193 HydrophobicContact CB-CE1 3.42Å; M68-F193 VanDerWaalsContact CB-CE1 3.42Å; M68-F193 HydrophobicContact CB-CE2 4.4Å; M68-F193 HydrophobicContact CB-CZ 3.61Å; M68-F193 HydrophobicContact CE-CD2 4Å; M68-F193 HydrophobicContact CE-CE2 4Å; M68-F193 HydrophobicContact CG-CD1 4.01Å; M68-F193 HydrophobicContact CG-CD2 4.27Å; M68-F193 HydrophobicContact CG-CE1 3.71Å; M68-F193 HydrophobicContact CG-CE2 4Å; M68-F193 HydrophobicContact CG-CG 4.27Å; M68-F193 HydrophobicContact CG-CZ 3.71Å; M68-F193 WeakPolarHBondContact O-CE1 3.31Å; M68-F193 HydrophobicContact SD-CD2 4.28Å; M68-F193 HydrophobicContact SD-CE1 4.44Å; M68-F193 HydrophobicContact SD-CE2 3.74Å; M68-F193 HydrophobicContact SD-CZ 3.83Å |
| 69 | W | 97.8 | Very high | 96.3 | Very high | 165 Ų | 165 | 58 Ų | 58 | 63% | 0.625 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -62.7 | -45.6 | 176.7 | 178.3 | -107.5 | 0 | 0 | 0 | 113 | L65 W66 Q67 L71 F72 V73 | L65-W69 WeakPolarHBondContact O-CB 3.19Å; L65-W69 PolarHBondContact O-N 3.5Å; W66-W69 PolarHBondContact O-N 3.12Å; Q67-W69 VanDerWaalsContact C-N 3.34Å; Q67-W69 PolarHBondContact O-N 2.98Å; W69-L71 PolarHBondContact O-N 3.5Å; W69-F72 PolarHBondContact O-N 3.47Å; W69-F72 VanDerWaalsContact O-N 3.1Å; W69-V73 HydrophobicContact CD2-CG2 4.25Å; W69-V73 HydrophobicContact CZ2-CG2 3.78Å; W69-V73 PolarHBondContact O-N 3.43Å |
| 70 | Q | 97.7 | Very high | 96.3 | Very high | 14 Ų | 14 | 63 Ų | 63 | 7% | 0.065 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -67.4 | -21.2 | -179.4 | -66.6 | -62.5 | -24.2 | 0 | 0 | 113 | W66 Q67 F72 V73 G74 P75 V78 | W66-Q70 HydrophobicContact CD2-CG 3.72Å; W66-Q70 HydrophobicContact CE3-CG 3.89Å; W66-Q70 HydrophobicContact CG-CG 4.41Å; W66-Q70 HydrophobicContact CH2-CG 3.75Å; W66-Q70 HydrophobicContact CZ2-CG 3.59Å; W66-Q70 HydrophobicContact CZ3-CB 4.43Å; W66-Q70 HydrophobicContact CZ3-CG 3.87Å; W66-Q70 WeakPolarHBondContact O-CB 3.19Å; W66-Q70 VanDerWaalsContact O-CG 3.24Å; W66-Q70 WeakPolarHBondContact O-CG 3.42Å; W66-Q70 PolarHBondContact O-N 2.8Å; Q67-Q70 PolarHBondContact O-N 2.91Å; Q70-F72 PolarHBondContact O-N 2.89Å; Q70-V73 PolarHBondContact O-N 2.91Å; Q70-G74 CarbonylContact O-C 3.52Å; Q70-G74 PolarHBondContact O-N 2.89Å; Q70-P75 WeakPolarHBondContact O-CA 3.29Å; Q70-V78 HydrophobicContact CB-CG2 3.48Å; Q70-V78 VanDerWaalsContact CB-CG2 3.48Å |
| 71 | L | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.6 | -28.8 | 172.9 | -72.7 | 167.7 | 0 | 0 | 0 | 111.9 | Q67 M68 W69 P75 V78 F99 N190 F193 P194 Y231 I235 | Q67-L71 WeakPolarHBondContact O-CG 3.35Å; Q67-L71 PolarHBondContact O-N 3.41Å; M68-L71 WeakPolarHBondContact O-CB 3.47Å; M68-L71 PolarHBondContact O-N 2.7Å; W69-L71 PolarHBondContact O-N 3.5Å; L71-P75 HydrophobicContact CD2-CB 4.46Å; L71-V78 HydrophobicContact CD2-CG2 4.26Å; L71-V78 HydrophobicContact CG-CG2 4.28Å; L71-F99 HydrophobicContact CD1-CE2 4.05Å; L71-F99 HydrophobicContact CD1-CZ 3.84Å; L71-N190 HydrophobicContact CD1-CB 4.35Å; L71-N190 WeakPolarHBondContact CD1-O 3.37Å; L71-N190 HydrophobicContact CD2-CB 3.95Å; L71-F193 HydrophobicContact CD1-CB 4.26Å; L71-F193 HydrophobicContact CD1-CD1 3.87Å; L71-F193 HydrophobicContact CD1-CG 4.47Å; L71-P194 HydrophobicContact CB-CG 3.87Å; L71-P194 HydrophobicContact CD1-CG 4.44Å; L71-Y231 PolarHBondContact O-OH 3.1Å; L71-I235 HydrophobicContact CD2-CD1 4.48Å; L71-I235 HydrophobicContact CD2-CG2 4.14Å |
| 72 | F | 97.2 | Very high | 95.9 | Very high | 87 Ų | 87 | 57.4 Ų | 57.4 | 38% | 0.382 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -87.3 | -46.8 | 174.3 | -60.8 | -72.3 | 0 | 0 | 0 | 113.1 | M68 W69 Q70 F193 P194 C197 | M68-F72 WeakPolarHBondContact O-CD2 3.42Å; W69-F72 PolarHBondContact O-N 3.47Å; W69-F72 VanDerWaalsContact O-N 3.1Å; Q70-F72 PolarHBondContact O-N 2.89Å; F72-F193 HydrophobicContact CD2-CE1 4.43Å; F72-F193 HydrophobicContact CE2-CD1 4.2Å; F72-F193 AromaticContact CE2-CE1 3.47Å; F72-F193 HydrophobicContact CE2-CE1 3.47Å; F72-F193 VanDerWaalsContact CE2-CE1 3.47Å; F72-F193 HydrophobicContact CE2-CZ 4.21Å; F72-F193 HydrophobicContact CZ-CD1 4.37Å; F72-F193 AromaticContact CZ-CE1 3.96Å; F72-F193 HydrophobicContact CZ-CE1 3.96Å; F72-P194 HydrophobicContact CD1-CB 4.37Å; F72-P194 HydrophobicContact CE1-CB 3.71Å; F72-P194 HydrophobicContact CE1-CG 4.32Å; F72-P194 HydrophobicContact CZ-CB 4.17Å; F72-P194 HydrophobicContact CZ-CG 4.5Å; F72-C197 HydrophobicContact CE1-CB 4.25Å; F72-C197 HydrophobicContact CZ-CB 3.73Å |
| 73 | V | 97.3 | Very high | 95.6 | Very high | 83 Ų | 83 | 52.4 Ų | 52.4 | 50% | 0.503 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -78.2 | -35.8 | -171.5 | 176.6 | 0 | 0 | 0 | 0 | 112.8 | W69 Q70 | W69-V73 HydrophobicContact CD2-CG2 4.25Å; W69-V73 HydrophobicContact CZ2-CG2 3.78Å; W69-V73 PolarHBondContact O-N 3.43Å; Q70-V73 PolarHBondContact O-N 2.91Å |
| 74 | G | 96.1 | Very high | 95.2 | Very high | 16 Ų | 16 | 55.5 Ų | 55.5 | 17% | 0.165 | 25% | 0.249 | C | C | . | . | trans | -173.2 | 72.8 | -171 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q70 Q76 R77 | Q70-G74 CarbonylContact O-C 3.52Å; Q70-G74 PolarHBondContact O-N 2.89Å; G74-Q76 PolarHBondContact O-N 3.04Å; G74-R77 VanDerWaalsContact O-CB 3.29Å; G74-R77 WeakPolarHBondContact O-CB 3.41Å; G74-R77 WeakPolarHBondContact O-CG 3.33Å; G74-R77 PolarHBondContact O-N 2.94Å | ||
| 75 | P | 96.5 | Very high | 94.8 | Very high | 12 Ų | 12 | 56.8 Ų | 56.8 | 8% | 0.078 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.7 | -23.6 | -169 | 22.8 | -35 | 0 | 0 | 0 | 113.4 | Q70 L71 R77 V78 F79 Y234 I235 L238 | Q70-P75 WeakPolarHBondContact O-CA 3.29Å; L71-P75 HydrophobicContact CD2-CB 4.46Å; P75-R77 PolarHBondContact O-N 3.27Å; P75-V78 WeakPolarHBondContact O-CB 3.29Å; P75-V78 PolarHBondContact O-N 3.19Å; P75-F79 VanDerWaalsContact O-CD2 3.22Å; P75-F79 WeakPolarHBondContact O-CD2 3.42Å; P75-F79 PolarHBondContact O-N 2.96Å; P75-Y234 HydrophobicContact CG-CE1 4.07Å; P75-I235 HydrophobicContact CB-CD1 3.36Å; P75-I235 HydrophobicContact CG-CD1 3.67Å; P75-L238 HydrophobicContact CB-CD2 3.9Å; P75-L238 HydrophobicContact CG-CD2 3.96Å |
| 76 | Q | 95.4 | Very high | 94.4 | Very high | 129 Ų | 129 | 53.5 Ų | 53.5 | 60% | 0.603 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -55.4 | -32 | 172.3 | -64.7 | -179.3 | -20.1 | 0 | 0 | 112.8 | G74 F79 R80 L238 | G74-Q76 PolarHBondContact O-N 3.04Å; Q76-F79 PolarHBondContact O-N 3.34Å; Q76-R80 PolarHBondContact O-N 2.87Å; Q76-L238 HydrophobicContact CG-CD1 4.17Å; Q76-L238 HydrophobicContact CG-CD2 3.89Å |
| 77 | R | 94 | Very high | 93.8 | Very high | 112 Ų | 112 | 52.8 Ų | 52.8 | 42% | 0.423 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -66.9 | -38.7 | 177.8 | -65.8 | 169.3 | 173.7 | -176.3 | -0.7 | 111.7 | W66 G74 P75 R80 N81 | W66-R77 HydrophobicContact CH2-CB 4.16Å; G74-R77 VanDerWaalsContact O-CB 3.29Å; G74-R77 WeakPolarHBondContact O-CB 3.41Å; G74-R77 WeakPolarHBondContact O-CG 3.33Å; G74-R77 PolarHBondContact O-N 2.94Å; P75-R77 PolarHBondContact O-N 3.27Å; R77-R80 PolarHBondContact O-N 3.23Å; R77-N81 PolarHBondContact O-N 3.35Å |
| 78 | V | 95.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.7 | -48.6 | 175.2 | -176.6 | 0 | 0 | 0 | 0 | 109.2 | Q67 Q70 L71 P75 R80 N81 F82 | Q67-V78 HydrophobicContact CB-CG1 4.46Å; Q67-V78 HydrophobicContact CG-CG1 4.34Å; Q70-V78 HydrophobicContact CB-CG2 3.48Å; Q70-V78 VanDerWaalsContact CB-CG2 3.48Å; L71-V78 HydrophobicContact CD2-CG2 4.26Å; L71-V78 HydrophobicContact CG-CG2 4.28Å; P75-V78 WeakPolarHBondContact O-CB 3.29Å; P75-V78 PolarHBondContact O-N 3.19Å; V78-R80 PolarHBondContact O-N 2.96Å; V78-N81 WeakPolarHBondContact O-CB 3.5Å; V78-N81 PolarHBondContact O-N 2.88Å; V78-N81 VanDerWaalsContact O-N 3.08Å; V78-F82 HydrophobicContact CG1-CE2 4.07Å; V78-F82 WeakPolarHBondContact O-CD2 3.41Å |
| 79 | F | 94.2 | Very high | 92.4 | Very high | 1 Ų | 1 | 62.1 Ų | 62.1 | 0% | 0.004 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -71.6 | -26.2 | -178.6 | -63.7 | -67.3 | 0 | 0 | 0 | 114.6 | P75 Q76 N81 F82 V187 N190 I235 L238 G239 T242 | P75-F79 VanDerWaalsContact O-CD2 3.22Å; P75-F79 WeakPolarHBondContact O-CD2 3.42Å; P75-F79 PolarHBondContact O-N 2.96Å; Q76-F79 PolarHBondContact O-N 3.34Å; F79-N81 PolarHBondContact O-N 3.44Å; F79-F82 HydrophobicContact CD1-CD2 4.08Å; F79-F82 HydrophobicContact CD1-CE2 4.17Å; F79-F82 HydrophobicContact CE1-CE2 4.49Å; F79-F82 WeakPolarHBondContact O-CB 3.39Å; F79-F82 PolarHBondContact O-N 3.43Å; F79-V187 HydrophobicContact CE1-CG2 4.49Å; F79-N190 HydrophobicContact CZ-CB 4.39Å; F79-I235 HydrophobicContact CE2-CG2 4.06Å; F79-I235 HydrophobicContact CZ-CG2 3.83Å; F79-I235 WeakPolarHBondContact CZ-O 3.46Å; F79-L238 HydrophobicContact CD2-CB 4.15Å; F79-L238 HydrophobicContact CD2-CD2 3.58Å; F79-L238 HydrophobicContact CD2-CG 3.49Å; F79-L238 VanDerWaalsContact CD2-CG 3.49Å; F79-L238 HydrophobicContact CE2-CB 3.87Å; F79-L238 HydrophobicContact CE2-CD2 3.76Å; F79-L238 HydrophobicContact CE2-CG 3.72Å; F79-L238 HydrophobicContact CG-CG 4.41Å; F79-G239 VanDerWaalsContact CZ-CA 3.49Å; F79-T242 HydrophobicContact CB-CG2 3.45Å; F79-T242 VanDerWaalsContact CB-CG2 3.45Å; F79-T242 HydrophobicContact CG-CG2 4.14Å |
| 80 | R | 92.4 | Very high | 91.7 | Very high | 121 Ų | 121 | 59.6 Ų | 59.6 | 46% | 0.457 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.6 | -34.7 | 168.2 | -172.6 | 178 | 61.7 | -147 | 2.2 | 111.9 | Q76 R77 V78 F82 N83 Y84 | Q76-R80 PolarHBondContact O-N 2.87Å; R77-R80 PolarHBondContact O-N 3.23Å; V78-R80 PolarHBondContact O-N 2.96Å; R80-F82 VanDerWaalsContact C-N 3.29Å; R80-F82 PolarHBondContact O-N 2.91Å; R80-N83 WeakPolarHBondContact O-CB 3.45Å; R80-N83 PolarHBondContact O-N 3.06Å; R80-Y84 HydrophobicContact CG-CD2 4.4Å; R80-Y84 HydrophobicContact CG-CE2 3.71Å; R80-Y84 WeakPolarHBondContact O-CD2 3.49Å; R80-Y84 PolarHBondContact O-N 3.05Å |
| 81 | N | 91.7 | Very high | 91.3 | Very high | 25 Ų | 25 | 59.7 Ų | 59.7 | 13% | 0.134 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -66.8 | -29.7 | 176.8 | -67.7 | -12.8 | 0 | 0 | 0 | 113.2 | Y63 W66 R77 V78 F79 N83 Y84 R85 | Y63-N81 WeakPolarHBondContact OH-CB 3.38Å; Y63-N81 PolarHBondContact OH-ND2 3.49Å; W66-N81 VanDerWaalsContact CH2-ND2 3.34Å; W66-N81 WeakPolarHBondContact CH2-ND2 3.34Å; W66-N81 WeakPolarHBondContact CZ3-ND2 3.37Å; R77-N81 PolarHBondContact O-N 3.35Å; V78-N81 WeakPolarHBondContact O-CB 3.5Å; V78-N81 PolarHBondContact O-N 2.88Å; V78-N81 VanDerWaalsContact O-N 3.08Å; F79-N81 PolarHBondContact O-N 3.44Å; N81-N83 VanDerWaalsContact C-N 3.31Å; N81-N83 PolarHBondContact O-N 3.13Å; N81-Y84 PolarHBondContact O-N 3.06Å; N81-R85 WeakPolarHBondContact O-CG 3.29Å; N81-R85 PolarHBondContact O-N 3.43Å; N81-R85 VanDerWaalsContact O-N 3.08Å |
| 82 | F | 91.3 | Very high | 90.9 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.6 | -39.7 | 172.9 | -76.4 | -101.3 | 0 | 0 | 0 | 111.3 | V78 F79 R80 Y84 R85 K86 W92 Y183 D186 | V78-F82 HydrophobicContact CG1-CE2 4.07Å; V78-F82 WeakPolarHBondContact O-CD2 3.41Å; F79-F82 HydrophobicContact CD1-CD2 4.08Å; F79-F82 HydrophobicContact CD1-CE2 4.17Å; F79-F82 HydrophobicContact CE1-CE2 4.49Å; F79-F82 WeakPolarHBondContact O-CB 3.39Å; F79-F82 PolarHBondContact O-N 3.43Å; R80-F82 VanDerWaalsContact C-N 3.29Å; R80-F82 PolarHBondContact O-N 2.91Å; F82-Y84 PolarHBondContact O-N 3.03Å; F82-R85 PolarHBondContact O-N 3.49Å; F82-K86 PolarHBondContact O-N 3.28Å; F82-W92 HydrophobicContact CB-CE3 4.05Å; F82-W92 HydrophobicContact CB-CZ3 4.28Å; F82-W92 WeakPolarHBondContact CD1-O 3.14Å; F82-Y183 HydrophobicContact CB-CE2 4.37Å; F82-Y183 AromaticContact CD1-CD2 3.51Å; F82-Y183 HydrophobicContact CD1-CD2 3.51Å; F82-Y183 AromaticContact CD1-CE2 3.27Å; F82-Y183 HydrophobicContact CD1-CE2 3.27Å; F82-Y183 AromaticContact CE1-CD2 3.62Å; F82-Y183 HydrophobicContact CE1-CD2 3.62Å; F82-Y183 AromaticContact CE1-CE2 3.64Å; F82-Y183 HydrophobicContact CE1-CE2 3.64Å; F82-Y183 AromaticContact CG-CE2 3.99Å; F82-Y183 HydrophobicContact CG-CE2 3.99Å; F82-D186 HydrophobicContact CE1-CB 3.95Å; F82-D186 HydrophobicContact CZ-CB 4.01Å |
| 83 | N | 89.5 | Confident | 90.7 | Very high | 60 Ų | 60 | 56.7 Ų | 56.7 | 32% | 0.321 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 174.2 | -66 | -35.4 | 0 | 0 | 0 | 111.9 | R80 N81 R85 K86 C87 W92 | R80-N83 WeakPolarHBondContact O-CB 3.45Å; R80-N83 PolarHBondContact O-N 3.06Å; N81-N83 VanDerWaalsContact C-N 3.31Å; N81-N83 PolarHBondContact O-N 3.13Å; N83-R85 VanDerWaalsContact C-N 3.28Å; N83-R85 PolarHBondContact O-N 3.33Å; N83-K86 PolarHBondContact O-N 3.35Å; N83-C87 PolarHBondContact O-N 2.97Å; N83-C87 PolarHBondContact O-SG 2.87Å; N83-C87 VanDerWaalsContact O-SG 3.36Å; N83-W92 VanDerWaalsContact OD1-CH2 3.28Å; N83-W92 WeakPolarHBondContact OD1-CH2 3.23Å; N83-W92 WeakPolarHBondContact OD1-CZ3 3.23Å |
| 84 | Y | 88.1 | Confident | 90.5 | Very high | 135 Ų | 135 | 53.6 Ų | 53.6 | 53% | 0.529 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.7 | -34.9 | 176.9 | -66.2 | -53.1 | 0 | 0 | 0 | 112.7 | R80 N81 F82 C87 S88 | R80-Y84 HydrophobicContact CG-CD2 4.4Å; R80-Y84 HydrophobicContact CG-CE2 3.71Å; R80-Y84 WeakPolarHBondContact O-CD2 3.49Å; R80-Y84 PolarHBondContact O-N 3.05Å; N81-Y84 PolarHBondContact O-N 3.06Å; F82-Y84 PolarHBondContact O-N 3.03Å; Y84-C87 PolarHBondContact O-N 2.89Å; Y84-S88 PolarHBondContact O-N 3.21Å; Y84-S88 VanDerWaalsContact O-N 3.13Å; Y84-S88 PolarHBondContact O-OG 3.05Å |
| 85 | R | 88 | Confident | 90.1 | Very high | 28 Ų | 28 | 54 Ų | 54 | 11% | 0.106 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.5 | -40.2 | 174.2 | -68 | -163.9 | -54.3 | -124.5 | 9.5 | 112.5 | N81 F82 N83 C87 S88 R89 Q91 W92 | N81-R85 WeakPolarHBondContact O-CG 3.29Å; N81-R85 PolarHBondContact O-N 3.43Å; N81-R85 VanDerWaalsContact O-N 3.08Å; F82-R85 PolarHBondContact O-N 3.49Å; N83-R85 VanDerWaalsContact C-N 3.28Å; N83-R85 PolarHBondContact O-N 3.33Å; R85-C87 VanDerWaalsContact C-N 3.32Å; R85-C87 PolarHBondContact O-N 3.35Å; R85-S88 PolarHBondContact O-N 3.23Å; R85-S88 PolarHBondContact O-OG 3.06Å; R85-R89 WeakPolarHBondContact O-CA 3.04Å; R85-R89 PolarHBondContact O-N 2.76Å; R85-Q91 CarbonylContact C-O 3.58Å; R85-W92 PolarHBondContact NH2-O 3.35Å |
| 86 | K | 88.4 | Confident | 89.9 | Confident | 30 Ų | 30 | 55.1 Ų | 55.1 | 13% | 0.13 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.8 | -42.9 | 174 | -175.4 | 64.6 | 176.3 | -176.6 | 0 | 110.9 | F82 N83 S88 Q90 Q91 W92 E174 | F82-K86 PolarHBondContact O-N 3.28Å; N83-K86 PolarHBondContact O-N 3.35Å; K86-S88 PolarHBondContact O-N 2.97Å; K86-Q90 PolarHBondContact NZ-O 3.43Å; K86-Q90 WeakPolarHBondContact O-CA 3.36Å; K86-Q90 PolarHBondContact O-N 3.43Å; K86-Q91 PolarHBondContact N-O 3.16Å; K86-W92 HydrophobicContact CB-CD2 4.04Å; K86-W92 HydrophobicContact CB-CE3 4.13Å; K86-W92 HydrophobicContact CB-CH2 4.04Å; K86-W92 HydrophobicContact CB-CZ2 3.94Å; K86-W92 HydrophobicContact CB-CZ3 4.14Å; K86-W92 HydrophobicContact CD-CD2 4.34Å; K86-W92 HydrophobicContact CD-CG 4.45Å; K86-W92 HydrophobicContact CD-CZ2 4.25Å; K86-W92 HydrophobicContact CG-CD2 4.31Å; K86-W92 HydrophobicContact CG-CH2 4.26Å; K86-W92 HydrophobicContact CG-CZ2 3.7Å; K86-E174 IonicContact NZ-OE1 3.8Å; K86-E174 IonicContact NZ-OE2 2.86Å; K86-E174 PolarHBondContact NZ-OE2 3.3Å |
| 87 | C | 85.2 | Confident | 89.9 | Confident | 78 Ų | 78 | 49 Ų | 49 | 53% | 0.527 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62 | -41.4 | 177.8 | -66 | 0 | 0 | 0 | 0 | 113.4 | N83 Y84 R85 | N83-C87 PolarHBondContact O-N 2.97Å; N83-C87 PolarHBondContact O-SG 2.87Å; N83-C87 VanDerWaalsContact O-SG 3.36Å; Y84-C87 PolarHBondContact O-N 2.89Å; R85-C87 VanDerWaalsContact C-N 3.32Å; R85-C87 PolarHBondContact O-N 3.35Å |
| 88 | S | 83.6 | Confident | 90 | Very high | 61 Ų | 61 | 43.7 Ų | 43.7 | 43% | 0.427 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -88.3 | -40 | -173.7 | 52.8 | 0 | 0 | 0 | 0 | 114 | K37 Y84 R85 K86 | K37-S88 PolarHBondContact NZ-O 3.38Å; K37-S88 VanDerWaalsContact NZ-O 3.12Å; Y84-S88 PolarHBondContact O-N 3.21Å; Y84-S88 VanDerWaalsContact O-N 3.13Å; Y84-S88 PolarHBondContact O-OG 3.05Å; R85-S88 PolarHBondContact O-N 3.23Å; R85-S88 PolarHBondContact O-OG 3.06Å; K86-S88 PolarHBondContact O-N 2.97Å |
| 89 | R | 81.6 | Confident | 90 | Very high | 147 Ų | 147 | 43.9 Ų | 43.9 | 56% | 0.555 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -118.1 | 0.8 | -170.6 | -60.9 | -172 | -179.5 | -176.9 | 4.1 | 114.3 | R85 Q91 D95 | R85-R89 WeakPolarHBondContact O-CA 3.04Å; R85-R89 PolarHBondContact O-N 2.76Å; R89-Q91 HydrophobicContact CB-CG 4.09Å; R89-Q91 PolarHBondContact O-N 3Å; R89-Q91 VanDerWaalsContact O-N 3.15Å; R89-D95 IonicContact CZ-OD2 3.94Å; R89-D95 IonicContact NH1-OD2 2.85Å; R89-D95 PolarHBondContact NH1-OD2 2.96Å |
| 90 | Q | 84.6 | Confident | 90.1 | Very high | 113 Ų | 113 | 44.5 Ų | 44.5 | 53% | 0.528 | 21% | 0.21 | S | C | . | . | S | Bend | trans | 57.3 | 26.1 | 179.4 | -64.5 | -63.4 | -21.6 | 0 | 0 | 114.5 | K86 | K86-Q90 PolarHBondContact NZ-O 3.43Å; K86-Q90 WeakPolarHBondContact O-CA 3.36Å; K86-Q90 PolarHBondContact O-N 3.43Å |
| 91 | Q | 87.8 | Confident | 90.3 | Very high | 15 Ų | 15 | 40.2 Ų | 40.2 | 7% | 0.07 | 20% | 0.198 | C | C | . | . | trans | -143.1 | 154.2 | 176.9 | 67.1 | -175.3 | -2.4 | 0 | 0 | 112.1 | K45 R85 K86 R89 D95 E180 | K45-Q91 VanDerWaalsContact CE-OE1 3.32Å; R85-Q91 CarbonylContact C-O 3.58Å; K86-Q91 PolarHBondContact N-O 3.16Å; R89-Q91 HydrophobicContact CB-CG 4.09Å; R89-Q91 PolarHBondContact O-N 3Å; R89-Q91 VanDerWaalsContact O-N 3.15Å; Q91-D95 PolarHBondContact NE2-OD1 3.31Å; Q91-D95 PolarHBondContact NE2-OD2 3.43Å; Q91-E180 VanDerWaalsContact CA-OE1 3.27Å; Q91-E180 WeakPolarHBondContact CA-OE1 3.49Å | ||
| 92 | W | 90.8 | Very high | 90.5 | Very high | 13 Ų | 13 | 40.7 Ų | 40.7 | 5% | 0.049 | 20% | 0.2 | C | C | . | . | trans | -95.4 | -41 | -179.2 | -65.7 | 103.2 | 0 | 0 | 0 | 112.8 | F82 N83 R85 K86 E180 Y183 L243 F245 | F82-W92 HydrophobicContact CB-CE3 4.05Å; F82-W92 HydrophobicContact CB-CZ3 4.28Å; F82-W92 WeakPolarHBondContact CD1-O 3.14Å; N83-W92 VanDerWaalsContact OD1-CH2 3.28Å; N83-W92 WeakPolarHBondContact OD1-CH2 3.23Å; N83-W92 WeakPolarHBondContact OD1-CZ3 3.23Å; R85-W92 PolarHBondContact NH2-O 3.35Å; K86-W92 HydrophobicContact CB-CD2 4.04Å; K86-W92 HydrophobicContact CB-CE3 4.13Å; K86-W92 HydrophobicContact CB-CH2 4.04Å; K86-W92 HydrophobicContact CB-CZ2 3.94Å; K86-W92 HydrophobicContact CB-CZ3 4.14Å; K86-W92 HydrophobicContact CD-CD2 4.34Å; K86-W92 HydrophobicContact CD-CG 4.45Å; K86-W92 HydrophobicContact CD-CZ2 4.25Å; K86-W92 HydrophobicContact CG-CD2 4.31Å; K86-W92 HydrophobicContact CG-CH2 4.26Å; K86-W92 HydrophobicContact CG-CZ2 3.7Å; W92-E180 PolarHBondContact N-OE1 3.04Å; W92-E180 PolarHBondContact N-OE2 2.66Å; W92-Y183 HydrophobicContact CB-CD2 3.47Å; W92-Y183 VanDerWaalsContact CB-CD2 3.47Å; W92-Y183 HydrophobicContact CB-CE2 4.14Å; W92-Y183 HydrophobicContact CB-CG 3.86Å; W92-Y183 HydrophobicContact CE3-CE2 4.37Å; W92-Y183 HydrophobicContact CG-CD2 4.4Å; W92-L243 HydrophobicContact CD2-CD2 3.45Å; W92-L243 VanDerWaalsContact CD2-CD2 3.45Å; W92-L243 VanDerWaalsContact CE2-CD2 3.43Å; W92-L243 HydrophobicContact CE3-CD2 3.69Å; W92-L243 HydrophobicContact CG-CD2 4Å; W92-L243 HydrophobicContact CH2-CD2 3.89Å; W92-L243 HydrophobicContact CZ2-CD2 3.68Å; W92-L243 HydrophobicContact CZ3-CD2 3.89Å; W92-F245 AromaticContact NE1-CE1 3.97Å | ||
| 93 | A | 93.1 | Very high | 90.8 | Very high | 12 Ų | 12 | 40.7 Ų | 40.7 | 10% | 0.099 | 20% | 0.2 | C | C | . | . | S | Bend | trans | -61.4 | 152.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113 | E180 D186 | A93-E180 PolarHBondContact N-OE2 3.19Å; A93-D186 WeakPolarHBondContact CA-OD2 3.28Å |
| 94 | R | 91.9 | Very high | 91.1 | Very high | 17 Ų | 17 | 39.9 Ų | 39.9 | 6% | 0.064 | 20% | 0.195 | C | C | . | . | trans | -69.6 | 135.5 | 169.8 | -71.9 | -179 | -177.8 | 112.7 | -10.9 | 109.8 | Q67 D186 N190 | Q67-R94 VanDerWaalsContact OE1-CZ 3.31Å; R94-D186 WeakPolarHBondContact CB-OD2 3.35Å; R94-D186 VanDerWaalsContact CD-OD1 3.23Å; R94-D186 WeakPolarHBondContact CD-OD1 3.36Å; R94-D186 WeakPolarHBondContact CG-OD1 3.41Å; R94-D186 WeakPolarHBondContact CG-OD2 3.25Å; R94-D186 IonicContact CZ-OD1 3.73Å; R94-D186 PolarHBondContact N-OD2 3.44Å; R94-D186 IonicContact NE-OD1 3.85Å; R94-D186 IonicContact NH1-OD1 2.87Å; R94-D186 PolarHBondContact NH1-OD1 3.38Å; R94-N190 PolarHBondContact NH1-OD1 2.88Å; R94-N190 PolarHBondContact NH2-OD1 3.44Å | ||
| 95 | D | 89 | Confident | 91.5 | Very high | 24 Ų | 24 | 36.6 Ų | 36.6 | 13% | 0.128 | 19% | 0.189 | C | C | . | . | S | Bend | trans | -90.6 | -8.7 | 169.3 | -60.1 | -56.5 | 0 | 0 | 0 | 113.3 | R52 R89 Q91 | R52-D95 VanDerWaalsContact CD-O 3.24Å; R52-D95 WeakPolarHBondContact CD-O 3.36Å; R52-D95 PolarHBondContact NH1-O 2.98Å; R89-D95 IonicContact CZ-OD2 3.94Å; R89-D95 IonicContact NH1-OD2 2.85Å; R89-D95 PolarHBondContact NH1-OD2 2.96Å; Q91-D95 PolarHBondContact NE2-OD1 3.31Å; Q91-D95 PolarHBondContact NE2-OD2 3.43Å |
| 96 | D | 92.2 | Very high | 91.9 | Very high | 36 Ų | 36 | 37.9 Ų | 37.9 | 19% | 0.193 | 20% | 0.195 | C | C | . | . | trans | -110.5 | 120.9 | -172.4 | -169.9 | -15.6 | 0 | 0 | 0 | 110.1 | D60 A98 | D60-D96 WeakPolarHBondContact CA-OD2 3.44Å; D60-D96 WeakPolarHBondContact CB-OD2 3.5Å; D60-D96 PolarHBondContact N-OD2 2.91Å; D96-A98 VanDerWaalsContact C-N 3.26Å; D96-A98 PolarHBondContact O-N 3.4Å; D96-A98 WeakPolarHBondContact OD1-CB 3.46Å; D96-A98 PolarHBondContact OD1-N 2.88Å | ||
| 97 | P | 94.5 | Very high | 92.3 | Very high | 1 Ų | 1 | 36.6 Ų | 36.6 | 1% | 0.006 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | -2.8 | 178 | 33.2 | -38.9 | 0 | 0 | 0 | 115 | Y49 R52 L53 M59 F99 L100 V101 | Y49-P97 HydrophobicContact CE1-CB 4.18Å; Y49-P97 HydrophobicContact CE2-CB 4.11Å; R52-P97 HydrophobicContact CB-CG 4.16Å; L53-P97 HydrophobicContact CD1-CB 3.69Å; L53-P97 HydrophobicContact CD1-CG 4.31Å; M59-P97 HydrophobicContact CE-CB 4.4Å; M59-P97 HydrophobicContact CE-CG 3.58Å; M59-P97 HydrophobicContact CG-CG 4.08Å; M59-P97 HydrophobicContact SD-CG 3.99Å; P97-F99 VanDerWaalsContact C-N 3.27Å; P97-F99 PolarHBondContact O-N 3.24Å; P97-F99 VanDerWaalsContact O-N 3.15Å; P97-L100 WeakPolarHBondContact O-CB 3.35Å; P97-L100 PolarHBondContact O-N 2.96Å; P97-V101 PolarHBondContact O-N 3.03Å |
| 98 | A | 96.4 | Very high | 92.9 | Very high | 1 Ų | 1 | 36 Ų | 36 | 1% | 0.008 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -48.5 | -43.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114 | M59 F61 A64 D96 L100 V101 L102 | M59-A98 HydrophobicContact CB-CB 3.98Å; F61-A98 HydrophobicContact CD1-CB 4.14Å; F61-A98 HydrophobicContact CE1-CB 4.38Å; A64-A98 HydrophobicContact CB-CB 3.66Å; D96-A98 VanDerWaalsContact C-N 3.26Å; D96-A98 PolarHBondContact O-N 3.4Å; D96-A98 WeakPolarHBondContact OD1-CB 3.46Å; D96-A98 PolarHBondContact OD1-N 2.88Å; A98-L100 PolarHBondContact O-N 3.3Å; A98-V101 PolarHBondContact O-N 3.41Å; A98-L102 WeakPolarHBondContact O-CG 3.3Å; A98-L102 PolarHBondContact O-N 3.16Å |
| 99 | F | 96.6 | Very high | 93.5 | Very high | 3 Ų | 3 | 39.9 Ų | 39.9 | 1% | 0.013 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.1 | -43.5 | 178.8 | -171.6 | -80.2 | 0 | 0 | 0 | 112.2 | A64 Q67 M68 L71 P97 M103 L189 F193 | A64-F99 HydrophobicContact CB-CB 4.28Å; Q67-F99 HydrophobicContact CB-CD2 4.14Å; Q67-F99 HydrophobicContact CB-CE2 4.18Å; M68-F99 HydrophobicContact CB-CE2 4.49Å; M68-F99 HydrophobicContact CE-CD1 4.25Å; M68-F99 HydrophobicContact CE-CD2 4.06Å; M68-F99 HydrophobicContact CE-CE1 4.24Å; M68-F99 HydrophobicContact CE-CE2 4.08Å; M68-F99 HydrophobicContact CE-CG 4.15Å; M68-F99 HydrophobicContact CE-CZ 4.17Å; M68-F99 VanDerWaalsContact CE-O 3.25Å; M68-F99 WeakPolarHBondContact CE-O 3.31Å; M68-F99 HydrophobicContact CG-CD2 3.91Å; M68-F99 HydrophobicContact CG-CE2 3.45Å; M68-F99 VanDerWaalsContact CG-CE2 3.45Å; M68-F99 HydrophobicContact CG-CZ 4.04Å; L71-F99 HydrophobicContact CD1-CE2 4.05Å; L71-F99 HydrophobicContact CD1-CZ 3.84Å; P97-F99 VanDerWaalsContact C-N 3.27Å; P97-F99 PolarHBondContact O-N 3.24Å; P97-F99 VanDerWaalsContact O-N 3.15Å; F99-M103 HydrophobicContact CD1-CE 4.23Å; F99-M103 HydrophobicContact CE1-CE 3.82Å; F99-M103 HydrophobicContact CE1-SD 4.25Å; F99-M103 WeakPolarHBondContact O-CB 3.41Å; F99-M103 PolarHBondContact O-N 2.91Å; F99-M103 VanDerWaalsContact O-N 3.09Å; F99-L189 HydrophobicContact CD1-CB 4.18Å; F99-L189 HydrophobicContact CD1-CD1 4.25Å; F99-L189 HydrophobicContact CE1-CB 3.85Å; F99-F193 HydrophobicContact CE1-CB 4.39Å; F99-F193 HydrophobicContact CZ-CB 3.98Å; F99-F193 HydrophobicContact CZ-CG 4.32Å |
| 100 | L | 96.5 | Very high | 94.2 | Very high | 14 Ų | 14 | 33.3 Ų | 33.3 | 7% | 0.073 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -64.9 | -44.9 | 178.5 | 178.4 | 66.4 | 0 | 0 | 0 | 110.8 | Y49 P97 A98 M103 M104 F137 F185 L189 | Y49-L100 HydrophobicContact CE1-CD2 4.3Å; Y49-L100 WeakPolarHBondContact OH-CD2 3.4Å; P97-L100 WeakPolarHBondContact O-CB 3.35Å; P97-L100 PolarHBondContact O-N 2.96Å; A98-L100 PolarHBondContact O-N 3.3Å; L100-M103 PolarHBondContact O-N 3.19Å; L100-M104 HydrophobicContact CD1-CE 3.86Å; L100-M104 HydrophobicContact CD2-CE 4.04Å; L100-M104 HydrophobicContact CG-CE 3.78Å; L100-M104 WeakPolarHBondContact O-CG 3.23Å; L100-M104 PolarHBondContact O-N 3.23Å; L100-F137 HydrophobicContact CD1-CE1 3.81Å; L100-F137 HydrophobicContact CD1-CZ 3.65Å; L100-F185 HydrophobicContact CD1-CE1 4.49Å; L100-F185 HydrophobicContact CD1-CZ 4.07Å; L100-F185 HydrophobicContact CD2-CZ 4.44Å; L100-L189 HydrophobicContact CB-CD1 4.34Å; L100-L189 HydrophobicContact CD1-CD1 4.02Å; L100-L189 HydrophobicContact CD1-CD2 4.17Å |
| 101 | V | 96.1 | Very high | 94.8 | Very high | 32 Ų | 32 | 27.9 Ų | 27.9 | 19% | 0.194 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.3 | -47.6 | 179.9 | 174.2 | 0 | 0 | 0 | 0 | 111.3 | L53 M59 F61 P97 A98 M103 M104 V105 | L53-V101 HydrophobicContact CD1-CG2 3.74Å; M59-V101 HydrophobicContact CE-CG2 4.12Å; M59-V101 HydrophobicContact SD-CB 4.45Å; M59-V101 HydrophobicContact SD-CG2 3.91Å; F61-V101 HydrophobicContact CE1-CB 4.42Å; F61-V101 HydrophobicContact CE1-CG1 4.17Å; F61-V101 HydrophobicContact CZ-CG1 4.43Å; P97-V101 PolarHBondContact O-N 3.03Å; A98-V101 PolarHBondContact O-N 3.41Å; V101-M103 VanDerWaalsContact C-N 3.26Å; V101-M103 PolarHBondContact O-N 2.7Å; V101-M104 PolarHBondContact O-N 2.93Å; V101-V105 WeakPolarHBondContact O-CG2 3.45Å; V101-V105 PolarHBondContact O-N 3.19Å |
| 102 | L | 96.6 | Very high | 95.2 | Very high | 34 Ų | 34 | 31.1 Ų | 31.1 | 18% | 0.178 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.9 | -38.9 | 176.3 | -75.5 | 172.8 | 0 | 0 | 0 | 112 | F61 A64 L65 M68 A98 V105 F106 | F61-L102 HydrophobicContact CD1-CD1 3.97Å; F61-L102 HydrophobicContact CD1-CD2 3.89Å; F61-L102 HydrophobicContact CD1-CG 3.72Å; F61-L102 HydrophobicContact CE1-CD2 4.31Å; F61-L102 HydrophobicContact CE1-CG 4.13Å; A64-L102 HydrophobicContact CB-CD1 3.67Å; L65-L102 HydrophobicContact CD2-CD1 3.93Å; L65-L102 HydrophobicContact CD2-CD2 4.5Å; L65-L102 HydrophobicContact CG-CD1 3.78Å; M68-L102 HydrophobicContact CE-CB 3.58Å; M68-L102 HydrophobicContact SD-CB 3.96Å; M68-L102 HydrophobicContact SD-CD1 4.2Å; A98-L102 WeakPolarHBondContact O-CG 3.3Å; A98-L102 PolarHBondContact O-N 3.16Å; L102-V105 PolarHBondContact O-N 3.44Å; L102-F106 WeakPolarHBondContact O-CB 3.34Å; L102-F106 PolarHBondContact O-N 3.47Å |
| 103 | M | 96.4 | Very high | 95.5 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -66.8 | -39.5 | 178.1 | -173.8 | 149.3 | 59.8 | 0 | 0 | 112 | M68 F99 L100 V101 F106 L107 F137 L189 F192 F193 L196 | M68-M103 HydrophobicContact CE-CB 4Å; F99-M103 HydrophobicContact CD1-CE 4.23Å; F99-M103 HydrophobicContact CE1-CE 3.82Å; F99-M103 HydrophobicContact CE1-SD 4.25Å; F99-M103 WeakPolarHBondContact O-CB 3.41Å; F99-M103 PolarHBondContact O-N 2.91Å; F99-M103 VanDerWaalsContact O-N 3.09Å; L100-M103 PolarHBondContact O-N 3.19Å; V101-M103 VanDerWaalsContact C-N 3.26Å; V101-M103 PolarHBondContact O-N 2.7Å; M103-F106 PolarHBondContact O-N 3.19Å; M103-L107 VanDerWaalsContact O-CB 3.31Å; M103-L107 WeakPolarHBondContact O-CB 3.39Å; M103-L107 PolarHBondContact O-N 2.9Å; M103-F137 HydrophobicContact CB-CZ 4.43Å; M103-F137 HydrophobicContact CE-CE2 3.59Å; M103-F137 HydrophobicContact CE-CZ 3.52Å; M103-F137 HydrophobicContact CG-CE2 4.16Å; M103-F137 HydrophobicContact CG-CZ 3.97Å; M103-F137 HydrophobicContact SD-CE2 4.18Å; M103-F137 HydrophobicContact SD-CZ 4.36Å; M103-L189 HydrophobicContact CE-CB 3.66Å; M103-L189 HydrophobicContact CE-CD1 4.17Å; M103-L189 HydrophobicContact CE-CD2 3.35Å; M103-L189 HydrophobicContact CE-CG 3.87Å; M103-F192 HydrophobicContact CE-CD1 4.39Å; M103-F192 HydrophobicContact SD-CD1 3.87Å; M103-F193 HydrophobicContact CG-CD2 4.5Å; M103-F193 HydrophobicContact SD-CB 3.74Å; M103-F193 HydrophobicContact SD-CD2 4.12Å; M103-F193 HydrophobicContact SD-CG 4.44Å; M103-L196 HydrophobicContact CG-CD1 4.35Å |
| 104 | M | 96.7 | Very high | 95.6 | Very high | 43 Ų | 43 | 31.8 Ų | 31.8 | 21% | 0.212 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62 | -44.7 | 173.3 | -70.5 | 175.5 | 177.8 | 0 | 0 | 111.8 | L100 V101 F106 L107 I108 F137 I138 | L100-M104 HydrophobicContact CD1-CE 3.86Å; L100-M104 HydrophobicContact CD2-CE 4.04Å; L100-M104 HydrophobicContact CG-CE 3.78Å; L100-M104 WeakPolarHBondContact O-CG 3.23Å; L100-M104 PolarHBondContact O-N 3.23Å; V101-M104 PolarHBondContact O-N 2.93Å; M104-F106 VanDerWaalsContact C-N 3.35Å; M104-F106 PolarHBondContact O-N 3.07Å; M104-L107 PolarHBondContact O-N 3.48Å; M104-I108 VanDerWaalsContact O-CG1 3.29Å; M104-I108 WeakPolarHBondContact O-CG1 3.46Å; M104-I108 PolarHBondContact O-N 3.1Å; M104-F137 HydrophobicContact CE-CE1 3.96Å; M104-F137 HydrophobicContact CG-CD1 4.15Å; M104-F137 HydrophobicContact CG-CE1 3.62Å; M104-I138 HydrophobicContact CE-CD1 3.81Å; M104-I138 HydrophobicContact CE-CG1 3.89Å |
| 105 | V | 96.2 | Very high | 95.7 | Very high | 66 Ų | 66 | 31 Ų | 31 | 40% | 0.4 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -59.4 | -47.6 | 176.9 | 171.6 | 0 | 0 | 0 | 0 | 110.5 | V101 L102 L107 I108 F109 | V101-V105 WeakPolarHBondContact O-CG2 3.45Å; V101-V105 PolarHBondContact O-N 3.19Å; L102-V105 PolarHBondContact O-N 3.44Å; V105-L107 VanDerWaalsContact C-N 3.33Å; V105-L107 PolarHBondContact O-N 3.28Å; V105-I108 PolarHBondContact O-N 3.13Å; V105-F109 HydrophobicContact CG1-CD2 3.75Å; V105-F109 HydrophobicContact CG1-CE2 3.51Å; V105-F109 WeakPolarHBondContact O-CD2 3.42Å; V105-F109 PolarHBondContact O-N 3.02Å; V105-F109 VanDerWaalsContact O-N 3.09Å |
| 106 | F | 96 | Very high | 96 | Very high | 56 Ų | 56 | 38.2 Ų | 38.2 | 25% | 0.246 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.3 | -39.1 | 178.2 | -171 | -104 | 0 | 0 | 0 | 112.6 | L102 M103 M104 F109 T110 F193 L196 C197 L201 | L102-F106 WeakPolarHBondContact O-CB 3.34Å; L102-F106 PolarHBondContact O-N 3.47Å; M103-F106 PolarHBondContact O-N 3.19Å; M104-F106 VanDerWaalsContact C-N 3.35Å; M104-F106 PolarHBondContact O-N 3.07Å; F106-F109 PolarHBondContact O-N 2.84Å; F106-T110 HydrophobicContact CD1-CG2 4.38Å; F106-T110 HydrophobicContact CE1-CG2 3.99Å; F106-T110 HydrophobicContact CE2-CG2 4.42Å; F106-T110 HydrophobicContact CZ-CG2 4.01Å; F106-T110 WeakPolarHBondContact O-CG2 3.28Å; F106-T110 PolarHBondContact O-N 3.39Å; F106-T110 PolarHBondContact O-OG1 3.06Å; F106-F193 HydrophobicContact CD1-CE2 4.48Å; F106-L196 HydrophobicContact CD1-CD2 3.28Å; F106-L196 HydrophobicContact CE1-CD2 3.27Å; F106-C197 VanDerWaalsContact CE1-SG 3.55Å; F106-L201 HydrophobicContact CE2-CD2 4.43Å; F106-L201 HydrophobicContact CZ-CB 3.93Å; F106-L201 HydrophobicContact CZ-CD1 4.4Å; F106-L201 HydrophobicContact CZ-CD2 3.88Å; F106-L201 HydrophobicContact CZ-CG 4.28Å |
| 107 | L | 96.5 | Very high | 96 | Very high | 2 Ų | 2 | 39.6 Ų | 39.6 | 1% | 0.01 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.1 | -43 | 175.2 | -175.3 | 62.5 | 0 | 0 | 0 | 112 | M103 M104 V105 T110 S111 V132 V133 F137 L196 | M103-L107 VanDerWaalsContact O-CB 3.31Å; M103-L107 WeakPolarHBondContact O-CB 3.39Å; M103-L107 PolarHBondContact O-N 2.9Å; M104-L107 PolarHBondContact O-N 3.48Å; V105-L107 VanDerWaalsContact C-N 3.33Å; V105-L107 PolarHBondContact O-N 3.28Å; L107-T110 PolarHBondContact O-N 3.11Å; L107-T110 PolarHBondContact O-OG1 2.99Å; L107-T110 VanDerWaalsContact O-OG1 3.13Å; L107-S111 WeakPolarHBondContact O-CB 3.36Å; L107-S111 PolarHBondContact O-N 3.28Å; L107-S111 PolarHBondContact O-OG 2.83Å; L107-V132 HydrophobicContact CD1-CG1 3.61Å; L107-V132 HydrophobicContact CD2-CG1 3.99Å; L107-V132 HydrophobicContact CG-CG1 3.84Å; L107-V133 HydrophobicContact CD2-CG2 4.15Å; L107-V133 HydrophobicContact CG-CG2 4.43Å; L107-F137 HydrophobicContact CD2-CB 3.36Å; L107-F137 HydrophobicContact CD2-CD1 3.95Å; L107-F137 HydrophobicContact CD2-CD2 4.42Å; L107-F137 HydrophobicContact CD2-CG 3.65Å; L107-L196 HydrophobicContact CB-CD1 4.21Å; L107-L196 HydrophobicContact CD1-CD1 3.73Å; L107-L196 HydrophobicContact CD1-CG 4.35Å; L107-L196 HydrophobicContact CG-CD1 4.45Å |
| 108 | I | 97.8 | Very high | 95.8 | Very high | 66 Ų | 66 | 40.6 Ų | 40.6 | 34% | 0.338 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -59.1 | -50.5 | 175.4 | -70 | 163.8 | 0 | 0 | 0 | 110.5 | M104 V105 T110 S111 L112 V129 V133 | M104-I108 VanDerWaalsContact O-CG1 3.29Å; M104-I108 WeakPolarHBondContact O-CG1 3.46Å; M104-I108 PolarHBondContact O-N 3.1Å; V105-I108 PolarHBondContact O-N 3.13Å; I108-T110 PolarHBondContact O-N 3.14Å; I108-S111 PolarHBondContact O-N 3.08Å; I108-L112 HydrophobicContact CG2-CD1 4.16Å; I108-L112 WeakPolarHBondContact O-CG 3.48Å; I108-L112 PolarHBondContact O-N 3.48Å; I108-V129 HydrophobicContact CB-CG1 4.48Å; I108-V129 HydrophobicContact CG1-CG1 4.08Å; I108-V129 HydrophobicContact CG2-CG1 4.23Å; I108-V133 HydrophobicContact CG1-CG2 3.79Å |
| 109 | F | 97.2 | Very high | 95.6 | Very high | 142 Ų | 142 | 45.6 Ų | 45.6 | 62% | 0.623 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -60.5 | -45.3 | -179.3 | -81.2 | -64.8 | 0 | 0 | 0 | 112.9 | V105 F106 L112 G113 | V105-F109 HydrophobicContact CG1-CD2 3.75Å; V105-F109 HydrophobicContact CG1-CE2 3.51Å; V105-F109 WeakPolarHBondContact O-CD2 3.42Å; V105-F109 PolarHBondContact O-N 3.02Å; V105-F109 VanDerWaalsContact O-N 3.09Å; F106-F109 PolarHBondContact O-N 2.84Å; F109-L112 PolarHBondContact O-N 2.83Å; F109-G113 PolarHBondContact O-N 2.81Å |
| 110 | T | 96.5 | Very high | 95.5 | Very high | 9 Ų | 9 | 46.3 Ų | 46.3 | 6% | 0.055 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -69.5 | -37.1 | 179.2 | 51.2 | 0 | 0 | 0 | 0 | 111.9 | F106 L107 I108 L112 G113 F114 H200 | F106-T110 HydrophobicContact CD1-CG2 4.38Å; F106-T110 HydrophobicContact CE1-CG2 3.99Å; F106-T110 HydrophobicContact CE2-CG2 4.42Å; F106-T110 HydrophobicContact CZ-CG2 4.01Å; F106-T110 WeakPolarHBondContact O-CG2 3.28Å; F106-T110 PolarHBondContact O-N 3.39Å; F106-T110 PolarHBondContact O-OG1 3.06Å; L107-T110 PolarHBondContact O-N 3.11Å; L107-T110 PolarHBondContact O-OG1 2.99Å; L107-T110 VanDerWaalsContact O-OG1 3.13Å; I108-T110 PolarHBondContact O-N 3.14Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L112 PolarHBondContact O-N 3.19Å; T110-G113 WeakPolarHBondContact O-CA 3.43Å; T110-G113 PolarHBondContact O-N 3.11Å; T110-F114 WeakPolarHBondContact O-CD2 3.49Å; T110-F114 PolarHBondContact O-N 3.19Å; T110-H200 HydrophobicContact CG2-CB 4.07Å |
| 111 | S | 96.7 | Very high | 95.4 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.7 | -38.8 | 176 | -57.8 | 0 | 0 | 0 | 0 | 112 | L107 I108 G113 F114 A115 F128 V132 | L107-S111 WeakPolarHBondContact O-CB 3.36Å; L107-S111 PolarHBondContact O-N 3.28Å; L107-S111 PolarHBondContact O-OG 2.83Å; I108-S111 PolarHBondContact O-N 3.08Å; S111-G113 VanDerWaalsContact C-N 3.27Å; S111-G113 PolarHBondContact O-N 3.16Å; S111-F114 PolarHBondContact O-N 3.09Å; S111-A115 PolarHBondContact O-N 2.75Å; S111-F128 VanDerWaalsContact O-CE1 3.28Å; S111-F128 WeakPolarHBondContact O-CE1 3.32Å; S111-V132 WeakPolarHBondContact OG-CG1 3.43Å |
| 112 | L | 96.8 | Very high | 95.4 | Very high | 83 Ų | 83 | 51.8 Ų | 51.8 | 44% | 0.435 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.1 | -37.1 | 170.9 | -71.1 | 170.6 | 0 | 0 | 0 | 111.9 | I108 F109 T110 A115 F116 V129 | I108-L112 HydrophobicContact CG2-CD1 4.16Å; I108-L112 WeakPolarHBondContact O-CG 3.48Å; I108-L112 PolarHBondContact O-N 3.48Å; F109-L112 PolarHBondContact O-N 2.83Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L112 PolarHBondContact O-N 3.19Å; L112-A115 PolarHBondContact O-N 3.46Å; L112-F116 WeakPolarHBondContact O-CB 3.14Å; L112-F116 PolarHBondContact O-N 2.85Å; L112-V129 HydrophobicContact CD2-CG2 3.85Å; L112-V129 HydrophobicContact CG-CG2 4.09Å |
| 113 | G | 95.6 | Very high | 95.3 | Very high | 20 Ų | 20 | 56 Ų | 56 | 21% | 0.206 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -59.8 | -45.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F109 T110 S111 F116 C117 | F109-G113 PolarHBondContact O-N 2.81Å; T110-G113 WeakPolarHBondContact O-CA 3.43Å; T110-G113 PolarHBondContact O-N 3.11Å; S111-G113 VanDerWaalsContact C-N 3.27Å; S111-G113 PolarHBondContact O-N 3.16Å; G113-F116 PolarHBondContact O-N 3.36Å; G113-C117 PolarHBondContact O-N 3.46Å; G113-C117 PolarHBondContact O-SG 3.25Å; G113-C117 VanDerWaalsContact O-SG 3.34Å |
| 114 | F | 95 | Very high | 95.3 | Very high | 19 Ų | 19 | 56.8 Ų | 56.8 | 8% | 0.083 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 173.8 | -86.1 | -90.1 | 0 | 0 | 0 | 112.4 | T110 S111 F116 C117 M118 F128 L199 H200 L204 L207 | T110-F114 WeakPolarHBondContact O-CD2 3.49Å; T110-F114 PolarHBondContact O-N 3.19Å; S111-F114 PolarHBondContact O-N 3.09Å; F114-F116 VanDerWaalsContact C-N 3.27Å; F114-F116 PolarHBondContact O-N 2.99Å; F114-C117 PolarHBondContact O-N 3.1Å; F114-M118 HydrophobicContact CB-CE 4.21Å; F114-M118 WeakPolarHBondContact O-CB 3.48Å; F114-M118 WeakPolarHBondContact O-CG 3.32Å; F114-M118 PolarHBondContact O-N 2.77Å; F114-F128 HydrophobicContact CB-CE1 3.84Å; F114-F128 HydrophobicContact CB-CZ 4.02Å; F114-L199 WeakPolarHBondContact CZ-O 3.26Å; F114-H200 HydrophobicContact CE2-CB 4.3Å; F114-L204 HydrophobicContact CD1-CD1 4.27Å; F114-L204 HydrophobicContact CD2-CD1 3.79Å; F114-L204 HydrophobicContact CE1-CD1 4.3Å; F114-L204 HydrophobicContact CE2-CB 4.23Å; F114-L204 HydrophobicContact CE2-CD1 3.75Å; F114-L204 HydrophobicContact CE2-CG 4.44Å; F114-L204 HydrophobicContact CG-CD1 4.02Å; F114-L204 HydrophobicContact CZ-CB 4.44Å; F114-L204 HydrophobicContact CZ-CD1 4.04Å; F114-L207 HydrophobicContact CD1-CD2 3.9Å; F114-L207 HydrophobicContact CE1-CD1 4.1Å; F114-L207 HydrophobicContact CE1-CD2 3.97Å |
| 115 | A | 95.3 | Very high | 95.3 | Very high | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.008 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.7 | -42.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | S111 L112 M118 S119 L120 F128 | S111-A115 PolarHBondContact O-N 2.75Å; L112-A115 PolarHBondContact O-N 3.46Å; A115-M118 PolarHBondContact O-N 2.89Å; A115-S119 PolarHBondContact O-N 3.39Å; A115-S119 VanDerWaalsContact O-N 3.16Å; A115-L120 HydrophobicContact CB-CB 4.42Å; A115-L120 HydrophobicContact CB-CD1 4.03Å; A115-L120 PolarHBondContact O-N 2.9Å; A115-F128 HydrophobicContact CB-CD1 4.08Å |
| 116 | F | 94.2 | Very high | 95.3 | Very high | 175 Ų | 175 | 56.9 Ų | 56.9 | 77% | 0.768 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.4 | -49.7 | 173.6 | 178.7 | -99.9 | 0 | 0 | 0 | 112.1 | L112 G113 F114 M118 S119 | L112-F116 WeakPolarHBondContact O-CB 3.14Å; L112-F116 PolarHBondContact O-N 2.85Å; G113-F116 PolarHBondContact O-N 3.36Å; F114-F116 VanDerWaalsContact C-N 3.27Å; F114-F116 PolarHBondContact O-N 2.99Å; F116-M118 VanDerWaalsContact C-N 3.26Å; F116-M118 PolarHBondContact O-N 2.89Å; F116-S119 PolarHBondContact O-N 3.36Å |
| 117 | C | 92.5 | Very high | 95.3 | Very high | 65 Ų | 65 | 58.9 Ų | 58.9 | 44% | 0.439 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.6 | -30.8 | 179.1 | -67.9 | 0 | 0 | 0 | 0 | 113.3 | G113 F114 S119 L207 | G113-C117 PolarHBondContact O-N 3.46Å; G113-C117 PolarHBondContact O-SG 3.25Å; G113-C117 VanDerWaalsContact O-SG 3.34Å; F114-C117 PolarHBondContact O-N 3.1Å; C117-S119 VanDerWaalsContact C-N 3.27Å; C117-L207 HydrophobicContact CB-CD2 3.72Å |
| 118 | M | 90.6 | Very high | 95.3 | Very high | 22 Ų | 22 | 59.1 Ų | 59.1 | 11% | 0.108 | 33% | 0.327 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | -0.2 | 175.2 | -67.7 | -173.3 | -60.8 | 0 | 0 | 113.3 | F114 A115 F116 L120 F128 C278 | F114-M118 HydrophobicContact CB-CE 4.21Å; F114-M118 WeakPolarHBondContact O-CB 3.48Å; F114-M118 WeakPolarHBondContact O-CG 3.32Å; F114-M118 PolarHBondContact O-N 2.77Å; A115-M118 PolarHBondContact O-N 2.89Å; F116-M118 VanDerWaalsContact C-N 3.26Å; F116-M118 PolarHBondContact O-N 2.89Å; M118-L120 VanDerWaalsContact C-N 3.26Å; M118-L120 HydrophobicContact CB-CD2 4.37Å; M118-L120 HydrophobicContact CB-CG 4.06Å; M118-L120 HydrophobicContact CE-CD1 3.92Å; M118-L120 HydrophobicContact CE-CG 4.44Å; M118-L120 PolarHBondContact O-N 3.4Å; M118-F128 HydrophobicContact CE-CD2 4.3Å; M118-F128 HydrophobicContact CE-CE1 4.19Å; M118-F128 HydrophobicContact CE-CE2 3.91Å; M118-F128 HydrophobicContact CE-CZ 3.85Å; M118-C278 HydrophobicContact SD-CB 4.41Å |
| 119 | S | 92.5 | Very high | 95.3 | Very high | 106 Ų | 106 | 56.9 Ų | 56.9 | 74% | 0.741 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.1 | 38.7 | -178.5 | -56.1 | 0 | 0 | 0 | 0 | 113.3 | A115 F116 C117 | A115-S119 PolarHBondContact O-N 3.39Å; A115-S119 VanDerWaalsContact O-N 3.16Å; F116-S119 PolarHBondContact O-N 3.36Å; C117-S119 VanDerWaalsContact C-N 3.27Å |
| 120 | L | 93.6 | Very high | 95.2 | Very high | 18 Ų | 18 | 54.3 Ų | 54.3 | 9% | 0.094 | 31% | 0.309 | C | S | . | . | trans | -70.2 | 146.3 | 175.2 | -62.1 | -175.6 | 0 | 0 | 0 | 110.7 | A115 M118 Q124 F128 L285 F286 | A115-L120 HydrophobicContact CB-CB 4.42Å; A115-L120 HydrophobicContact CB-CD1 4.03Å; A115-L120 PolarHBondContact O-N 2.9Å; M118-L120 VanDerWaalsContact C-N 3.26Å; M118-L120 HydrophobicContact CB-CD2 4.37Å; M118-L120 HydrophobicContact CB-CG 4.06Å; M118-L120 HydrophobicContact CE-CD1 3.92Å; M118-L120 HydrophobicContact CE-CG 4.44Å; M118-L120 PolarHBondContact O-N 3.4Å; L120-Q124 HydrophobicContact CB-CB 3.99Å; L120-Q124 HydrophobicContact CD1-CB 4.49Å; L120-Q124 HydrophobicContact CD2-CB 4.43Å; L120-F128 HydrophobicContact CD1-CB 3.97Å; L120-F128 HydrophobicContact CD1-CG 4.12Å; L120-L285 HydrophobicContact CD1-CD1 3.7Å; L120-L285 HydrophobicContact CD2-CD1 4.23Å; L120-F286 HydrophobicContact CD2-CE2 3.99Å; L120-F286 HydrophobicContact CD2-CZ 4.28Å | ||
| 121 | N | 94.6 | Very high | 95.2 | Very high | 82 Ų | 82 | 58.4 Ų | 58.4 | 44% | 0.439 | 32% | 0.323 | S | S | . | . | trans | -71.4 | 172.1 | 171.7 | 72.1 | 38.2 | 0 | 0 | 0 | 111.2 | I123 Q124 S125 | N121-I123 VanDerWaalsContact C-N 3.34Å; N121-I123 PolarHBondContact O-N 3.17Å; N121-I123 PolarHBondContact OD1-N 3.31Å; N121-I123 VanDerWaalsContact OD1-N 3.11Å; N121-Q124 VanDerWaalsContact CG-OE1 3.27Å; N121-Q124 VanDerWaalsContact ND2-CD 3.31Å; N121-Q124 PolarHBondContact ND2-OE1 3.14Å; N121-Q124 PolarHBondContact O-N 3.45Å; N121-Q124 VanDerWaalsContact OD1-CB 3.32Å; N121-Q124 WeakPolarHBondContact OD1-CB 3.23Å; N121-Q124 VanDerWaalsContact OD1-CG 3.23Å; N121-Q124 WeakPolarHBondContact OD1-CG 3.36Å; N121-Q124 PolarHBondContact OD1-N 3.38Å; N121-S125 WeakPolarHBondContact O-CB 3.39Å; N121-S125 PolarHBondContact O-N 2.98Å; N121-S125 PolarHBondContact O-OG 3.34Å | ||
| 122 | A | 95.3 | Very high | 95.2 | Very high | 79 Ų | 79 | 58.6 Ų | 58.6 | 65% | 0.653 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -60.7 | -39.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S125 V126 | A122-S125 PolarHBondContact O-N 2.74Å; A122-V126 WeakPolarHBondContact O-CG2 3.46Å; A122-V126 PolarHBondContact O-N 2.98Å; A122-V126 VanDerWaalsContact O-N 3.17Å |
| 123 | I | 95.5 | Very high | 95.2 | Very high | 121 Ų | 121 | 55.3 Ų | 55.3 | 62% | 0.621 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -68.3 | -49.3 | -179.9 | -63.5 | 171.5 | 0 | 0 | 0 | 109.8 | N121 S125 V126 E127 | N121-I123 VanDerWaalsContact C-N 3.34Å; N121-I123 PolarHBondContact O-N 3.17Å; N121-I123 PolarHBondContact OD1-N 3.31Å; N121-I123 VanDerWaalsContact OD1-N 3.11Å; I123-S125 VanDerWaalsContact C-N 3.25Å; I123-S125 PolarHBondContact O-N 2.95Å; I123-V126 PolarHBondContact O-N 2.92Å; I123-V126 VanDerWaalsContact O-N 3.09Å; I123-E127 PolarHBondContact O-N 2.63Å |
| 124 | Q | 95.9 | Very high | 95.2 | Very high | 17 Ų | 17 | 60.2 Ų | 60.2 | 8% | 0.079 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -60.5 | -35.5 | 176.8 | -71.4 | 174.7 | -31.6 | 0 | 0 | 112.2 | L120 N121 E127 F128 L285 | L120-Q124 HydrophobicContact CB-CB 3.99Å; L120-Q124 HydrophobicContact CD1-CB 4.49Å; L120-Q124 HydrophobicContact CD2-CB 4.43Å; N121-Q124 VanDerWaalsContact CG-OE1 3.27Å; N121-Q124 VanDerWaalsContact ND2-CD 3.31Å; N121-Q124 PolarHBondContact ND2-OE1 3.14Å; N121-Q124 PolarHBondContact O-N 3.45Å; N121-Q124 VanDerWaalsContact OD1-CB 3.32Å; N121-Q124 WeakPolarHBondContact OD1-CB 3.23Å; N121-Q124 VanDerWaalsContact OD1-CG 3.23Å; N121-Q124 WeakPolarHBondContact OD1-CG 3.36Å; N121-Q124 PolarHBondContact OD1-N 3.38Å; Q124-E127 PolarHBondContact O-N 2.78Å; Q124-F128 WeakPolarHBondContact O-CB 3.36Å; Q124-F128 PolarHBondContact O-N 3.4Å; Q124-L285 HydrophobicContact CG-CB 4.37Å; Q124-L285 PolarHBondContact NE2-O 3.04Å |
| 125 | S | 96.5 | Very high | 95.3 | Very high | 21 Ų | 21 | 61.8 Ų | 61.8 | 15% | 0.147 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 175.6 | -61.2 | 0 | 0 | 0 | 0 | 111.4 | N121 A122 I123 V129 | N121-S125 WeakPolarHBondContact O-CB 3.39Å; N121-S125 PolarHBondContact O-N 2.98Å; N121-S125 PolarHBondContact O-OG 3.34Å; A122-S125 PolarHBondContact O-N 2.74Å; I123-S125 VanDerWaalsContact C-N 3.25Å; I123-S125 PolarHBondContact O-N 2.95Å; S125-V129 VanDerWaalsContact O-CG2 3.25Å; S125-V129 WeakPolarHBondContact O-CG2 3.33Å; S125-V129 PolarHBondContact O-N 3.49Å |
| 126 | V | 96.6 | Very high | 95.3 | Very high | 90 Ų | 90 | 63.7 Ų | 63.7 | 55% | 0.545 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -66.4 | -47.3 | 175.7 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | A122 I123 F128 V129 L130 | A122-V126 WeakPolarHBondContact O-CG2 3.46Å; A122-V126 PolarHBondContact O-N 2.98Å; A122-V126 VanDerWaalsContact O-N 3.17Å; I123-V126 PolarHBondContact O-N 2.92Å; I123-V126 VanDerWaalsContact O-N 3.09Å; V126-F128 VanDerWaalsContact C-N 3.33Å; V126-F128 PolarHBondContact O-N 2.9Å; V126-V129 PolarHBondContact O-N 3.03Å; V126-L130 HydrophobicContact CG1-CD1 3.96Å; V126-L130 HydrophobicContact CG1-CG 4.35Å; V126-L130 WeakPolarHBondContact O-CB 3.2Å; V126-L130 VanDerWaalsContact O-CG 3.29Å; V126-L130 WeakPolarHBondContact O-CG 3.35Å; V126-L130 PolarHBondContact O-N 3.43Å |
| 127 | E | 95.8 | Very high | 95.4 | Very high | 99 Ų | 99 | 55.5 Ų | 55.5 | 46% | 0.463 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.3 | -43.3 | 176.7 | -71.8 | -179.2 | 169.3 | 0 | 0 | 112 | I123 Q124 L130 W131 L285 | I123-E127 PolarHBondContact O-N 2.63Å; Q124-E127 PolarHBondContact O-N 2.78Å; E127-L130 PolarHBondContact O-N 3.13Å; E127-W131 WeakPolarHBondContact O-CB 3.26Å; E127-W131 PolarHBondContact O-N 3.41Å; E127-L285 HydrophobicContact CB-CD2 3.65Å |
| 128 | F | 96.5 | Very high | 95.6 | Very high | 7 Ų | 7 | 54.8 Ų | 54.8 | 3% | 0.031 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.5 | -51.1 | 175.4 | 177.4 | -109 | 0 | 0 | 0 | 111.7 | S111 F114 A115 M118 L120 Q124 V126 L130 W131 V132 Y281 L285 | S111-F128 VanDerWaalsContact O-CE1 3.28Å; S111-F128 WeakPolarHBondContact O-CE1 3.32Å; F114-F128 HydrophobicContact CB-CE1 3.84Å; F114-F128 HydrophobicContact CB-CZ 4.02Å; A115-F128 HydrophobicContact CB-CD1 4.08Å; M118-F128 HydrophobicContact CE-CD2 4.3Å; M118-F128 HydrophobicContact CE-CE1 4.19Å; M118-F128 HydrophobicContact CE-CE2 3.91Å; M118-F128 HydrophobicContact CE-CZ 3.85Å; L120-F128 HydrophobicContact CD1-CB 3.97Å; L120-F128 HydrophobicContact CD1-CG 4.12Å; Q124-F128 WeakPolarHBondContact O-CB 3.36Å; Q124-F128 PolarHBondContact O-N 3.4Å; V126-F128 VanDerWaalsContact C-N 3.33Å; V126-F128 PolarHBondContact O-N 2.9Å; F128-L130 PolarHBondContact O-N 2.88Å; F128-W131 PolarHBondContact O-N 3.03Å; F128-V132 HydrophobicContact CD2-CG2 4.18Å; F128-V132 HydrophobicContact CE1-CG2 4.16Å; F128-V132 HydrophobicContact CE2-CG2 3.76Å; F128-V132 HydrophobicContact CZ-CG2 3.76Å; F128-V132 WeakPolarHBondContact O-CG2 3.42Å; F128-V132 PolarHBondContact O-N 3.46Å; F128-Y281 AromaticContact CD2-CD1 3.93Å; F128-Y281 HydrophobicContact CD2-CD1 3.93Å; F128-Y281 HydrophobicContact CD2-CD2 4.49Å; F128-Y281 HydrophobicContact CD2-CE1 4.42Å; F128-Y281 AromaticContact CD2-CG 3.99Å; F128-Y281 HydrophobicContact CD2-CG 3.99Å; F128-Y281 AromaticContact CE2-CD1 3.72Å; F128-Y281 HydrophobicContact CE2-CD1 3.72Å; F128-Y281 AromaticContact CE2-CD2 3.61Å; F128-Y281 HydrophobicContact CE2-CD2 3.61Å; F128-Y281 AromaticContact CE2-CE1 3.98Å; F128-Y281 HydrophobicContact CE2-CE1 3.98Å; F128-Y281 AromaticContact CE2-CE2 3.81Å; F128-Y281 HydrophobicContact CE2-CE2 3.81Å; F128-Y281 AromaticContact CE2-CG 3.54Å; F128-Y281 HydrophobicContact CE2-CG 3.54Å; F128-Y281 HydrophobicContact CZ-CD2 4.44Å; F128-Y281 HydrophobicContact CZ-CE2 4.41Å; F128-L285 HydrophobicContact CB-CD1 3.97Å; F128-L285 HydrophobicContact CD2-CD1 4.21Å; F128-L285 HydrophobicContact CG-CD1 4.48Å |
| 129 | V | 97.1 | Very high | 96 | Very high | 18 Ų | 18 | 54.9 Ų | 54.9 | 11% | 0.109 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.6 | -43.7 | 179.2 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | I108 L112 S125 V126 W131 V132 V133 | I108-V129 HydrophobicContact CB-CG1 4.48Å; I108-V129 HydrophobicContact CG1-CG1 4.08Å; I108-V129 HydrophobicContact CG2-CG1 4.23Å; L112-V129 HydrophobicContact CD2-CG2 3.85Å; L112-V129 HydrophobicContact CG-CG2 4.09Å; S125-V129 VanDerWaalsContact O-CG2 3.25Å; S125-V129 WeakPolarHBondContact O-CG2 3.33Å; S125-V129 PolarHBondContact O-N 3.49Å; V126-V129 PolarHBondContact O-N 3.03Å; V129-W131 VanDerWaalsContact C-N 3.32Å; V129-W131 PolarHBondContact O-N 3.2Å; V129-V132 PolarHBondContact O-N 3.3Å; V129-V133 HydrophobicContact CG1-CG2 4.3Å; V129-V133 WeakPolarHBondContact O-CB 3.28Å; V129-V133 VanDerWaalsContact O-CG2 3.28Å; V129-V133 WeakPolarHBondContact O-CG2 3.44Å; V129-V133 PolarHBondContact O-N 3.4Å |
| 130 | L | 96.5 | Very high | 96.2 | Very high | 89 Ų | 89 | 53.7 Ų | 53.7 | 47% | 0.466 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.9 | -43.7 | 177.8 | -71.6 | 174.5 | 0 | 0 | 0 | 111.1 | V126 E127 F128 V133 F134 | V126-L130 HydrophobicContact CG1-CD1 3.96Å; V126-L130 HydrophobicContact CG1-CG 4.35Å; V126-L130 WeakPolarHBondContact O-CB 3.2Å; V126-L130 VanDerWaalsContact O-CG 3.29Å; V126-L130 WeakPolarHBondContact O-CG 3.35Å; V126-L130 PolarHBondContact O-N 3.43Å; E127-L130 PolarHBondContact O-N 3.13Å; F128-L130 PolarHBondContact O-N 2.88Å; L130-V133 PolarHBondContact O-N 3.4Å; L130-F134 HydrophobicContact CB-CD2 4.43Å; L130-F134 HydrophobicContact CD2-CD2 4.08Å; L130-F134 HydrophobicContact CD2-CE2 3.69Å; L130-F134 WeakPolarHBondContact O-CB 3.25Å; L130-F134 VanDerWaalsContact O-CD2 3.29Å; L130-F134 WeakPolarHBondContact O-CD2 3.19Å; L130-F134 PolarHBondContact O-N 3.45Å |
| 131 | W | 95.8 | Very high | 96.4 | Very high | 94 Ų | 94 | 53 Ų | 53 | 36% | 0.356 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -64.1 | -47.6 | 178.8 | -168.3 | -94.6 | 0 | 0 | 0 | 112.1 | E127 F128 V129 V133 V135 D136 Y281 | E127-W131 WeakPolarHBondContact O-CB 3.26Å; E127-W131 PolarHBondContact O-N 3.41Å; F128-W131 PolarHBondContact O-N 3.03Å; V129-W131 VanDerWaalsContact C-N 3.32Å; V129-W131 PolarHBondContact O-N 3.2Å; W131-V133 VanDerWaalsContact C-N 3.33Å; W131-V133 PolarHBondContact O-N 3.47Å; W131-V135 HydrophobicContact CD2-CB 3.93Å; W131-V135 HydrophobicContact CD2-CG1 4.49Å; W131-V135 HydrophobicContact CD2-CG2 3.67Å; W131-V135 HydrophobicContact CE3-CB 4.22Å; W131-V135 HydrophobicContact CE3-CG2 3.43Å; W131-V135 VanDerWaalsContact CE3-CG2 3.43Å; W131-V135 HydrophobicContact CG-CB 4.43Å; W131-V135 HydrophobicContact CG-CG2 4.48Å; W131-V135 HydrophobicContact CH2-CB 4.25Å; W131-V135 HydrophobicContact CH2-CG1 4.07Å; W131-V135 HydrophobicContact CH2-CG2 3.63Å; W131-V135 HydrophobicContact CZ2-CB 3.94Å; W131-V135 HydrophobicContact CZ2-CG1 3.6Å; W131-V135 HydrophobicContact CZ2-CG2 3.83Å; W131-V135 HydrophobicContact CZ3-CB 4.38Å; W131-V135 HydrophobicContact CZ3-CG2 3.41Å; W131-V135 VanDerWaalsContact CZ3-CG2 3.41Å; W131-V135 WeakPolarHBondContact O-CA 3.48Å; W131-V135 WeakPolarHBondContact O-CB 3.37Å; W131-V135 PolarHBondContact O-N 2.96Å; W131-D136 PolarHBondContact O-N 3.18Å; W131-Y281 AromaticContact CD1-CE1 3.81Å |
| 132 | V | 96.5 | Very high | 96.6 | Very high | 4 Ų | 4 | 52.8 Ų | 52.8 | 2% | 0.024 | 29% | 0.287 | C | S | . | . | I | π-helix | trans | -60.4 | -42.4 | 178.2 | 172 | 0 | 0 | 0 | 0 | 111.4 | L107 S111 F128 V129 D136 F137 Y281 | L107-V132 HydrophobicContact CD1-CG1 3.61Å; L107-V132 HydrophobicContact CD2-CG1 3.99Å; L107-V132 HydrophobicContact CG-CG1 3.84Å; S111-V132 WeakPolarHBondContact OG-CG1 3.43Å; F128-V132 HydrophobicContact CD2-CG2 4.18Å; F128-V132 HydrophobicContact CE1-CG2 4.16Å; F128-V132 HydrophobicContact CE2-CG2 3.76Å; F128-V132 HydrophobicContact CZ-CG2 3.76Å; F128-V132 WeakPolarHBondContact O-CG2 3.42Å; F128-V132 PolarHBondContact O-N 3.46Å; V129-V132 PolarHBondContact O-N 3.3Å; V132-D136 WeakPolarHBondContact CA-OD2 3.22Å; V132-F137 WeakPolarHBondContact O-CB 3.49Å; V132-F137 PolarHBondContact O-N 2.88Å; V132-Y281 HydrophobicContact CG2-CE1 4.19Å |
| 133 | V | 97.1 | Very high | 96.7 | Very high | 14 Ų | 14 | 54.7 Ų | 54.7 | 9% | 0.085 | 29% | 0.285 | C | S | . | . | I | π-helix | trans | -72.4 | -49.6 | -179.8 | 171.7 | 0 | 0 | 0 | 0 | 112 | L107 I108 V129 L130 W131 F137 I138 | L107-V133 HydrophobicContact CD2-CG2 4.15Å; L107-V133 HydrophobicContact CG-CG2 4.43Å; I108-V133 HydrophobicContact CG1-CG2 3.79Å; V129-V133 HydrophobicContact CG1-CG2 4.3Å; V129-V133 WeakPolarHBondContact O-CB 3.28Å; V129-V133 VanDerWaalsContact O-CG2 3.28Å; V129-V133 WeakPolarHBondContact O-CG2 3.44Å; V129-V133 PolarHBondContact O-N 3.4Å; L130-V133 PolarHBondContact O-N 3.4Å; W131-V133 VanDerWaalsContact C-N 3.33Å; W131-V133 PolarHBondContact O-N 3.47Å; V133-F137 WeakPolarHBondContact O-CB 3.03Å; V133-I138 HydrophobicContact CG1-CD1 4.42Å; V133-I138 WeakPolarHBondContact O-CG1 3.47Å; V133-I138 PolarHBondContact O-N 3Å |
| 134 | F | 96.6 | Very high | 96.8 | Very high | 124 Ų | 124 | 51.3 Ų | 51.3 | 54% | 0.544 | 27% | 0.267 | S | S | . | . | I | π-helix | trans | -84.1 | -40.9 | -171.4 | -74.3 | -72.6 | 0 | 0 | 0 | 113.2 | L130 I138 G139 | L130-F134 HydrophobicContact CB-CD2 4.43Å; L130-F134 HydrophobicContact CD2-CD2 4.08Å; L130-F134 HydrophobicContact CD2-CE2 3.69Å; L130-F134 WeakPolarHBondContact O-CB 3.25Å; L130-F134 VanDerWaalsContact O-CD2 3.29Å; L130-F134 WeakPolarHBondContact O-CD2 3.19Å; L130-F134 PolarHBondContact O-N 3.45Å; F134-I138 HydrophobicContact CD1-CD1 3.78Å; F134-I138 HydrophobicContact CE1-CD1 4.09Å; F134-I138 WeakPolarHBondContact O-CB 3.48Å; F134-G139 PolarHBondContact O-N 3.28Å |
| 135 | V | 95.8 | Very high | 97 | Very high | 51 Ų | 51 | 50.5 Ų | 50.5 | 31% | 0.309 | 26% | 0.263 | S | S | . | . | I | π-helix | trans | -91.4 | -59.6 | -175.9 | -177.5 | 0 | 0 | 0 | 0 | 110.6 | W131 F137 G139 I140 | W131-V135 HydrophobicContact CD2-CB 3.93Å; W131-V135 HydrophobicContact CD2-CG1 4.49Å; W131-V135 HydrophobicContact CD2-CG2 3.67Å; W131-V135 HydrophobicContact CE3-CB 4.22Å; W131-V135 HydrophobicContact CE3-CG2 3.43Å; W131-V135 VanDerWaalsContact CE3-CG2 3.43Å; W131-V135 HydrophobicContact CG-CB 4.43Å; W131-V135 HydrophobicContact CG-CG2 4.48Å; W131-V135 HydrophobicContact CH2-CB 4.25Å; W131-V135 HydrophobicContact CH2-CG1 4.07Å; W131-V135 HydrophobicContact CH2-CG2 3.63Å; W131-V135 HydrophobicContact CZ2-CB 3.94Å; W131-V135 HydrophobicContact CZ2-CG1 3.6Å; W131-V135 HydrophobicContact CZ2-CG2 3.83Å; W131-V135 HydrophobicContact CZ3-CB 4.38Å; W131-V135 HydrophobicContact CZ3-CG2 3.41Å; W131-V135 VanDerWaalsContact CZ3-CG2 3.41Å; W131-V135 WeakPolarHBondContact O-CA 3.48Å; W131-V135 WeakPolarHBondContact O-CB 3.37Å; W131-V135 PolarHBondContact O-N 2.96Å; V135-F137 VanDerWaalsContact C-N 3.34Å; V135-F137 PolarHBondContact O-N 3.03Å; V135-G139 VanDerWaalsContact O-CA 3.3Å; V135-G139 WeakPolarHBondContact O-CA 3.21Å; V135-G139 PolarHBondContact O-N 2.91Å; V135-I140 PolarHBondContact O-N 3.38Å; V135-I140 VanDerWaalsContact O-N 3.15Å |
| 136 | D | 94.9 | Very high | 97.1 | Very high | 42 Ų | 42 | 52 Ų | 52 | 23% | 0.225 | 27% | 0.272 | C | S | . | . | I | π-helix | trans | -73.5 | -30.8 | -170.9 | -56 | -41.9 | 0 | 0 | 0 | 112.1 | W131 V132 I140 Y281 | W131-D136 PolarHBondContact O-N 3.18Å; V132-D136 WeakPolarHBondContact CA-OD2 3.22Å; D136-I140 WeakPolarHBondContact O-CB 3.47Å; D136-I140 WeakPolarHBondContact O-CG1 3.47Å; D136-Y281 PolarHBondContact OD2-OH 2.8Å |
| 137 | F | 97.6 | Very high | 97.1 | Very high | 2 Ų | 2 | 52.8 Ų | 52.8 | 1% | 0.009 | 27% | 0.268 | C | S | . | . | I | π-helix | trans | -95.5 | -66 | 177.3 | 176.4 | -119.4 | 0 | 0 | 0 | 113.1 | L100 M103 M104 L107 V132 V133 V135 S141 L189 F192 | L100-F137 HydrophobicContact CD1-CE1 3.81Å; L100-F137 HydrophobicContact CD1-CZ 3.65Å; M103-F137 HydrophobicContact CB-CZ 4.43Å; M103-F137 HydrophobicContact CE-CE2 3.59Å; M103-F137 HydrophobicContact CE-CZ 3.52Å; M103-F137 HydrophobicContact CG-CE2 4.16Å; M103-F137 HydrophobicContact CG-CZ 3.97Å; M103-F137 HydrophobicContact SD-CE2 4.18Å; M103-F137 HydrophobicContact SD-CZ 4.36Å; M104-F137 HydrophobicContact CE-CE1 3.96Å; M104-F137 HydrophobicContact CG-CD1 4.15Å; M104-F137 HydrophobicContact CG-CE1 3.62Å; L107-F137 HydrophobicContact CD2-CB 3.36Å; L107-F137 HydrophobicContact CD2-CD1 3.95Å; L107-F137 HydrophobicContact CD2-CD2 4.42Å; L107-F137 HydrophobicContact CD2-CG 3.65Å; V132-F137 WeakPolarHBondContact O-CB 3.49Å; V132-F137 PolarHBondContact O-N 2.88Å; V133-F137 WeakPolarHBondContact O-CB 3.03Å; V135-F137 VanDerWaalsContact C-N 3.34Å; V135-F137 PolarHBondContact O-N 3.03Å; F137-S141 WeakPolarHBondContact O-CB 3.4Å; F137-S141 PolarHBondContact O-N 2.95Å; F137-S141 PolarHBondContact O-OG 3.44Å; F137-L189 HydrophobicContact CE2-CD2 3.99Å; F137-L189 HydrophobicContact CZ-CD2 4Å; F137-F192 AromaticContact CD2-CD1 3.76Å; F137-F192 HydrophobicContact CD2-CD1 3.76Å; F137-F192 AromaticContact CD2-CE1 3.27Å; F137-F192 HydrophobicContact CD2-CE1 3.27Å; F137-F192 HydrophobicContact CD2-CZ 4.06Å; F137-F192 AromaticContact CE2-CD1 3.66Å; F137-F192 HydrophobicContact CE2-CD1 3.66Å; F137-F192 AromaticContact CE2-CE1 3.64Å; F137-F192 HydrophobicContact CE2-CE1 3.64Å; F137-F192 HydrophobicContact CG-CE1 4.32Å |
| 138 | I | 97 | Very high | 97.2 | Very high | 50 Ų | 50 | 49 Ų | 49 | 26% | 0.256 | 25% | 0.25 | S | C | . | . | I | π-helix | trans | -64.6 | -51.2 | -176.2 | -66.8 | 168.9 | 0 | 0 | 0 | 110.7 | M104 V133 F134 S141 L142 | M104-I138 HydrophobicContact CE-CD1 3.81Å; M104-I138 HydrophobicContact CE-CG1 3.89Å; V133-I138 HydrophobicContact CG1-CD1 4.42Å; V133-I138 WeakPolarHBondContact O-CG1 3.47Å; V133-I138 PolarHBondContact O-N 3Å; F134-I138 HydrophobicContact CD1-CD1 3.78Å; F134-I138 HydrophobicContact CE1-CD1 4.09Å; F134-I138 WeakPolarHBondContact O-CB 3.48Å; I138-S141 PolarHBondContact O-N 2.9Å; I138-L142 HydrophobicContact CG2-CD1 4.11Å; I138-L142 WeakPolarHBondContact O-CG 3.39Å; I138-L142 PolarHBondContact O-N 3.38Å |
| 139 | G | 97.8 | Very high | 97.3 | Very high | 25 Ų | 25 | 52.9 Ų | 52.9 | 26% | 0.258 | 26% | 0.264 | S | S | . | . | I | π-helix | trans | -56.7 | -55 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | F134 V135 S141 L142 L143 | F134-G139 PolarHBondContact O-N 3.28Å; V135-G139 VanDerWaalsContact O-CA 3.3Å; V135-G139 WeakPolarHBondContact O-CA 3.21Å; V135-G139 PolarHBondContact O-N 2.91Å; G139-S141 VanDerWaalsContact C-N 3.31Å; G139-S141 PolarHBondContact O-N 3.06Å; G139-L142 PolarHBondContact O-N 3.26Å; G139-L143 WeakPolarHBondContact O-CG 3.41Å; G139-L143 PolarHBondContact O-N 2.98Å |
| 140 | I | 97.2 | Very high | 97.3 | Very high | 81 Ų | 81 | 56.3 Ų | 56.3 | 42% | 0.415 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.6 | -36.3 | 178.1 | -55.4 | -59.8 | 0 | 0 | 0 | 111.8 | V135 D136 L142 L143 Q144 | V135-I140 PolarHBondContact O-N 3.38Å; V135-I140 VanDerWaalsContact O-N 3.15Å; D136-I140 WeakPolarHBondContact O-CB 3.47Å; D136-I140 WeakPolarHBondContact O-CG1 3.47Å; I140-L142 PolarHBondContact O-N 3.07Å; I140-L143 HydrophobicContact CD1-CD1 4.35Å; I140-L143 PolarHBondContact O-N 3.33Å; I140-Q144 VanDerWaalsContact O-CB 3.23Å; I140-Q144 WeakPolarHBondContact O-CB 3.36Å; I140-Q144 PolarHBondContact O-N 3.28Å |
| 141 | S | 98.2 | Very high | 97.4 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.014 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.5 | -42 | 177.8 | -64.7 | 0 | 0 | 0 | 0 | 112.7 | F137 I138 G139 A145 H188 | F137-S141 WeakPolarHBondContact O-CB 3.4Å; F137-S141 PolarHBondContact O-N 2.95Å; F137-S141 PolarHBondContact O-OG 3.44Å; I138-S141 PolarHBondContact O-N 2.9Å; G139-S141 VanDerWaalsContact C-N 3.31Å; G139-S141 PolarHBondContact O-N 3.06Å; S141-A145 VanDerWaalsContact O-CB 3.23Å; S141-A145 WeakPolarHBondContact O-CB 3.5Å; S141-A145 PolarHBondContact O-N 3.31Å; S141-H188 VanDerWaalsContact CA-CD2 3.42Å; S141-H188 WeakPolarHBondContact CA-CD2 3.49Å; S141-H188 WeakPolarHBondContact CA-NE2 3.47Å; S141-H188 PolarHBondContact OG-CD2 3.42Å; S141-H188 PolarHBondContact OG-NE2 3.19Å |
| 142 | L | 98 | Very high | 97.4 | Very high | 79 Ų | 79 | 49.5 Ų | 49.5 | 41% | 0.414 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.5 | -41.6 | 176.7 | -66.4 | 176.1 | 0 | 0 | 0 | 111.6 | I138 G139 I140 T146 W181 F185 | I138-L142 HydrophobicContact CG2-CD1 4.11Å; I138-L142 WeakPolarHBondContact O-CG 3.39Å; I138-L142 PolarHBondContact O-N 3.38Å; G139-L142 PolarHBondContact O-N 3.26Å; I140-L142 PolarHBondContact O-N 3.07Å; L142-T146 WeakPolarHBondContact O-CB 3.48Å; L142-T146 PolarHBondContact O-N 3.44Å; L142-T146 VanDerWaalsContact O-N 3.09Å; L142-T146 PolarHBondContact O-OG1 2.91Å; L142-W181 HydrophobicContact CD2-CH2 3.55Å; L142-W181 HydrophobicContact CD2-CZ2 3.71Å; L142-F185 HydrophobicContact CD2-CE2 4.32Å |
| 143 | L | 98.3 | Very high | 97.4 | Very high | 119 Ų | 119 | 51.2 Ų | 51.2 | 62% | 0.623 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -61.4 | -47.4 | 175.6 | -72.7 | 175.3 | 0 | 0 | 0 | 111.1 | G139 I140 T146 F147 | G139-L143 WeakPolarHBondContact O-CG 3.41Å; G139-L143 PolarHBondContact O-N 2.98Å; I140-L143 HydrophobicContact CD1-CD1 4.35Å; I140-L143 PolarHBondContact O-N 3.33Å; L143-T146 PolarHBondContact O-N 2.82Å; L143-F147 WeakPolarHBondContact O-CB 3.42Å; L143-F147 PolarHBondContact O-N 3.24Å |
| 144 | Q | 98.2 | Very high | 97.2 | Very high | 50 Ų | 50 | 57.4 Ų | 57.4 | 23% | 0.234 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -73.1 | -35.8 | -174.8 | -166.8 | 65.3 | -40.2 | 0 | 0 | 112.7 | I140 T146 F147 F148 H188 Y232 | I140-Q144 VanDerWaalsContact O-CB 3.23Å; I140-Q144 WeakPolarHBondContact O-CB 3.36Å; I140-Q144 PolarHBondContact O-N 3.28Å; Q144-T146 VanDerWaalsContact C-N 3.32Å; Q144-F147 PolarHBondContact O-N 3.41Å; Q144-F148 VanDerWaalsContact CD-CE2 3.46Å; Q144-F148 HydrophobicContact CG-CD2 3.9Å; Q144-F148 HydrophobicContact CG-CE2 3.78Å; Q144-F148 WeakPolarHBondContact O-CD2 3.5Å; Q144-F148 PolarHBondContact O-N 3.01Å; Q144-H188 VanDerWaalsContact CG-ND1 3.3Å; Q144-H188 WeakPolarHBondContact CG-ND1 3.29Å; Q144-Y232 WeakPolarHBondContact CG-OH 3.24Å; Q144-Y232 PolarHBondContact NE2-OH 3.47Å |
| 145 | A | 98.4 | Very high | 97.2 | Very high | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -58.6 | -45.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | S141 W149 W181 A184 F185 | S141-A145 VanDerWaalsContact O-CB 3.23Å; S141-A145 WeakPolarHBondContact O-CB 3.5Å; S141-A145 PolarHBondContact O-N 3.31Å; A145-W149 WeakPolarHBondContact O-CB 3.38Å; A145-W149 PolarHBondContact O-N 3.15Å; A145-W181 HydrophobicContact CB-CZ2 4.02Å; A145-A184 WeakPolarHBondContact O-CB 3.3Å; A145-F185 HydrophobicContact CB-CB 3.74Å; A145-F185 HydrophobicContact CB-CD2 3.97Å; A145-F185 HydrophobicContact CB-CG 4.37Å |
| 146 | T | 98.4 | Very high | 97.1 | Very high | 53 Ų | 53 | 55.8 Ų | 55.8 | 33% | 0.325 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -66.9 | -43.8 | 179.8 | -55.4 | 0 | 0 | 0 | 0 | 111.6 | L142 L143 Q144 W149 I150 W181 | L142-T146 WeakPolarHBondContact O-CB 3.48Å; L142-T146 PolarHBondContact O-N 3.44Å; L142-T146 VanDerWaalsContact O-N 3.09Å; L142-T146 PolarHBondContact O-OG1 2.91Å; L143-T146 PolarHBondContact O-N 2.82Å; Q144-T146 VanDerWaalsContact C-N 3.32Å; T146-W149 PolarHBondContact O-N 3.42Å; T146-I150 HydrophobicContact CG2-CD1 3.97Å; T146-I150 VanDerWaalsContact O-CG1 3.32Å; T146-I150 WeakPolarHBondContact O-CG1 3.48Å; T146-I150 PolarHBondContact O-N 2.93Å; T146-W181 PolarHBondContact OG1-NE1 3.24Å; T146-W181 VanDerWaalsContact OG1-NE1 3.13Å |
| 147 | F | 98.3 | Very high | 97 | Very high | 105 Ų | 105 | 55.1 Ų | 55.1 | 46% | 0.461 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -56.4 | -56 | 175.7 | 172.4 | -101.6 | 0 | 0 | 0 | 111.3 | L143 Q144 W149 I150 I151 | L143-F147 WeakPolarHBondContact O-CB 3.42Å; L143-F147 PolarHBondContact O-N 3.24Å; Q144-F147 PolarHBondContact O-N 3.41Å; F147-W149 VanDerWaalsContact C-N 3.33Å; F147-W149 PolarHBondContact O-N 2.95Å; F147-I150 PolarHBondContact O-N 3.46Å; F147-I151 HydrophobicContact CD1-CG1 4.48Å; F147-I151 HydrophobicContact CD2-CG1 4.13Å; F147-I151 HydrophobicContact CE1-CG1 4.14Å; F147-I151 HydrophobicContact CE2-CD1 4.13Å; F147-I151 HydrophobicContact CE2-CG1 3.77Å; F147-I151 HydrophobicContact CG-CG1 4.48Å; F147-I151 HydrophobicContact CZ-CD1 4.31Å; F147-I151 HydrophobicContact CZ-CG1 3.78Å; F147-I151 WeakPolarHBondContact O-CB 3.42Å; F147-I151 VanDerWaalsContact O-CG1 3.27Å; F147-I151 WeakPolarHBondContact O-CG1 3.18Å; F147-I151 PolarHBondContact O-N 3.26Å |
| 148 | F | 98.2 | Very high | 96.6 | Very high | 20 Ų | 20 | 55.9 Ų | 55.9 | 9% | 0.088 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -68.8 | -32.2 | -179.5 | -77.4 | -66.1 | 0 | 0 | 0 | 113 | Q144 I151 T152 Y232 T236 Y240 L252 | Q144-F148 VanDerWaalsContact CD-CE2 3.46Å; Q144-F148 HydrophobicContact CG-CD2 3.9Å; Q144-F148 HydrophobicContact CG-CE2 3.78Å; Q144-F148 WeakPolarHBondContact O-CD2 3.5Å; Q144-F148 PolarHBondContact O-N 3.01Å; F148-I151 PolarHBondContact O-N 3.43Å; F148-T152 WeakPolarHBondContact O-CB 3.39Å; F148-T152 WeakPolarHBondContact O-CG2 3.27Å; F148-T152 PolarHBondContact O-N 3.38Å; F148-T152 PolarHBondContact O-OG1 3.44Å; F148-Y232 HydrophobicContact CE2-CE1 4.49Å; F148-T236 HydrophobicContact CD1-CG2 4.41Å; F148-T236 HydrophobicContact CD2-CG2 4.38Å; F148-T236 HydrophobicContact CE1-CG2 4Å; F148-T236 HydrophobicContact CE2-CG2 3.94Å; F148-T236 HydrophobicContact CZ-CG2 3.74Å; F148-Y240 HydrophobicContact CB-CE2 3.98Å; F148-Y240 WeakPolarHBondContact CB-OH 3.42Å; F148-Y240 HydrophobicContact CD1-CE2 4.04Å; F148-Y240 AromaticContact CG-CE2 3.98Å; F148-Y240 HydrophobicContact CG-CE2 3.98Å; F148-L252 HydrophobicContact CD1-CD2 4.12Å; F148-L252 HydrophobicContact CE1-CD2 3.74Å |
| 149 | W | 97.9 | Very high | 95.8 | Very high | 88 Ų | 88 | 57.7 Ų | 57.7 | 33% | 0.333 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | 173.5 | 175.7 | 68.4 | 0 | 0 | 0 | 111.6 | A145 T146 F147 T152 N153 V179 W181 A184 | A145-W149 WeakPolarHBondContact O-CB 3.38Å; A145-W149 PolarHBondContact O-N 3.15Å; T146-W149 PolarHBondContact O-N 3.42Å; F147-W149 VanDerWaalsContact C-N 3.33Å; F147-W149 PolarHBondContact O-N 2.95Å; W149-T152 PolarHBondContact O-OG1 2.85Å; W149-N153 PolarHBondContact NE1-ND2 2.8Å; W149-N153 WeakPolarHBondContact O-CB 3.27Å; W149-N153 PolarHBondContact O-N 3.31Å; W149-N153 VanDerWaalsContact O-N 3.16Å; W149-N153 PolarHBondContact O-ND2 3.39Å; W149-V179 PolarHBondContact NE1-O 2.88Å; W149-W181 HydrophobicContact CD2-CB 4.37Å; W149-W181 HydrophobicContact CG-CB 4.15Å; W149-A184 HydrophobicContact CB-CB 3.93Å |
| 150 | I | 97.9 | Very high | 94.8 | Very high | 91 Ų | 91 | 60 Ų | 60 | 47% | 0.467 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.7 | -53.2 | 175.9 | -67.5 | 167.9 | 0 | 0 | 0 | 110.5 | T146 F147 T152 N153 H154 | T146-I150 HydrophobicContact CG2-CD1 3.97Å; T146-I150 VanDerWaalsContact O-CG1 3.32Å; T146-I150 WeakPolarHBondContact O-CG1 3.48Å; T146-I150 PolarHBondContact O-N 2.93Å; F147-I150 PolarHBondContact O-N 3.46Å; I150-T152 VanDerWaalsContact C-N 3.33Å; I150-T152 PolarHBondContact O-N 2.94Å; I150-N153 PolarHBondContact O-N 3.4Å; I150-H154 WeakPolarHBondContact O-CB 3.23Å; I150-H154 PolarHBondContact O-N 3.35Å |
| 151 | I | 96.8 | Very high | 93.4 | Very high | 39 Ų | 39 | 60.7 Ų | 60.7 | 20% | 0.2 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -59.1 | -44.8 | -176.5 | -68.7 | -63.1 | 0 | 0 | 0 | 111.3 | F147 F148 F155 F156 | F147-I151 HydrophobicContact CD1-CG1 4.48Å; F147-I151 HydrophobicContact CD2-CG1 4.13Å; F147-I151 HydrophobicContact CE1-CG1 4.14Å; F147-I151 HydrophobicContact CE2-CD1 4.13Å; F147-I151 HydrophobicContact CE2-CG1 3.77Å; F147-I151 HydrophobicContact CG-CG1 4.48Å; F147-I151 HydrophobicContact CZ-CD1 4.31Å; F147-I151 HydrophobicContact CZ-CG1 3.78Å; F147-I151 WeakPolarHBondContact O-CB 3.42Å; F147-I151 VanDerWaalsContact O-CG1 3.27Å; F147-I151 WeakPolarHBondContact O-CG1 3.18Å; F147-I151 PolarHBondContact O-N 3.26Å; F148-I151 PolarHBondContact O-N 3.43Å; I151-F155 HydrophobicContact CD1-CD2 4.02Å; I151-F155 HydrophobicContact CD1-CE2 3.77Å; I151-F155 HydrophobicContact CG2-CD2 4.16Å; I151-F155 WeakPolarHBondContact O-CB 3.11Å; I151-F155 WeakPolarHBondContact O-CD2 3.15Å; I151-F155 PolarHBondContact O-N 3.39Å; I151-F156 HydrophobicContact CG2-CE2 3.92Å; I151-F156 HydrophobicContact CG2-CZ 4.49Å |
| 152 | T | 96.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 32% | 0.315 | C | S | . | . | I | π-helix | trans | -71.1 | -43.3 | -175.6 | 56.9 | 0 | 0 | 0 | 0 | 112.5 | F148 W149 I150 H154 F156 V157 V179 Y240 | F148-T152 WeakPolarHBondContact O-CB 3.39Å; F148-T152 WeakPolarHBondContact O-CG2 3.27Å; F148-T152 PolarHBondContact O-N 3.38Å; F148-T152 PolarHBondContact O-OG1 3.44Å; W149-T152 PolarHBondContact O-OG1 2.85Å; I150-T152 VanDerWaalsContact C-N 3.33Å; I150-T152 PolarHBondContact O-N 2.94Å; T152-H154 VanDerWaalsContact C-N 3.33Å; T152-H154 PolarHBondContact O-N 2.86Å; T152-F156 HydrophobicContact CG2-CD2 3.76Å; T152-F156 HydrophobicContact CG2-CE2 4.24Å; T152-F156 WeakPolarHBondContact O-CA 3.3Å; T152-F156 WeakPolarHBondContact O-CB 3.36Å; T152-F156 PolarHBondContact O-N 3.2Å; T152-V157 PolarHBondContact O-N 3.09Å; T152-V179 WeakPolarHBondContact OG1-CG2 3.31Å; T152-Y240 HydrophobicContact CG2-CD1 3.6Å; T152-Y240 HydrophobicContact CG2-CD2 4.26Å; T152-Y240 HydrophobicContact CG2-CE1 3.64Å; T152-Y240 HydrophobicContact CG2-CE2 4.26Å; T152-Y240 HydrophobicContact CG2-CG 3.95Å |
| 153 | N | 96 | Very high | 89.4 | Confident | 40 Ų | 40 | 66.6 Ų | 66.6 | 21% | 0.214 | 33% | 0.328 | C | S | . | . | I | π-helix | trans | -67.1 | -35.2 | 176.6 | -77.1 | -38.4 | 0 | 0 | 0 | 112.7 | W149 I150 V179 | W149-N153 PolarHBondContact NE1-ND2 2.8Å; W149-N153 WeakPolarHBondContact O-CB 3.27Å; W149-N153 PolarHBondContact O-N 3.31Å; W149-N153 VanDerWaalsContact O-N 3.16Å; W149-N153 PolarHBondContact O-ND2 3.39Å; I150-N153 PolarHBondContact O-N 3.4Å; N153-V179 PolarHBondContact ND2-O 3.47Å; N153-V179 VanDerWaalsContact ND2-O 3.14Å; N153-V179 WeakPolarHBondContact OD1-CB 3.39Å; N153-V179 PolarHBondContact OD1-N 3.44Å |
| 154 | H | 94.1 | Very high | 87.2 | Confident | 144 Ų | 144 | 64.3 Ų | 64.3 | 67% | 0.667 | 32% | 0.322 | S | S | * | . | I | π-helix | trans | -80.1 | -42.3 | -178.2 | -166.8 | 73.7 | 0 | 0 | 0 | 113.2 | I150 T152 | I150-H154 WeakPolarHBondContact O-CB 3.23Å; I150-H154 PolarHBondContact O-N 3.35Å; T152-H154 VanDerWaalsContact C-N 3.33Å; T152-H154 PolarHBondContact O-N 2.86Å |
| 155 | F | 94.8 | Very high | 85 | Confident | 130 Ų | 130 | 66.2 Ų | 66.2 | 57% | 0.57 | 33% | 0.331 | S | S | * | . | I | π-helix | trans | -106.5 | -26 | -170.7 | -64.8 | -70.9 | 0 | 0 | 0 | 115.1 | I151 | I151-F155 HydrophobicContact CD1-CD2 4.02Å; I151-F155 HydrophobicContact CD1-CE2 3.77Å; I151-F155 HydrophobicContact CG2-CD2 4.16Å; I151-F155 WeakPolarHBondContact O-CB 3.11Å; I151-F155 WeakPolarHBondContact O-CD2 3.15Å; I151-F155 PolarHBondContact O-N 3.39Å |
| 156 | F | 94.6 | Very high | 82.7 | Confident | 11 Ų | 11 | 70.4 Ų | 70.4 | 5% | 0.048 | 35% | 0.353 | C | S | . | . | I | π-helix | trans | -108.6 | -18 | -170.5 | -60.1 | -45 | 0 | 0 | 0 | 114.4 | I151 T152 D158 L246 K247 R248 V251 L252 | I151-F156 HydrophobicContact CG2-CE2 3.92Å; I151-F156 HydrophobicContact CG2-CZ 4.49Å; T152-F156 HydrophobicContact CG2-CD2 3.76Å; T152-F156 HydrophobicContact CG2-CE2 4.24Å; T152-F156 WeakPolarHBondContact O-CA 3.3Å; T152-F156 WeakPolarHBondContact O-CB 3.36Å; T152-F156 PolarHBondContact O-N 3.2Å; F156-D158 PolarHBondContact O-N 2.63Å; F156-L246 HydrophobicContact CB-CB 4.34Å; F156-L246 HydrophobicContact CB-CD2 3.88Å; F156-L246 HydrophobicContact CB-CG 4.49Å; F156-L246 CarbonylContact O-C 3.56Å; F156-L246 VanDerWaalsContact O-CA 3.31Å; F156-L246 WeakPolarHBondContact O-CA 3.3Å; F156-K247 WeakPolarHBondContact CB-O 3.2Å; F156-K247 VanDerWaalsContact CD1-O 3.27Å; F156-K247 WeakPolarHBondContact CD1-O 3.47Å; F156-K247 WeakPolarHBondContact O-CG 3.48Å; F156-K247 PolarHBondContact O-N 3.19Å; F156-R248 HydrophobicContact CD1-CB 4.5Å; F156-R248 WeakPolarHBondContact CE1-O 3.35Å; F156-V251 HydrophobicContact CE1-CB 4.17Å; F156-V251 HydrophobicContact CZ-CB 4.3Å; F156-V251 HydrophobicContact CZ-CG1 4.4Å; F156-L252 HydrophobicContact CE2-CD1 4.25Å; F156-L252 HydrophobicContact CE2-CD2 3.7Å; F156-L252 HydrophobicContact CE2-CG 3.86Å; F156-L252 HydrophobicContact CZ-CD2 4.06Å; F156-L252 HydrophobicContact CZ-CG 4.08Å |
| 157 | V | 93.6 | Very high | 80.3 | Confident | 28 Ų | 28 | 74.2 Ų | 74.2 | 17% | 0.17 | 37% | 0.372 | C | S | . | . | B | Isolated β-bridge | trans | -64.8 | 128.3 | 177.6 | 170.9 | 0 | 0 | 0 | 0 | 110.5 | T152 P177 F245 L246 | T152-V157 PolarHBondContact O-N 3.09Å; V157-P177 WeakPolarHBondContact CG1-O 3.45Å; V157-F245 HydrophobicContact CG2-CD2 4.28Å; V157-F245 HydrophobicContact CG2-CE2 4.41Å; V157-L246 HydrophobicContact CG2-CD2 3.73Å |
| 158 | D | 87.7 | Confident | 78.2 | Confident | 18 Ų | 18 | 75 Ų | 75 | 10% | 0.096 | 39% | 0.385 | C | S | . | . | trans | -100 | 91.5 | 177.8 | -165.8 | 10.7 | 0 | 0 | 0 | 111.8 | F156 S160 K161 F245 K247 | F156-D158 PolarHBondContact O-N 2.63Å; D158-S160 PolarHBondContact O-N 3.46Å; D158-S160 VanDerWaalsContact O-N 3.08Å; D158-S160 PolarHBondContact OD1-N 2.95Å; D158-S160 PolarHBondContact OD1-OG 2.93Å; D158-S160 PolarHBondContact OD2-OG 3.3Å; D158-K161 HydrophobicContact CB-CD 4.39Å; D158-K161 PolarHBondContact O-N 3.02Å; D158-F245 PolarHBondContact N-O 3.45Å; D158-K247 HydrophobicContact CB-CB 4.26Å; D158-K247 HydrophobicContact CB-CD 3.79Å; D158-K247 HydrophobicContact CB-CG 3.99Å; D158-K247 IonicContact OD1-NZ 2.91Å; D158-K247 PolarHBondContact OD1-NZ 2.82Å | ||
| 159 | S | 80.7 | Confident | 76 | Confident | 88 Ų | 88 | 80 Ų | 80 | 62% | 0.615 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.8 | -18.7 | 178.7 | -45.4 | 0 | 0 | 0 | 0 | 113.6 | S162 R163 | S159-S162 PolarHBondContact O-N 2.93Å; S159-R163 PolarHBondContact O-N 3.19Å |
| 160 | S | 77.4 | Confident | 73.6 | Confident | 75 Ų | 75 | 79.2 Ų | 79.2 | 52% | 0.524 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 178.4 | 69.7 | 0 | 0 | 0 | 0 | 112.7 | D158 S162 R163 | D158-S160 PolarHBondContact O-N 3.46Å; D158-S160 VanDerWaalsContact O-N 3.08Å; D158-S160 PolarHBondContact OD1-N 2.95Å; D158-S160 PolarHBondContact OD1-OG 2.93Å; D158-S160 PolarHBondContact OD2-OG 3.3Å; S160-S162 VanDerWaalsContact C-N 3.31Å; S160-S162 PolarHBondContact O-N 3.45Å; S160-R163 PolarHBondContact O-N 3.2Å |
| 161 | K | 67.1 | Low | 71.4 | Confident | 95 Ų | 95 | 86.1 Ų | 86.1 | 41% | 0.413 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -68.4 | -30 | 176.6 | -67.8 | 178.7 | -178.1 | 174.6 | 0 | 112.8 | D158 S164 P244 | D158-K161 HydrophobicContact CB-CD 4.39Å; D158-K161 PolarHBondContact O-N 3.02Å; K161-S164 PolarHBondContact O-OG 2.76Å; K161-P244 PolarHBondContact NZ-O 3.17Å; K161-P244 VanDerWaalsContact NZ-O 3.12Å |
| 162 | S | 58.5 | Low | 69.2 | Low | 22 Ų | 22 | 92.4 Ų | 92.4 | 15% | 0.154 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -64.6 | -42 | 177.1 | 175.7 | 0 | 0 | 0 | 0 | 111.6 | S159 S160 S164 L166 P177 | S159-S162 PolarHBondContact O-N 2.93Å; S160-S162 VanDerWaalsContact C-N 3.31Å; S160-S162 PolarHBondContact O-N 3.45Å; S162-S164 PolarHBondContact O-N 3.23Å; S162-L166 PolarHBondContact O-N 3.12Å; S162-P177 VanDerWaalsContact OG-CD 3.32Å; S162-P177 WeakPolarHBondContact OG-CD 3.41Å |
| 163 | R | 55.3 | Low | 67.2 | Low | 182 Ų | 182 | 94.5 Ų | 94.5 | 69% | 0.687 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -69 | -34.4 | -179.4 | -163.4 | 177.6 | -62 | -154.4 | 0.2 | 113.4 | S159 S160 Q165 L166 N167 | S159-R163 PolarHBondContact O-N 3.19Å; S160-R163 PolarHBondContact O-N 3.2Å; R163-Q165 PolarHBondContact O-N 2.64Å; R163-L166 PolarHBondContact O-N 3.23Å; R163-N167 PolarHBondContact O-N 2.91Å |
| 164 | S | 51.8 | Low | 65.3 | Low | 72 Ų | 72 | 97.4 Ų | 97.4 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.4 | -32.3 | -179.9 | 56 | 0 | 0 | 0 | 0 | 113.4 | K161 S162 T168 | K161-S164 PolarHBondContact O-OG 2.76Å; S162-S164 PolarHBondContact O-N 3.23Å; S164-T168 PolarHBondContact O-OG1 3.19Å |
| 165 | Q | 50.3 | Low | 63.6 | Low | 89 Ų | 89 | 95.3 Ų | 95.3 | 42% | 0.416 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -75.2 | -33.3 | 175.8 | -72.7 | -162.4 | -90.9 | 0 | 0 | 112.6 | H6 R163 N167 T168 V173 | H6-Q165 PolarHBondContact CE1-NE2 2.96Å; H6-Q165 PolarHBondContact NE2-NE2 3.3Å; R163-Q165 PolarHBondContact O-N 2.64Å; Q165-N167 VanDerWaalsContact C-N 3.28Å; Q165-N167 PolarHBondContact O-N 3.4Å; Q165-T168 PolarHBondContact O-N 2.91Å; Q165-V173 HydrophobicContact CB-CG1 4.39Å |
| 166 | L | 50 | Low | 62.3 | Low | 89 Ų | 89 | 95 Ų | 95 | 47% | 0.466 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.8 | -39 | 177.6 | -172.4 | 76.3 | 0 | 0 | 0 | 112.2 | S162 R163 T168 | S162-L166 PolarHBondContact O-N 3.12Å; R163-L166 PolarHBondContact O-N 3.23Å; L166-T168 VanDerWaalsContact C-N 3.26Å; L166-T168 PolarHBondContact O-N 3.34Å |
| 167 | N | 50 | Low | 61.7 | Low | 133 Ų | 133 | 95.5 Ų | 95.5 | 71% | 0.711 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -14.3 | -176.9 | -70.7 | -4.3 | 0 | 0 | 0 | 114.2 | R163 Q165 | R163-N167 PolarHBondContact O-N 2.91Å; Q165-N167 VanDerWaalsContact C-N 3.28Å; Q165-N167 PolarHBondContact O-N 3.4Å |
| 168 | T | 53.5 | Low | 61.6 | Low | 121 Ų | 121 | 99.2 Ų | 99.2 | 74% | 0.742 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.6 | -20.1 | -171.4 | -31 | 0 | 0 | 0 | 0 | 113.8 | S164 Q165 L166 | S164-T168 PolarHBondContact O-OG1 3.19Å; Q165-T168 PolarHBondContact O-N 2.91Å; L166-T168 VanDerWaalsContact C-N 3.26Å; L166-T168 PolarHBondContact O-N 3.34Å |
| 169 | L | 52.8 | Low | 61.9 | Low | 126 Ų | 126 | 98.4 Ų | 98.4 | 66% | 0.66 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -146.4 | 104.6 | -177.9 | -164.4 | 71.8 | 0 | 0 | 0 | 111 | R171 | L169-R171 PolarHBondContact O-N 3.46Š|
| 170 | G | 47 | Very low | 62.6 | Low | 70 Ų | 70 | 95.3 Ų | 95.3 | 72% | 0.722 | 50% | 0.495 | S | S | * | . | trans | -52.9 | 133.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | F172 | G170-F172 PolarHBondContact O-N 3.15Š| ||
| 171 | R | 51 | Low | 63.5 | Low | 237 Ų | 237 | 96.5 Ų | 96.5 | 89% | 0.894 | 49% | 0.488 | S | S | * | . | S | Bend | trans | 67.8 | 6.7 | 146.4 | -142.3 | 179.5 | 68.5 | 151.1 | -1.4 | 121.3 | L169 | L169-R171 PolarHBondContact O-N 3.46Š|
| 172 | F | 51.5 | Low | 64.9 | Low | 170 Ų | 170 | 93 Ų | 93 | 75% | 0.746 | 48% | 0.48 | S | S | * | . | trans | -123.7 | 8.9 | 168.1 | -116.1 | -84.9 | 0 | 0 | 0 | 115.1 | G170 | G170-F172 PolarHBondContact O-N 3.15Š| ||
| 173 | V | 54.3 | Low | 66.7 | Low | 45 Ų | 45 | 92 Ų | 92 | 27% | 0.273 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -89.5 | 125.6 | -178.9 | -178 | 0 | 0 | 0 | 0 | 109.6 | Q165 T175 | Q165-V173 HydrophobicContact CB-CG1 4.39Å; V173-T175 PolarHBondContact O-N 2.9Å |
| 174 | E | 54.5 | Low | 68.7 | Low | 100 Ų | 100 | 83.3 Ų | 83.3 | 47% | 0.467 | 44% | 0.44 | S | S | . | . | trans | -44.5 | 105.8 | 172 | -158.4 | 161.8 | -155.8 | 0 | 0 | 109.4 | K86 N176 | K86-E174 IonicContact NZ-OE1 3.8Å; K86-E174 IonicContact NZ-OE2 2.86Å; K86-E174 PolarHBondContact NZ-OE2 3.3Å; E174-N176 PolarHBondContact O-N 3.3Å | ||
| 175 | T | 58.5 | Low | 70.9 | Confident | 100 Ų | 100 | 81 Ų | 81 | 61% | 0.613 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -65.3 | -23.4 | -167.9 | 31.8 | 0 | 0 | 0 | 0 | 113.2 | V173 | V173-T175 PolarHBondContact O-N 2.9Š|
| 176 | N | 68.7 | Low | 73.1 | Confident | 124 Ų | 124 | 77 Ų | 77 | 66% | 0.663 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -136.7 | 106.7 | 172.4 | -65.5 | -59.3 | 0 | 0 | 0 | 108.7 | E174 E178 | E174-N176 PolarHBondContact O-N 3.3Å; N176-E178 PolarHBondContact O-N 3.28Å; N176-E178 VanDerWaalsContact O-N 3.17Å |
| 177 | P | 82.1 | Confident | 75.4 | Confident | 22 Ų | 22 | 72.8 Ų | 72.8 | 14% | 0.143 | 38% | 0.38 | C | S | . | . | trans | -68.6 | 115.7 | 176.2 | 27.9 | -33.1 | 0 | 0 | 0 | 109.3 | V157 S162 F245 | V157-P177 WeakPolarHBondContact CG1-O 3.45Å; S162-P177 VanDerWaalsContact OG-CD 3.32Å; S162-P177 WeakPolarHBondContact OG-CD 3.41Å; P177-F245 HydrophobicContact CB-CB 3.83Å; P177-F245 HydrophobicContact CB-CD1 4.1Å; P177-F245 HydrophobicContact CB-CD2 3.87Å; P177-F245 HydrophobicContact CB-CE2 4.43Å; P177-F245 HydrophobicContact CB-CG 3.68Å; P177-F245 HydrophobicContact CG-CB 4.03Å; P177-F245 HydrophobicContact CG-CD2 4.49Å; P177-F245 HydrophobicContact CG-CG 4.36Å | ||
| 178 | E | 90.9 | Very high | 77.7 | Confident | 106 Ų | 106 | 66.7 Ų | 66.7 | 50% | 0.495 | 35% | 0.347 | S | S | . | . | trans | -116.5 | 151.5 | 176.2 | 63.6 | 174.8 | -160.8 | 0 | 0 | 111 | N176 E180 F245 | N176-E178 PolarHBondContact O-N 3.28Å; N176-E178 VanDerWaalsContact O-N 3.17Å; E178-E180 PolarHBondContact O-N 3.42Å; E178-F245 WeakPolarHBondContact O-CZ 3.22Å | ||
| 179 | V | 94.9 | Very high | 79.9 | Confident | 1 Ų | 1 | 61 Ų | 61 | 1% | 0.006 | 31% | 0.312 | C | S | . | . | trans | -73.5 | 120.8 | 165.1 | -176.5 | 0 | 0 | 0 | 0 | 107.6 | W149 T152 N153 Y183 Y240 L243 F245 L246 | W149-V179 PolarHBondContact NE1-O 2.88Å; T152-V179 WeakPolarHBondContact OG1-CG2 3.31Å; N153-V179 PolarHBondContact ND2-O 3.47Å; N153-V179 VanDerWaalsContact ND2-O 3.14Å; N153-V179 WeakPolarHBondContact OD1-CB 3.39Å; N153-V179 PolarHBondContact OD1-N 3.44Å; V179-Y183 HydrophobicContact CG1-CD1 3.95Å; V179-Y240 HydrophobicContact CG1-CE1 4.03Å; V179-L243 HydrophobicContact CG1-CD1 4.21Å; V179-L243 HydrophobicContact CG2-CD1 3.85Å; V179-F245 HydrophobicContact CG2-CE2 3.87Å; V179-F245 HydrophobicContact CG2-CZ 4.29Å; V179-L246 HydrophobicContact CG2-CD1 4.01Å; V179-L246 HydrophobicContact CG2-CD2 3.87Å; V179-L246 HydrophobicContact CG2-CG 4.33Å | ||
| 180 | E | 94.5 | Very high | 82.1 | Confident | 22 Ų | 22 | 55 Ų | 55 | 10% | 0.103 | 28% | 0.281 | C | S | . | . | trans | -65.2 | 133.7 | 173.7 | -62.6 | 172.4 | -150.4 | 0 | 0 | 109.9 | K45 Q91 W92 A93 E178 G182 Y183 A184 | K45-E180 IonicContact NZ-OE2 3.78Å; Q91-E180 VanDerWaalsContact CA-OE1 3.27Å; Q91-E180 WeakPolarHBondContact CA-OE1 3.49Å; W92-E180 PolarHBondContact N-OE1 3.04Å; W92-E180 PolarHBondContact N-OE2 2.66Å; A93-E180 PolarHBondContact N-OE2 3.19Å; E178-E180 PolarHBondContact O-N 3.42Å; E180-G182 PolarHBondContact O-N 3.4Å; E180-Y183 WeakPolarHBondContact O-CA 3.2Å; E180-Y183 WeakPolarHBondContact O-CB 3.09Å; E180-Y183 PolarHBondContact O-N 3.35Å; E180-A184 PolarHBondContact O-N 3.09Å | ||
| 181 | W | 96.2 | Very high | 84.5 | Confident | 100 Ų | 100 | 51.6 Ų | 51.6 | 38% | 0.379 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -56.6 | -39.8 | 176 | 179.8 | 93.7 | 0 | 0 | 0 | 112.1 | L142 A145 T146 W149 Y183 A184 F185 | L142-W181 HydrophobicContact CD2-CH2 3.55Å; L142-W181 HydrophobicContact CD2-CZ2 3.71Å; A145-W181 HydrophobicContact CB-CZ2 4.02Å; T146-W181 PolarHBondContact OG1-NE1 3.24Å; T146-W181 VanDerWaalsContact OG1-NE1 3.13Å; W149-W181 HydrophobicContact CD2-CB 4.37Å; W149-W181 HydrophobicContact CG-CB 4.15Å; W181-Y183 PolarHBondContact O-N 3.21Å; W181-A184 WeakPolarHBondContact O-CB 3.42Å; W181-A184 PolarHBondContact O-N 2.99Å; W181-A184 VanDerWaalsContact O-N 3.11Å; W181-F185 HydrophobicContact CH2-CB 4.36Å; W181-F185 HydrophobicContact CH2-CD2 4.23Å; W181-F185 HydrophobicContact CH2-CG 4.34Å; W181-F185 HydrophobicContact CZ3-CB 4.25Å; W181-F185 HydrophobicContact CZ3-CG 4.47Å; W181-F185 PolarHBondContact O-N 3.09Å |
| 182 | G | 95.8 | Very high | 86.7 | Confident | 23 Ų | 23 | 42.3 Ų | 42.3 | 24% | 0.237 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.6 | -30.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | E180 D186 | E180-G182 PolarHBondContact O-N 3.4Å; G182-D186 PolarHBondContact O-N 2.83Å |
| 183 | Y | 96.5 | Very high | 89 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -72.9 | -40.9 | 172.7 | 177.1 | -95.2 | 0 | 0 | 0 | 111.5 | F82 W92 V179 E180 W181 F185 D186 V187 G239 Y240 T242 L243 | F82-Y183 HydrophobicContact CB-CE2 4.37Å; F82-Y183 AromaticContact CD1-CD2 3.51Å; F82-Y183 HydrophobicContact CD1-CD2 3.51Å; F82-Y183 AromaticContact CD1-CE2 3.27Å; F82-Y183 HydrophobicContact CD1-CE2 3.27Å; F82-Y183 AromaticContact CE1-CD2 3.62Å; F82-Y183 HydrophobicContact CE1-CD2 3.62Å; F82-Y183 AromaticContact CE1-CE2 3.64Å; F82-Y183 HydrophobicContact CE1-CE2 3.64Å; F82-Y183 AromaticContact CG-CE2 3.99Å; F82-Y183 HydrophobicContact CG-CE2 3.99Å; W92-Y183 HydrophobicContact CB-CD2 3.47Å; W92-Y183 VanDerWaalsContact CB-CD2 3.47Å; W92-Y183 HydrophobicContact CB-CE2 4.14Å; W92-Y183 HydrophobicContact CB-CG 3.86Å; W92-Y183 HydrophobicContact CE3-CE2 4.37Å; W92-Y183 HydrophobicContact CG-CD2 4.4Å; V179-Y183 HydrophobicContact CG1-CD1 3.95Å; E180-Y183 WeakPolarHBondContact O-CA 3.2Å; E180-Y183 WeakPolarHBondContact O-CB 3.09Å; E180-Y183 PolarHBondContact O-N 3.35Å; W181-Y183 PolarHBondContact O-N 3.21Å; Y183-F185 VanDerWaalsContact C-N 3.26Å; Y183-F185 PolarHBondContact O-N 3.01Å; Y183-D186 WeakPolarHBondContact O-CB 3.36Å; Y183-D186 PolarHBondContact O-N 3.29Å; Y183-D186 VanDerWaalsContact O-N 3.15Å; Y183-V187 HydrophobicContact CD1-CG2 3.94Å; Y183-V187 HydrophobicContact CE1-CG2 3.46Å; Y183-V187 VanDerWaalsContact CE1-CG2 3.46Å; Y183-V187 HydrophobicContact CE2-CG2 4.23Å; Y183-V187 HydrophobicContact CG-CG2 4.49Å; Y183-V187 WeakPolarHBondContact O-CG2 3.41Å; Y183-V187 PolarHBondContact O-N 3.44Å; Y183-G239 VanDerWaalsContact OH-C 3.27Å; Y183-G239 PolarHBondContact OH-O 2.97Å; Y183-Y240 HydrophobicContact CD1-CE1 4.37Å; Y183-Y240 HydrophobicContact CE1-CD1 4.17Å; Y183-Y240 HydrophobicContact CE1-CE1 4.19Å; Y183-T242 PolarHBondContact OH-OG1 3.46Å; Y183-T242 VanDerWaalsContact OH-OG1 3.04Å; Y183-L243 HydrophobicContact CD1-CD1 3.95Å; Y183-L243 HydrophobicContact CE1-CD1 3.49Å; Y183-L243 VanDerWaalsContact CE1-CD1 3.49Å; Y183-L243 HydrophobicContact CE1-CD2 4.04Å; Y183-L243 HydrophobicContact CE1-CG 3.84Å; Y183-L243 HydrophobicContact CE2-CD2 4.37Å |
| 184 | A | 98.1 | Very high | 91 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60 | -39.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | A145 W149 E180 W181 V187 H188 Y240 | A145-A184 WeakPolarHBondContact O-CB 3.3Å; W149-A184 HydrophobicContact CB-CB 3.93Å; E180-A184 PolarHBondContact O-N 3.09Å; W181-A184 WeakPolarHBondContact O-CB 3.42Å; W181-A184 PolarHBondContact O-N 2.99Å; W181-A184 VanDerWaalsContact O-N 3.11Å; A184-V187 PolarHBondContact O-N 2.96Å; A184-H188 PolarHBondContact O-N 3.37Å; A184-Y240 VanDerWaalsContact CA-OH 3.3Å; A184-Y240 WeakPolarHBondContact CA-OH 3.49Å; A184-Y240 WeakPolarHBondContact CB-OH 3.45Å |
| 185 | F | 98 | Very high | 93.1 | Very high | 24 Ų | 24 | 28.3 Ų | 28.3 | 11% | 0.105 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.7 | -48.6 | 171 | -177.3 | -106.5 | 0 | 0 | 0 | 111.9 | L100 L142 A145 W181 Y183 V187 H188 L189 | L100-F185 HydrophobicContact CD1-CE1 4.49Å; L100-F185 HydrophobicContact CD1-CZ 4.07Å; L100-F185 HydrophobicContact CD2-CZ 4.44Å; L142-F185 HydrophobicContact CD2-CE2 4.32Å; A145-F185 HydrophobicContact CB-CB 3.74Å; A145-F185 HydrophobicContact CB-CD2 3.97Å; A145-F185 HydrophobicContact CB-CG 4.37Å; W181-F185 HydrophobicContact CH2-CB 4.36Å; W181-F185 HydrophobicContact CH2-CD2 4.23Å; W181-F185 HydrophobicContact CH2-CG 4.34Å; W181-F185 HydrophobicContact CZ3-CB 4.25Å; W181-F185 HydrophobicContact CZ3-CG 4.47Å; W181-F185 PolarHBondContact O-N 3.09Å; Y183-F185 VanDerWaalsContact C-N 3.26Å; Y183-F185 PolarHBondContact O-N 3.01Å; F185-V187 VanDerWaalsContact C-N 3.33Å; F185-V187 PolarHBondContact O-N 3.17Å; F185-H188 WeakPolarHBondContact O-CB 3.43Å; F185-H188 PolarHBondContact O-N 2.95Å; F185-H188 VanDerWaalsContact O-N 3.15Å; F185-L189 HydrophobicContact CD1-CD1 3.93Å; F185-L189 HydrophobicContact CD1-CG 4.22Å; F185-L189 HydrophobicContact CE1-CD1 3.45Å; F185-L189 VanDerWaalsContact CE1-CD1 3.45Å; F185-L189 HydrophobicContact CE1-CD2 4.28Å; F185-L189 HydrophobicContact CE1-CG 3.99Å; F185-L189 HydrophobicContact CE2-CD2 4.12Å; F185-L189 HydrophobicContact CE2-CG 4.47Å; F185-L189 HydrophobicContact CZ-CD1 3.88Å; F185-L189 HydrophobicContact CZ-CD2 3.88Å; F185-L189 HydrophobicContact CZ-CG 4.11Å; F185-L189 WeakPolarHBondContact O-CG 3.41Å; F185-L189 PolarHBondContact O-N 2.96Å |
| 186 | D | 97.6 | Very high | 94.9 | Very high | 4 Ų | 4 | 23.6 Ų | 23.6 | 2% | 0.021 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -58.4 | -40.9 | 175.8 | -82.3 | -37 | 0 | 0 | 0 | 113.9 | F82 A93 R94 G182 Y183 H188 L189 N190 | F82-D186 HydrophobicContact CE1-CB 3.95Å; F82-D186 HydrophobicContact CZ-CB 4.01Å; A93-D186 WeakPolarHBondContact CA-OD2 3.28Å; R94-D186 WeakPolarHBondContact CB-OD2 3.35Å; R94-D186 VanDerWaalsContact CD-OD1 3.23Å; R94-D186 WeakPolarHBondContact CD-OD1 3.36Å; R94-D186 WeakPolarHBondContact CG-OD1 3.41Å; R94-D186 WeakPolarHBondContact CG-OD2 3.25Å; R94-D186 IonicContact CZ-OD1 3.73Å; R94-D186 PolarHBondContact N-OD2 3.44Å; R94-D186 IonicContact NE-OD1 3.85Å; R94-D186 IonicContact NH1-OD1 2.87Å; R94-D186 PolarHBondContact NH1-OD1 3.38Å; G182-D186 PolarHBondContact O-N 2.83Å; Y183-D186 WeakPolarHBondContact O-CB 3.36Å; Y183-D186 PolarHBondContact O-N 3.29Å; Y183-D186 VanDerWaalsContact O-N 3.15Å; D186-H188 VanDerWaalsContact C-N 3.34Å; D186-L189 PolarHBondContact O-N 3.27Å; D186-N190 WeakPolarHBondContact O-CB 3.37Å; D186-N190 PolarHBondContact O-N 2.94Å; D186-N190 PolarHBondContact O-ND2 3.35Å; D186-N190 PolarHBondContact O-OD1 3.08Å |
| 187 | V | 98.3 | Very high | 96.3 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -63.9 | -43.1 | 176.9 | 172.8 | 0 | 0 | 0 | 0 | 110.1 | F79 Y183 A184 F185 N190 G191 T236 Y240 | F79-V187 HydrophobicContact CE1-CG2 4.49Å; Y183-V187 HydrophobicContact CD1-CG2 3.94Å; Y183-V187 HydrophobicContact CE1-CG2 3.46Å; Y183-V187 VanDerWaalsContact CE1-CG2 3.46Å; Y183-V187 HydrophobicContact CE2-CG2 4.23Å; Y183-V187 HydrophobicContact CG-CG2 4.49Å; Y183-V187 WeakPolarHBondContact O-CG2 3.41Å; Y183-V187 PolarHBondContact O-N 3.44Å; A184-V187 PolarHBondContact O-N 2.96Å; F185-V187 VanDerWaalsContact C-N 3.33Å; F185-V187 PolarHBondContact O-N 3.17Å; V187-N190 PolarHBondContact O-N 3.4Å; V187-G191 PolarHBondContact O-N 2.91Å; V187-T236 HydrophobicContact CG1-CG2 4.12Å; V187-Y240 HydrophobicContact CB-CE2 4.29Å; V187-Y240 HydrophobicContact CG1-CD2 4.06Å; V187-Y240 HydrophobicContact CG1-CE2 3.62Å; V187-Y240 HydrophobicContact CG2-CE1 4.48Å |
| 188 | H | 98.3 | Very high | 97.1 | Very high | 5 Ų | 5 | 17.5 Ų | 17.5 | 2% | 0.023 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -58.8 | -51.2 | 173.8 | 173.5 | 64.4 | 0 | 0 | 0 | 111.4 | S141 Q144 A184 F185 D186 N190 G191 F192 Y232 | S141-H188 VanDerWaalsContact CA-CD2 3.42Å; S141-H188 WeakPolarHBondContact CA-CD2 3.49Å; S141-H188 WeakPolarHBondContact CA-NE2 3.47Å; S141-H188 PolarHBondContact OG-CD2 3.42Å; S141-H188 PolarHBondContact OG-NE2 3.19Å; Q144-H188 VanDerWaalsContact CG-ND1 3.3Å; Q144-H188 WeakPolarHBondContact CG-ND1 3.29Å; A184-H188 PolarHBondContact O-N 3.37Å; F185-H188 WeakPolarHBondContact O-CB 3.43Å; F185-H188 PolarHBondContact O-N 2.95Å; F185-H188 VanDerWaalsContact O-N 3.15Å; D186-H188 VanDerWaalsContact C-N 3.34Å; H188-N190 VanDerWaalsContact C-N 3.28Å; H188-N190 PolarHBondContact O-N 3.41Å; H188-G191 PolarHBondContact O-N 3.49Å; H188-G191 VanDerWaalsContact O-N 3.14Å; H188-F192 VanDerWaalsContact O-CB 3.23Å; H188-F192 WeakPolarHBondContact O-CB 3.29Å; H188-F192 PolarHBondContact O-N 2.95Å; H188-Y232 AromaticContact CE1-CE2 3.86Å; H188-Y232 AromaticContact ND1-CE2 3.52Å; H188-Y232 AromaticContact ND1-CZ 3.6Å; H188-Y232 PolarHBondContact ND1-OH 3.13Å |
| 189 | L | 98.4 | Very high | 97.4 | Very high | 1 Ų | 1 | 13.4 Ų | 13.4 | 1% | 0.005 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -57.7 | -40.2 | 178.2 | -66.3 | -169 | 0 | 0 | 0 | 112.3 | F99 L100 M103 F137 F185 D186 F192 F193 | F99-L189 HydrophobicContact CD1-CB 4.18Å; F99-L189 HydrophobicContact CD1-CD1 4.25Å; F99-L189 HydrophobicContact CE1-CB 3.85Å; L100-L189 HydrophobicContact CB-CD1 4.34Å; L100-L189 HydrophobicContact CD1-CD1 4.02Å; L100-L189 HydrophobicContact CD1-CD2 4.17Å; M103-L189 HydrophobicContact CE-CB 3.66Å; M103-L189 HydrophobicContact CE-CD1 4.17Å; M103-L189 HydrophobicContact CE-CD2 3.35Å; M103-L189 HydrophobicContact CE-CG 3.87Å; F137-L189 HydrophobicContact CE2-CD2 3.99Å; F137-L189 HydrophobicContact CZ-CD2 4Å; F185-L189 HydrophobicContact CD1-CD1 3.93Å; F185-L189 HydrophobicContact CD1-CG 4.22Å; F185-L189 HydrophobicContact CE1-CD1 3.45Å; F185-L189 VanDerWaalsContact CE1-CD1 3.45Å; F185-L189 HydrophobicContact CE1-CD2 4.28Å; F185-L189 HydrophobicContact CE1-CG 3.99Å; F185-L189 HydrophobicContact CE2-CD2 4.12Å; F185-L189 HydrophobicContact CE2-CG 4.47Å; F185-L189 HydrophobicContact CZ-CD1 3.88Å; F185-L189 HydrophobicContact CZ-CD2 3.88Å; F185-L189 HydrophobicContact CZ-CG 4.11Å; F185-L189 WeakPolarHBondContact O-CG 3.41Å; F185-L189 PolarHBondContact O-N 2.96Å; D186-L189 PolarHBondContact O-N 3.27Å; L189-F192 PolarHBondContact O-N 3.22Å; L189-F193 PolarHBondContact O-N 3.48Å |
| 190 | N | 98.2 | Very high | 97.4 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -66.1 | -40.1 | 177.4 | -72.9 | -15.3 | 0 | 0 | 0 | 112.8 | L71 F79 R94 D186 V187 H188 P194 I235 | L71-N190 HydrophobicContact CD1-CB 4.35Å; L71-N190 WeakPolarHBondContact CD1-O 3.37Å; L71-N190 HydrophobicContact CD2-CB 3.95Å; F79-N190 HydrophobicContact CZ-CB 4.39Å; R94-N190 PolarHBondContact NH1-OD1 2.88Å; R94-N190 PolarHBondContact NH2-OD1 3.44Å; D186-N190 WeakPolarHBondContact O-CB 3.37Å; D186-N190 PolarHBondContact O-N 2.94Å; D186-N190 PolarHBondContact O-ND2 3.35Å; D186-N190 PolarHBondContact O-OD1 3.08Å; V187-N190 PolarHBondContact O-N 3.4Å; H188-N190 VanDerWaalsContact C-N 3.28Å; H188-N190 PolarHBondContact O-N 3.41Å; N190-P194 WeakPolarHBondContact O-CD 3.23Å; N190-I235 HydrophobicContact CB-CG2 3.96Å |
| 191 | G | 98.4 | Very high | 97.4 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -72.2 | -36.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V187 H188 A195 Y232 | V187-G191 PolarHBondContact O-N 2.91Å; H188-G191 PolarHBondContact O-N 3.49Å; H188-G191 VanDerWaalsContact O-N 3.14Å; G191-A195 WeakPolarHBondContact O-CB 3.29Å; G191-Y232 WeakPolarHBondContact O-CD2 3.21Å |
| 192 | F | 98.1 | Very high | 97.5 | Very high | 42 Ų | 42 | 17.7 Ų | 17.7 | 18% | 0.184 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -70.6 | -38 | -177.4 | -174.1 | -111.1 | 0 | 0 | 0 | 112.2 | M103 F137 H188 L189 A195 L196 Y232 | M103-F192 HydrophobicContact CE-CD1 4.39Å; M103-F192 HydrophobicContact SD-CD1 3.87Å; F137-F192 AromaticContact CD2-CD1 3.76Å; F137-F192 HydrophobicContact CD2-CD1 3.76Å; F137-F192 AromaticContact CD2-CE1 3.27Å; F137-F192 HydrophobicContact CD2-CE1 3.27Å; F137-F192 HydrophobicContact CD2-CZ 4.06Å; F137-F192 AromaticContact CE2-CD1 3.66Å; F137-F192 HydrophobicContact CE2-CD1 3.66Å; F137-F192 AromaticContact CE2-CE1 3.64Å; F137-F192 HydrophobicContact CE2-CE1 3.64Å; F137-F192 HydrophobicContact CG-CE1 4.32Å; H188-F192 VanDerWaalsContact O-CB 3.23Å; H188-F192 WeakPolarHBondContact O-CB 3.29Å; H188-F192 PolarHBondContact O-N 2.95Å; L189-F192 PolarHBondContact O-N 3.22Å; F192-A195 CarbonylContact O-C 3.42Å; F192-A195 WeakPolarHBondContact O-CB 3.46Å; F192-A195 PolarHBondContact O-N 2.94Å; F192-A195 VanDerWaalsContact O-N 3.16Å; F192-L196 HydrophobicContact CD1-CB 4.38Å; F192-L196 HydrophobicContact CD1-CD1 4.15Å; F192-L196 HydrophobicContact CE1-CB 4.13Å; F192-L196 HydrophobicContact CE1-CD1 3.46Å; F192-L196 VanDerWaalsContact CE1-CD1 3.46Å; F192-L196 HydrophobicContact CE1-CG 4.31Å; F192-L196 HydrophobicContact CZ-CB 4.29Å; F192-L196 HydrophobicContact CZ-CD1 4.01Å; F192-L196 VanDerWaalsContact O-CB 3.25Å; F192-L196 WeakPolarHBondContact O-CB 3.37Å; F192-L196 PolarHBondContact O-N 3.31Å; F192-Y232 HydrophobicContact CB-CD2 4.49Å; F192-Y232 HydrophobicContact CB-CE2 4.34Å |
| 193 | F | 98.1 | Very high | 97.5 | Very high | 15 Ų | 15 | 16.8 Ų | 16.8 | 7% | 0.066 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -57.6 | -52.2 | -176.4 | 174.5 | -103.7 | 0 | 0 | 0 | 113.9 | M68 L71 F72 F99 M103 F106 L189 A195 L196 C197 | M68-F193 HydrophobicContact CB-CD1 4.09Å; M68-F193 HydrophobicContact CB-CE1 3.42Å; M68-F193 VanDerWaalsContact CB-CE1 3.42Å; M68-F193 HydrophobicContact CB-CE2 4.4Å; M68-F193 HydrophobicContact CB-CZ 3.61Å; M68-F193 HydrophobicContact CE-CD2 4Å; M68-F193 HydrophobicContact CE-CE2 4Å; M68-F193 HydrophobicContact CG-CD1 4.01Å; M68-F193 HydrophobicContact CG-CD2 4.27Å; M68-F193 HydrophobicContact CG-CE1 3.71Å; M68-F193 HydrophobicContact CG-CE2 4Å; M68-F193 HydrophobicContact CG-CG 4.27Å; M68-F193 HydrophobicContact CG-CZ 3.71Å; M68-F193 WeakPolarHBondContact O-CE1 3.31Å; M68-F193 HydrophobicContact SD-CD2 4.28Å; M68-F193 HydrophobicContact SD-CE1 4.44Å; M68-F193 HydrophobicContact SD-CE2 3.74Å; M68-F193 HydrophobicContact SD-CZ 3.83Å; L71-F193 HydrophobicContact CD1-CB 4.26Å; L71-F193 HydrophobicContact CD1-CD1 3.87Å; L71-F193 HydrophobicContact CD1-CG 4.47Å; F72-F193 HydrophobicContact CD2-CE1 4.43Å; F72-F193 HydrophobicContact CE2-CD1 4.2Å; F72-F193 AromaticContact CE2-CE1 3.47Å; F72-F193 HydrophobicContact CE2-CE1 3.47Å; F72-F193 VanDerWaalsContact CE2-CE1 3.47Å; F72-F193 HydrophobicContact CE2-CZ 4.21Å; F72-F193 HydrophobicContact CZ-CD1 4.37Å; F72-F193 AromaticContact CZ-CE1 3.96Å; F72-F193 HydrophobicContact CZ-CE1 3.96Å; F99-F193 HydrophobicContact CE1-CB 4.39Å; F99-F193 HydrophobicContact CZ-CB 3.98Å; F99-F193 HydrophobicContact CZ-CG 4.32Å; M103-F193 HydrophobicContact CG-CD2 4.5Å; M103-F193 HydrophobicContact SD-CB 3.74Å; M103-F193 HydrophobicContact SD-CD2 4.12Å; M103-F193 HydrophobicContact SD-CG 4.44Å; F106-F193 HydrophobicContact CD1-CE2 4.48Å; L189-F193 PolarHBondContact O-N 3.48Å; F193-A195 VanDerWaalsContact C-N 3.34Å; F193-A195 PolarHBondContact O-N 3.31Å; F193-L196 WeakPolarHBondContact O-CB 3.25Å; F193-L196 PolarHBondContact O-N 2.65Å; F193-C197 PolarHBondContact O-N 3.43Å; F193-C197 PolarHBondContact O-SG 3.16Å; F193-C197 VanDerWaalsContact O-SG 3.4Å |
| 194 | P | 98.1 | Very high | 97.4 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -64.1 | -37.5 | 174.4 | -23.7 | 35.3 | 0 | 0 | 0 | 113.3 | L71 F72 N190 L196 C197 I198 Y231 | L71-P194 HydrophobicContact CB-CG 3.87Å; L71-P194 HydrophobicContact CD1-CG 4.44Å; F72-P194 HydrophobicContact CD1-CB 4.37Å; F72-P194 HydrophobicContact CE1-CB 3.71Å; F72-P194 HydrophobicContact CE1-CG 4.32Å; F72-P194 HydrophobicContact CZ-CB 4.17Å; F72-P194 HydrophobicContact CZ-CG 4.5Å; N190-P194 WeakPolarHBondContact O-CD 3.23Å; P194-L196 VanDerWaalsContact C-N 3.3Å; P194-L196 PolarHBondContact O-N 3.36Å; P194-C197 PolarHBondContact O-N 2.84Å; P194-I198 VanDerWaalsContact O-CG1 3.3Å; P194-I198 WeakPolarHBondContact O-CG1 3.33Å; P194-I198 PolarHBondContact O-N 3.48Å; P194-Y231 HydrophobicContact CB-CD1 3.4Å; P194-Y231 HydrophobicContact CB-CE1 3.49Å; P194-Y231 VanDerWaalsContact CB-CE1 3.49Å; P194-Y231 HydrophobicContact CG-CD1 3.94Å; P194-Y231 HydrophobicContact CG-CE1 3.71Å |
| 195 | A | 98.1 | Very high | 97.3 | Very high | 6 Ų | 6 | 23.1 Ų | 23.1 | 5% | 0.05 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.6 | -41 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G191 F192 F193 I198 L199 S228 Y232 | G191-A195 WeakPolarHBondContact O-CB 3.29Å; F192-A195 CarbonylContact O-C 3.42Å; F192-A195 WeakPolarHBondContact O-CB 3.46Å; F192-A195 PolarHBondContact O-N 2.94Å; F192-A195 VanDerWaalsContact O-N 3.16Å; F193-A195 VanDerWaalsContact C-N 3.34Å; F193-A195 PolarHBondContact O-N 3.31Å; A195-I198 PolarHBondContact O-N 2.98Å; A195-L199 WeakPolarHBondContact O-CG 3.37Å; A195-L199 PolarHBondContact O-N 3.17Å; A195-S228 VanDerWaalsContact CA-OG 3.23Å; A195-S228 WeakPolarHBondContact CA-OG 3.42Å; A195-S228 VanDerWaalsContact CB-OG 3.23Å; A195-S228 WeakPolarHBondContact CB-OG 3.42Å; A195-S228 PolarHBondContact O-OG 3.09Å; A195-Y232 HydrophobicContact CB-CD2 4.47Å |
| 196 | L | 96.7 | Very high | 97.2 | Very high | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.005 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.4 | -49.7 | 171.4 | -177.4 | 166.2 | 0 | 0 | 0 | 109.5 | M103 F106 L107 F192 F193 P194 I198 L199 H200 | M103-L196 HydrophobicContact CG-CD1 4.35Å; F106-L196 HydrophobicContact CD1-CD2 3.28Å; F106-L196 HydrophobicContact CE1-CD2 3.27Å; L107-L196 HydrophobicContact CB-CD1 4.21Å; L107-L196 HydrophobicContact CD1-CD1 3.73Å; L107-L196 HydrophobicContact CD1-CG 4.35Å; L107-L196 HydrophobicContact CG-CD1 4.45Å; F192-L196 HydrophobicContact CD1-CB 4.38Å; F192-L196 HydrophobicContact CD1-CD1 4.15Å; F192-L196 HydrophobicContact CE1-CB 4.13Å; F192-L196 HydrophobicContact CE1-CD1 3.46Å; F192-L196 VanDerWaalsContact CE1-CD1 3.46Å; F192-L196 HydrophobicContact CE1-CG 4.31Å; F192-L196 HydrophobicContact CZ-CB 4.29Å; F192-L196 HydrophobicContact CZ-CD1 4.01Å; F192-L196 VanDerWaalsContact O-CB 3.25Å; F192-L196 WeakPolarHBondContact O-CB 3.37Å; F192-L196 PolarHBondContact O-N 3.31Å; F193-L196 WeakPolarHBondContact O-CB 3.25Å; F193-L196 PolarHBondContact O-N 2.65Å; P194-L196 VanDerWaalsContact C-N 3.3Å; P194-L196 PolarHBondContact O-N 3.36Å; L196-I198 VanDerWaalsContact C-N 3.25Å; L196-I198 PolarHBondContact O-N 3.36Å; L196-L199 PolarHBondContact O-N 2.89Å; L196-H200 HydrophobicContact CD2-CB 3.95Å; L196-H200 HydrophobicContact CG-CB 4.28Å; L196-H200 WeakPolarHBondContact O-CA 3.39Å; L196-H200 VanDerWaalsContact O-CB 3.23Å; L196-H200 WeakPolarHBondContact O-CB 3.45Å; L196-H200 PolarHBondContact O-N 2.82Å |
| 197 | C | 97.8 | Very high | 97 | Very high | 10 Ų | 10 | 26 Ų | 26 | 7% | 0.068 | 14% | 0.137 | C | C | . | . | I | π-helix | trans | -58.1 | -37.4 | 177.2 | -66.8 | 0 | 0 | 0 | 0 | 112.7 | F72 F106 F193 P194 L201 L202 | F72-C197 HydrophobicContact CE1-CB 4.25Å; F72-C197 HydrophobicContact CZ-CB 3.73Å; F106-C197 VanDerWaalsContact CE1-SG 3.55Å; F193-C197 PolarHBondContact O-N 3.43Å; F193-C197 PolarHBondContact O-SG 3.16Å; F193-C197 VanDerWaalsContact O-SG 3.4Å; P194-C197 PolarHBondContact O-N 2.84Å; C197-L201 WeakPolarHBondContact O-CA 3.17Å; C197-L201 VanDerWaalsContact O-CB 3.28Å; C197-L201 WeakPolarHBondContact O-CB 3.44Å; C197-L201 PolarHBondContact O-N 3.24Å; C197-L202 PolarHBondContact O-N 3.09Å |
| 198 | I | 98.2 | Very high | 96.8 | Very high | 8 Ų | 8 | 34.7 Ų | 34.7 | 4% | 0.041 | 17% | 0.171 | C | C | . | . | I | π-helix | trans | -65 | -49.3 | 176.2 | -67.7 | 162.9 | 0 | 0 | 0 | 111 | P194 A195 L196 L202 Q203 F224 M227 | P194-I198 VanDerWaalsContact O-CG1 3.3Å; P194-I198 WeakPolarHBondContact O-CG1 3.33Å; P194-I198 PolarHBondContact O-N 3.48Å; A195-I198 PolarHBondContact O-N 2.98Å; L196-I198 VanDerWaalsContact C-N 3.25Å; L196-I198 PolarHBondContact O-N 3.36Å; I198-L202 HydrophobicContact CG1-CD1 4.36Å; I198-Q203 WeakPolarHBondContact O-CB 3.34Å; I198-Q203 PolarHBondContact O-N 2.74Å; I198-F224 HydrophobicContact CG2-CD1 3.84Å; I198-M227 HydrophobicContact CD1-CG 4.14Å; I198-M227 HydrophobicContact CG2-CB 4.45Å; I198-M227 HydrophobicContact CG2-SD 4.5Å |
| 199 | L | 97.4 | Very high | 96.6 | Very high | 20 Ų | 20 | 38 Ų | 38 | 11% | 0.105 | 19% | 0.188 | C | C | . | . | I | π-helix | trans | -81.7 | -30.8 | -175.2 | -68.3 | 175.8 | 0 | 0 | 0 | 114.4 | F114 A195 L196 Q203 F224 W225 S228 | F114-L199 WeakPolarHBondContact CZ-O 3.26Å; A195-L199 WeakPolarHBondContact O-CG 3.37Å; A195-L199 PolarHBondContact O-N 3.17Å; L196-L199 PolarHBondContact O-N 2.89Å; L199-Q203 WeakPolarHBondContact O-CB 3.05Å; L199-Q203 PolarHBondContact O-OE1 3.06Å; L199-F224 HydrophobicContact CD2-CB 4.31Å; L199-W225 HydrophobicContact CD1-CD2 4.32Å; L199-W225 HydrophobicContact CD1-CE3 3.85Å; L199-W225 HydrophobicContact CD1-CH2 4.05Å; L199-W225 HydrophobicContact CD1-CZ2 4.48Å; L199-W225 HydrophobicContact CD1-CZ3 3.71Å; L199-W225 HydrophobicContact CD2-CD2 3.85Å; L199-W225 HydrophobicContact CD2-CE3 4.19Å; L199-W225 HydrophobicContact CD2-CG 4.07Å; L199-S228 WeakPolarHBondContact CD1-OG 3.46Å; L199-S228 WeakPolarHBondContact CG-OG 3.34Å |
| 200 | H | 95.1 | Very high | 96.4 | Very high | 34 Ų | 34 | 38 Ų | 38 | 16% | 0.157 | 19% | 0.188 | C | C | . | . | I | π-helix | trans | -104.2 | -30.7 | -171.8 | -76.5 | 58.2 | 0 | 0 | 0 | 113.4 | T110 F114 L196 L204 | T110-H200 HydrophobicContact CG2-CB 4.07Å; F114-H200 HydrophobicContact CE2-CB 4.3Å; L196-H200 HydrophobicContact CD2-CB 3.95Å; L196-H200 HydrophobicContact CG-CB 4.28Å; L196-H200 WeakPolarHBondContact O-CA 3.39Å; L196-H200 VanDerWaalsContact O-CB 3.23Å; L196-H200 WeakPolarHBondContact O-CB 3.45Å; L196-H200 PolarHBondContact O-N 2.82Å; H200-L204 WeakPolarHBondContact O-CB 3.46Å |
| 201 | L | 95.3 | Very high | 96.2 | Very high | 88 Ų | 88 | 40.4 Ų | 40.4 | 46% | 0.461 | 20% | 0.2 | S | C | . | . | I | π-helix | trans | -102.2 | -54.6 | 179.7 | -177.7 | 70 | 0 | 0 | 0 | 111.3 | F106 C197 P205 | F106-L201 HydrophobicContact CE2-CD2 4.43Å; F106-L201 HydrophobicContact CZ-CB 3.93Å; F106-L201 HydrophobicContact CZ-CD1 4.4Å; F106-L201 HydrophobicContact CZ-CD2 3.88Å; F106-L201 HydrophobicContact CZ-CG 4.28Å; C197-L201 WeakPolarHBondContact O-CA 3.17Å; C197-L201 VanDerWaalsContact O-CB 3.28Å; C197-L201 WeakPolarHBondContact O-CB 3.44Å; C197-L201 PolarHBondContact O-N 3.24Å; L201-P205 VanDerWaalsContact O-CD 3.29Å; L201-P205 WeakPolarHBondContact O-CD 3.42Å |
| 202 | L | 96.3 | Very high | 95.9 | Very high | 91 Ų | 91 | 43.9 Ų | 43.9 | 48% | 0.476 | 22% | 0.217 | S | C | . | . | I | π-helix | trans | -74.4 | -36.3 | -174.8 | -65.4 | 179.5 | 0 | 0 | 0 | 112.9 | C197 I198 P205 F206 F224 | C197-L202 PolarHBondContact O-N 3.09Å; I198-L202 HydrophobicContact CG1-CD1 4.36Å; L202-P205 WeakPolarHBondContact O-CD 3.43Å; L202-F206 WeakPolarHBondContact O-CD2 3.32Å; L202-F206 WeakPolarHBondContact O-CE2 3.49Å; L202-F224 HydrophobicContact CB-CE1 3.93Å |
| 203 | Q | 96.5 | Very high | 95.3 | Very high | 4 Ų | 4 | 48.2 Ų | 48.2 | 2% | 0.019 | 24% | 0.242 | C | C | . | . | S | Bend | trans | -74.8 | -30.2 | 179.3 | -174.4 | 175.2 | 44.8 | 0 | 0 | 113.2 | I198 L199 F206 L207 I210 F224 T274 | I198-Q203 WeakPolarHBondContact O-CB 3.34Å; I198-Q203 PolarHBondContact O-N 2.74Å; L199-Q203 WeakPolarHBondContact O-CB 3.05Å; L199-Q203 PolarHBondContact O-OE1 3.06Å; Q203-F206 CarbonylContact O-C 3.51Å; Q203-F206 WeakPolarHBondContact O-CA 3.34Å; Q203-F206 WeakPolarHBondContact O-CB 3.19Å; Q203-F206 PolarHBondContact O-N 3.31Å; Q203-L207 PolarHBondContact O-N 3.19Å; Q203-I210 HydrophobicContact CG-CD1 3.47Å; Q203-I210 VanDerWaalsContact CG-CD1 3.47Å; Q203-F224 HydrophobicContact CB-CB 4.42Å; Q203-F224 HydrophobicContact CB-CD1 4.14Å; Q203-F224 HydrophobicContact CB-CD2 4.08Å; Q203-F224 HydrophobicContact CB-CE1 4.41Å; Q203-F224 HydrophobicContact CB-CE2 4.34Å; Q203-F224 HydrophobicContact CB-CG 3.97Å; Q203-F224 HydrophobicContact CG-CB 4.3Å; Q203-F224 HydrophobicContact CG-CD2 3.83Å; Q203-F224 HydrophobicContact CG-CE2 4.3Å; Q203-F224 HydrophobicContact CG-CG 4.05Å; Q203-T274 PolarHBondContact NE2-OG1 2.9Å |
| 204 | L | 95.3 | Very high | 95 | Very high | 33 Ų | 33 | 56.3 Ų | 56.3 | 17% | 0.173 | 27% | 0.272 | C | S | . | . | G | 310 helix | trans | -51.9 | -49.1 | -174.3 | -176.9 | 62.8 | 0 | 0 | 0 | 114.5 | F114 H200 F206 L207 | F114-L204 HydrophobicContact CD1-CD1 4.27Å; F114-L204 HydrophobicContact CD2-CD1 3.79Å; F114-L204 HydrophobicContact CE1-CD1 4.3Å; F114-L204 HydrophobicContact CE2-CB 4.23Å; F114-L204 HydrophobicContact CE2-CD1 3.75Å; F114-L204 HydrophobicContact CE2-CG 4.44Å; F114-L204 HydrophobicContact CG-CD1 4.02Å; F114-L204 HydrophobicContact CZ-CB 4.44Å; F114-L204 HydrophobicContact CZ-CD1 4.04Å; H200-L204 WeakPolarHBondContact O-CB 3.46Å; L204-F206 PolarHBondContact O-N 3.4Å; L204-L207 HydrophobicContact CD1-CD2 4.43Å; L204-L207 WeakPolarHBondContact O-CB 3.4Å; L204-L207 PolarHBondContact O-N 2.69Å; L204-L207 VanDerWaalsContact O-N 3.08Å |
| 205 | P | 95.2 | Very high | 94.9 | Very high | 100 Ų | 100 | 61.8 Ų | 61.8 | 65% | 0.649 | 30% | 0.296 | S | S | * | . | G | 310 helix | trans | -65.2 | -20.8 | 177.7 | 25.7 | -35.6 | 0 | 0 | 0 | 113.7 | L201 L202 | L201-P205 VanDerWaalsContact O-CD 3.29Å; L201-P205 WeakPolarHBondContact O-CD 3.42Å; L202-P205 WeakPolarHBondContact O-CD 3.43Å |
| 206 | F | 95.2 | Very high | 94.8 | Very high | 84 Ų | 84 | 66 Ų | 66 | 37% | 0.368 | 32% | 0.317 | S | S | . | . | G | 310 helix | trans | -91.7 | -1.2 | 177.2 | -57.6 | -81.3 | 0 | 0 | 0 | 113 | L202 Q203 L204 Y208 I209 I210 L220 F224 | L202-F206 WeakPolarHBondContact O-CD2 3.32Å; L202-F206 WeakPolarHBondContact O-CE2 3.49Å; Q203-F206 CarbonylContact O-C 3.51Å; Q203-F206 WeakPolarHBondContact O-CA 3.34Å; Q203-F206 WeakPolarHBondContact O-CB 3.19Å; Q203-F206 PolarHBondContact O-N 3.31Å; L204-F206 PolarHBondContact O-N 3.4Å; F206-Y208 VanDerWaalsContact C-N 3.26Å; F206-Y208 PolarHBondContact O-N 2.98Å; F206-I209 PolarHBondContact O-N 3.28Å; F206-I210 HydrophobicContact CB-CD1 3.81Å; F206-I210 HydrophobicContact CB-CG1 4.26Å; F206-I210 WeakPolarHBondContact O-CG1 3.42Å; F206-I210 PolarHBondContact O-N 3.08Å; F206-L220 HydrophobicContact CB-CD2 3.77Å; F206-L220 HydrophobicContact CD1-CD2 3.87Å; F206-L220 HydrophobicContact CG-CD2 3.99Å; F206-F224 HydrophobicContact CB-CE2 4.34Å; F206-F224 AromaticContact CD2-CE2 3.89Å; F206-F224 HydrophobicContact CD2-CE2 3.89Å; F206-F224 AromaticContact CD2-CZ 3.66Å; F206-F224 HydrophobicContact CD2-CZ 3.66Å; F206-F224 AromaticContact CE2-CZ 3.95Å; F206-F224 HydrophobicContact CE2-CZ 3.95Å; F206-F224 HydrophobicContact CG-CE2 4.26Å; F206-F224 HydrophobicContact CG-CZ 4.43Å |
| 207 | L | 94.6 | Very high | 94.8 | Very high | 4 Ų | 4 | 66 Ų | 66 | 2% | 0.021 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -56.7 | -40.9 | -172.4 | -170.9 | 64.4 | 0 | 0 | 0 | 111.8 | F114 C117 Q203 L204 I209 I210 L211 T274 | F114-L207 HydrophobicContact CD1-CD2 3.9Å; F114-L207 HydrophobicContact CE1-CD1 4.1Å; F114-L207 HydrophobicContact CE1-CD2 3.97Å; C117-L207 HydrophobicContact CB-CD2 3.72Å; Q203-L207 PolarHBondContact O-N 3.19Å; L204-L207 HydrophobicContact CD1-CD2 4.43Å; L204-L207 WeakPolarHBondContact O-CB 3.4Å; L204-L207 PolarHBondContact O-N 2.69Å; L204-L207 VanDerWaalsContact O-N 3.08Å; L207-I209 VanDerWaalsContact C-N 3.31Å; L207-I209 PolarHBondContact O-N 3.43Å; L207-I210 PolarHBondContact O-N 2.92Å; L207-L211 HydrophobicContact CD1-CD1 4.06Å; L207-L211 HydrophobicContact CD1-CD2 4.24Å; L207-L211 HydrophobicContact CD1-CG 3.97Å; L207-L211 HydrophobicContact CD2-CD1 4.37Å; L207-L211 HydrophobicContact CG-CD1 3.8Å; L207-L211 HydrophobicContact CG-CG 4.1Å; L207-L211 WeakPolarHBondContact O-CB 3.45Å; L207-L211 VanDerWaalsContact O-CG 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.36Å; L207-L211 PolarHBondContact O-N 3.02Å; L207-T274 HydrophobicContact CD1-CG2 3.63Å |
| 208 | Y | 93.3 | Very high | 94.8 | Very high | 182 Ų | 182 | 67.2 Ų | 67.2 | 71% | 0.714 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -57.3 | -41.3 | 177.1 | 179.8 | -99.6 | 0 | 0 | 0 | 113.1 | F206 Q212 | F206-Y208 VanDerWaalsContact C-N 3.26Å; F206-Y208 PolarHBondContact O-N 2.98Å; Y208-Q212 WeakPolarHBondContact O-CG 3.1Å; Y208-Q212 PolarHBondContact O-NE2 2.95Å; Y208-Q212 VanDerWaalsContact O-NE2 3.13Å |
| 209 | I | 94.5 | Very high | 94.7 | Very high | 75 Ų | 75 | 69.2 Ų | 69.2 | 39% | 0.385 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -73.7 | -41.4 | 178 | -62.2 | 170.2 | 0 | 0 | 0 | 110.2 | F206 L207 L211 Q212 I216 G217 L220 | F206-I209 PolarHBondContact O-N 3.28Å; L207-I209 VanDerWaalsContact C-N 3.31Å; L207-I209 PolarHBondContact O-N 3.43Å; I209-L211 VanDerWaalsContact C-N 3.32Å; I209-L211 PolarHBondContact O-N 2.92Å; I209-Q212 WeakPolarHBondContact O-CB 3.22Å; I209-Q212 PolarHBondContact O-N 3.39Å; I209-I216 HydrophobicContact CG2-CG2 4.43Å; I209-G217 VanDerWaalsContact O-CA 3.3Å; I209-G217 WeakPolarHBondContact O-CA 3.38Å; I209-L220 HydrophobicContact CG2-CD2 4.39Å |
| 210 | I | 95.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.4 | -37.1 | -177.4 | -69 | 168.5 | 0 | 0 | 0 | 111.6 | Q203 F206 L207 Q212 L220 F224 N272 T274 | Q203-I210 HydrophobicContact CG-CD1 3.47Å; Q203-I210 VanDerWaalsContact CG-CD1 3.47Å; F206-I210 HydrophobicContact CB-CD1 3.81Å; F206-I210 HydrophobicContact CB-CG1 4.26Å; F206-I210 WeakPolarHBondContact O-CG1 3.42Å; F206-I210 PolarHBondContact O-N 3.08Å; L207-I210 PolarHBondContact O-N 2.92Å; I210-Q212 VanDerWaalsContact C-N 3.27Å; I210-Q212 PolarHBondContact O-N 3.42Å; I210-L220 HydrophobicContact CD1-CD2 4.39Å; I210-L220 HydrophobicContact CD1-CG 4.37Å; I210-L220 HydrophobicContact CG1-CB 4.25Å; I210-L220 HydrophobicContact CG1-CD2 4Å; I210-L220 HydrophobicContact CG1-CG 4.18Å; I210-F224 HydrophobicContact CD1-CD2 3.97Å; I210-F224 HydrophobicContact CD1-CE2 4.16Å; I210-N272 PolarHBondContact O-ND2 3.44Å; I210-T274 HydrophobicContact CG2-CG2 3.86Å |
| 211 | L | 93.7 | Very high | 94.9 | Very high | 51 Ų | 51 | 69 Ų | 69 | 27% | 0.267 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -9.1 | -179.8 | -64.2 | 179.7 | 0 | 0 | 0 | 113.5 | L207 I209 L275 C278 | L207-L211 HydrophobicContact CD1-CD1 4.06Å; L207-L211 HydrophobicContact CD1-CD2 4.24Å; L207-L211 HydrophobicContact CD1-CG 3.97Å; L207-L211 HydrophobicContact CD2-CD1 4.37Å; L207-L211 HydrophobicContact CG-CD1 3.8Å; L207-L211 HydrophobicContact CG-CG 4.1Å; L207-L211 WeakPolarHBondContact O-CB 3.45Å; L207-L211 VanDerWaalsContact O-CG 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.36Å; L207-L211 PolarHBondContact O-N 3.02Å; I209-L211 VanDerWaalsContact C-N 3.32Å; I209-L211 PolarHBondContact O-N 2.92Å; L211-L275 HydrophobicContact CD2-CB 4.27Å; L211-L275 HydrophobicContact CD2-CD1 3.84Å; L211-C278 HydrophobicContact CD2-CB 4.31Å |
| 212 | Q | 91.5 | Very high | 95 | Very high | 74 Ų | 74 | 64.9 Ų | 64.9 | 35% | 0.346 | 31% | 0.309 | S | S | . | . | S | Bend | trans | -69.4 | 146 | 172.6 | -58 | -54.7 | -38.2 | 0 | 0 | 111.2 | Y208 I209 I210 W214 | Y208-Q212 WeakPolarHBondContact O-CG 3.1Å; Y208-Q212 PolarHBondContact O-NE2 2.95Å; Y208-Q212 VanDerWaalsContact O-NE2 3.13Å; I209-Q212 WeakPolarHBondContact O-CB 3.22Å; I209-Q212 PolarHBondContact O-N 3.39Å; I210-Q212 VanDerWaalsContact C-N 3.27Å; I210-Q212 PolarHBondContact O-N 3.42Å; Q212-W214 PolarHBondContact O-N 3.04Å |
| 213 | N | 86.5 | Confident | 95.1 | Very high | 133 Ų | 133 | 63.2 Ų | 63.2 | 71% | 0.711 | 30% | 0.303 | S | S | * | . | S | Bend | trans | -71.8 | 22.2 | 179.7 | -73 | -39.6 | 0 | 0 | 0 | 114.9 | R218 | N213-R218 PolarHBondContact O-NH1 3.35Š|
| 214 | W | 91.7 | Very high | 95.2 | Very high | 185 Ų | 185 | 64.3 Ų | 64.3 | 70% | 0.701 | 31% | 0.307 | S | S | * | . | S | Bend | trans | -97.5 | 156.2 | -174.6 | -70.4 | 59.1 | 0 | 0 | 0 | 111.6 | Q212 I216 G217 R218 | Q212-W214 PolarHBondContact O-N 3.04Å; W214-I216 HydrophobicContact CB-CG2 4.07Å; W214-I216 PolarHBondContact O-N 3Å; W214-G217 PolarHBondContact O-N 3.27Å; W214-R218 PolarHBondContact O-N 2.88Å; W214-R218 PolarHBondContact O-NH1 3.03Å |
| 215 | F | 96 | Very high | 95.3 | Very high | 114 Ų | 114 | 66.3 Ų | 66.3 | 50% | 0.5 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -57.1 | -39.4 | 176.1 | 175.1 | -104.7 | 0 | 0 | 0 | 112.1 | G217 R218 L219 | F215-G217 PolarHBondContact O-N 2.87Å; F215-R218 PolarHBondContact O-N 2.88Å; F215-L219 HydrophobicContact CE1-CB 4.36Å; F215-L219 HydrophobicContact CE1-CD2 4.01Å; F215-L219 HydrophobicContact CZ-CB 4.41Å; F215-L219 HydrophobicContact CZ-CD1 4.27Å; F215-L219 HydrophobicContact CZ-CD2 4.38Å; F215-L219 WeakPolarHBondContact O-CB 3.1Å; F215-L219 PolarHBondContact O-N 3.15Å |
| 216 | I | 96 | Very high | 95.5 | Very high | 95 Ų | 95 | 63.6 Ų | 63.6 | 49% | 0.487 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.6 | -40.7 | 179.7 | -167.9 | 61.1 | 0 | 0 | 0 | 112.7 | I209 W214 L219 L220 | I209-I216 HydrophobicContact CG2-CG2 4.43Å; W214-I216 HydrophobicContact CB-CG2 4.07Å; W214-I216 PolarHBondContact O-N 3Å; I216-L219 PolarHBondContact O-N 3Å; I216-L220 VanDerWaalsContact O-CB 3.23Å; I216-L220 WeakPolarHBondContact O-CB 3.37Å; I216-L220 PolarHBondContact O-N 2.89Å |
| 217 | G | 95.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | I209 W214 F215 G221 | I209-G217 VanDerWaalsContact O-CA 3.3Å; I209-G217 WeakPolarHBondContact O-CA 3.38Å; W214-G217 PolarHBondContact O-N 3.27Å; F215-G217 PolarHBondContact O-N 2.87Å; G217-G221 PolarHBondContact O-N 2.68Å |
| 218 | R | 96.9 | Very high | 95.8 | Very high | 37 Ų | 37 | 64.5 Ų | 64.5 | 14% | 0.14 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.5 | -47.1 | 174.6 | -61 | -167.1 | -71 | -80 | 0.4 | 112.4 | N213 W214 F215 N222 K270 N272 | N213-R218 PolarHBondContact O-NH1 3.35Å; W214-R218 PolarHBondContact O-N 2.88Å; W214-R218 PolarHBondContact O-NH1 3.03Å; F215-R218 PolarHBondContact O-N 2.88Å; R218-N222 VanDerWaalsContact O-CB 3.23Å; R218-N222 WeakPolarHBondContact O-CB 3.44Å; R218-N222 VanDerWaalsContact O-CG 3.25Å; R218-N222 PolarHBondContact O-N 2.99Å; R218-K270 VanDerWaalsContact CD-O 3.3Å; R218-K270 WeakPolarHBondContact CD-O 3.44Å; R218-N272 HydrophobicContact CG-CB 4.07Å |
| 219 | L | 97.8 | Very high | 96.1 | Very high | 50 Ų | 50 | 59.7 Ų | 59.7 | 26% | 0.262 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -59.3 | -50.5 | 179.3 | -177.9 | 69.3 | 0 | 0 | 0 | 110.3 | F215 I216 T223 Y263 L267 | F215-L219 HydrophobicContact CE1-CB 4.36Å; F215-L219 HydrophobicContact CE1-CD2 4.01Å; F215-L219 HydrophobicContact CZ-CB 4.41Å; F215-L219 HydrophobicContact CZ-CD1 4.27Å; F215-L219 HydrophobicContact CZ-CD2 4.38Å; F215-L219 WeakPolarHBondContact O-CB 3.1Å; F215-L219 PolarHBondContact O-N 3.15Å; I216-L219 PolarHBondContact O-N 3Å; L219-T223 WeakPolarHBondContact O-CB 3.23Å; L219-T223 PolarHBondContact O-N 3.04Å; L219-T223 PolarHBondContact O-OG1 3.04Å; L219-Y263 WeakPolarHBondContact CD1-OH 3.31Å; L219-L267 HydrophobicContact CD1-CD1 3.88Å; L219-L267 HydrophobicContact CD1-CD2 4.21Å |
| 220 | L | 97.3 | Very high | 96.3 | Very high | 50 Ų | 50 | 58.4 Ų | 58.4 | 26% | 0.262 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.8 | -49.9 | -179.2 | -170.6 | 67 | 0 | 0 | 0 | 111.3 | F206 I209 I210 I216 T223 F224 | F206-L220 HydrophobicContact CB-CD2 3.77Å; F206-L220 HydrophobicContact CD1-CD2 3.87Å; F206-L220 HydrophobicContact CG-CD2 3.99Å; I209-L220 HydrophobicContact CG2-CD2 4.39Å; I210-L220 HydrophobicContact CD1-CD2 4.39Å; I210-L220 HydrophobicContact CD1-CG 4.37Å; I210-L220 HydrophobicContact CG1-CB 4.25Å; I210-L220 HydrophobicContact CG1-CD2 4Å; I210-L220 HydrophobicContact CG1-CG 4.18Å; I216-L220 VanDerWaalsContact O-CB 3.23Å; I216-L220 WeakPolarHBondContact O-CB 3.37Å; I216-L220 PolarHBondContact O-N 2.89Å; L220-T223 PolarHBondContact O-N 3.48Å; L220-F224 HydrophobicContact CD1-CE2 4Å; L220-F224 HydrophobicContact CG-CD2 4.26Å; L220-F224 HydrophobicContact CG-CE2 3.88Å; L220-F224 VanDerWaalsContact O-CD2 3.23Å; L220-F224 WeakPolarHBondContact O-CD2 3.49Å; L220-F224 PolarHBondContact O-N 3.22Å; L220-F224 VanDerWaalsContact O-N 3.1Å |
| 221 | G | 97.6 | Very high | 96.4 | Very high | 0 Ų | 0 | 61.1 Ų | 61.1 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.5 | -53.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G217 T223 F224 W225 | G217-G221 PolarHBondContact O-N 2.68Å; G221-T223 PolarHBondContact O-N 3.31Å; G221-F224 WeakPolarHBondContact O-CB 3.47Å; G221-F224 PolarHBondContact O-N 3.41Å; G221-W225 VanDerWaalsContact O-CD1 3.26Å; G221-W225 PolarHBondContact O-N 2.87Å |
| 222 | N | 98.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.8 | -28 | -179.7 | -66.8 | -5.9 | 0 | 0 | 0 | 112.2 | R218 W225 L226 Y263 S266 L267 W271 F273 | R218-N222 VanDerWaalsContact O-CB 3.23Å; R218-N222 WeakPolarHBondContact O-CB 3.44Å; R218-N222 VanDerWaalsContact O-CG 3.25Å; R218-N222 PolarHBondContact O-N 2.99Å; N222-W225 PolarHBondContact O-N 3.48Å; N222-L226 PolarHBondContact O-N 2.96Å; N222-Y263 HydrophobicContact CB-CD2 3.87Å; N222-Y263 HydrophobicContact CB-CE2 3.81Å; N222-S266 PolarHBondContact ND2-OG 3.32Å; N222-L267 HydrophobicContact CB-CD2 4.48Å; N222-W271 PolarHBondContact ND2-O 2.89Å; N222-F273 HydrophobicContact CB-CD2 4.35Å; N222-F273 WeakPolarHBondContact OD1-CD2 3.46Å; N222-F273 PolarHBondContact OD1-N 3.38Å; N222-F273 VanDerWaalsContact OD1-N 3.15Å |
| 223 | T | 98.4 | Very high | 97 | Very high | 57 Ų | 57 | 56.8 Ų | 56.8 | 35% | 0.35 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -69.4 | -40.1 | 175.5 | -60.1 | 0 | 0 | 0 | 0 | 111.2 | L219 L220 G221 W225 L226 M227 Y263 | L219-T223 WeakPolarHBondContact O-CB 3.23Å; L219-T223 PolarHBondContact O-N 3.04Å; L219-T223 PolarHBondContact O-OG1 3.04Å; L220-T223 PolarHBondContact O-N 3.48Å; G221-T223 PolarHBondContact O-N 3.31Å; T223-W225 VanDerWaalsContact C-N 3.31Å; T223-W225 PolarHBondContact O-N 3.29Å; T223-L226 PolarHBondContact O-N 3.18Å; T223-M227 VanDerWaalsContact O-CB 3.27Å; T223-M227 WeakPolarHBondContact O-CB 3.09Å; T223-M227 PolarHBondContact O-N 3.48Å; T223-Y263 PolarHBondContact OG1-OH 3.11Å |
| 224 | F | 98.4 | Very high | 97.6 | Very high | 26 Ų | 26 | 54.6 Ų | 54.6 | 11% | 0.114 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.8 | -42.5 | 171.1 | -81.3 | -68.3 | 0 | 0 | 0 | 111.9 | I198 L199 L202 Q203 F206 I210 L220 G221 M227 S228 | I198-F224 HydrophobicContact CG2-CD1 3.84Å; L199-F224 HydrophobicContact CD2-CB 4.31Å; L202-F224 HydrophobicContact CB-CE1 3.93Å; Q203-F224 HydrophobicContact CB-CB 4.42Å; Q203-F224 HydrophobicContact CB-CD1 4.14Å; Q203-F224 HydrophobicContact CB-CD2 4.08Å; Q203-F224 HydrophobicContact CB-CE1 4.41Å; Q203-F224 HydrophobicContact CB-CE2 4.34Å; Q203-F224 HydrophobicContact CB-CG 3.97Å; Q203-F224 HydrophobicContact CG-CB 4.3Å; Q203-F224 HydrophobicContact CG-CD2 3.83Å; Q203-F224 HydrophobicContact CG-CE2 4.3Å; Q203-F224 HydrophobicContact CG-CG 4.05Å; F206-F224 HydrophobicContact CB-CE2 4.34Å; F206-F224 AromaticContact CD2-CE2 3.89Å; F206-F224 HydrophobicContact CD2-CE2 3.89Å; F206-F224 AromaticContact CD2-CZ 3.66Å; F206-F224 HydrophobicContact CD2-CZ 3.66Å; F206-F224 AromaticContact CE2-CZ 3.95Å; F206-F224 HydrophobicContact CE2-CZ 3.95Å; F206-F224 HydrophobicContact CG-CE2 4.26Å; F206-F224 HydrophobicContact CG-CZ 4.43Å; I210-F224 HydrophobicContact CD1-CD2 3.97Å; I210-F224 HydrophobicContact CD1-CE2 4.16Å; L220-F224 HydrophobicContact CD1-CE2 4Å; L220-F224 HydrophobicContact CG-CD2 4.26Å; L220-F224 HydrophobicContact CG-CE2 3.88Å; L220-F224 VanDerWaalsContact O-CD2 3.23Å; L220-F224 WeakPolarHBondContact O-CD2 3.49Å; L220-F224 PolarHBondContact O-N 3.22Å; L220-F224 VanDerWaalsContact O-N 3.1Å; G221-F224 WeakPolarHBondContact O-CB 3.47Å; G221-F224 PolarHBondContact O-N 3.41Å; F224-M227 PolarHBondContact O-N 2.84Å; F224-S228 WeakPolarHBondContact O-CB 3.35Å; F224-S228 PolarHBondContact O-N 3.08Å |
| 225 | W | 98.4 | Very high | 97.9 | Very high | 76 Ų | 76 | 45.8 Ų | 45.8 | 29% | 0.288 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -62.9 | -47.1 | 175.2 | -79.2 | 98.9 | 0 | 0 | 0 | 112.9 | L199 G221 N222 T223 M227 S228 F229 F273 T274 L277 | L199-W225 HydrophobicContact CD1-CD2 4.32Å; L199-W225 HydrophobicContact CD1-CE3 3.85Å; L199-W225 HydrophobicContact CD1-CH2 4.05Å; L199-W225 HydrophobicContact CD1-CZ2 4.48Å; L199-W225 HydrophobicContact CD1-CZ3 3.71Å; L199-W225 HydrophobicContact CD2-CD2 3.85Å; L199-W225 HydrophobicContact CD2-CE3 4.19Å; L199-W225 HydrophobicContact CD2-CG 4.07Å; G221-W225 VanDerWaalsContact O-CD1 3.26Å; G221-W225 PolarHBondContact O-N 2.87Å; N222-W225 PolarHBondContact O-N 3.48Å; T223-W225 VanDerWaalsContact C-N 3.31Å; T223-W225 PolarHBondContact O-N 3.29Å; W225-M227 PolarHBondContact O-N 3.26Å; W225-S228 PolarHBondContact O-N 3.46Å; W225-F229 VanDerWaalsContact O-CB 3.31Å; W225-F229 WeakPolarHBondContact O-CB 3.36Å; W225-F229 PolarHBondContact O-N 3.08Å; W225-F273 HydrophobicContact CB-CD2 4.28Å; W225-F273 HydrophobicContact CD2-CB 4.07Å; W225-F273 HydrophobicContact CG-CB 3.86Å; W225-F273 HydrophobicContact CG-CD2 4.34Å; W225-F273 HydrophobicContact CG-CG 4.45Å; W225-T274 PolarHBondContact NE1-OG1 3.43Å; W225-L277 HydrophobicContact CH2-CD2 4.01Å; W225-L277 HydrophobicContact CZ2-CD2 3.78Å |
| 226 | L | 98.6 | Very high | 98 | Very high | 42 Ų | 42 | 40.4 Ų | 40.4 | 22% | 0.22 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.9 | -44.6 | 176.9 | 179.6 | 63.1 | 0 | 0 | 0 | 111.5 | N222 T223 T230 A259 Y263 | N222-L226 PolarHBondContact O-N 2.96Å; T223-L226 PolarHBondContact O-N 3.18Å; L226-T230 VanDerWaalsContact O-CB 3.22Å; L226-T230 WeakPolarHBondContact O-CB 3.37Å; L226-T230 PolarHBondContact O-N 3.28Å; L226-T230 PolarHBondContact O-OG1 2.95Å; L226-A259 HydrophobicContact CD1-CB 4.1Å; L226-Y263 HydrophobicContact CB-CD2 3.99Å; L226-Y263 HydrophobicContact CB-CE2 4.5Å; L226-Y263 HydrophobicContact CB-CG 4.44Å; L226-Y263 HydrophobicContact CD2-CD1 3.98Å; L226-Y263 HydrophobicContact CD2-CD2 3.98Å; L226-Y263 HydrophobicContact CD2-CE1 4.35Å; L226-Y263 HydrophobicContact CD2-CE2 4.35Å; L226-Y263 HydrophobicContact CD2-CG 3.77Å |
| 227 | M | 98.5 | Very high | 98.1 | Very high | 102 Ų | 102 | 36.6 Ų | 36.6 | 50% | 0.502 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62.5 | -46.9 | 178.8 | -172.1 | -178.5 | -178 | 0 | 0 | 111.2 | I198 T223 F224 W225 T230 Y231 | I198-M227 HydrophobicContact CD1-CG 4.14Å; I198-M227 HydrophobicContact CG2-CB 4.45Å; I198-M227 HydrophobicContact CG2-SD 4.5Å; T223-M227 VanDerWaalsContact O-CB 3.27Å; T223-M227 WeakPolarHBondContact O-CB 3.09Å; T223-M227 PolarHBondContact O-N 3.48Å; F224-M227 PolarHBondContact O-N 2.84Å; W225-M227 PolarHBondContact O-N 3.26Å; M227-T230 PolarHBondContact O-N 3.36Å; M227-Y231 WeakPolarHBondContact O-CB 3.29Å; M227-Y231 PolarHBondContact O-N 3.43Å |
| 228 | S | 98.6 | Very high | 98.2 | Very high | 6 Ų | 6 | 37.1 Ų | 37.1 | 4% | 0.042 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.7 | -51.2 | 177.3 | 178.9 | 0 | 0 | 0 | 0 | 111.8 | A195 L199 F224 W225 T230 Y231 Y232 | A195-S228 VanDerWaalsContact CA-OG 3.23Å; A195-S228 WeakPolarHBondContact CA-OG 3.42Å; A195-S228 VanDerWaalsContact CB-OG 3.23Å; A195-S228 WeakPolarHBondContact CB-OG 3.42Å; A195-S228 PolarHBondContact O-OG 3.09Å; L199-S228 WeakPolarHBondContact CD1-OG 3.46Å; L199-S228 WeakPolarHBondContact CG-OG 3.34Å; F224-S228 WeakPolarHBondContact O-CB 3.35Å; F224-S228 PolarHBondContact O-N 3.08Å; W225-S228 PolarHBondContact O-N 3.46Å; S228-T230 PolarHBondContact O-N 3.09Å; S228-Y231 PolarHBondContact O-N 3.47Å; S228-Y232 WeakPolarHBondContact O-CB 3.28Å; S228-Y232 PolarHBondContact O-N 3.43Å |
| 229 | F | 98.6 | Very high | 98.2 | Very high | 80 Ų | 80 | 35.3 Ų | 35.3 | 35% | 0.351 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -62.3 | -41.9 | 178.8 | -177.4 | -89.7 | 0 | 0 | 0 | 112.6 | W225 T233 P255 A259 | W225-F229 VanDerWaalsContact O-CB 3.31Å; W225-F229 WeakPolarHBondContact O-CB 3.36Å; W225-F229 PolarHBondContact O-N 3.08Å; F229-T233 WeakPolarHBondContact O-CB 3.41Å; F229-T233 PolarHBondContact O-N 3.42Å; F229-T233 PolarHBondContact O-OG1 3.47Å; F229-P255 HydrophobicContact CE1-CB 3.97Å; F229-P255 WeakPolarHBondContact CE1-O 3.43Å; F229-P255 HydrophobicContact CZ-CB 3.71Å; F229-A259 HydrophobicContact CD1-CB 3.4Å; F229-A259 VanDerWaalsContact CD1-CB 3.4Å; F229-A259 HydrophobicContact CE1-CB 3.5Å; F229-A259 HydrophobicContact CG-CB 4.28Å; F229-A259 HydrophobicContact CZ-CB 4.42Å |
| 230 | T | 98.7 | Very high | 98.2 | Very high | 49 Ų | 49 | 33 Ų | 33 | 30% | 0.301 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -62.2 | -45.9 | 177.7 | -60.6 | 0 | 0 | 0 | 0 | 110.8 | L226 M227 S228 T233 Y234 V256 | L226-T230 VanDerWaalsContact O-CB 3.22Å; L226-T230 WeakPolarHBondContact O-CB 3.37Å; L226-T230 PolarHBondContact O-N 3.28Å; L226-T230 PolarHBondContact O-OG1 2.95Å; M227-T230 PolarHBondContact O-N 3.36Å; S228-T230 PolarHBondContact O-N 3.09Å; T230-T233 PolarHBondContact O-N 3.43Å; T230-Y234 WeakPolarHBondContact O-CB 3.15Å; T230-Y234 PolarHBondContact O-N 3.17Å; T230-V256 HydrophobicContact CG2-CG1 3.91Å |
| 231 | Y | 98.4 | Very high | 98.1 | Very high | 57 Ų | 57 | 38 Ų | 38 | 22% | 0.224 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -68.6 | -43.3 | -179.6 | -152.5 | -92.1 | 0 | 0 | 0 | 111.9 | L71 P194 M227 S228 T233 Y234 I235 | L71-Y231 PolarHBondContact O-OH 3.1Å; P194-Y231 HydrophobicContact CB-CD1 3.4Å; P194-Y231 HydrophobicContact CB-CE1 3.49Å; P194-Y231 VanDerWaalsContact CB-CE1 3.49Å; P194-Y231 HydrophobicContact CG-CD1 3.94Å; P194-Y231 HydrophobicContact CG-CE1 3.71Å; M227-Y231 WeakPolarHBondContact O-CB 3.29Å; M227-Y231 PolarHBondContact O-N 3.43Å; S228-Y231 PolarHBondContact O-N 3.47Å; Y231-T233 VanDerWaalsContact C-N 3.28Å; Y231-T233 PolarHBondContact O-N 3.46Å; Y231-Y234 PolarHBondContact O-N 3.14Å; Y231-I235 HydrophobicContact CD1-CD1 4.38Å; Y231-I235 HydrophobicContact CD1-CG1 3.77Å; Y231-I235 HydrophobicContact CE1-CD1 3.83Å; Y231-I235 HydrophobicContact CE1-CG1 3.72Å; Y231-I235 WeakPolarHBondContact O-CG1 3.4Å; Y231-I235 PolarHBondContact O-N 3.46Å |
| 232 | Y | 98.7 | Very high | 97.9 | Very high | 25 Ų | 25 | 39.6 Ų | 39.6 | 10% | 0.098 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -51.6 | -49.5 | 171.6 | 174.8 | -89.6 | 0 | 0 | 0 | 111.4 | Q144 F148 H188 G191 F192 A195 S228 I235 T236 | Q144-Y232 WeakPolarHBondContact CG-OH 3.24Å; Q144-Y232 PolarHBondContact NE2-OH 3.47Å; F148-Y232 HydrophobicContact CE2-CE1 4.49Å; H188-Y232 AromaticContact CE1-CE2 3.86Å; H188-Y232 AromaticContact ND1-CE2 3.52Å; H188-Y232 AromaticContact ND1-CZ 3.6Å; H188-Y232 PolarHBondContact ND1-OH 3.13Å; G191-Y232 WeakPolarHBondContact O-CD2 3.21Å; F192-Y232 HydrophobicContact CB-CD2 4.49Å; F192-Y232 HydrophobicContact CB-CE2 4.34Å; A195-Y232 HydrophobicContact CB-CD2 4.47Å; S228-Y232 WeakPolarHBondContact O-CB 3.28Å; S228-Y232 PolarHBondContact O-N 3.43Å; Y232-I235 PolarHBondContact O-N 2.93Å; Y232-T236 WeakPolarHBondContact O-CB 3.36Å; Y232-T236 PolarHBondContact O-N 3.02Å; Y232-T236 PolarHBondContact O-OG1 3.2Å |
| 233 | T | 98.5 | Very high | 97.7 | Very high | 8 Ų | 8 | 39.7 Ų | 39.7 | 5% | 0.049 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -66.5 | -40.9 | -178.1 | -55 | 0 | 0 | 0 | 0 | 111.6 | F229 T230 Y231 T236 F237 L252 V256 | F229-T233 WeakPolarHBondContact O-CB 3.41Å; F229-T233 PolarHBondContact O-N 3.42Å; F229-T233 PolarHBondContact O-OG1 3.47Å; T230-T233 PolarHBondContact O-N 3.43Å; Y231-T233 VanDerWaalsContact C-N 3.28Å; Y231-T233 PolarHBondContact O-N 3.46Å; T233-T236 PolarHBondContact O-N 3.31Å; T233-F237 WeakPolarHBondContact O-CB 3.23Å; T233-F237 PolarHBondContact O-N 3.49Å; T233-L252 WeakPolarHBondContact CG2-O 3.33Å; T233-V256 HydrophobicContact CG2-CG2 3.57Å |
| 234 | Y | 98.3 | Very high | 97.3 | Very high | 87 Ų | 87 | 41.2 Ų | 41.2 | 34% | 0.341 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61.6 | -46.9 | 175.8 | 171.1 | -110.8 | 0 | 0 | 0 | 112.6 | P75 T230 Y231 T236 F237 L238 | P75-Y234 HydrophobicContact CG-CE1 4.07Å; T230-Y234 WeakPolarHBondContact O-CB 3.15Å; T230-Y234 PolarHBondContact O-N 3.17Å; Y231-Y234 PolarHBondContact O-N 3.14Å; Y234-T236 VanDerWaalsContact C-N 3.33Å; Y234-F237 HydrophobicContact CD2-CD1 4.41Å; Y234-F237 WeakPolarHBondContact O-CB 3.4Å; Y234-F237 PolarHBondContact O-N 3.48Å; Y234-L238 WeakPolarHBondContact O-CB 3.36Å; Y234-L238 PolarHBondContact O-N 2.95Å |
| 235 | I | 98.4 | Very high | 97 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.1 | -39.2 | 178.4 | -62.3 | -64.6 | 0 | 0 | 0 | 110.9 | L71 P75 F79 N190 Y231 Y232 L238 G239 | L71-I235 HydrophobicContact CD2-CD1 4.48Å; L71-I235 HydrophobicContact CD2-CG2 4.14Å; P75-I235 HydrophobicContact CB-CD1 3.36Å; P75-I235 HydrophobicContact CG-CD1 3.67Å; F79-I235 HydrophobicContact CE2-CG2 4.06Å; F79-I235 HydrophobicContact CZ-CG2 3.83Å; F79-I235 WeakPolarHBondContact CZ-O 3.46Å; N190-I235 HydrophobicContact CB-CG2 3.96Å; Y231-I235 HydrophobicContact CD1-CD1 4.38Å; Y231-I235 HydrophobicContact CD1-CG1 3.77Å; Y231-I235 HydrophobicContact CE1-CD1 3.83Å; Y231-I235 HydrophobicContact CE1-CG1 3.72Å; Y231-I235 WeakPolarHBondContact O-CG1 3.4Å; Y231-I235 PolarHBondContact O-N 3.46Å; Y232-I235 PolarHBondContact O-N 2.93Å; I235-L238 PolarHBondContact O-N 3.26Å; I235-G239 PolarHBondContact O-N 2.75Å |
| 236 | T | 98.3 | Very high | 96.8 | Very high | 2 Ų | 2 | 38 Ų | 38 | 1% | 0.012 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.2 | -49.3 | 174.8 | -60.1 | 0 | 0 | 0 | 0 | 110.9 | F148 V187 Y232 T233 Y234 L238 G239 Y240 | F148-T236 HydrophobicContact CD1-CG2 4.41Å; F148-T236 HydrophobicContact CD2-CG2 4.38Å; F148-T236 HydrophobicContact CE1-CG2 4Å; F148-T236 HydrophobicContact CE2-CG2 3.94Å; F148-T236 HydrophobicContact CZ-CG2 3.74Å; V187-T236 HydrophobicContact CG1-CG2 4.12Å; Y232-T236 WeakPolarHBondContact O-CB 3.36Å; Y232-T236 PolarHBondContact O-N 3.02Å; Y232-T236 PolarHBondContact O-OG1 3.2Å; T233-T236 PolarHBondContact O-N 3.31Å; Y234-T236 VanDerWaalsContact C-N 3.33Å; T236-L238 PolarHBondContact O-N 3.27Å; T236-G239 PolarHBondContact O-N 3.11Å; T236-Y240 HydrophobicContact CG2-CD2 3.92Å; T236-Y240 HydrophobicContact CG2-CE2 3.67Å; T236-Y240 WeakPolarHBondContact O-CD2 3.39Å; T236-Y240 PolarHBondContact O-N 2.96Å |
| 237 | F | 98 | Very high | 96.5 | Very high | 14 Ų | 14 | 40.5 Ų | 40.5 | 6% | 0.061 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -56.7 | -47.8 | 174 | 158.6 | -108.1 | 0 | 0 | 0 | 111.9 | T233 Y234 G239 Y240 R241 T249 T250 L252 L253 | T233-F237 WeakPolarHBondContact O-CB 3.23Å; T233-F237 PolarHBondContact O-N 3.49Å; Y234-F237 HydrophobicContact CD2-CD1 4.41Å; Y234-F237 WeakPolarHBondContact O-CB 3.4Å; Y234-F237 PolarHBondContact O-N 3.48Å; F237-G239 VanDerWaalsContact C-N 3.29Å; F237-G239 PolarHBondContact O-N 3.45Å; F237-Y240 PolarHBondContact O-N 2.91Å; F237-R241 HydrophobicContact CE2-CB 4.22Å; F237-R241 HydrophobicContact CZ-CB 4.46Å; F237-R241 HydrophobicContact CZ-CG 4.49Å; F237-R241 VanDerWaalsContact O-CB 3.26Å; F237-R241 WeakPolarHBondContact O-CB 3.35Å; F237-R241 PolarHBondContact O-N 3.47Å; F237-T249 WeakPolarHBondContact CD2-O 3.3Å; F237-T250 HydrophobicContact CE2-CG2 4.01Å; F237-T250 HydrophobicContact CZ-CG2 4.34Å; F237-L252 HydrophobicContact CB-CB 4.34Å; F237-L253 HydrophobicContact CB-CD2 3.72Å; F237-L253 HydrophobicContact CB-CG 4.03Å; F237-L253 HydrophobicContact CD1-CD1 3.99Å; F237-L253 HydrophobicContact CD1-CD2 3.97Å; F237-L253 HydrophobicContact CD1-CG 4.16Å; F237-L253 HydrophobicContact CD2-CD1 4.22Å; F237-L253 HydrophobicContact CD2-CG 4.12Å; F237-L253 HydrophobicContact CE1-CD1 4.04Å; F237-L253 HydrophobicContact CE2-CD1 4.28Å; F237-L253 HydrophobicContact CG-CD1 4.06Å; F237-L253 HydrophobicContact CG-CD2 3.85Å; F237-L253 HydrophobicContact CG-CG 3.83Å; F237-L253 HydrophobicContact CZ-CD1 4.15Å |
| 238 | L | 97.5 | Very high | 96.3 | Very high | 11 Ų | 11 | 45 Ų | 45 | 6% | 0.058 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.9 | -39.5 | -178.1 | -175.6 | 60.4 | 0 | 0 | 0 | 111.4 | P75 Q76 F79 Y234 I235 T236 T242 | P75-L238 HydrophobicContact CB-CD2 3.9Å; P75-L238 HydrophobicContact CG-CD2 3.96Å; Q76-L238 HydrophobicContact CG-CD1 4.17Å; Q76-L238 HydrophobicContact CG-CD2 3.89Å; F79-L238 HydrophobicContact CD2-CB 4.15Å; F79-L238 HydrophobicContact CD2-CD2 3.58Å; F79-L238 HydrophobicContact CD2-CG 3.49Å; F79-L238 VanDerWaalsContact CD2-CG 3.49Å; F79-L238 HydrophobicContact CE2-CB 3.87Å; F79-L238 HydrophobicContact CE2-CD2 3.76Å; F79-L238 HydrophobicContact CE2-CG 3.72Å; F79-L238 HydrophobicContact CG-CG 4.41Å; Y234-L238 WeakPolarHBondContact O-CB 3.36Å; Y234-L238 PolarHBondContact O-N 2.95Å; I235-L238 PolarHBondContact O-N 3.26Å; T236-L238 PolarHBondContact O-N 3.27Å; L238-T242 WeakPolarHBondContact O-CG2 3.42Å; L238-T242 PolarHBondContact O-N 3.38Å |
| 239 | G | 97.6 | Very high | 96.2 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -55.2 | -65.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | F79 Y183 I235 T236 F237 R241 T242 | F79-G239 VanDerWaalsContact CZ-CA 3.49Å; Y183-G239 VanDerWaalsContact OH-C 3.27Å; Y183-G239 PolarHBondContact OH-O 2.97Å; I235-G239 PolarHBondContact O-N 2.75Å; T236-G239 PolarHBondContact O-N 3.11Å; F237-G239 VanDerWaalsContact C-N 3.29Å; F237-G239 PolarHBondContact O-N 3.45Å; G239-R241 VanDerWaalsContact C-N 3.26Å; G239-R241 PolarHBondContact O-N 3.36Å; G239-T242 WeakPolarHBondContact O-CB 3.41Å; G239-T242 PolarHBondContact O-N 3.37Å; G239-T242 PolarHBondContact O-OG1 3.32Å |
| 240 | Y | 97.4 | Very high | 96.1 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.5 | -30.8 | -176.7 | -67.4 | -64.2 | 0 | 0 | 0 | 113.9 | F148 T152 V179 Y183 A184 V187 T236 F237 T242 L243 L246 L252 | F148-Y240 HydrophobicContact CB-CE2 3.98Å; F148-Y240 WeakPolarHBondContact CB-OH 3.42Å; F148-Y240 HydrophobicContact CD1-CE2 4.04Å; F148-Y240 AromaticContact CG-CE2 3.98Å; F148-Y240 HydrophobicContact CG-CE2 3.98Å; T152-Y240 HydrophobicContact CG2-CD1 3.6Å; T152-Y240 HydrophobicContact CG2-CD2 4.26Å; T152-Y240 HydrophobicContact CG2-CE1 3.64Å; T152-Y240 HydrophobicContact CG2-CE2 4.26Å; T152-Y240 HydrophobicContact CG2-CG 3.95Å; V179-Y240 HydrophobicContact CG1-CE1 4.03Å; Y183-Y240 HydrophobicContact CD1-CE1 4.37Å; Y183-Y240 HydrophobicContact CE1-CD1 4.17Å; Y183-Y240 HydrophobicContact CE1-CE1 4.19Å; A184-Y240 VanDerWaalsContact CA-OH 3.3Å; A184-Y240 WeakPolarHBondContact CA-OH 3.49Å; A184-Y240 WeakPolarHBondContact CB-OH 3.45Å; V187-Y240 HydrophobicContact CB-CE2 4.29Å; V187-Y240 HydrophobicContact CG1-CD2 4.06Å; V187-Y240 HydrophobicContact CG1-CE2 3.62Å; V187-Y240 HydrophobicContact CG2-CE1 4.48Å; T236-Y240 HydrophobicContact CG2-CD2 3.92Å; T236-Y240 HydrophobicContact CG2-CE2 3.67Å; T236-Y240 WeakPolarHBondContact O-CD2 3.39Å; T236-Y240 PolarHBondContact O-N 2.96Å; F237-Y240 PolarHBondContact O-N 2.91Å; Y240-T242 PolarHBondContact O-N 3.15Å; Y240-L243 HydrophobicContact CD1-CD1 4.42Å; Y240-L243 PolarHBondContact O-N 3.39Å; Y240-L246 HydrophobicContact CD1-CD1 3.98Å; Y240-L246 HydrophobicContact CG-CD1 4.41Å; Y240-L252 HydrophobicContact CD2-CD1 3.56Å; Y240-L252 HydrophobicContact CG-CD1 3.99Å |
| 241 | R | 95.4 | Very high | 96 | Very high | 157 Ų | 157 | 45.1 Ų | 45.1 | 59% | 0.592 | 21% | 0.208 | S | C | * | . | H | α-helix | trans | -61.2 | -26 | 174.4 | -179 | 178.5 | 178.2 | -170.7 | 1.9 | 113.1 | F237 G239 L243 | F237-R241 HydrophobicContact CE2-CB 4.22Å; F237-R241 HydrophobicContact CZ-CB 4.46Å; F237-R241 HydrophobicContact CZ-CG 4.49Å; F237-R241 VanDerWaalsContact O-CB 3.26Å; F237-R241 WeakPolarHBondContact O-CB 3.35Å; F237-R241 PolarHBondContact O-N 3.47Å; G239-R241 VanDerWaalsContact C-N 3.26Å; G239-R241 PolarHBondContact O-N 3.36Å; R241-L243 VanDerWaalsContact C-N 3.26Å; R241-L243 PolarHBondContact O-N 3.44Å |
| 242 | T | 93.4 | Very high | 95.9 | Very high | 32 Ų | 32 | 43.1 Ų | 43.1 | 20% | 0.196 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -19.5 | -179.6 | 63.8 | 0 | 0 | 0 | 0 | 113.7 | F79 Y183 L238 G239 Y240 P244 | F79-T242 HydrophobicContact CB-CG2 3.45Å; F79-T242 VanDerWaalsContact CB-CG2 3.45Å; F79-T242 HydrophobicContact CG-CG2 4.14Å; Y183-T242 PolarHBondContact OH-OG1 3.46Å; Y183-T242 VanDerWaalsContact OH-OG1 3.04Å; L238-T242 WeakPolarHBondContact O-CG2 3.42Å; L238-T242 PolarHBondContact O-N 3.38Å; G239-T242 WeakPolarHBondContact O-CB 3.41Å; G239-T242 PolarHBondContact O-N 3.37Å; G239-T242 PolarHBondContact O-OG1 3.32Å; Y240-T242 PolarHBondContact O-N 3.15Å; T242-P244 WeakPolarHBondContact O-CD 3.43Å |
| 243 | L | 93.6 | Very high | 95.9 | Very high | 3 Ų | 3 | 44.7 Ų | 44.7 | 2% | 0.016 | 21% | 0.211 | C | C | . | . | trans | -75.9 | 117.9 | 177.7 | -62.3 | -178.8 | 0 | 0 | 0 | 110.4 | W92 V179 Y183 Y240 R241 F245 L246 | W92-L243 HydrophobicContact CD2-CD2 3.45Å; W92-L243 VanDerWaalsContact CD2-CD2 3.45Å; W92-L243 VanDerWaalsContact CE2-CD2 3.43Å; W92-L243 HydrophobicContact CE3-CD2 3.69Å; W92-L243 HydrophobicContact CG-CD2 4Å; W92-L243 HydrophobicContact CH2-CD2 3.89Å; W92-L243 HydrophobicContact CZ2-CD2 3.68Å; W92-L243 HydrophobicContact CZ3-CD2 3.89Å; V179-L243 HydrophobicContact CG1-CD1 4.21Å; V179-L243 HydrophobicContact CG2-CD1 3.85Å; Y183-L243 HydrophobicContact CD1-CD1 3.95Å; Y183-L243 HydrophobicContact CE1-CD1 3.49Å; Y183-L243 VanDerWaalsContact CE1-CD1 3.49Å; Y183-L243 HydrophobicContact CE1-CD2 4.04Å; Y183-L243 HydrophobicContact CE1-CG 3.84Å; Y183-L243 HydrophobicContact CE2-CD2 4.37Å; Y240-L243 HydrophobicContact CD1-CD1 4.42Å; Y240-L243 PolarHBondContact O-N 3.39Å; R241-L243 VanDerWaalsContact C-N 3.26Å; R241-L243 PolarHBondContact O-N 3.44Å; L243-F245 HydrophobicContact CB-CD1 4.39Å; L243-F245 HydrophobicContact CB-CE1 3.99Å; L243-F245 HydrophobicContact CB-CZ 4.1Å; L243-F245 HydrophobicContact CD1-CE1 4.43Å; L243-F245 HydrophobicContact CD1-CE2 4.35Å; L243-F245 HydrophobicContact CD1-CZ 3.84Å; L243-F245 HydrophobicContact CD2-CE1 4.1Å; L243-F245 HydrophobicContact CD2-CZ 4.25Å; L243-F245 HydrophobicContact CG-CE1 4.41Å; L243-F245 HydrophobicContact CG-CZ 4.3Å; L243-F245 PolarHBondContact O-N 3.05Å; L243-L246 HydrophobicContact CB-CB 4.4Å; L243-L246 HydrophobicContact CB-CD1 4.03Å; L243-L246 HydrophobicContact CB-CG 3.87Å; L243-L246 HydrophobicContact CD1-CD1 3.72Å; L243-L246 HydrophobicContact CD1-CG 4.18Å; L243-L246 HydrophobicContact CG-CD1 4.4Å; L243-L246 PolarHBondContact O-N 2.95Å | ||
| 244 | P | 90.5 | Very high | 95.9 | Very high | 88 Ų | 88 | 52.6 Ų | 52.6 | 57% | 0.571 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -69.5 | -21 | -170.7 | 27.1 | -35.4 | 0 | 0 | 0 | 114.1 | K161 T242 | K161-P244 PolarHBondContact NZ-O 3.17Å; K161-P244 VanDerWaalsContact NZ-O 3.12Å; T242-P244 WeakPolarHBondContact O-CD 3.43Å |
| 245 | F | 91.3 | Very high | 95.8 | Very high | 23 Ų | 23 | 51.2 Ų | 51.2 | 10% | 0.101 | 24% | 0.242 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | -4.7 | -179.6 | 59.5 | -93.7 | 0 | 0 | 0 | 113.6 | W92 V157 D158 P177 E178 V179 L243 | W92-F245 AromaticContact NE1-CE1 3.97Å; V157-F245 HydrophobicContact CG2-CD2 4.28Å; V157-F245 HydrophobicContact CG2-CE2 4.41Å; D158-F245 PolarHBondContact N-O 3.45Å; P177-F245 HydrophobicContact CB-CB 3.83Å; P177-F245 HydrophobicContact CB-CD1 4.1Å; P177-F245 HydrophobicContact CB-CD2 3.87Å; P177-F245 HydrophobicContact CB-CE2 4.43Å; P177-F245 HydrophobicContact CB-CG 3.68Å; P177-F245 HydrophobicContact CG-CB 4.03Å; P177-F245 HydrophobicContact CG-CD2 4.49Å; P177-F245 HydrophobicContact CG-CG 4.36Å; E178-F245 WeakPolarHBondContact O-CZ 3.22Å; V179-F245 HydrophobicContact CG2-CE2 3.87Å; V179-F245 HydrophobicContact CG2-CZ 4.29Å; L243-F245 HydrophobicContact CB-CD1 4.39Å; L243-F245 HydrophobicContact CB-CE1 3.99Å; L243-F245 HydrophobicContact CB-CZ 4.1Å; L243-F245 HydrophobicContact CD1-CE1 4.43Å; L243-F245 HydrophobicContact CD1-CE2 4.35Å; L243-F245 HydrophobicContact CD1-CZ 3.84Å; L243-F245 HydrophobicContact CD2-CE1 4.1Å; L243-F245 HydrophobicContact CD2-CZ 4.25Å; L243-F245 HydrophobicContact CG-CE1 4.41Å; L243-F245 HydrophobicContact CG-CZ 4.3Å; L243-F245 PolarHBondContact O-N 3.05Å |
| 246 | L | 93.9 | Very high | 95.8 | Very high | 12 Ų | 12 | 52.8 Ų | 52.8 | 6% | 0.063 | 25% | 0.251 | C | S | . | . | B | Isolated β-bridge | trans | -88.8 | 141.6 | 172 | -63.3 | -170.5 | 0 | 0 | 0 | 111.1 | F156 V157 V179 Y240 L243 T249 | F156-L246 HydrophobicContact CB-CB 4.34Å; F156-L246 HydrophobicContact CB-CD2 3.88Å; F156-L246 HydrophobicContact CB-CG 4.49Å; F156-L246 CarbonylContact O-C 3.56Å; F156-L246 VanDerWaalsContact O-CA 3.31Å; F156-L246 WeakPolarHBondContact O-CA 3.3Å; V157-L246 HydrophobicContact CG2-CD2 3.73Å; V179-L246 HydrophobicContact CG2-CD1 4.01Å; V179-L246 HydrophobicContact CG2-CD2 3.87Å; V179-L246 HydrophobicContact CG2-CG 4.33Å; Y240-L246 HydrophobicContact CD1-CD1 3.98Å; Y240-L246 HydrophobicContact CG-CD1 4.41Å; L243-L246 HydrophobicContact CB-CB 4.4Å; L243-L246 HydrophobicContact CB-CD1 4.03Å; L243-L246 HydrophobicContact CB-CG 3.87Å; L243-L246 HydrophobicContact CD1-CD1 3.72Å; L243-L246 HydrophobicContact CD1-CG 4.18Å; L243-L246 HydrophobicContact CG-CD1 4.4Å; L243-L246 PolarHBondContact O-N 2.95Å; L246-T249 HydrophobicContact CB-CG2 3.74Å; L246-T249 HydrophobicContact CD1-CG2 4.28Å |
| 247 | K | 93.6 | Very high | 95.8 | Very high | 95 Ų | 95 | 57 Ų | 57 | 41% | 0.413 | 28% | 0.278 | S | S | . | . | trans | -120.6 | 158.8 | 172.6 | 63.6 | 178 | 165.7 | -160.2 | 0 | 110.5 | F156 D158 T249 | F156-K247 WeakPolarHBondContact CB-O 3.2Å; F156-K247 VanDerWaalsContact CD1-O 3.27Å; F156-K247 WeakPolarHBondContact CD1-O 3.47Å; F156-K247 WeakPolarHBondContact O-CG 3.48Å; F156-K247 PolarHBondContact O-N 3.19Å; D158-K247 HydrophobicContact CB-CB 4.26Å; D158-K247 HydrophobicContact CB-CD 3.79Å; D158-K247 HydrophobicContact CB-CG 3.99Å; D158-K247 IonicContact OD1-NZ 2.91Å; D158-K247 PolarHBondContact OD1-NZ 2.82Å; K247-T249 PolarHBondContact O-N 3.36Å; K247-T249 VanDerWaalsContact O-N 3.1Å | ||
| 248 | R | 93.6 | Very high | 95.8 | Very high | 197 Ų | 197 | 58.6 Ų | 58.6 | 74% | 0.743 | 29% | 0.293 | S | S | * | . | trans | 54.4 | 30.7 | 174.7 | -156.7 | -172.6 | -78.6 | -176.3 | -5.4 | 114 | F156 T250 V251 | F156-R248 HydrophobicContact CD1-CB 4.5Å; F156-R248 WeakPolarHBondContact CE1-O 3.35Å; R248-T250 PolarHBondContact O-N 3.35Å; R248-T250 VanDerWaalsContact O-N 3.09Å; R248-V251 HydrophobicContact CG-CG2 3.69Å; R248-V251 PolarHBondContact O-N 3.11Å | ||
| 249 | T | 95.9 | Very high | 95.8 | Very high | 14 Ų | 14 | 58.8 Ų | 58.8 | 9% | 0.086 | 30% | 0.296 | C | S | . | . | G | 310 helix | trans | -63.2 | -17.9 | 178.1 | 55.3 | 0 | 0 | 0 | 0 | 112.9 | F237 L246 K247 V251 L252 | F237-T249 WeakPolarHBondContact CD2-O 3.3Å; L246-T249 HydrophobicContact CB-CG2 3.74Å; L246-T249 HydrophobicContact CD1-CG2 4.28Å; K247-T249 PolarHBondContact O-N 3.36Å; K247-T249 VanDerWaalsContact O-N 3.1Å; T249-V251 PolarHBondContact O-N 3.19Å; T249-V251 VanDerWaalsContact O-N 3.16Å; T249-L252 WeakPolarHBondContact O-CB 3.43Å; T249-L252 WeakPolarHBondContact O-CG 3.47Å; T249-L252 PolarHBondContact O-N 3.33Å |
| 250 | T | 96.4 | Very high | 95.9 | Very high | 85 Ų | 85 | 60.8 Ų | 60.8 | 52% | 0.521 | 31% | 0.313 | S | S | . | . | G | 310 helix | trans | -57.2 | -24.9 | 174 | 51.1 | 0 | 0 | 0 | 0 | 113.8 | F237 R248 L252 L253 | F237-T250 HydrophobicContact CE2-CG2 4.01Å; F237-T250 HydrophobicContact CZ-CG2 4.34Å; R248-T250 PolarHBondContact O-N 3.35Å; R248-T250 VanDerWaalsContact O-N 3.09Å; T250-L252 PolarHBondContact O-N 2.93Å; T250-L253 WeakPolarHBondContact O-CB 3.34Å; T250-L253 PolarHBondContact O-N 2.81Å |
| 251 | V | 97.3 | Very high | 95.9 | Very high | 37 Ų | 37 | 66 Ų | 66 | 22% | 0.224 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -60.6 | -26.4 | 174.1 | 169.1 | 0 | 0 | 0 | 0 | 111.8 | F156 R248 T249 L253 W254 | F156-V251 HydrophobicContact CE1-CB 4.17Å; F156-V251 HydrophobicContact CZ-CB 4.3Å; F156-V251 HydrophobicContact CZ-CG1 4.4Å; R248-V251 HydrophobicContact CG-CG2 3.69Å; R248-V251 PolarHBondContact O-N 3.11Å; T249-V251 PolarHBondContact O-N 3.19Å; T249-V251 VanDerWaalsContact O-N 3.16Å; V251-L253 PolarHBondContact O-N 3.11Å; V251-W254 HydrophobicContact CG1-CD2 4.1Å; V251-W254 HydrophobicContact CG1-CE3 3.92Å; V251-W254 HydrophobicContact CG1-CZ3 4.24Å; V251-W254 HydrophobicContact CG2-CH2 4.34Å; V251-W254 HydrophobicContact CG2-CZ2 4.1Å; V251-W254 WeakPolarHBondContact O-CB 3.32Å; V251-W254 PolarHBondContact O-N 3.4Å |
| 252 | L | 97.2 | Very high | 96 | Very high | 15 Ų | 15 | 62.8 Ų | 62.8 | 8% | 0.079 | 33% | 0.333 | C | S | . | . | G | 310 helix | trans | -62.7 | -13 | 174.9 | -66.2 | 174.9 | 0 | 0 | 0 | 113.7 | F148 F156 T233 F237 Y240 T249 T250 P255 | F148-L252 HydrophobicContact CD1-CD2 4.12Å; F148-L252 HydrophobicContact CE1-CD2 3.74Å; F156-L252 HydrophobicContact CE2-CD1 4.25Å; F156-L252 HydrophobicContact CE2-CD2 3.7Å; F156-L252 HydrophobicContact CE2-CG 3.86Å; F156-L252 HydrophobicContact CZ-CD2 4.06Å; F156-L252 HydrophobicContact CZ-CG 4.08Å; T233-L252 WeakPolarHBondContact CG2-O 3.33Å; F237-L252 HydrophobicContact CB-CB 4.34Å; Y240-L252 HydrophobicContact CD2-CD1 3.56Å; Y240-L252 HydrophobicContact CG-CD1 3.99Å; T249-L252 WeakPolarHBondContact O-CB 3.43Å; T249-L252 WeakPolarHBondContact O-CG 3.47Å; T249-L252 PolarHBondContact O-N 3.33Å; T250-L252 PolarHBondContact O-N 2.93Å; L252-P255 WeakPolarHBondContact O-CD 3.27Å |
| 253 | L | 97.9 | Very high | 96.3 | Very high | 58 Ų | 58 | 63.2 Ų | 63.2 | 30% | 0.304 | 33% | 0.331 | S | S | . | . | G | 310 helix | trans | -87.9 | -14.5 | 175.5 | -64.9 | 170.3 | 0 | 0 | 0 | 113.4 | F237 T250 V251 P255 V256 | F237-L253 HydrophobicContact CB-CD2 3.72Å; F237-L253 HydrophobicContact CB-CG 4.03Å; F237-L253 HydrophobicContact CD1-CD1 3.99Å; F237-L253 HydrophobicContact CD1-CD2 3.97Å; F237-L253 HydrophobicContact CD1-CG 4.16Å; F237-L253 HydrophobicContact CD2-CD1 4.22Å; F237-L253 HydrophobicContact CD2-CG 4.12Å; F237-L253 HydrophobicContact CE1-CD1 4.04Å; F237-L253 HydrophobicContact CE2-CD1 4.28Å; F237-L253 HydrophobicContact CG-CD1 4.06Å; F237-L253 HydrophobicContact CG-CD2 3.85Å; F237-L253 HydrophobicContact CG-CG 3.83Å; F237-L253 HydrophobicContact CZ-CD1 4.15Å; T250-L253 WeakPolarHBondContact O-CB 3.34Å; T250-L253 PolarHBondContact O-N 2.81Å; V251-L253 PolarHBondContact O-N 3.11Å; L253-P255 VanDerWaalsContact C-N 3.33Å; L253-V256 VanDerWaalsContact O-CB 3.31Å; L253-V256 WeakPolarHBondContact O-CB 3.46Å; L253-V256 WeakPolarHBondContact O-CG2 3.27Å; L253-V256 PolarHBondContact O-N 3.13Å |
| 254 | W | 97.6 | Very high | 96.5 | Very high | 174 Ų | 174 | 66.9 Ų | 66.9 | 66% | 0.659 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -58.3 | -32.7 | 179.1 | -69.5 | -1.1 | 0 | 0 | 0 | 115 | V251 V256 T257 A258 | V251-W254 HydrophobicContact CG1-CD2 4.1Å; V251-W254 HydrophobicContact CG1-CE3 3.92Å; V251-W254 HydrophobicContact CG1-CZ3 4.24Å; V251-W254 HydrophobicContact CG2-CH2 4.34Å; V251-W254 HydrophobicContact CG2-CZ2 4.1Å; V251-W254 WeakPolarHBondContact O-CB 3.32Å; V251-W254 PolarHBondContact O-N 3.4Å; W254-V256 PolarHBondContact O-N 2.86Å; W254-V256 VanDerWaalsContact O-N 3.13Å; W254-T257 PolarHBondContact O-N 2.83Å; W254-T257 VanDerWaalsContact O-N 3.12Å; W254-T257 PolarHBondContact O-OG1 2.99Å; W254-A258 PolarHBondContact O-N 3.09Å |
| 255 | P | 97.8 | Very high | 96.9 | Very high | 58 Ų | 58 | 66.3 Ų | 66.3 | 38% | 0.377 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -57.3 | -27.3 | 173.1 | -26.8 | 36.4 | 0 | 0 | 0 | 113.5 | F229 L252 L253 T257 A258 A259 | F229-P255 HydrophobicContact CE1-CB 3.97Å; F229-P255 WeakPolarHBondContact CE1-O 3.43Å; F229-P255 HydrophobicContact CZ-CB 3.71Å; L252-P255 WeakPolarHBondContact O-CD 3.27Å; L253-P255 VanDerWaalsContact C-N 3.33Å; P255-T257 PolarHBondContact O-N 3.29Å; P255-A258 PolarHBondContact O-N 3.14Å; P255-A259 WeakPolarHBondContact O-CB 3.48Å; P255-A259 PolarHBondContact O-N 3.39Å |
| 256 | V | 98.2 | Very high | 97.2 | Very high | 33 Ų | 33 | 65.2 Ų | 65.2 | 20% | 0.2 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 177 | -178 | 0 | 0 | 0 | 0 | 111.4 | T230 T233 L253 W254 A258 A259 A260 | T230-V256 HydrophobicContact CG2-CG1 3.91Å; T233-V256 HydrophobicContact CG2-CG2 3.57Å; L253-V256 VanDerWaalsContact O-CB 3.31Å; L253-V256 WeakPolarHBondContact O-CB 3.46Å; L253-V256 WeakPolarHBondContact O-CG2 3.27Å; L253-V256 PolarHBondContact O-N 3.13Å; W254-V256 PolarHBondContact O-N 2.86Å; W254-V256 VanDerWaalsContact O-N 3.13Å; V256-A258 VanDerWaalsContact C-N 3.35Å; V256-A259 PolarHBondContact O-N 3.21Å; V256-A260 PolarHBondContact O-N 3.48Å |
| 257 | T | 97.6 | Very high | 97.3 | Very high | 92 Ų | 92 | 66.1 Ų | 66.1 | 56% | 0.564 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -67.1 | -39.2 | 177.9 | 53.1 | 0 | 0 | 0 | 0 | 111.2 | W254 P255 A260 I261 | W254-T257 PolarHBondContact O-N 2.83Å; W254-T257 VanDerWaalsContact O-N 3.12Å; W254-T257 PolarHBondContact O-OG1 2.99Å; P255-T257 PolarHBondContact O-N 3.29Å; T257-A260 PolarHBondContact O-N 3.36Å; T257-I261 WeakPolarHBondContact O-CG1 3.19Å; T257-I261 PolarHBondContact O-N 3.31Å |
| 258 | A | 98.1 | Very high | 97.5 | Very high | 46 Ų | 46 | 67.7 Ų | 67.7 | 38% | 0.38 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 173 | 0 | 0 | 0 | 0 | 0 | 111.7 | W254 P255 V256 A260 I261 I262 | W254-A258 PolarHBondContact O-N 3.09Å; P255-A258 PolarHBondContact O-N 3.14Å; V256-A258 VanDerWaalsContact C-N 3.35Å; A258-A260 VanDerWaalsContact C-N 3.34Å; A258-A260 PolarHBondContact O-N 3.37Å; A258-I261 PolarHBondContact O-N 3.4Å; A258-I262 WeakPolarHBondContact O-CG1 3.2Å; A258-I262 PolarHBondContact O-N 2.86Å |
| 259 | A | 98.2 | Very high | 97.7 | Very high | 15 Ų | 15 | 63 Ų | 63 | 12% | 0.124 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -63.4 | -36.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L226 F229 P255 V256 I262 Y263 | L226-A259 HydrophobicContact CD1-CB 4.1Å; F229-A259 HydrophobicContact CD1-CB 3.4Å; F229-A259 VanDerWaalsContact CD1-CB 3.4Å; F229-A259 HydrophobicContact CE1-CB 3.5Å; F229-A259 HydrophobicContact CG-CB 4.28Å; F229-A259 HydrophobicContact CZ-CB 4.42Å; P255-A259 WeakPolarHBondContact O-CB 3.48Å; P255-A259 PolarHBondContact O-N 3.39Å; V256-A259 PolarHBondContact O-N 3.21Å; A259-I262 PolarHBondContact O-N 3.33Å; A259-Y263 VanDerWaalsContact O-CB 3.3Å; A259-Y263 WeakPolarHBondContact O-CB 3.43Å; A259-Y263 PolarHBondContact O-N 3.48Å |
| 260 | A | 98.3 | Very high | 97.6 | Very high | 43 Ų | 43 | 69.6 Ų | 69.6 | 36% | 0.355 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V256 T257 A258 Y263 V264 | V256-A260 PolarHBondContact O-N 3.48Å; T257-A260 PolarHBondContact O-N 3.36Å; A258-A260 VanDerWaalsContact C-N 3.34Å; A258-A260 PolarHBondContact O-N 3.37Å; A260-Y263 WeakPolarHBondContact O-CB 3.37Å; A260-Y263 PolarHBondContact O-N 3.36Å; A260-V264 WeakPolarHBondContact O-CG2 3.36Å; A260-V264 PolarHBondContact O-N 3.26Å; A260-V264 VanDerWaalsContact O-N 3.16Å |
| 261 | I | 98.3 | Very high | 97.6 | Very high | 109 Ų | 109 | 72.1 Ų | 72.1 | 56% | 0.559 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -65.6 | -48.2 | 174.9 | -64.6 | 166.9 | 0 | 0 | 0 | 110.4 | T257 A258 Y263 V264 I265 | T257-I261 WeakPolarHBondContact O-CG1 3.19Å; T257-I261 PolarHBondContact O-N 3.31Å; A258-I261 PolarHBondContact O-N 3.4Å; I261-Y263 PolarHBondContact O-N 3.39Å; I261-V264 PolarHBondContact O-N 3Å; I261-V264 VanDerWaalsContact O-N 3.16Å; I261-I265 HydrophobicContact CG2-CD1 3.78Å; I261-I265 HydrophobicContact CG2-CG1 4.43Å; I261-I265 WeakPolarHBondContact O-CG1 3.29Å; I261-I265 PolarHBondContact O-N 2.7Å |
| 262 | I | 98.2 | Very high | 97.6 | Very high | 90 Ų | 90 | 71 Ų | 71 | 46% | 0.462 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -58.8 | -38.2 | 177.4 | -69.2 | 166.6 | 0 | 0 | 0 | 111 | A258 A259 I265 S266 F273 | A258-I262 WeakPolarHBondContact O-CG1 3.2Å; A258-I262 PolarHBondContact O-N 2.86Å; A259-I262 PolarHBondContact O-N 3.33Å; I262-I265 PolarHBondContact O-N 2.94Å; I262-S266 WeakPolarHBondContact O-CB 3.49Å; I262-S266 PolarHBondContact O-N 2.95Å; I262-S266 PolarHBondContact O-OG 2.99Å; I262-F273 HydrophobicContact CG2-CZ 3.91Å |
| 263 | Y | 98.4 | Very high | 97.6 | Very high | 40 Ų | 40 | 73.1 Ų | 73.1 | 16% | 0.157 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.1 | -45.5 | 175.4 | 169.5 | -94.3 | 0 | 0 | 0 | 112.5 | L219 N222 T223 L226 A259 A260 I261 S266 L267 | L219-Y263 WeakPolarHBondContact CD1-OH 3.31Å; N222-Y263 HydrophobicContact CB-CD2 3.87Å; N222-Y263 HydrophobicContact CB-CE2 3.81Å; T223-Y263 PolarHBondContact OG1-OH 3.11Å; L226-Y263 HydrophobicContact CB-CD2 3.99Å; L226-Y263 HydrophobicContact CB-CE2 4.5Å; L226-Y263 HydrophobicContact CB-CG 4.44Å; L226-Y263 HydrophobicContact CD2-CD1 3.98Å; L226-Y263 HydrophobicContact CD2-CD2 3.98Å; L226-Y263 HydrophobicContact CD2-CE1 4.35Å; L226-Y263 HydrophobicContact CD2-CE2 4.35Å; L226-Y263 HydrophobicContact CD2-CG 3.77Å; A259-Y263 VanDerWaalsContact O-CB 3.3Å; A259-Y263 WeakPolarHBondContact O-CB 3.43Å; A259-Y263 PolarHBondContact O-N 3.48Å; A260-Y263 WeakPolarHBondContact O-CB 3.37Å; A260-Y263 PolarHBondContact O-N 3.36Å; I261-Y263 PolarHBondContact O-N 3.39Å; Y263-S266 PolarHBondContact O-N 3.17Å; Y263-S266 PolarHBondContact O-OG 3.46Å; Y263-L267 HydrophobicContact CD1-CD1 4.31Å; Y263-L267 HydrophobicContact CE1-CD1 3.68Å; Y263-L267 HydrophobicContact CE2-CD1 4.33Å; Y263-L267 WeakPolarHBondContact O-CG 3.48Å; Y263-L267 PolarHBondContact O-N 3Å |
| 264 | V | 98.3 | Very high | 97.5 | Very high | 81 Ų | 81 | 70.5 Ų | 70.5 | 49% | 0.491 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.3 | -44.5 | 176.9 | 174.8 | 0 | 0 | 0 | 0 | 110.6 | A260 I261 S266 L267 I268 | A260-V264 WeakPolarHBondContact O-CG2 3.36Å; A260-V264 PolarHBondContact O-N 3.26Å; A260-V264 VanDerWaalsContact O-N 3.16Å; I261-V264 PolarHBondContact O-N 3Å; I261-V264 VanDerWaalsContact O-N 3.16Å; V264-S266 VanDerWaalsContact C-N 3.33Å; V264-S266 PolarHBondContact O-N 3.3Å; V264-L267 PolarHBondContact O-N 3.15Å; V264-I268 HydrophobicContact CG1-CD1 4.02Å; V264-I268 WeakPolarHBondContact O-CG1 3.24Å; V264-I268 PolarHBondContact O-N 2.77Å |
| 265 | I | 98.2 | Very high | 97.3 | Very high | 76 Ų | 76 | 64.1 Ų | 64.1 | 39% | 0.39 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 177.1 | -67.4 | 170.8 | 0 | 0 | 0 | 110.7 | I261 I262 L267 I268 M269 | I261-I265 HydrophobicContact CG2-CD1 3.78Å; I261-I265 HydrophobicContact CG2-CG1 4.43Å; I261-I265 WeakPolarHBondContact O-CG1 3.29Å; I261-I265 PolarHBondContact O-N 2.7Å; I262-I265 PolarHBondContact O-N 2.94Å; I265-L267 VanDerWaalsContact C-N 3.3Å; I265-L267 PolarHBondContact O-N 3.26Å; I265-I268 PolarHBondContact O-N 2.93Å; I265-M269 HydrophobicContact CG2-CG 4.05Å; I265-M269 HydrophobicContact CG2-SD 3.56Å; I265-M269 VanDerWaalsContact CG2-SD 3.56Å; I265-M269 WeakPolarHBondContact O-CB 3.09Å; I265-M269 WeakPolarHBondContact O-CG 3.3Å; I265-M269 PolarHBondContact O-N 3.17Å |
| 266 | S | 97.8 | Very high | 97.2 | Very high | 0 Ų | 0 | 68.2 Ų | 68.2 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.4 | -35 | -178.4 | 72.9 | 0 | 0 | 0 | 0 | 112.2 | N222 I262 Y263 V264 K270 W271 | N222-S266 PolarHBondContact ND2-OG 3.32Å; I262-S266 WeakPolarHBondContact O-CB 3.49Å; I262-S266 PolarHBondContact O-N 2.95Å; I262-S266 PolarHBondContact O-OG 2.99Å; Y263-S266 PolarHBondContact O-N 3.17Å; Y263-S266 PolarHBondContact O-OG 3.46Å; V264-S266 VanDerWaalsContact C-N 3.33Å; V264-S266 PolarHBondContact O-N 3.3Å; S266-K270 CarbonylContact O-C 3.59Å; S266-K270 PolarHBondContact O-N 3.12Å; S266-K270 VanDerWaalsContact O-N 3.08Å; S266-W271 PolarHBondContact O-N 3.07Å |
| 267 | L | 97.3 | Very high | 97 | Very high | 31 Ų | 31 | 69 Ų | 69 | 16% | 0.162 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 173.6 | -65.9 | 178.8 | 0 | 0 | 0 | 112.3 | L219 N222 Y263 V264 I265 K270 | L219-L267 HydrophobicContact CD1-CD1 3.88Å; L219-L267 HydrophobicContact CD1-CD2 4.21Å; N222-L267 HydrophobicContact CB-CD2 4.48Å; Y263-L267 HydrophobicContact CD1-CD1 4.31Å; Y263-L267 HydrophobicContact CE1-CD1 3.68Å; Y263-L267 HydrophobicContact CE2-CD1 4.33Å; Y263-L267 WeakPolarHBondContact O-CG 3.48Å; Y263-L267 PolarHBondContact O-N 3Å; V264-L267 PolarHBondContact O-N 3.15Å; I265-L267 VanDerWaalsContact C-N 3.3Å; I265-L267 PolarHBondContact O-N 3.26Å; L267-K270 PolarHBondContact O-N 3.11Å |
| 268 | I | 97.1 | Very high | 96.8 | Very high | 128 Ų | 128 | 65.1 Ų | 65.1 | 66% | 0.656 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -65.5 | -46.4 | 177.8 | -64.8 | 167.4 | 0 | 0 | 0 | 110.6 | V264 I265 K270 | V264-I268 HydrophobicContact CG1-CD1 4.02Å; V264-I268 WeakPolarHBondContact O-CG1 3.24Å; V264-I268 PolarHBondContact O-N 2.77Å; I265-I268 PolarHBondContact O-N 2.93Å; I268-K270 PolarHBondContact O-N 2.85Å |
| 269 | M | 96.9 | Very high | 96.5 | Very high | 97 Ų | 97 | 67.8 Ų | 67.8 | 48% | 0.478 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | 1.6 | 179.4 | -64.4 | -173.2 | 73.1 | 0 | 0 | 113.5 | I265 W271 | I265-M269 HydrophobicContact CG2-CG 4.05Å; I265-M269 HydrophobicContact CG2-SD 3.56Å; I265-M269 VanDerWaalsContact CG2-SD 3.56Å; I265-M269 WeakPolarHBondContact O-CB 3.09Å; I265-M269 WeakPolarHBondContact O-CG 3.3Å; I265-M269 PolarHBondContact O-N 3.17Å; M269-W271 HydrophobicContact CB-CD2 4.18Å; M269-W271 HydrophobicContact CB-CG 4.16Å; M269-W271 HydrophobicContact CE-CH2 3.9Å; M269-W271 HydrophobicContact CE-CZ2 3.32Å; M269-W271 PolarHBondContact O-N 3.15Å; M269-W271 HydrophobicContact SD-CH2 4.01Å; M269-W271 HydrophobicContact SD-CZ2 3.92Å; M269-W271 HydrophobicContact SD-CZ3 4.38Å |
| 270 | K | 95.3 | Very high | 96.3 | Very high | 154 Ų | 154 | 70.2 Ų | 70.2 | 67% | 0.67 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.3 | 27.8 | -178.1 | -54 | 176.3 | -179.3 | 174.9 | 0 | 113.8 | R218 S266 L267 I268 | R218-K270 VanDerWaalsContact CD-O 3.3Å; R218-K270 WeakPolarHBondContact CD-O 3.44Å; S266-K270 CarbonylContact O-C 3.59Å; S266-K270 PolarHBondContact O-N 3.12Å; S266-K270 VanDerWaalsContact O-N 3.08Å; L267-K270 PolarHBondContact O-N 3.11Å; I268-K270 PolarHBondContact O-N 2.85Å |
| 271 | W | 96.5 | Very high | 96 | Very high | 137 Ų | 137 | 69.2 Ų | 69.2 | 52% | 0.519 | 33% | 0.329 | S | S | . | . | trans | -78 | 139.3 | 175.1 | -68.7 | -5.1 | 0 | 0 | 0 | 111.3 | N222 S266 M269 | N222-W271 PolarHBondContact ND2-O 2.89Å; S266-W271 PolarHBondContact O-N 3.07Å; M269-W271 HydrophobicContact CB-CD2 4.18Å; M269-W271 HydrophobicContact CB-CG 4.16Å; M269-W271 HydrophobicContact CE-CH2 3.9Å; M269-W271 HydrophobicContact CE-CZ2 3.32Å; M269-W271 PolarHBondContact O-N 3.15Å; M269-W271 HydrophobicContact SD-CH2 4.01Å; M269-W271 HydrophobicContact SD-CZ2 3.92Å; M269-W271 HydrophobicContact SD-CZ3 4.38Å | ||
| 272 | N | 96.9 | Very high | 95.6 | Very high | 13 Ų | 13 | 67.4 Ų | 67.4 | 7% | 0.07 | 32% | 0.319 | C | S | . | . | trans | -125.6 | 108 | 176.2 | -175.5 | -26.2 | 0 | 0 | 0 | 108.7 | I210 R218 T274 L275 F276 | I210-N272 PolarHBondContact O-ND2 3.44Å; R218-N272 HydrophobicContact CG-CB 4.07Å; N272-T274 VanDerWaalsContact C-N 3.3Å; N272-T274 PolarHBondContact O-N 3.31Å; N272-T274 PolarHBondContact OD1-N 3.21Å; N272-L275 HydrophobicContact CB-CB 3.79Å; N272-L275 HydrophobicContact CB-CD2 4.49Å; N272-L275 PolarHBondContact O-N 2.89Å; N272-L275 PolarHBondContact OD1-N 2.91Å; N272-L275 VanDerWaalsContact OD1-N 3.17Å; N272-F276 WeakPolarHBondContact O-CB 3.5Å; N272-F276 PolarHBondContact O-N 3.07Å | ||
| 273 | F | 96.5 | Very high | 95.2 | Very high | 60 Ų | 60 | 71.2 Ų | 71.2 | 26% | 0.263 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.3 | -35.3 | -174.9 | -67.1 | -61.4 | 0 | 0 | 0 | 112.8 | N222 W225 I262 F276 L277 | N222-F273 HydrophobicContact CB-CD2 4.35Å; N222-F273 WeakPolarHBondContact OD1-CD2 3.46Å; N222-F273 PolarHBondContact OD1-N 3.38Å; N222-F273 VanDerWaalsContact OD1-N 3.15Å; W225-F273 HydrophobicContact CB-CD2 4.28Å; W225-F273 HydrophobicContact CD2-CB 4.07Å; W225-F273 HydrophobicContact CG-CB 3.86Å; W225-F273 HydrophobicContact CG-CD2 4.34Å; W225-F273 HydrophobicContact CG-CG 4.45Å; I262-F273 HydrophobicContact CG2-CZ 3.91Å; F273-F276 PolarHBondContact O-N 3.48Å; F273-L277 WeakPolarHBondContact O-CB 3.22Å; F273-L277 PolarHBondContact O-N 3.19Å |
| 274 | T | 95.9 | Very high | 94.8 | Very high | 4 Ų | 4 | 75.8 Ų | 75.8 | 3% | 0.025 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -69.3 | -44.6 | 178.1 | -54.1 | 0 | 0 | 0 | 0 | 111.1 | Q203 L207 I210 W225 N272 F276 L277 C278 | Q203-T274 PolarHBondContact NE2-OG1 2.9Å; L207-T274 HydrophobicContact CD1-CG2 3.63Å; I210-T274 HydrophobicContact CG2-CG2 3.86Å; W225-T274 PolarHBondContact NE1-OG1 3.43Å; N272-T274 VanDerWaalsContact C-N 3.3Å; N272-T274 PolarHBondContact O-N 3.31Å; N272-T274 PolarHBondContact OD1-N 3.21Å; T274-F276 VanDerWaalsContact C-N 3.33Å; T274-F276 PolarHBondContact O-N 3.46Å; T274-L277 PolarHBondContact O-N 3.48Å; T274-C278 PolarHBondContact O-N 3.02Å; T274-C278 PolarHBondContact O-SG 2.86Å; T274-C278 VanDerWaalsContact O-SG 3.41Å |
| 275 | L | 94.5 | Very high | 94.1 | Very high | 39 Ų | 39 | 73.1 Ų | 73.1 | 20% | 0.204 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 175.3 | -177.7 | 63.4 | 0 | 0 | 0 | 111.2 | L211 N272 L277 C278 H279 | L211-L275 HydrophobicContact CD2-CB 4.27Å; L211-L275 HydrophobicContact CD2-CD1 3.84Å; N272-L275 HydrophobicContact CB-CB 3.79Å; N272-L275 HydrophobicContact CB-CD2 4.49Å; N272-L275 PolarHBondContact O-N 2.89Å; N272-L275 PolarHBondContact OD1-N 2.91Å; N272-L275 VanDerWaalsContact OD1-N 3.17Å; L275-L277 VanDerWaalsContact C-N 3.33Å; L275-L277 PolarHBondContact O-N 2.9Å; L275-C278 PolarHBondContact O-N 3.44Å; L275-H279 WeakPolarHBondContact CD1-NE2 3.16Å; L275-H279 PolarHBondContact O-CD2 2.91Å; L275-H279 PolarHBondContact O-N 2.95Å |
| 276 | F | 95.1 | Very high | 93.2 | Very high | 144 Ų | 144 | 77.7 Ų | 77.7 | 63% | 0.632 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -57.1 | -46 | 174.3 | 173.7 | -96.3 | 0 | 0 | 0 | 111.8 | N272 F273 T274 H279 F280 | N272-F276 WeakPolarHBondContact O-CB 3.5Å; N272-F276 PolarHBondContact O-N 3.07Å; F273-F276 PolarHBondContact O-N 3.48Å; T274-F276 VanDerWaalsContact C-N 3.33Å; T274-F276 PolarHBondContact O-N 3.46Å; F276-H279 PolarHBondContact O-N 3.18Å; F276-F280 WeakPolarHBondContact O-CB 3.39Å; F276-F280 PolarHBondContact O-N 2.82Å |
| 277 | L | 93.9 | Very high | 93 | Very high | 51 Ų | 51 | 81.6 Ų | 81.6 | 27% | 0.267 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66 | -40.2 | 178.8 | -172.9 | 66.2 | 0 | 0 | 0 | 112.1 | W225 F273 T274 L275 F280 Y281 | W225-L277 HydrophobicContact CH2-CD2 4.01Å; W225-L277 HydrophobicContact CZ2-CD2 3.78Å; F273-L277 WeakPolarHBondContact O-CB 3.22Å; F273-L277 PolarHBondContact O-N 3.19Å; T274-L277 PolarHBondContact O-N 3.48Å; L275-L277 VanDerWaalsContact C-N 3.33Å; L275-L277 PolarHBondContact O-N 2.9Å; L277-F280 HydrophobicContact CD1-CD1 4.38Å; L277-F280 WeakPolarHBondContact O-CB 3.34Å; L277-F280 PolarHBondContact O-N 3.36Å; L277-Y281 HydrophobicContact CD1-CD2 4.23Å; L277-Y281 HydrophobicContact CD1-CE2 3.61Å; L277-Y281 HydrophobicContact CD2-CE2 3.9Å; L277-Y281 HydrophobicContact CG-CD2 3.93Å; L277-Y281 HydrophobicContact CG-CE2 3.46Å; L277-Y281 VanDerWaalsContact CG-CE2 3.46Å; L277-Y281 WeakPolarHBondContact O-CD2 3.48Å; L277-Y281 PolarHBondContact O-N 3.26Å |
| 278 | C | 93 | Very high | 92.8 | Very high | 10 Ų | 10 | 84.2 Ų | 84.2 | 7% | 0.068 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.8 | -45.3 | 173.8 | -72.8 | 0 | 0 | 0 | 0 | 111.7 | M118 L211 T274 L275 F280 Y281 Q282 | M118-C278 HydrophobicContact SD-CB 4.41Å; L211-C278 HydrophobicContact CD2-CB 4.31Å; T274-C278 PolarHBondContact O-N 3.02Å; T274-C278 PolarHBondContact O-SG 2.86Å; T274-C278 VanDerWaalsContact O-SG 3.41Å; L275-C278 PolarHBondContact O-N 3.44Å; C278-F280 VanDerWaalsContact C-N 3.31Å; C278-F280 PolarHBondContact O-N 3.41Å; C278-Y281 PolarHBondContact O-N 3.2Å; C278-Q282 WeakPolarHBondContact O-CB 3.36Å; C278-Q282 WeakPolarHBondContact O-CG 3.29Å; C278-Q282 PolarHBondContact O-N 3.07Å |
| 279 | H | 92.1 | Very high | 92.6 | Very high | 101 Ų | 101 | 81.8 Ų | 81.8 | 47% | 0.468 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.7 | -39.5 | 175.2 | -76.6 | -56 | 0 | 0 | 0 | 112.5 | L275 F276 Y281 Q282 F283 | L275-H279 WeakPolarHBondContact CD1-NE2 3.16Å; L275-H279 PolarHBondContact O-CD2 2.91Å; L275-H279 PolarHBondContact O-N 2.95Å; F276-H279 PolarHBondContact O-N 3.18Å; H279-Y281 PolarHBondContact O-N 3.46Å; H279-Q282 PolarHBondContact O-N 2.74Å; H279-F283 VanDerWaalsContact O-CB 3.29Å; H279-F283 WeakPolarHBondContact O-CB 3.49Å; H279-F283 PolarHBondContact O-N 2.63Å |
| 280 | F | 93.8 | Very high | 92.3 | Very high | 66 Ų | 66 | 80.9 Ų | 80.9 | 29% | 0.289 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -59.7 | -44.5 | 175.7 | 170.4 | -91.4 | 0 | 0 | 0 | 112.2 | F276 L277 C278 R284 | F276-F280 WeakPolarHBondContact O-CB 3.39Å; F276-F280 PolarHBondContact O-N 2.82Å; L277-F280 HydrophobicContact CD1-CD1 4.38Å; L277-F280 WeakPolarHBondContact O-CB 3.34Å; L277-F280 PolarHBondContact O-N 3.36Å; C278-F280 VanDerWaalsContact C-N 3.31Å; C278-F280 PolarHBondContact O-N 3.41Å; F280-R284 VanDerWaalsContact CZ-CZ 3.45Å; F280-R284 WeakPolarHBondContact O-CG 3.32Å; F280-R284 PolarHBondContact O-N 3.14Å |
| 281 | Y | 92.7 | Very high | 92.1 | Very high | 22 Ų | 22 | 76.3 Ų | 76.3 | 9% | 0.086 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -70.9 | -42.4 | 177.4 | -70.4 | -60.3 | 0 | 0 | 0 | 112.3 | F128 W131 V132 D136 L277 C278 H279 F283 R284 L285 | F128-Y281 AromaticContact CD2-CD1 3.93Å; F128-Y281 HydrophobicContact CD2-CD1 3.93Å; F128-Y281 HydrophobicContact CD2-CD2 4.49Å; F128-Y281 HydrophobicContact CD2-CE1 4.42Å; F128-Y281 AromaticContact CD2-CG 3.99Å; F128-Y281 HydrophobicContact CD2-CG 3.99Å; F128-Y281 AromaticContact CE2-CD1 3.72Å; F128-Y281 HydrophobicContact CE2-CD1 3.72Å; F128-Y281 AromaticContact CE2-CD2 3.61Å; F128-Y281 HydrophobicContact CE2-CD2 3.61Å; F128-Y281 AromaticContact CE2-CE1 3.98Å; F128-Y281 HydrophobicContact CE2-CE1 3.98Å; F128-Y281 AromaticContact CE2-CE2 3.81Å; F128-Y281 HydrophobicContact CE2-CE2 3.81Å; F128-Y281 AromaticContact CE2-CG 3.54Å; F128-Y281 HydrophobicContact CE2-CG 3.54Å; F128-Y281 HydrophobicContact CZ-CD2 4.44Å; F128-Y281 HydrophobicContact CZ-CE2 4.41Å; W131-Y281 AromaticContact CD1-CE1 3.81Å; V132-Y281 HydrophobicContact CG2-CE1 4.19Å; D136-Y281 PolarHBondContact OD2-OH 2.8Å; L277-Y281 HydrophobicContact CD1-CD2 4.23Å; L277-Y281 HydrophobicContact CD1-CE2 3.61Å; L277-Y281 HydrophobicContact CD2-CE2 3.9Å; L277-Y281 HydrophobicContact CG-CD2 3.93Å; L277-Y281 HydrophobicContact CG-CE2 3.46Å; L277-Y281 VanDerWaalsContact CG-CE2 3.46Å; L277-Y281 WeakPolarHBondContact O-CD2 3.48Å; L277-Y281 PolarHBondContact O-N 3.26Å; C278-Y281 PolarHBondContact O-N 3.2Å; H279-Y281 PolarHBondContact O-N 3.46Å; Y281-F283 VanDerWaalsContact C-N 3.35Å; Y281-F283 PolarHBondContact O-N 2.91Å; Y281-R284 PolarHBondContact O-N 2.87Å; Y281-R284 VanDerWaalsContact O-N 3.13Å; Y281-L285 VanDerWaalsContact O-CG 3.26Å; Y281-L285 WeakPolarHBondContact O-CG 3.2Å; Y281-L285 PolarHBondContact O-N 2.79Å; Y281-L285 VanDerWaalsContact O-N 3.14Å |
| 282 | Q | 89.4 | Confident | 91.8 | Very high | 72 Ų | 72 | 72.3 Ų | 72.3 | 34% | 0.336 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -58.4 | -47.2 | 175.8 | -74.5 | 178.5 | -22.2 | 0 | 0 | 111.1 | C278 H279 R284 L285 F286 | C278-Q282 WeakPolarHBondContact O-CB 3.36Å; C278-Q282 WeakPolarHBondContact O-CG 3.29Å; C278-Q282 PolarHBondContact O-N 3.07Å; H279-Q282 PolarHBondContact O-N 2.74Å; Q282-R284 PolarHBondContact O-N 2.75Å; Q282-R284 VanDerWaalsContact O-N 3.11Å; Q282-L285 PolarHBondContact O-N 3.19Å; Q282-L285 VanDerWaalsContact O-N 3.08Å; Q282-F286 HydrophobicContact CB-CD2 4.23Å; Q282-F286 HydrophobicContact CG-CE2 4.39Å; Q282-F286 VanDerWaalsContact O-CD2 3.29Å; Q282-F286 WeakPolarHBondContact O-CD2 3.4Å; Q282-F286 PolarHBondContact O-N 2.77Å |
| 283 | F | 90.9 | Very high | 91.5 | Very high | 169 Ų | 169 | 76.5 Ų | 76.5 | 74% | 0.741 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -60.4 | -23.8 | 178.2 | 178.7 | -98.4 | 0 | 0 | 0 | 114.2 | H279 Y281 | H279-F283 VanDerWaalsContact O-CB 3.29Å; H279-F283 WeakPolarHBondContact O-CB 3.49Å; H279-F283 PolarHBondContact O-N 2.63Å; Y281-F283 VanDerWaalsContact C-N 3.35Å; Y281-F283 PolarHBondContact O-N 2.91Å |
| 284 | R | 88.4 | Confident | 91.1 | Very high | 137 Ų | 137 | 77.8 Ų | 77.8 | 52% | 0.517 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -87.9 | -24.7 | 176.5 | -70.9 | -171.7 | -167.6 | -87.3 | 5.5 | 113.6 | F280 Y281 Q282 | F280-R284 VanDerWaalsContact CZ-CZ 3.45Å; F280-R284 WeakPolarHBondContact O-CG 3.32Å; F280-R284 PolarHBondContact O-N 3.14Å; Y281-R284 PolarHBondContact O-N 2.87Å; Y281-R284 VanDerWaalsContact O-N 3.13Å; Q282-R284 PolarHBondContact O-N 2.75Å; Q282-R284 VanDerWaalsContact O-N 3.11Å |
| 285 | L | 85 | Confident | 90.7 | Very high | 24 Ų | 24 | 83.9 Ų | 83.9 | 13% | 0.126 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -97.9 | -10.9 | -174.4 | -64.9 | 170 | 0 | 0 | 0 | 113.2 | L120 Q124 E127 F128 Y281 Q282 | L120-L285 HydrophobicContact CD1-CD1 3.7Å; L120-L285 HydrophobicContact CD2-CD1 4.23Å; Q124-L285 HydrophobicContact CG-CB 4.37Å; Q124-L285 PolarHBondContact NE2-O 3.04Å; E127-L285 HydrophobicContact CB-CD2 3.65Å; F128-L285 HydrophobicContact CB-CD1 3.97Å; F128-L285 HydrophobicContact CD2-CD1 4.21Å; F128-L285 HydrophobicContact CG-CD1 4.48Å; Y281-L285 VanDerWaalsContact O-CG 3.26Å; Y281-L285 WeakPolarHBondContact O-CG 3.2Å; Y281-L285 PolarHBondContact O-N 2.79Å; Y281-L285 VanDerWaalsContact O-N 3.14Å; Q282-L285 PolarHBondContact O-N 3.19Å; Q282-L285 VanDerWaalsContact O-N 3.08Å |
| 286 | F | 79.2 | Confident | 90.3 | Very high | 172 Ų | 172 | 88 Ų | 88 | 75% | 0.754 | 39% | 0.389 | S | S | * | . | trans | -127.1 | 0 | 179.6 | -66.8 | -82.8 | 0 | 0 | 0 | 109.5 | L120 Q282 | L120-F286 HydrophobicContact CD2-CE2 3.99Å; L120-F286 HydrophobicContact CD2-CZ 4.28Å; Q282-F286 HydrophobicContact CB-CD2 4.23Å; Q282-F286 HydrophobicContact CG-CE2 4.39Å; Q282-F286 VanDerWaalsContact O-CD2 3.29Å; Q282-F286 WeakPolarHBondContact O-CD2 3.4Å; Q282-F286 PolarHBondContact O-N 2.77Å |
Retrieved 286 of 286 residues in 110.8 ms
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