| 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 | 36.5 | Very low | 47.5 | Very low | 246 Ų | 246 | 144.3 Ų | 144.3 | 100% | 1.212 | 82% | 0.821 | S | S | * | * | 0 | 115.3 | 0 | -86.3 | 168.1 | 170.7 | 0 | 0 | 107.6 | |||||
| 2 | C | 44 | Very low | 49.9 | Very low | 130 Ų | 130 | 140.1 Ų | 140.1 | 88% | 0.878 | 80% | 0.8 | S | S | * | * | trans | -77 | 131.2 | -173.4 | -55.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 3 | A | 42.4 | Very low | 52.5 | Low | 101 Ų | 101 | 140.7 Ų | 140.7 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | -135.6 | 79.7 | 159 | 0 | 0 | 0 | 0 | 0 | 107.1 | H5 | A3-H5 PolarHBondContact O-N 3.12Š| ||
| 4 | Q | 44.1 | Very low | 54.9 | Low | 183 Ų | 183 | 135.1 Ų | 135.1 | 86% | 0.855 | 75% | 0.749 | S | S | * | * | trans | -74.5 | 99.4 | 164.9 | -76.4 | 173.1 | -38.7 | 0 | 0 | 106.5 | V6 | Q4-V6 PolarHBondContact O-N 2.94Å; Q4-V6 VanDerWaalsContact O-N 3.13Å | ||
| 5 | H | 41.6 | Very low | 56.8 | Low | 181 Ų | 181 | 133.5 Ų | 133.5 | 84% | 0.838 | 73% | 0.733 | S | S | * | * | trans | -72.1 | 102 | 164.6 | -139.4 | -80.5 | 0 | 0 | 0 | 105.9 | A3 A7 | A3-H5 PolarHBondContact O-N 3.12Å; H5-A7 PolarHBondContact O-N 3.13Å | ||
| 6 | V | 49.8 | Very low | 58.4 | Low | 131 Ų | 131 | 133.6 Ų | 133.6 | 79% | 0.794 | 72% | 0.724 | S | S | * | * | trans | -67.9 | 90.1 | 167.7 | 178.9 | 0 | 0 | 0 | 0 | 105.4 | Q4 D8 | Q4-V6 PolarHBondContact O-N 2.94Å; Q4-V6 VanDerWaalsContact O-N 3.13Å; V6-D8 PolarHBondContact O-N 3.22Å | ||
| 7 | A | 47.7 | Very low | 60 | Low | 72 Ų | 72 | 129.8 Ų | 129.8 | 60% | 0.595 | 71% | 0.706 | S | S | * | * | trans | -66.2 | 114 | 165.6 | 0 | 0 | 0 | 0 | 0 | 105.8 | H5 T9 | H5-A7 PolarHBondContact O-N 3.13Å; A7-T9 PolarHBondContact O-N 2.89Å | ||
| 8 | D | 42.1 | Very low | 61.2 | Low | 139 Ų | 139 | 130.4 Ų | 130.4 | 74% | 0.743 | 71% | 0.708 | S | S | * | * | trans | -41.4 | 108 | 163.3 | -175.4 | 31.2 | 0 | 0 | 0 | 107.9 | V6 S10 | V6-D8 PolarHBondContact O-N 3.22Å; D8-S10 PolarHBondContact O-N 2.75Å | ||
| 9 | T | 48.1 | Very low | 62.3 | Low | 132 Ų | 132 | 134.7 Ų | 134.7 | 81% | 0.81 | 71% | 0.714 | S | S | * | * | trans | -74.5 | 67.3 | 177.7 | 51.6 | 0 | 0 | 0 | 0 | 107.5 | A7 E11 | A7-T9 PolarHBondContact O-N 2.89Å; T9-E11 PolarHBondContact O-N 2.92Å; T9-E11 VanDerWaalsContact O-N 3.12Å | ||
| 10 | S | 58 | Low | 63.5 | Low | 85 Ų | 85 | 133.6 Ų | 133.6 | 59% | 0.594 | 71% | 0.705 | S | S | * | * | trans | -55.4 | 114.2 | 153 | 53.4 | 0 | 0 | 0 | 0 | 105.4 | D8 V12 | D8-S10 PolarHBondContact O-N 2.75Å; S10-V12 PolarHBondContact O-N 2.87Å | ||
| 11 | E | 68.7 | Low | 64.4 | Low | 187 Ų | 187 | 139.1 Ų | 139.1 | 87% | 0.874 | 72% | 0.716 | S | S | * | * | trans | -50.6 | 112.8 | 176.2 | -73.3 | -173.9 | 153.6 | 0 | 0 | 108 | T9 K13 | T9-E11 PolarHBondContact O-N 2.92Å; T9-E11 VanDerWaalsContact O-N 3.12Å; E11-K13 PolarHBondContact O-N 3.19Å | ||
| 12 | V | 76 | Confident | 66.8 | Low | 94 Ų | 94 | 129.6 Ų | 129.6 | 57% | 0.57 | 67% | 0.669 | S | S | * | * | trans | -67.6 | 102.8 | 179.7 | -179.8 | 0 | 0 | 0 | 0 | 106.5 | S10 P23 F24 | S10-V12 PolarHBondContact O-N 2.87Å; V12-P23 HydrophobicContact CB-CG 4.31Å; V12-P23 HydrophobicContact CG1-CG 3.72Å; V12-F24 HydrophobicContact CG1-CE2 4.35Å; V12-F24 WeakPolarHBondContact O-CZ 3.32Å | ||
| 13 | K | 84.1 | Confident | 69 | Low | 148 Ų | 148 | 128.3 Ų | 128.3 | 64% | 0.643 | 66% | 0.658 | S | S | * | * | trans | -83.6 | 134.7 | 178.1 | -168.3 | 176.8 | -177.1 | 176.1 | 0 | 109.3 | E11 Q15 | E11-K13 PolarHBondContact O-N 3.19Å; K13-Q15 PolarHBondContact O-N 3.48Å | ||
| 14 | W | 85 | Confident | 71.1 | Confident | 63 Ų | 63 | 126.1 Ų | 126.1 | 24% | 0.239 | 63% | 0.63 | C | S | . | * | trans | -57 | 136.7 | 172.3 | 179.2 | 90.1 | 0 | 0 | 0 | 110.9 | K16 F24 Y28 D30 | W14-K16 HydrophobicContact CH2-CB 3.63Å; W14-K16 HydrophobicContact CH2-CD 4.41Å; W14-K16 HydrophobicContact CH2-CG 3.79Å; W14-K16 HydrophobicContact CZ2-CB 4.48Å; W14-K16 HydrophobicContact CZ3-CB 3.78Å; W14-K16 HydrophobicContact CZ3-CG 4.36Å; W14-F24 VanDerWaalsContact CA-CE2 3.41Å; W14-F24 HydrophobicContact CB-CD1 4.4Å; W14-F24 HydrophobicContact CB-CD2 4Å; W14-F24 HydrophobicContact CB-CE1 4.08Å; W14-F24 HydrophobicContact CB-CE2 3.67Å; W14-F24 HydrophobicContact CB-CG 4.37Å; W14-F24 HydrophobicContact CB-CZ 3.71Å; W14-F24 AromaticContact CD1-CD2 3.71Å; W14-F24 AromaticContact CD1-CG 3.8Å; W14-F24 HydrophobicContact CG-CD2 4.27Å; W14-F24 HydrophobicContact CG-CE2 4.4Å; W14-F24 HydrophobicContact CG-CG 4.5Å; W14-Y28 HydrophobicContact CB-CD1 4.23Å; W14-Y28 HydrophobicContact CB-CE1 3.69Å; W14-Y28 AromaticContact CD1-CD1 3.36Å; W14-Y28 AromaticContact CD1-CE1 3.74Å; W14-Y28 HydrophobicContact CD2-CD1 4.32Å; W14-Y28 HydrophobicContact CD2-CE1 4.26Å; W14-Y28 AromaticContact CG-CD1 3.72Å; W14-Y28 HydrophobicContact CG-CD1 3.72Å; W14-Y28 AromaticContact CG-CE1 3.61Å; W14-Y28 HydrophobicContact CG-CE1 3.61Å; W14-Y28 AromaticContact NE1-CD1 3.72Å; W14-D30 HydrophobicContact CD2-CB 4.3Å; W14-D30 HydrophobicContact CE3-CB 3.59Å; W14-D30 HydrophobicContact CZ3-CB 3.7Å | ||
| 15 | Q | 83.8 | Confident | 73.2 | Confident | 110 Ų | 110 | 121.9 Ų | 121.9 | 51% | 0.514 | 62% | 0.618 | S | S | . | * | trans | -122.9 | 140.7 | 177.9 | -58.1 | -171.7 | 10.3 | 0 | 0 | 110.8 | K13 V17 Q22 | K13-Q15 PolarHBondContact O-N 3.48Å; Q15-V17 HydrophobicContact CB-CG2 4.09Å; Q15-V17 PolarHBondContact O-N 3.47Å; Q15-Q22 PolarHBondContact O-NE2 3.47Å; Q15-Q22 PolarHBondContact O-OE1 2.97Å | ||
| 16 | K | 83.1 | Confident | 75.2 | Confident | 136 Ų | 136 | 121.5 Ų | 121.5 | 59% | 0.591 | 62% | 0.623 | S | S | * | * | trans | -80.8 | 64.6 | 179.2 | -163.6 | 177.9 | -169.6 | 175.9 | 0 | 111.2 | W14 E36 | W14-K16 HydrophobicContact CH2-CB 3.63Å; W14-K16 HydrophobicContact CH2-CD 4.41Å; W14-K16 HydrophobicContact CH2-CG 3.79Å; W14-K16 HydrophobicContact CZ2-CB 4.48Å; W14-K16 HydrophobicContact CZ3-CB 3.78Å; W14-K16 HydrophobicContact CZ3-CG 4.36Å; K16-E36 IonicContact NZ-OE2 2.78Å; K16-E36 PolarHBondContact NZ-OE2 2.79Å | ||
| 17 | V | 84.4 | Confident | 76.8 | Confident | 68 Ų | 68 | 122.7 Ų | 122.7 | 41% | 0.412 | 63% | 0.625 | S | S | . | * | trans | -116.3 | 131 | -179.9 | -178.6 | 0 | 0 | 0 | 0 | 108.9 | Q15 Y19 E20 | Q15-V17 HydrophobicContact CB-CG2 4.09Å; Q15-V17 PolarHBondContact O-N 3.47Å; V17-Y19 PolarHBondContact O-N 3.36Å; V17-E20 HydrophobicContact CB-CB 4.11Å; V17-E20 HydrophobicContact CG1-CB 3.73Å | ||
| 18 | L | 82.2 | Confident | 78.7 | Confident | 141 Ų | 141 | 123.5 Ų | 123.5 | 74% | 0.738 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -72 | -30 | -168.2 | -173.1 | 61.5 | 0 | 0 | 0 | 114.5 | ||
| 19 | Y | 82.8 | Confident | 80.6 | Confident | 212 Ų | 212 | 121.1 Ų | 121.1 | 83% | 0.831 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -125.8 | 8.3 | -169.3 | -61.1 | -66.7 | 0 | 0 | 0 | 114.7 | V17 | V17-Y19 PolarHBondContact O-N 3.36Š|
| 20 | E | 85.3 | Confident | 82.4 | Confident | 113 Ų | 113 | 116.6 Ų | 116.6 | 53% | 0.528 | 57% | 0.574 | S | S | . | * | trans | -91.9 | 131.9 | -178.4 | -169.1 | 165.3 | -172.4 | 0 | 0 | 110.9 | V17 Q22 | V17-E20 HydrophobicContact CB-CB 4.11Å; V17-E20 HydrophobicContact CG1-CB 3.73Å; E20-Q22 PolarHBondContact O-N 2.93Å | ||
| 21 | R | 82.5 | Confident | 83.7 | Confident | 249 Ų | 249 | 120.9 Ų | 120.9 | 94% | 0.94 | 59% | 0.585 | S | S | * | * | trans | -75.2 | 115.2 | 176.5 | -83.4 | -173.9 | 167.5 | 178.7 | -2.9 | 109.7 | ||||
| 22 | Q | 87.4 | Confident | 84.2 | Confident | 47 Ų | 47 | 118.6 Ų | 118.6 | 22% | 0.22 | 57% | 0.568 | C | S | . | * | trans | -120.5 | 154.5 | 179.4 | -59.4 | 176.6 | 49 | 0 | 0 | 110.8 | Q15 E20 F24 | Q15-Q22 PolarHBondContact O-NE2 3.47Å; Q15-Q22 PolarHBondContact O-OE1 2.97Å; E20-Q22 PolarHBondContact O-N 2.93Å; Q22-F24 HydrophobicContact CB-CD2 3.86Å; Q22-F24 PolarHBondContact O-N 3.32Å | ||
| 23 | P | 89.6 | Confident | 84.6 | Confident | 102 Ų | 102 | 118.1 Ų | 118.1 | 66% | 0.662 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -79.1 | 44.7 | -179 | 35.2 | -37.4 | 0 | 0 | 0 | 112.5 | V12 | V12-P23 HydrophobicContact CB-CG 4.31Å; V12-P23 HydrophobicContact CG1-CG 3.72Å |
| 24 | F | 86.9 | Confident | 84.5 | Confident | 56 Ų | 56 | 117 Ų | 117 | 25% | 0.246 | 56% | 0.559 | C | S | . | * | S | Bend | trans | -123.6 | 147.1 | 177.7 | -63.6 | -82.9 | 0 | 0 | 0 | 109.6 | V12 W14 Q22 Y28 | V12-F24 HydrophobicContact CG1-CE2 4.35Å; V12-F24 WeakPolarHBondContact O-CZ 3.32Å; W14-F24 VanDerWaalsContact CA-CE2 3.41Å; W14-F24 HydrophobicContact CB-CD1 4.4Å; W14-F24 HydrophobicContact CB-CD2 4Å; W14-F24 HydrophobicContact CB-CE1 4.08Å; W14-F24 HydrophobicContact CB-CE2 3.67Å; W14-F24 HydrophobicContact CB-CG 4.37Å; W14-F24 HydrophobicContact CB-CZ 3.71Å; W14-F24 AromaticContact CD1-CD2 3.71Å; W14-F24 AromaticContact CD1-CG 3.8Å; W14-F24 HydrophobicContact CG-CD2 4.27Å; W14-F24 HydrophobicContact CG-CE2 4.4Å; W14-F24 HydrophobicContact CG-CG 4.5Å; Q22-F24 HydrophobicContact CB-CD2 3.86Å; Q22-F24 PolarHBondContact O-N 3.32Å; F24-Y28 HydrophobicContact CB-CD1 4.26Å; F24-Y28 HydrophobicContact CB-CG 4.14Å; F24-Y28 AromaticContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD2 4.19Å; F24-Y28 AromaticContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE2 4.22Å; F24-Y28 HydrophobicContact CD1-CG 4.04Å; F24-Y28 HydrophobicContact CE1-CE1 4.26Å; F24-Y28 HydrophobicContact CG-CD1 4.22Å; F24-Y28 HydrophobicContact CG-CG 4.41Å |
| 25 | P | 87.8 | Confident | 84.3 | Confident | 93 Ų | 93 | 120.7 Ų | 120.7 | 60% | 0.604 | 58% | 0.579 | S | S | * | * | trans | -65.1 | 151 | 175.4 | 25.2 | -29.9 | 0 | 0 | 0 | 110.8 | N27 Y28 | P25-N27 PolarHBondContact O-N 3.25Å; P25-Y28 WeakPolarHBondContact O-CB 3.42Å; P25-Y28 PolarHBondContact O-N 3.37Å | ||
| 26 | D | 83.7 | Confident | 84.1 | Confident | 173 Ų | 173 | 120.7 Ų | 120.7 | 93% | 0.925 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | -27.6 | -177.2 | -99.5 | 15.7 | 0 | 0 | 0 | 114.2 | ||
| 27 | N | 84.9 | Confident | 84 | Confident | 157 Ų | 157 | 118.3 Ų | 118.3 | 84% | 0.84 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | 7.6 | 179 | -66.7 | -21 | 0 | 0 | 0 | 113.6 | P25 V29 | P25-N27 PolarHBondContact O-N 3.25Å; N27-V29 PolarHBondContact O-N 2.98Å |
| 28 | Y | 86.1 | Confident | 83.7 | Confident | 88 Ų | 88 | 124 Ų | 124 | 35% | 0.345 | 59% | 0.586 | S | S | . | * | trans | -72.3 | 128.4 | 178.8 | -173.4 | -91.9 | 0 | 0 | 0 | 110.8 | W14 F24 P25 | W14-Y28 HydrophobicContact CB-CD1 4.23Å; W14-Y28 HydrophobicContact CB-CE1 3.69Å; W14-Y28 AromaticContact CD1-CD1 3.36Å; W14-Y28 AromaticContact CD1-CE1 3.74Å; W14-Y28 HydrophobicContact CD2-CD1 4.32Å; W14-Y28 HydrophobicContact CD2-CE1 4.26Å; W14-Y28 AromaticContact CG-CD1 3.72Å; W14-Y28 HydrophobicContact CG-CD1 3.72Å; W14-Y28 AromaticContact CG-CE1 3.61Å; W14-Y28 HydrophobicContact CG-CE1 3.61Å; W14-Y28 AromaticContact NE1-CD1 3.72Å; F24-Y28 HydrophobicContact CB-CD1 4.26Å; F24-Y28 HydrophobicContact CB-CG 4.14Å; F24-Y28 AromaticContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD1 3.94Å; F24-Y28 HydrophobicContact CD1-CD2 4.19Å; F24-Y28 AromaticContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE1 3.97Å; F24-Y28 HydrophobicContact CD1-CE2 4.22Å; F24-Y28 HydrophobicContact CD1-CG 4.04Å; F24-Y28 HydrophobicContact CE1-CE1 4.26Å; F24-Y28 HydrophobicContact CG-CD1 4.22Å; F24-Y28 HydrophobicContact CG-CG 4.41Å; P25-Y28 WeakPolarHBondContact O-CB 3.42Å; P25-Y28 PolarHBondContact O-N 3.37Å | ||
| 29 | V | 81.9 | Confident | 83.3 | Confident | 89 Ų | 89 | 126.1 Ų | 126.1 | 54% | 0.539 | 59% | 0.589 | S | S | . | * | trans | -123.3 | 139.2 | 168.8 | -66.9 | 0 | 0 | 0 | 0 | 108.7 | N27 F33 | N27-V29 PolarHBondContact O-N 2.98Å; V29-F33 HydrophobicContact CB-CB 4.42Å; V29-F33 HydrophobicContact CB-CG 4.47Å | ||
| 30 | D | 87.1 | Confident | 82.6 | Confident | 37 Ų | 37 | 122 Ų | 122 | 20% | 0.198 | 58% | 0.582 | C | S | . | * | trans | -66.3 | 151.6 | 176.2 | -173.7 | 29.6 | 0 | 0 | 0 | 111.4 | W14 R32 F33 | W14-D30 HydrophobicContact CD2-CB 4.3Å; W14-D30 HydrophobicContact CE3-CB 3.59Å; W14-D30 HydrophobicContact CZ3-CB 3.7Å; D30-R32 PolarHBondContact O-N 3.19Å; D30-R32 WeakPolarHBondContact OD2-CB 3.17Å; D30-R32 WeakPolarHBondContact OD2-CG 3.32Å; D30-F33 WeakPolarHBondContact O-CB 3.43Å; D30-F33 PolarHBondContact O-N 2.9Å | ||
| 31 | Q | 83.9 | Confident | 81.9 | Confident | 175 Ų | 175 | 120.6 Ų | 120.6 | 82% | 0.818 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -60.5 | -30 | 178.6 | -64.9 | -176.8 | -6.3 | 0 | 0 | 111.8 | F33 | Q31-F33 PolarHBondContact O-N 3.47Š|
| 32 | R | 80.6 | Confident | 81.5 | Confident | 140 Ų | 140 | 118.5 Ų | 118.5 | 53% | 0.528 | 57% | 0.571 | S | S | . | * | G | 310 helix | trans | -76.5 | -8 | 178 | -48.9 | -172.7 | 97.7 | 175.4 | 13.6 | 113.5 | D30 L34 E35 E36 | D30-R32 PolarHBondContact O-N 3.19Å; D30-R32 WeakPolarHBondContact OD2-CB 3.17Å; D30-R32 WeakPolarHBondContact OD2-CG 3.32Å; R32-L34 VanDerWaalsContact C-N 3.26Å; R32-L34 PolarHBondContact O-N 2.86Å; R32-E35 IonicContact NE-OE2 3.81Å; R32-E35 PolarHBondContact NE-OE2 3.49Å; R32-E35 WeakPolarHBondContact O-CA 3.09Å; R32-E35 WeakPolarHBondContact O-CB 3.48Å; R32-E35 PolarHBondContact O-N 3.26Å; R32-E36 PolarHBondContact O-N 3.37Å |
| 33 | F | 83.5 | Confident | 80.8 | Confident | 83 Ų | 83 | 119 Ų | 119 | 36% | 0.364 | 58% | 0.583 | S | S | . | * | G | 310 helix | trans | -53.5 | -44.7 | 179.8 | 172.8 | -101.9 | 0 | 0 | 0 | 112.1 | V29 D30 Q31 E35 E36 L37 | V29-F33 HydrophobicContact CB-CB 4.42Å; V29-F33 HydrophobicContact CB-CG 4.47Å; D30-F33 WeakPolarHBondContact O-CB 3.43Å; D30-F33 PolarHBondContact O-N 2.9Å; Q31-F33 PolarHBondContact O-N 3.47Å; F33-E35 VanDerWaalsContact C-N 3.34Å; F33-E36 PolarHBondContact O-N 2.82Å; F33-L37 HydrophobicContact CE1-CD1 4.3Å; F33-L37 HydrophobicContact CZ-CD2 4.42Å; F33-L37 PolarHBondContact O-N 3.48Å |
| 34 | L | 82.2 | Confident | 79.8 | Confident | 125 Ų | 125 | 124 Ų | 124 | 65% | 0.654 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | -28.2 | 178.4 | -62.8 | -179.8 | 0 | 0 | 0 | 112.3 | R32 E36 L37 | R32-L34 VanDerWaalsContact C-N 3.26Å; R32-L34 PolarHBondContact O-N 2.86Å; L34-E36 VanDerWaalsContact C-N 3.31Å; L34-L37 HydrophobicContact CD2-CD1 3.58Å; L34-L37 WeakPolarHBondContact O-CB 3.47Å; L34-L37 PolarHBondContact O-N 3.02Å |
| 35 | E | 81.1 | Confident | 79.2 | Confident | 140 Ų | 140 | 130.5 Ų | 130.5 | 65% | 0.654 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -33.8 | 173.5 | -55.5 | 179.5 | 165.6 | 0 | 0 | 111.2 | R32 F33 L37 | R32-E35 IonicContact NE-OE2 3.81Å; R32-E35 PolarHBondContact NE-OE2 3.49Å; R32-E35 WeakPolarHBondContact O-CA 3.09Å; R32-E35 WeakPolarHBondContact O-CB 3.48Å; R32-E35 PolarHBondContact O-N 3.26Å; F33-E35 VanDerWaalsContact C-N 3.34Å; E35-L37 VanDerWaalsContact C-N 3.3Å; E35-L37 PolarHBondContact O-N 2.91Å |
| 36 | E | 79.3 | Confident | 78.4 | Confident | 110 Ų | 110 | 134.4 Ų | 134.4 | 51% | 0.514 | 62% | 0.62 | S | S | . | * | S | Bend | trans | -77.3 | -11.7 | 176 | -70.7 | -176.4 | 179.2 | 0 | 0 | 113.7 | K16 R32 F33 L34 R38 | K16-E36 IonicContact NZ-OE2 2.78Å; K16-E36 PolarHBondContact NZ-OE2 2.79Å; R32-E36 PolarHBondContact O-N 3.37Å; F33-E36 PolarHBondContact O-N 2.82Å; L34-E36 VanDerWaalsContact C-N 3.31Å; E36-R38 VanDerWaalsContact C-N 3.32Å; E36-R38 PolarHBondContact O-N 2.8Å |
| 37 | L | 81.5 | Confident | 78.3 | Confident | 87 Ų | 87 | 132.7 Ų | 132.7 | 46% | 0.455 | 61% | 0.607 | S | S | . | * | trans | -70.7 | 86.8 | 178.4 | -75.4 | -179.5 | 0 | 0 | 0 | 111.2 | F33 L34 E35 K39 | F33-L37 HydrophobicContact CE1-CD1 4.3Å; F33-L37 HydrophobicContact CZ-CD2 4.42Å; F33-L37 PolarHBondContact O-N 3.48Å; L34-L37 HydrophobicContact CD2-CD1 3.58Å; L34-L37 WeakPolarHBondContact O-CB 3.47Å; L34-L37 PolarHBondContact O-N 3.02Å; E35-L37 VanDerWaalsContact C-N 3.3Å; E35-L37 PolarHBondContact O-N 2.91Å; L37-K39 PolarHBondContact O-N 3.32Å | ||
| 38 | R | 77.6 | Confident | 78.2 | Confident | 187 Ų | 187 | 133.4 Ų | 133.4 | 71% | 0.706 | 60% | 0.599 | S | S | * | * | trans | -79.4 | 103.8 | 169.2 | -63.4 | -165.7 | 76.5 | 176.3 | 5.1 | 110.4 | E36 I41 | E36-R38 VanDerWaalsContact C-N 3.32Å; E36-R38 PolarHBondContact O-N 2.8Å; R38-I41 HydrophobicContact CB-CD1 3.45Å; R38-I41 VanDerWaalsContact CB-CD1 3.45Å; R38-I41 HydrophobicContact CB-CG1 3.55Å; R38-I41 HydrophobicContact CG-CD1 4.15Å; R38-I41 HydrophobicContact CG-CG1 4.44Å | ||
| 39 | K | 73.8 | Confident | 78.4 | Confident | 185 Ų | 185 | 137.6 Ų | 137.6 | 80% | 0.804 | 61% | 0.614 | S | S | * | * | trans | -85.3 | 132.7 | 170.6 | -67 | -179.6 | -176.2 | 173.1 | 0 | 110.3 | L37 I41 | L37-K39 PolarHBondContact O-N 3.32Å; K39-I41 PolarHBondContact O-N 3.37Å | ||
| 40 | N | 68.7 | Low | 78.5 | Confident | 127 Ų | 127 | 135.9 Ų | 135.9 | 68% | 0.679 | 61% | 0.61 | S | S | * | * | trans | 55.2 | 48.4 | 166.1 | -152.2 | -0.6 | 0 | 0 | 0 | 115.1 | Y42 A43 | N40-Y42 PolarHBondContact O-N 3.4Å; N40-Y42 VanDerWaalsContact O-N 3.16Å; N40-A43 PolarHBondContact O-N 3.16Å; N40-A43 WeakPolarHBondContact OD1-CB 3.42Å; N40-A43 PolarHBondContact OD1-N 3.3Å | ||
| 41 | I | 69.3 | Low | 78.5 | Confident | 82 Ų | 82 | 137.6 Ų | 137.6 | 42% | 0.421 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58.4 | -27.8 | -179.8 | -55.1 | 171.4 | 0 | 0 | 0 | 112.2 | R38 K39 | R38-I41 HydrophobicContact CB-CD1 3.45Å; R38-I41 VanDerWaalsContact CB-CD1 3.45Å; R38-I41 HydrophobicContact CB-CG1 3.55Å; R38-I41 HydrophobicContact CG-CD1 4.15Å; R38-I41 HydrophobicContact CG-CG1 4.44Å; K39-I41 PolarHBondContact O-N 3.37Å |
| 42 | Y | 74.5 | Confident | 78.7 | Confident | 206 Ų | 206 | 131.7 Ų | 131.7 | 81% | 0.808 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.6 | 23.8 | -172.5 | -57.8 | -70.6 | 0 | 0 | 0 | 114 | N40 R44 | N40-Y42 PolarHBondContact O-N 3.4Å; N40-Y42 VanDerWaalsContact O-N 3.16Å; Y42-R44 PolarHBondContact O-N 3.08Å |
| 43 | A | 72.4 | Confident | 79 | Confident | 57 Ų | 57 | 131.7 Ų | 131.7 | 47% | 0.471 | 60% | 0.601 | S | S | . | * | trans | -60.9 | 106 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111 | N40 K45 | N40-A43 PolarHBondContact O-N 3.16Å; N40-A43 WeakPolarHBondContact OD1-CB 3.42Å; N40-A43 PolarHBondContact OD1-N 3.3Å; A43-K45 PolarHBondContact O-N 3.33Å | ||
| 44 | R | 69.1 | Low | 79.2 | Confident | 208 Ų | 208 | 134.9 Ų | 134.9 | 79% | 0.785 | 62% | 0.617 | S | S | * | * | trans | -73.3 | 114.2 | 171.8 | -90.3 | 175.1 | -177.9 | 157 | 2.3 | 109.7 | Y42 Y46 | Y42-R44 PolarHBondContact O-N 3.08Å; R44-Y46 HydrophobicContact CB-CD2 4.27Å; R44-Y46 HydrophobicContact CB-CE2 3.89Å; R44-Y46 PolarHBondContact O-N 3.5Å | ||
| 45 | K | 73.4 | Confident | 79.5 | Confident | 192 Ų | 192 | 131.3 Ų | 131.3 | 84% | 0.835 | 60% | 0.602 | S | S | * | * | trans | -79.5 | 96.6 | 168.9 | -64.8 | -171.2 | -179.8 | -176.7 | 0 | 108.7 | A43 | A43-K45 PolarHBondContact O-N 3.33Š| ||
| 46 | Y | 72.5 | Confident | 80.1 | Confident | 174 Ų | 174 | 127.1 Ų | 127.1 | 68% | 0.682 | 59% | 0.589 | S | S | * | * | trans | -69.7 | 129.3 | 170.2 | -75.9 | -89.2 | 0 | 0 | 0 | 109.5 | R44 Y48 V51 | R44-Y46 HydrophobicContact CB-CD2 4.27Å; R44-Y46 HydrophobicContact CB-CE2 3.89Å; R44-Y46 PolarHBondContact O-N 3.5Å; Y46-Y48 PolarHBondContact O-N 3.05Å; Y46-V51 HydrophobicContact CD1-CG2 4.03Å; Y46-V51 HydrophobicContact CG-CG2 4.35Å | ||
| 47 | Q | 81.6 | Confident | 80.7 | Confident | 137 Ų | 137 | 126.1 Ų | 126.1 | 64% | 0.64 | 59% | 0.59 | S | S | * | * | trans | -72 | 117.7 | 170.6 | -63.8 | -61.4 | -51.3 | 0 | 0 | 107.7 | W49 A50 V51 | Q47-W49 VanDerWaalsContact C-N 3.26Å; Q47-W49 PolarHBondContact O-N 3.18Å; Q47-A50 HydrophobicContact CB-CB 4.15Å; Q47-A50 WeakPolarHBondContact O-CB 3.47Å; Q47-A50 PolarHBondContact O-N 3.27Å; Q47-V51 PolarHBondContact O-N 3.38Å | ||
| 48 | Y | 83 | Confident | 81.2 | Confident | 172 Ų | 172 | 127.1 Ų | 127.1 | 68% | 0.675 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -49.7 | -47.4 | -176.2 | 176.5 | -100.7 | 0 | 0 | 0 | 112.2 | Y46 A50 V51 V52 | Y46-Y48 PolarHBondContact O-N 3.05Å; Y48-A50 PolarHBondContact O-N 3.23Å; Y48-V51 PolarHBondContact O-N 3.21Å; Y48-V52 HydrophobicContact CD1-CG2 4.06Å; Y48-V52 HydrophobicContact CE1-CG2 3.66Å; Y48-V52 HydrophobicContact CE2-CG2 4.18Å; Y48-V52 HydrophobicContact CG-CG2 4.48Å; Y48-V52 WeakPolarHBondContact O-CG2 3.23Å; Y48-V52 PolarHBondContact O-N 2.98Å |
| 49 | W | 88.5 | Confident | 82 | Confident | 176 Ų | 176 | 122.9 Ų | 122.9 | 67% | 0.667 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -59.9 | -41.3 | 179.5 | -71.9 | 108.5 | 0 | 0 | 0 | 113.8 | Q47 V51 V52 F53 | Q47-W49 VanDerWaalsContact C-N 3.26Å; Q47-W49 PolarHBondContact O-N 3.18Å; W49-V51 VanDerWaalsContact C-N 3.3Å; W49-V51 PolarHBondContact O-N 3.33Å; W49-V52 PolarHBondContact O-N 2.9Å; W49-F53 HydrophobicContact CE3-CE2 4.42Å; W49-F53 WeakPolarHBondContact O-CD2 3.46Å; W49-F53 PolarHBondContact O-N 3.39Å |
| 50 | A | 85.9 | Confident | 82.9 | Confident | 54 Ų | 54 | 120.4 Ų | 120.4 | 45% | 0.446 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.6 | -43.7 | 178 | 0 | 0 | 0 | 0 | 0 | 110.6 | Q47 Y48 V52 F53 E54 | Q47-A50 HydrophobicContact CB-CB 4.15Å; Q47-A50 WeakPolarHBondContact O-CB 3.47Å; Q47-A50 PolarHBondContact O-N 3.27Å; Y48-A50 PolarHBondContact O-N 3.23Å; A50-V52 VanDerWaalsContact C-N 3.33Å; A50-V52 PolarHBondContact O-N 3.26Å; A50-F53 PolarHBondContact O-N 3.33Å; A50-E54 VanDerWaalsContact O-CG 3.28Å; A50-E54 WeakPolarHBondContact O-CG 3.48Å; A50-E54 PolarHBondContact O-N 3.39Å |
| 51 | V | 86.3 | Confident | 84.2 | Confident | 72 Ų | 72 | 120.3 Ų | 120.3 | 44% | 0.436 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.5 | -39.2 | 177.3 | -176.8 | 0 | 0 | 0 | 0 | 111.4 | Y46 Q47 Y48 W49 E54 S55 | Y46-V51 HydrophobicContact CD1-CG2 4.03Å; Y46-V51 HydrophobicContact CG-CG2 4.35Å; Q47-V51 PolarHBondContact O-N 3.38Å; Y48-V51 PolarHBondContact O-N 3.21Å; W49-V51 VanDerWaalsContact C-N 3.3Å; W49-V51 PolarHBondContact O-N 3.33Å; V51-E54 PolarHBondContact O-N 2.99Å; V51-S55 VanDerWaalsContact O-CB 3.31Å; V51-S55 WeakPolarHBondContact O-CB 3.27Å; V51-S55 PolarHBondContact O-N 2.96Å; V51-S55 PolarHBondContact O-OG 2.89Å; V51-S55 VanDerWaalsContact O-OG 3.13Å |
| 52 | V | 87.8 | Confident | 85.5 | Confident | 51 Ų | 51 | 121.9 Ų | 121.9 | 31% | 0.309 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.7 | -48.2 | 175.9 | 173 | 0 | 0 | 0 | 0 | 110.9 | Y48 W49 A50 E54 S55 S56 | Y48-V52 HydrophobicContact CD1-CG2 4.06Å; Y48-V52 HydrophobicContact CE1-CG2 3.66Å; Y48-V52 HydrophobicContact CE2-CG2 4.18Å; Y48-V52 HydrophobicContact CG-CG2 4.48Å; Y48-V52 WeakPolarHBondContact O-CG2 3.23Å; Y48-V52 PolarHBondContact O-N 2.98Å; W49-V52 PolarHBondContact O-N 2.9Å; A50-V52 VanDerWaalsContact C-N 3.33Å; A50-V52 PolarHBondContact O-N 3.26Å; V52-E54 PolarHBondContact O-N 3.5Å; V52-S55 WeakPolarHBondContact CA-OG 3.45Å; V52-S55 PolarHBondContact O-N 3.34Å; V52-S55 PolarHBondContact O-OG 3.27Å; V52-S56 WeakPolarHBondContact O-CB 3.47Å; V52-S56 PolarHBondContact O-N 2.91Å |
| 53 | F | 87.1 | Confident | 86.4 | Confident | 141 Ų | 141 | 115.3 Ų | 115.3 | 62% | 0.618 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.3 | -45.5 | 177.4 | -79.6 | -67.3 | 0 | 0 | 0 | 112.3 | W49 A50 S55 S56 | W49-F53 HydrophobicContact CE3-CE2 4.42Å; W49-F53 WeakPolarHBondContact O-CD2 3.46Å; W49-F53 PolarHBondContact O-N 3.39Å; A50-F53 PolarHBondContact O-N 3.33Å; F53-S55 VanDerWaalsContact C-N 3.35Å; F53-S55 PolarHBondContact O-N 3.15Å; F53-S56 WeakPolarHBondContact O-CB 3.28Å; F53-S56 PolarHBondContact O-N 3.11Å; F53-S56 PolarHBondContact O-OG 2.94Å |
| 54 | E | 87.1 | Confident | 87.5 | Confident | 150 Ų | 150 | 116 Ų | 116 | 70% | 0.701 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.2 | -41.2 | 177.6 | -66.9 | -63 | 150.9 | 0 | 0 | 111.7 | A50 V51 V52 S56 | A50-E54 VanDerWaalsContact O-CG 3.28Å; A50-E54 WeakPolarHBondContact O-CG 3.48Å; A50-E54 PolarHBondContact O-N 3.39Å; V51-E54 PolarHBondContact O-N 2.99Å; V52-E54 PolarHBondContact O-N 3.5Å; E54-S56 VanDerWaalsContact C-N 3.3Å; E54-S56 PolarHBondContact O-N 3.37Å |
| 55 | S | 90.1 | Very high | 88.8 | Confident | 49 Ų | 49 | 110.3 Ų | 110.3 | 34% | 0.343 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -71.3 | -23.7 | 177.8 | 71.2 | 0 | 0 | 0 | 0 | 113.9 | V51 V52 F53 V57 V58 I59 | V51-S55 VanDerWaalsContact O-CB 3.31Å; V51-S55 WeakPolarHBondContact O-CB 3.27Å; V51-S55 PolarHBondContact O-N 2.96Å; V51-S55 PolarHBondContact O-OG 2.89Å; V51-S55 VanDerWaalsContact O-OG 3.13Å; V52-S55 WeakPolarHBondContact CA-OG 3.45Å; V52-S55 PolarHBondContact O-N 3.34Å; V52-S55 PolarHBondContact O-OG 3.27Å; F53-S55 VanDerWaalsContact C-N 3.35Å; F53-S55 PolarHBondContact O-N 3.15Å; S55-V57 PolarHBondContact O-N 3.47Å; S55-V58 PolarHBondContact O-N 2.87Å; S55-I59 PolarHBondContact O-N 3.4Å |
| 56 | S | 91.9 | Very high | 89.9 | Confident | 52 Ų | 52 | 104.4 Ų | 104.4 | 36% | 0.364 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.5 | -30.8 | -175.8 | 75.1 | 0 | 0 | 0 | 0 | 112.8 | V52 F53 E54 V58 I59 Q60 | V52-S56 WeakPolarHBondContact O-CB 3.47Å; V52-S56 PolarHBondContact O-N 2.91Å; F53-S56 WeakPolarHBondContact O-CB 3.28Å; F53-S56 PolarHBondContact O-N 3.11Å; F53-S56 PolarHBondContact O-OG 2.94Å; E54-S56 VanDerWaalsContact C-N 3.3Å; E54-S56 PolarHBondContact O-N 3.37Å; S56-V58 VanDerWaalsContact C-N 3.33Å; S56-V58 PolarHBondContact O-N 3.48Å; S56-I59 PolarHBondContact O-N 3.05Å; S56-Q60 WeakPolarHBondContact O-CB 3.47Å; S56-Q60 PolarHBondContact O-N 3.33Å |
| 57 | V | 91.7 | Very high | 90.9 | Very high | 90 Ų | 90 | 100 Ų | 100 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 179 | 179.4 | 0 | 0 | 0 | 0 | 110.8 | S55 Q60 Q61 | S55-V57 PolarHBondContact O-N 3.47Å; V57-Q60 PolarHBondContact O-N 2.93Å; V57-Q61 WeakPolarHBondContact O-CG 3.37Å; V57-Q61 PolarHBondContact O-N 3.03Å |
| 58 | V | 92.6 | Very high | 91.4 | Very high | 107 Ų | 107 | 100 Ų | 100 | 65% | 0.648 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.9 | -42 | 178.5 | -178.6 | 0 | 0 | 0 | 0 | 110.5 | S55 S56 Q60 Q61 L62 | S55-V58 PolarHBondContact O-N 2.87Å; S56-V58 VanDerWaalsContact C-N 3.33Å; S56-V58 PolarHBondContact O-N 3.48Å; V58-Q60 VanDerWaalsContact C-N 3.31Å; V58-Q60 PolarHBondContact O-N 2.91Å; V58-Q61 PolarHBondContact O-N 3.01Å; V58-L62 PolarHBondContact O-N 3.28Å |
| 59 | I | 94 | Very high | 92 | Very high | 99 Ų | 99 | 95.8 Ų | 95.8 | 51% | 0.508 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63 | -39.8 | 177.8 | -62.8 | 170.5 | 0 | 0 | 0 | 110.8 | S55 S56 Q61 L62 C63 | S55-I59 PolarHBondContact O-N 3.4Å; S56-I59 PolarHBondContact O-N 3.05Å; I59-Q61 PolarHBondContact O-N 3.47Å; I59-L62 PolarHBondContact O-N 3.44Å; I59-C63 WeakPolarHBondContact O-CB 3.09Å; I59-C63 PolarHBondContact O-N 2.99Å |
| 60 | Q | 94.3 | Very high | 92.2 | Very high | 133 Ų | 133 | 91 Ų | 91 | 62% | 0.621 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.5 | -44.5 | 177.3 | -175.5 | 66.9 | 14.4 | 0 | 0 | 111.5 | S56 V57 V58 C63 S64 | S56-Q60 WeakPolarHBondContact O-CB 3.47Å; S56-Q60 PolarHBondContact O-N 3.33Å; V57-Q60 PolarHBondContact O-N 2.93Å; V58-Q60 VanDerWaalsContact C-N 3.31Å; V58-Q60 PolarHBondContact O-N 2.91Å; Q60-C63 PolarHBondContact O-N 3.21Å; Q60-S64 WeakPolarHBondContact O-CB 3.39Å; Q60-S64 PolarHBondContact O-N 3.43Å |
| 61 | Q | 95.3 | Very high | 92.4 | Very high | 124 Ų | 124 | 91.1 Ų | 91.1 | 58% | 0.579 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -43.5 | 177.4 | -66.1 | -61.7 | -14.3 | 0 | 0 | 111.3 | V57 V58 I59 S64 V65 | V57-Q61 WeakPolarHBondContact O-CG 3.37Å; V57-Q61 PolarHBondContact O-N 3.03Å; V58-Q61 PolarHBondContact O-N 3.01Å; I59-Q61 PolarHBondContact O-N 3.47Å; Q61-S64 WeakPolarHBondContact O-CB 3.34Å; Q61-S64 PolarHBondContact O-N 3.23Å; Q61-V65 WeakPolarHBondContact O-CG2 3.23Å; Q61-V65 PolarHBondContact O-N 3.43Å; Q61-V65 VanDerWaalsContact O-N 3.11Å |
| 62 | L | 95.7 | Very high | 92.5 | Very high | 115 Ų | 115 | 95.5 Ų | 95.5 | 60% | 0.602 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.8 | -46.5 | 175.8 | -172.8 | 70.8 | 0 | 0 | 0 | 111.6 | V58 I59 S64 V65 C66 | V58-L62 PolarHBondContact O-N 3.28Å; I59-L62 PolarHBondContact O-N 3.44Å; L62-S64 VanDerWaalsContact C-N 3.32Å; L62-S64 PolarHBondContact O-N 2.95Å; L62-V65 PolarHBondContact O-N 3.41Å; L62-C66 PolarHBondContact O-N 3.44Å; L62-C66 PolarHBondContact O-SG 3.12Å |
| 63 | C | 95.3 | Very high | 92.7 | Very high | 69 Ų | 69 | 100.7 Ų | 100.7 | 47% | 0.466 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.8 | -42.3 | 175.4 | -96.7 | 0 | 0 | 0 | 0 | 111.9 | I59 Q60 V65 C66 V67 | I59-C63 WeakPolarHBondContact O-CB 3.09Å; I59-C63 PolarHBondContact O-N 2.99Å; Q60-C63 PolarHBondContact O-N 3.21Å; C63-V65 VanDerWaalsContact C-N 3.35Å; C63-V65 PolarHBondContact O-N 3.41Å; C63-C66 PolarHBondContact O-N 2.9Å; C63-V67 WeakPolarHBondContact O-CB 3.44Å; C63-V67 VanDerWaalsContact O-CG2 3.29Å; C63-V67 WeakPolarHBondContact O-CG2 3.31Å; C63-V67 PolarHBondContact O-N 2.86Å |
| 64 | S | 94.6 | Very high | 92.7 | Very high | 70 Ų | 70 | 99.5 Ų | 99.5 | 49% | 0.49 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -57.7 | -46.8 | 176.9 | -173.3 | 0 | 0 | 0 | 0 | 111.7 | Q60 Q61 L62 V67 F68 | Q60-S64 WeakPolarHBondContact O-CB 3.39Å; Q60-S64 PolarHBondContact O-N 3.43Å; Q61-S64 WeakPolarHBondContact O-CB 3.34Å; Q61-S64 PolarHBondContact O-N 3.23Å; L62-S64 VanDerWaalsContact C-N 3.32Å; L62-S64 PolarHBondContact O-N 2.95Å; S64-V67 PolarHBondContact O-N 3.13Å; S64-F68 WeakPolarHBondContact O-CB 3.28Å; S64-F68 PolarHBondContact O-N 3.46Å |
| 65 | V | 96.5 | Very high | 92.8 | Very high | 90 Ų | 90 | 96.1 Ų | 96.1 | 55% | 0.545 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63 | -46.3 | 176.6 | 177.2 | 0 | 0 | 0 | 0 | 111.1 | Q61 L62 C63 V67 F68 V69 | Q61-V65 WeakPolarHBondContact O-CG2 3.23Å; Q61-V65 PolarHBondContact O-N 3.43Å; Q61-V65 VanDerWaalsContact O-N 3.11Å; L62-V65 PolarHBondContact O-N 3.41Å; C63-V65 VanDerWaalsContact C-N 3.35Å; C63-V65 PolarHBondContact O-N 3.41Å; V65-V67 PolarHBondContact O-N 2.88Å; V65-F68 PolarHBondContact O-N 3.3Å; V65-V69 WeakPolarHBondContact O-CG2 3.11Å; V65-V69 PolarHBondContact O-N 3.46Å |
| 66 | C | 96.2 | Very high | 92.7 | Very high | 67 Ų | 67 | 99.8 Ų | 99.8 | 45% | 0.453 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.5 | -46.2 | 178.3 | -68.2 | 0 | 0 | 0 | 0 | 112.1 | L62 C63 F68 V69 V70 | L62-C66 PolarHBondContact O-N 3.44Å; L62-C66 PolarHBondContact O-SG 3.12Å; C63-C66 PolarHBondContact O-N 2.9Å; C66-F68 VanDerWaalsContact C-N 3.33Å; C66-F68 PolarHBondContact O-N 2.93Å; C66-V69 PolarHBondContact O-N 2.78Å; C66-V70 VanDerWaalsContact O-CG2 3.27Å; C66-V70 WeakPolarHBondContact O-CG2 3.11Å; C66-V70 PolarHBondContact O-N 2.86Å |
| 67 | V | 93.4 | Very high | 92.6 | Very high | 82 Ų | 82 | 102.6 Ų | 102.6 | 50% | 0.497 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 178.6 | 168.6 | 0 | 0 | 0 | 0 | 110.8 | C63 S64 V65 V69 V70 I71 | C63-V67 WeakPolarHBondContact O-CB 3.44Å; C63-V67 VanDerWaalsContact O-CG2 3.29Å; C63-V67 WeakPolarHBondContact O-CG2 3.31Å; C63-V67 PolarHBondContact O-N 2.86Å; S64-V67 PolarHBondContact O-N 3.13Å; V65-V67 PolarHBondContact O-N 2.88Å; V67-V69 PolarHBondContact O-N 3.41Å; V67-V70 PolarHBondContact O-N 3.4Å; V67-I71 HydrophobicContact CG1-CD1 3.63Å; V67-I71 HydrophobicContact CG1-CG1 4.3Å; V67-I71 WeakPolarHBondContact O-CB 3.48Å; V67-I71 VanDerWaalsContact O-CG1 3.27Å; V67-I71 WeakPolarHBondContact O-CG1 3.29Å; V67-I71 PolarHBondContact O-N 3.23Å |
| 68 | F | 92.4 | Very high | 92.2 | Very high | 138 Ų | 138 | 101.3 Ų | 101.3 | 61% | 0.605 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -58.9 | -48.2 | 175.7 | 177 | -98.2 | 0 | 0 | 0 | 112.1 | S64 V65 C66 V70 I71 W72 | S64-F68 WeakPolarHBondContact O-CB 3.28Å; S64-F68 PolarHBondContact O-N 3.46Å; V65-F68 PolarHBondContact O-N 3.3Å; C66-F68 VanDerWaalsContact C-N 3.33Å; C66-F68 PolarHBondContact O-N 2.93Å; F68-V70 VanDerWaalsContact C-N 3.34Å; F68-V70 PolarHBondContact O-N 2.91Å; F68-I71 PolarHBondContact O-N 3.3Å; F68-W72 WeakPolarHBondContact O-CB 3.49Å; F68-W72 PolarHBondContact O-N 3.21Å |
| 69 | V | 94.7 | Very high | 91.6 | Very high | 82 Ų | 82 | 102.5 Ų | 102.5 | 50% | 0.497 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 178.6 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | V65 C66 V67 W72 W73 | V65-V69 WeakPolarHBondContact O-CG2 3.11Å; V65-V69 PolarHBondContact O-N 3.46Å; C66-V69 PolarHBondContact O-N 2.78Å; V67-V69 PolarHBondContact O-N 3.41Å; V69-W72 WeakPolarHBondContact O-CB 3.34Å; V69-W72 PolarHBondContact O-N 3.45Å; V69-W73 WeakPolarHBondContact O-CB 3.4Å; V69-W73 PolarHBondContact O-N 3.25Å |
| 70 | V | 92.6 | Very high | 90.9 | Very high | 76 Ų | 76 | 100.2 Ų | 100.2 | 46% | 0.461 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.4 | -50.4 | 176.6 | 170.5 | 0 | 0 | 0 | 0 | 110.5 | C66 V67 F68 W72 W73 Y74 | C66-V70 VanDerWaalsContact O-CG2 3.27Å; C66-V70 WeakPolarHBondContact O-CG2 3.11Å; C66-V70 PolarHBondContact O-N 2.86Å; V67-V70 PolarHBondContact O-N 3.4Å; F68-V70 VanDerWaalsContact C-N 3.34Å; F68-V70 PolarHBondContact O-N 2.91Å; V70-W72 VanDerWaalsContact C-N 3.27Å; V70-W72 PolarHBondContact O-N 2.62Å; V70-W73 PolarHBondContact O-N 3.25Å; V70-W73 VanDerWaalsContact O-N 3.17Å; V70-Y74 HydrophobicContact CG1-CD2 3.65Å; V70-Y74 HydrophobicContact CG1-CE2 3.67Å; V70-Y74 VanDerWaalsContact O-CD2 3.29Å; V70-Y74 WeakPolarHBondContact O-CD2 3.39Å; V70-Y74 PolarHBondContact O-N 3.43Å |
| 71 | I | 90.5 | Very high | 90.4 | Very high | 57 Ų | 57 | 95.4 Ų | 95.4 | 29% | 0.292 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.5 | -43.5 | 178.5 | -70.3 | 168.5 | 0 | 0 | 0 | 110.9 | V67 F68 Y74 M75 L85 | V67-I71 HydrophobicContact CG1-CD1 3.63Å; V67-I71 HydrophobicContact CG1-CG1 4.3Å; V67-I71 WeakPolarHBondContact O-CB 3.48Å; V67-I71 VanDerWaalsContact O-CG1 3.27Å; V67-I71 WeakPolarHBondContact O-CG1 3.29Å; V67-I71 PolarHBondContact O-N 3.23Å; F68-I71 PolarHBondContact O-N 3.3Å; I71-Y74 PolarHBondContact O-N 3Å; I71-M75 HydrophobicContact CG2-CE 4.12Å; I71-M75 WeakPolarHBondContact O-CB 3.46Å; I71-M75 PolarHBondContact O-N 3.01Å; I71-M75 VanDerWaalsContact O-N 3.08Å; I71-L85 HydrophobicContact CD1-CD2 4.38Å; I71-L85 HydrophobicContact CG1-CD2 4.32Å; I71-L85 HydrophobicContact CG2-CD1 3.66Å; I71-L85 HydrophobicContact CG2-CD2 4.01Å |
| 72 | W | 88.8 | Confident | 89.7 | Confident | 163 Ų | 163 | 92.8 Ų | 92.8 | 62% | 0.617 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -57.8 | -52.3 | 175.4 | 177.7 | -80.4 | 0 | 0 | 0 | 111.6 | F68 V69 V70 Y74 M75 D76 | F68-W72 WeakPolarHBondContact O-CB 3.49Å; F68-W72 PolarHBondContact O-N 3.21Å; V69-W72 WeakPolarHBondContact O-CB 3.34Å; V69-W72 PolarHBondContact O-N 3.45Å; V70-W72 VanDerWaalsContact C-N 3.27Å; V70-W72 PolarHBondContact O-N 2.62Å; W72-Y74 VanDerWaalsContact C-N 3.33Å; W72-Y74 PolarHBondContact O-N 3.11Å; W72-M75 WeakPolarHBondContact O-CB 3.27Å; W72-M75 PolarHBondContact O-N 3.35Å; W72-D76 PolarHBondContact O-N 2.96Å |
| 73 | W | 92.1 | Very high | 89.2 | Confident | 161 Ų | 161 | 94.1 Ų | 94.1 | 61% | 0.61 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -55.8 | -48.4 | -179.8 | -173.4 | -65.8 | 0 | 0 | 0 | 111.7 | V69 V70 M75 D76 E77 | V69-W73 WeakPolarHBondContact O-CB 3.4Å; V69-W73 PolarHBondContact O-N 3.25Å; V70-W73 PolarHBondContact O-N 3.25Å; V70-W73 VanDerWaalsContact O-N 3.17Å; W73-M75 PolarHBondContact O-N 3.37Å; W73-D76 PolarHBondContact O-N 2.99Å; W73-E77 WeakPolarHBondContact O-CG 3.38Å; W73-E77 PolarHBondContact O-N 2.85Å; W73-E77 VanDerWaalsContact O-N 3.07Å |
| 74 | Y | 88 | Confident | 88.8 | Confident | 115 Ų | 115 | 99.1 Ų | 99.1 | 45% | 0.451 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.7 | -26.7 | -180 | -87.7 | -87.1 | 0 | 0 | 0 | 113.4 | V70 I71 W72 L79 L80 | V70-Y74 HydrophobicContact CG1-CD2 3.65Å; V70-Y74 HydrophobicContact CG1-CE2 3.67Å; V70-Y74 VanDerWaalsContact O-CD2 3.29Å; V70-Y74 WeakPolarHBondContact O-CD2 3.39Å; V70-Y74 PolarHBondContact O-N 3.43Å; I71-Y74 PolarHBondContact O-N 3Å; W72-Y74 VanDerWaalsContact C-N 3.33Å; W72-Y74 PolarHBondContact O-N 3.11Å; Y74-L79 HydrophobicContact CD1-CB 4.31Å; Y74-L79 HydrophobicContact CD1-CD1 4.36Å; Y74-L79 PolarHBondContact O-N 2.83Å; Y74-L80 VanDerWaalsContact CB-CD1 3.41Å; Y74-L80 HydrophobicContact CD1-CD1 4.04Å; Y74-L80 HydrophobicContact CG-CD1 3.81Å; Y74-L80 PolarHBondContact O-N 3.5Å |
| 75 | M | 88.1 | Confident | 88.4 | Confident | 79 Ų | 79 | 98 Ų | 98 | 39% | 0.389 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -76.6 | -37.7 | 174.7 | -162.5 | -178.9 | -44 | 0 | 0 | 111.5 | I71 W72 W73 G78 L85 | I71-M75 HydrophobicContact CG2-CE 4.12Å; I71-M75 WeakPolarHBondContact O-CB 3.46Å; I71-M75 PolarHBondContact O-N 3.01Å; I71-M75 VanDerWaalsContact O-N 3.08Å; W72-M75 WeakPolarHBondContact O-CB 3.27Å; W72-M75 PolarHBondContact O-N 3.35Å; W73-M75 PolarHBondContact O-N 3.37Å; M75-G78 PolarHBondContact O-N 2.79Å; M75-G78 VanDerWaalsContact O-N 3.08Å; M75-L85 HydrophobicContact CE-CD1 3.8Å |
| 76 | D | 88.6 | Confident | 88 | Confident | 126 Ų | 126 | 99.9 Ų | 99.9 | 67% | 0.674 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.8 | -42.2 | 176.6 | -167.8 | 62.1 | 0 | 0 | 0 | 111.8 | W72 W73 G78 | W72-D76 PolarHBondContact O-N 2.96Å; W73-D76 PolarHBondContact O-N 2.99Å; D76-G78 PolarHBondContact O-N 2.74Å; D76-G78 VanDerWaalsContact O-N 3.15Å |
| 77 | E | 89 | Confident | 87.6 | Confident | 111 Ų | 111 | 98.5 Ų | 98.5 | 52% | 0.519 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | -4 | 173.3 | -66.3 | -74.6 | -178.5 | 0 | 0 | 113.4 | W73 L79 | W73-E77 WeakPolarHBondContact O-CG 3.38Å; W73-E77 PolarHBondContact O-N 2.85Å; W73-E77 VanDerWaalsContact O-N 3.07Å; E77-L79 HydrophobicContact CB-CD1 4.18Å; E77-L79 HydrophobicContact CB-CG 4.13Å; E77-L79 PolarHBondContact O-N 3.33Å; E77-L79 VanDerWaalsContact O-N 3.16Å |
| 78 | G | 84.1 | Confident | 87.4 | Confident | 63 Ų | 63 | 98.7 Ų | 98.7 | 65% | 0.649 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.8 | 6.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | M75 D76 | M75-G78 PolarHBondContact O-N 2.79Å; M75-G78 VanDerWaalsContact O-N 3.08Å; D76-G78 PolarHBondContact O-N 2.74Å; D76-G78 VanDerWaalsContact O-N 3.15Å |
| 79 | L | 79.1 | Confident | 87.3 | Confident | 132 Ų | 132 | 93.4 Ų | 93.4 | 69% | 0.691 | 48% | 0.484 | S | S | * | . | trans | -76.5 | -23.3 | -178.4 | -65.2 | 175.1 | 0 | 0 | 0 | 112.8 | Y74 E77 | Y74-L79 HydrophobicContact CD1-CB 4.31Å; Y74-L79 HydrophobicContact CD1-CD1 4.36Å; Y74-L79 PolarHBondContact O-N 2.83Å; E77-L79 HydrophobicContact CB-CD1 4.18Å; E77-L79 HydrophobicContact CB-CG 4.13Å; E77-L79 PolarHBondContact O-N 3.33Å; E77-L79 VanDerWaalsContact O-N 3.16Å | ||
| 80 | L | 79.9 | Confident | 87.1 | Confident | 51 Ų | 51 | 95.1 Ų | 95.1 | 27% | 0.267 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -116.7 | 104.7 | -178.5 | -105.6 | 157.8 | 0 | 0 | 0 | 111 | Y74 W84 L85 | Y74-L80 VanDerWaalsContact CB-CD1 3.41Å; Y74-L80 HydrophobicContact CD1-CD1 4.04Å; Y74-L80 HydrophobicContact CG-CD1 3.81Å; Y74-L80 PolarHBondContact O-N 3.5Å; L80-W84 HydrophobicContact CD2-CB 4.25Å; L80-L85 HydrophobicContact CD2-CD2 4.29Å; L80-L85 HydrophobicContact CD2-CG 4.29Å |
| 81 | A | 83.9 | Confident | 87.1 | Confident | 32 Ų | 32 | 94 Ų | 94 | 26% | 0.264 | 49% | 0.488 | S | S | . | . | trans | -71.1 | 136.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | Q83 W84 | A81-Q83 HydrophobicContact CB-CG 3.9Å; A81-Q83 PolarHBondContact O-N 3.33Å; A81-W84 PolarHBondContact O-N 3.27Å | ||
| 82 | P | 81.3 | Confident | 87.2 | Confident | 69 Ų | 69 | 94.8 Ų | 94.8 | 45% | 0.448 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -53.8 | -32.9 | -176.1 | -28.8 | 34.4 | 0 | 0 | 0 | 114.5 | W84 L85 F86 | P82-W84 VanDerWaalsContact C-N 3.27Å; P82-W84 PolarHBondContact O-N 3.46Å; P82-L85 WeakPolarHBondContact O-CB 3.34Å; P82-L85 PolarHBondContact O-N 2.96Å; P82-L85 VanDerWaalsContact O-N 3.14Å; P82-F86 WeakPolarHBondContact O-CD2 3.28Å; P82-F86 PolarHBondContact O-N 3.43Å |
| 83 | Q | 85.3 | Confident | 87.2 | Confident | 143 Ų | 143 | 90.9 Ų | 90.9 | 67% | 0.668 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -57.2 | -34.9 | 176.2 | 60.7 | -167 | -34.3 | 0 | 0 | 114 | A81 F86 G87 | A81-Q83 HydrophobicContact CB-CG 3.9Å; A81-Q83 PolarHBondContact O-N 3.33Å; Q83-F86 PolarHBondContact O-N 3.04Å; Q83-G87 PolarHBondContact O-N 2.86Å |
| 84 | W | 85.8 | Confident | 87.2 | Confident | 175 Ų | 175 | 88.9 Ų | 88.9 | 66% | 0.663 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -69.8 | -34.7 | 178.2 | -71.6 | 109.4 | 0 | 0 | 0 | 111.6 | L80 A81 P82 G87 T88 | L80-W84 HydrophobicContact CD2-CB 4.25Å; A81-W84 PolarHBondContact O-N 3.27Å; P82-W84 VanDerWaalsContact C-N 3.27Å; P82-W84 PolarHBondContact O-N 3.46Å; W84-G87 PolarHBondContact O-N 2.92Å; W84-T88 WeakPolarHBondContact O-CG2 3.37Å; W84-T88 PolarHBondContact O-N 2.91Å; W84-T88 PolarHBondContact O-OG1 3.42Å; W84-T88 VanDerWaalsContact O-OG1 3.11Å |
| 85 | L | 86.4 | Confident | 87.5 | Confident | 45 Ų | 45 | 88 Ų | 88 | 24% | 0.236 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 174.7 | -67.2 | 168.1 | 0 | 0 | 0 | 111.4 | I71 M75 L80 P82 G87 T88 G89 | I71-L85 HydrophobicContact CD1-CD2 4.38Å; I71-L85 HydrophobicContact CG1-CD2 4.32Å; I71-L85 HydrophobicContact CG2-CD1 3.66Å; I71-L85 HydrophobicContact CG2-CD2 4.01Å; M75-L85 HydrophobicContact CE-CD1 3.8Å; L80-L85 HydrophobicContact CD2-CD2 4.29Å; L80-L85 HydrophobicContact CD2-CG 4.29Å; P82-L85 WeakPolarHBondContact O-CB 3.34Å; P82-L85 PolarHBondContact O-N 2.96Å; P82-L85 VanDerWaalsContact O-N 3.14Å; L85-G87 VanDerWaalsContact C-N 3.35Å; L85-T88 PolarHBondContact O-OG1 2.82Å; L85-G89 PolarHBondContact O-N 3.45Å |
| 86 | F | 87 | Confident | 87.7 | Confident | 131 Ų | 131 | 86.1 Ų | 86.1 | 58% | 0.575 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.9 | -41.8 | 174.1 | -70.6 | -69.7 | 0 | 0 | 0 | 111.6 | P82 Q83 G89 L90 | P82-F86 WeakPolarHBondContact O-CD2 3.28Å; P82-F86 PolarHBondContact O-N 3.43Å; Q83-F86 PolarHBondContact O-N 3.04Å; F86-G89 PolarHBondContact O-N 3.18Å; F86-L90 WeakPolarHBondContact O-CB 3.22Å; F86-L90 VanDerWaalsContact O-CG 3.27Å; F86-L90 WeakPolarHBondContact O-CG 3.31Å; F86-L90 PolarHBondContact O-N 3.43Å |
| 87 | G | 89.5 | Confident | 87.7 | Confident | 37 Ų | 37 | 84.2 Ų | 84.2 | 38% | 0.381 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.7 | -49.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q83 W84 L85 L90 A91 | Q83-G87 PolarHBondContact O-N 2.86Å; W84-G87 PolarHBondContact O-N 2.92Å; L85-G87 VanDerWaalsContact C-N 3.35Å; G87-L90 PolarHBondContact O-N 3.3Å; G87-A91 VanDerWaalsContact O-CB 3.28Å; G87-A91 WeakPolarHBondContact O-CB 3.34Å; G87-A91 PolarHBondContact O-N 2.88Å |
| 88 | T | 88.9 | Confident | 87.8 | Confident | 86 Ų | 86 | 82.7 Ų | 82.7 | 53% | 0.528 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68.7 | -35.9 | 178 | 58.1 | 0 | 0 | 0 | 0 | 112.3 | W84 L85 A91 S92 | W84-T88 WeakPolarHBondContact O-CG2 3.37Å; W84-T88 PolarHBondContact O-N 2.91Å; W84-T88 PolarHBondContact O-OG1 3.42Å; W84-T88 VanDerWaalsContact O-OG1 3.11Å; L85-T88 PolarHBondContact O-OG1 2.82Å; T88-A91 PolarHBondContact O-N 3.38Å; T88-S92 VanDerWaalsContact O-CB 3.31Å; T88-S92 WeakPolarHBondContact O-CB 3.48Å; T88-S92 PolarHBondContact O-N 2.93Å; T88-S92 PolarHBondContact O-OG 2.89Å |
| 89 | G | 89.7 | Confident | 88.2 | Confident | 28 Ų | 28 | 84.5 Ų | 84.5 | 29% | 0.289 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113 | L85 F86 S92 S93 | L85-G89 PolarHBondContact O-N 3.45Å; F86-G89 PolarHBondContact O-N 3.18Å; G89-S92 WeakPolarHBondContact CA-OG 3.5Å; G89-S92 PolarHBondContact O-OG 3.47Å; G89-S93 WeakPolarHBondContact O-CB 3.43Å; G89-S93 PolarHBondContact O-N 2.84Å; G89-S93 PolarHBondContact O-OG 3.26Å |
| 90 | L | 89.9 | Confident | 88.6 | Confident | 118 Ų | 118 | 84.4 Ų | 84.4 | 62% | 0.618 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66 | -44.6 | 174.9 | -71.9 | 173.8 | 0 | 0 | 0 | 111.6 | F86 G87 S93 L94 | F86-L90 WeakPolarHBondContact O-CB 3.22Å; F86-L90 VanDerWaalsContact O-CG 3.27Å; F86-L90 WeakPolarHBondContact O-CG 3.31Å; F86-L90 PolarHBondContact O-N 3.43Å; G87-L90 PolarHBondContact O-N 3.3Å; L90-S93 PolarHBondContact O-N 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.35Å; L90-L94 PolarHBondContact O-N 3.05Å |
| 91 | A | 93.5 | Very high | 88.9 | Confident | 51 Ų | 51 | 83.6 Ų | 83.6 | 42% | 0.421 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.8 | -48.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | G87 T88 S93 L94 V95 | G87-A91 VanDerWaalsContact O-CB 3.28Å; G87-A91 WeakPolarHBondContact O-CB 3.34Å; G87-A91 PolarHBondContact O-N 2.88Å; T88-A91 PolarHBondContact O-N 3.38Å; A91-S93 VanDerWaalsContact C-N 3.33Å; A91-S93 PolarHBondContact O-N 3.11Å; A91-L94 PolarHBondContact O-N 3.09Å; A91-V95 VanDerWaalsContact O-CG2 3.29Å; A91-V95 WeakPolarHBondContact O-CG2 3.38Å; A91-V95 PolarHBondContact O-N 3.18Å |
| 92 | S | 92.1 | Very high | 89.1 | Confident | 75 Ų | 75 | 88.1 Ų | 88.1 | 52% | 0.524 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.6 | -39.6 | 177.1 | 59.3 | 0 | 0 | 0 | 0 | 112.5 | T88 G89 V95 G96 | T88-S92 VanDerWaalsContact O-CB 3.31Å; T88-S92 WeakPolarHBondContact O-CB 3.48Å; T88-S92 PolarHBondContact O-N 2.93Å; T88-S92 PolarHBondContact O-OG 2.89Å; G89-S92 WeakPolarHBondContact CA-OG 3.5Å; G89-S92 PolarHBondContact O-OG 3.47Å; S92-V95 PolarHBondContact O-N 2.91Å; S92-G96 PolarHBondContact O-N 3.44Å |
| 93 | S | 89.8 | Confident | 89.5 | Confident | 81 Ų | 81 | 91.3 Ų | 91.3 | 57% | 0.566 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.8 | -42.4 | 175.7 | -60.1 | 0 | 0 | 0 | 0 | 112.1 | G89 L90 A91 G96 Y97 | G89-S93 WeakPolarHBondContact O-CB 3.43Å; G89-S93 PolarHBondContact O-N 2.84Å; G89-S93 PolarHBondContact O-OG 3.26Å; L90-S93 PolarHBondContact O-N 3.3Å; A91-S93 VanDerWaalsContact C-N 3.33Å; A91-S93 PolarHBondContact O-N 3.11Å; S93-G96 PolarHBondContact O-N 3.45Å; S93-Y97 PolarHBondContact O-N 3.25Å |
| 94 | L | 91.7 | Very high | 89.5 | Confident | 118 Ų | 118 | 87.2 Ų | 87.2 | 62% | 0.618 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -64.8 | -45 | 175.7 | -72.8 | 171 | 0 | 0 | 0 | 111.8 | L90 A91 G96 Y97 V98 | L90-L94 WeakPolarHBondContact O-CG 3.35Å; L90-L94 PolarHBondContact O-N 3.05Å; A91-L94 PolarHBondContact O-N 3.09Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-G96 PolarHBondContact O-N 3.11Å; L94-Y97 PolarHBondContact O-N 3.25Å; L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.27Å |
| 95 | V | 94.8 | Very high | 89.2 | Confident | 98 Ų | 98 | 81.7 Ų | 81.7 | 59% | 0.594 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -59.7 | -45.1 | 176 | 170.8 | 0 | 0 | 0 | 0 | 110.4 | A91 S92 Y97 V98 L99 | A91-V95 VanDerWaalsContact O-CG2 3.29Å; A91-V95 WeakPolarHBondContact O-CG2 3.38Å; A91-V95 PolarHBondContact O-N 3.18Å; S92-V95 PolarHBondContact O-N 2.91Å; V95-Y97 PolarHBondContact O-N 3.33Å; V95-V98 PolarHBondContact O-N 2.85Å; V95-L99 WeakPolarHBondContact O-CB 3.38Å; V95-L99 PolarHBondContact O-N 3.48Å |
| 96 | G | 91.4 | Very high | 88.4 | Confident | 39 Ų | 39 | 80.1 Ų | 80.1 | 40% | 0.402 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | S92 S93 L94 L99 F100 | S92-G96 PolarHBondContact O-N 3.44Å; S93-G96 PolarHBondContact O-N 3.45Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-G96 PolarHBondContact O-N 3.11Å; G96-L99 PolarHBondContact O-N 2.95Å; G96-F100 WeakPolarHBondContact O-CB 3.37Å; G96-F100 PolarHBondContact O-N 3.01Å |
| 97 | Y | 88.7 | Confident | 87.9 | Confident | 86 Ų | 86 | 77.5 Ų | 77.5 | 34% | 0.337 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 176.4 | -176.9 | -99.2 | 0 | 0 | 0 | 112.4 | S93 L94 V95 F100 D101 D119 | S93-Y97 PolarHBondContact O-N 3.25Å; L94-Y97 PolarHBondContact O-N 3.25Å; V95-Y97 PolarHBondContact O-N 3.33Å; Y97-F100 PolarHBondContact O-N 2.92Å; Y97-D101 WeakPolarHBondContact O-CB 3.42Å; Y97-D101 PolarHBondContact O-N 3.47Å; Y97-D119 PolarHBondContact OH-OD2 3.41Å |
| 98 | V | 90.4 | Very high | 87.1 | Confident | 79 Ų | 79 | 77 Ų | 77 | 48% | 0.479 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | 177.2 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | L94 V95 F100 D101 L102 | L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.27Å; V95-V98 PolarHBondContact O-N 2.85Å; V98-F100 VanDerWaalsContact C-N 3.29Å; V98-F100 PolarHBondContact O-N 3.43Å; V98-D101 PolarHBondContact O-N 2.88Å; V98-L102 HydrophobicContact CG1-CD1 3.98Å; V98-L102 HydrophobicContact CG1-CG 4.3Å; V98-L102 WeakPolarHBondContact O-CB 3.27Å; V98-L102 VanDerWaalsContact O-CG 3.27Å; V98-L102 WeakPolarHBondContact O-CG 3.4Å; V98-L102 PolarHBondContact O-N 2.78Å |
| 99 | L | 92.3 | Very high | 86.3 | Confident | 100 Ų | 100 | 77.7 Ų | 77.7 | 52% | 0.524 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.9 | -40.4 | 179 | -162.9 | 72.5 | 0 | 0 | 0 | 111.1 | V95 G96 L102 I103 | V95-L99 WeakPolarHBondContact O-CB 3.38Å; V95-L99 PolarHBondContact O-N 3.48Å; G96-L99 PolarHBondContact O-N 2.95Å; L99-L102 PolarHBondContact O-N 3.42Å; L99-I103 HydrophobicContact CD2-CD1 4.45Å; L99-I103 HydrophobicContact CG-CD1 4.02Å; L99-I103 WeakPolarHBondContact O-CB 3.47Å; L99-I103 VanDerWaalsContact O-CG1 3.23Å; L99-I103 WeakPolarHBondContact O-CG1 3.47Å; L99-I103 PolarHBondContact O-N 2.86Å |
| 100 | F | 88.4 | Confident | 85.5 | Confident | 131 Ų | 131 | 84.3 Ų | 84.3 | 58% | 0.575 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -61.6 | -48.4 | 173.4 | 178 | -98 | 0 | 0 | 0 | 112.2 | G96 Y97 V98 L102 I103 D104 | G96-F100 WeakPolarHBondContact O-CB 3.37Å; G96-F100 PolarHBondContact O-N 3.01Å; Y97-F100 PolarHBondContact O-N 2.92Å; V98-F100 VanDerWaalsContact C-N 3.29Å; V98-F100 PolarHBondContact O-N 3.43Å; F100-L102 VanDerWaalsContact C-N 3.25Å; F100-L102 PolarHBondContact O-N 2.91Å; F100-I103 PolarHBondContact O-N 3.46Å; F100-D104 VanDerWaalsContact O-CB 3.28Å; F100-D104 WeakPolarHBondContact O-CB 3.43Å; F100-D104 PolarHBondContact O-N 3.29Å |
| 101 | D | 86.7 | Confident | 84.9 | Confident | 34 Ų | 34 | 86.6 Ų | 86.6 | 18% | 0.182 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -61.8 | -34.5 | 178.5 | -161.1 | 35 | 0 | 0 | 0 | 111.4 | Y97 V98 G105 G106 R116 | Y97-D101 WeakPolarHBondContact O-CB 3.42Å; Y97-D101 PolarHBondContact O-N 3.47Å; V98-D101 PolarHBondContact O-N 2.88Å; D101-G105 PolarHBondContact O-N 3.36Å; D101-G105 VanDerWaalsContact O-N 3.15Å; D101-G106 PolarHBondContact O-N 2.91Å; D101-R116 IonicContact OD2-CZ 2.79Å; D101-R116 IonicContact OD2-NH2 3.08Å; D101-R116 PolarHBondContact OD2-NH2 3.5Å |
| 102 | L | 87.9 | Confident | 83.9 | Confident | 127 Ų | 127 | 88 Ų | 88 | 67% | 0.665 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -70.9 | -44.9 | 174.8 | -70.8 | 174.7 | 0 | 0 | 0 | 112.8 | V98 L99 F100 G105 | V98-L102 HydrophobicContact CG1-CD1 3.98Å; V98-L102 HydrophobicContact CG1-CG 4.3Å; V98-L102 WeakPolarHBondContact O-CB 3.27Å; V98-L102 VanDerWaalsContact O-CG 3.27Å; V98-L102 WeakPolarHBondContact O-CG 3.4Å; V98-L102 PolarHBondContact O-N 2.78Å; L99-L102 PolarHBondContact O-N 3.42Å; F100-L102 VanDerWaalsContact C-N 3.25Å; F100-L102 PolarHBondContact O-N 2.91Å; L102-G105 PolarHBondContact O-N 3.41Å |
| 103 | I | 89.6 | Confident | 83.2 | Confident | 135 Ų | 135 | 87.5 Ų | 87.5 | 69% | 0.692 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.4 | -42.5 | 179.1 | -70.6 | 165.9 | 0 | 0 | 0 | 110.8 | L99 F100 G105 | L99-I103 HydrophobicContact CD2-CD1 4.45Å; L99-I103 HydrophobicContact CG-CD1 4.02Å; L99-I103 WeakPolarHBondContact O-CB 3.47Å; L99-I103 VanDerWaalsContact O-CG1 3.23Å; L99-I103 WeakPolarHBondContact O-CG1 3.47Å; L99-I103 PolarHBondContact O-N 2.86Å; F100-I103 PolarHBondContact O-N 3.46Å; I103-G105 PolarHBondContact O-N 2.99Å |
| 104 | D | 85.2 | Confident | 82.5 | Confident | 57 Ų | 57 | 88.8 Ų | 88.8 | 31% | 0.305 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.8 | -10.4 | -179.6 | -164.9 | 36.6 | 0 | 0 | 0 | 112.1 | F100 G106 D107 G108 | F100-D104 VanDerWaalsContact O-CB 3.28Å; F100-D104 WeakPolarHBondContact O-CB 3.43Å; F100-D104 PolarHBondContact O-N 3.29Å; D104-G106 PolarHBondContact O-N 3.35Å; D104-D107 WeakPolarHBondContact O-CB 3.29Å; D104-D107 PolarHBondContact O-N 3.28Å; D104-G108 PolarHBondContact OD1-N 2.97Å; D104-G108 WeakPolarHBondContact OD2-CA 3.27Å; D104-G108 PolarHBondContact OD2-N 2.99Å |
| 105 | G | 79 | Confident | 82 | Confident | 59 Ų | 59 | 87 Ų | 87 | 61% | 0.608 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 18.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114 | D101 L102 I103 D107 | D101-G105 PolarHBondContact O-N 3.36Å; D101-G105 VanDerWaalsContact O-N 3.15Å; L102-G105 PolarHBondContact O-N 3.41Å; I103-G105 PolarHBondContact O-N 2.99Å; G105-D107 PolarHBondContact O-N 3.3Å |
| 106 | G | 70.7 | Confident | 81.4 | Confident | 13 Ų | 13 | 88.8 Ų | 88.8 | 13% | 0.134 | 48% | 0.478 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 67.8 | 9.5 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | D101 D104 R109 K110 | D101-G106 PolarHBondContact O-N 2.91Å; D104-G106 PolarHBondContact O-N 3.35Å; G106-R109 PolarHBondContact O-N 2.93Å; G106-K110 WeakPolarHBondContact O-CG 3.27Å; G106-K110 PolarHBondContact O-N 3.3Å; G106-K110 VanDerWaalsContact O-N 3.11Å |
| 107 | D | 75 | Confident | 80.9 | Confident | 76 Ų | 76 | 96.4 Ų | 96.4 | 41% | 0.406 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -75.5 | -40.5 | -178 | -156.1 | 44.5 | 0 | 0 | 0 | 111.7 | D104 G105 R109 K110 K111 | D104-D107 WeakPolarHBondContact O-CB 3.29Å; D104-D107 PolarHBondContact O-N 3.28Å; G105-D107 PolarHBondContact O-N 3.3Å; D107-R109 VanDerWaalsContact C-N 3.26Å; D107-R109 PolarHBondContact O-N 3.46Å; D107-K110 PolarHBondContact O-N 3.46Å; D107-K111 WeakPolarHBondContact O-CG 3.35Å; D107-K111 PolarHBondContact O-N 2.89Å; D107-K111 WeakPolarHBondContact OD2-CE 3.29Å; D107-K111 IonicContact OD2-NZ 3.48Å; D107-K111 PolarHBondContact OD2-NZ 3.42Å; D107-K111 VanDerWaalsContact OD2-NZ 3.08Å |
| 108 | G | 72.8 | Confident | 80.8 | Confident | 26 Ų | 26 | 94 Ų | 94 | 27% | 0.268 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -33.7 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | D104 K111 S112 | D104-G108 PolarHBondContact OD1-N 2.97Å; D104-G108 WeakPolarHBondContact OD2-CA 3.27Å; D104-G108 PolarHBondContact OD2-N 2.99Å; G108-K111 PolarHBondContact O-N 3.17Å; G108-S112 VanDerWaalsContact O-CB 3.23Å; G108-S112 WeakPolarHBondContact O-CB 3.43Å; G108-S112 PolarHBondContact O-N 3.33Å |
| 109 | R | 72.5 | Confident | 80.6 | Confident | 100 Ų | 100 | 92 Ų | 92 | 38% | 0.377 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.8 | -37.8 | 175.5 | -160.6 | 161.7 | 67.6 | 87.6 | -2.4 | 113 | G106 D107 G113 R114 | G106-R109 PolarHBondContact O-N 2.93Å; D107-R109 VanDerWaalsContact C-N 3.26Å; D107-R109 PolarHBondContact O-N 3.46Å; R109-G113 PolarHBondContact O-N 3.35Å; R109-R114 WeakPolarHBondContact CG-O 3.16Å |
| 110 | K | 72.4 | Confident | 80.4 | Confident | 167 Ų | 167 | 92.1 Ų | 92.1 | 73% | 0.726 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -65.8 | -40.6 | 174 | -73 | 173 | -173.4 | 174.7 | 0 | 112 | G106 D107 | G106-K110 WeakPolarHBondContact O-CG 3.27Å; G106-K110 PolarHBondContact O-N 3.3Å; G106-K110 VanDerWaalsContact O-N 3.11Å; D107-K110 PolarHBondContact O-N 3.46Å |
| 111 | K | 77.3 | Confident | 80.5 | Confident | 166 Ų | 166 | 93.2 Ų | 93.2 | 72% | 0.722 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -69.2 | -37.3 | 176.4 | -70.4 | 175.2 | -172.5 | 163.1 | 0 | 112.8 | D107 G108 | D107-K111 WeakPolarHBondContact O-CG 3.35Å; D107-K111 PolarHBondContact O-N 2.89Å; D107-K111 WeakPolarHBondContact OD2-CE 3.29Å; D107-K111 IonicContact OD2-NZ 3.48Å; D107-K111 PolarHBondContact OD2-NZ 3.42Å; D107-K111 VanDerWaalsContact OD2-NZ 3.08Å; G108-K111 PolarHBondContact O-N 3.17Å |
| 112 | S | 73.6 | Confident | 80.5 | Confident | 80 Ų | 80 | 93.6 Ų | 93.6 | 56% | 0.559 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -80 | -19.2 | -179.8 | -174.7 | 0 | 0 | 0 | 0 | 113.5 | G108 R114 | G108-S112 VanDerWaalsContact O-CB 3.23Å; G108-S112 WeakPolarHBondContact O-CB 3.43Å; G108-S112 PolarHBondContact O-N 3.33Å; S112-R114 PolarHBondContact O-N 2.94Å; S112-R114 VanDerWaalsContact O-N 3.12Å |
| 113 | G | 77 | Confident | 80.6 | Confident | 65 Ų | 65 | 91.1 Ų | 91.1 | 67% | 0.67 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.3 | 10 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | R109 | R109-G113 PolarHBondContact O-N 3.35Š|
| 114 | R | 75.1 | Confident | 80.6 | Confident | 108 Ų | 108 | 89.9 Ų | 89.9 | 41% | 0.408 | 48% | 0.475 | S | S | . | . | trans | -88.2 | 130.2 | -169.7 | -164.2 | 168.4 | 149.5 | 126.6 | -1.9 | 110.6 | R109 S112 A118 D119 | R109-R114 WeakPolarHBondContact CG-O 3.16Å; S112-R114 PolarHBondContact O-N 2.94Å; S112-R114 VanDerWaalsContact O-N 3.12Å; R114-A118 HydrophobicContact CG-CB 3.92Å; R114-D119 IonicContact CZ-OD1 3.21Å; R114-D119 IonicContact NE-OD1 2.74Å; R114-D119 PolarHBondContact NE-OD1 2.99Å; R114-D119 IonicContact NH2-OD1 2.79Å; R114-D119 PolarHBondContact NH2-OD1 3.08Å | ||
| 115 | T | 82.2 | Confident | 81 | Confident | 82 Ų | 82 | 91.4 Ų | 91.4 | 50% | 0.503 | 49% | 0.486 | S | S | . | . | trans | -91 | 153.1 | -179.9 | 34.7 | 0 | 0 | 0 | 0 | 111.3 | W117 A118 D119 | T115-W117 PolarHBondContact O-N 3.03Å; T115-W117 VanDerWaalsContact O-N 3.11Å; T115-A118 WeakPolarHBondContact O-CA 3.47Å; T115-A118 VanDerWaalsContact O-CB 3.27Å; T115-A118 WeakPolarHBondContact O-CB 3.45Å; T115-A118 PolarHBondContact O-N 3.14Å; T115-D119 PolarHBondContact O-N 3.3Å | ||
| 116 | R | 81.8 | Confident | 81.4 | Confident | 134 Ų | 134 | 95 Ų | 95 | 51% | 0.506 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -55.7 | -29.4 | 176.1 | -73.8 | -177 | 156.2 | -179.5 | -4.8 | 113.2 | D101 A118 D119 L120 | D101-R116 IonicContact OD2-CZ 2.79Å; D101-R116 IonicContact OD2-NH2 3.08Å; D101-R116 PolarHBondContact OD2-NH2 3.5Å; R116-A118 VanDerWaalsContact C-N 3.34Å; R116-D119 PolarHBondContact O-N 2.95Å; R116-L120 PolarHBondContact O-N 3.25Å |
| 117 | W | 81.3 | Confident | 82.3 | Confident | 200 Ų | 200 | 98.8 Ų | 98.8 | 76% | 0.758 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.1 | -33.2 | 173 | -77.8 | 104.6 | 0 | 0 | 0 | 113.4 | T115 L120 K121 | T115-W117 PolarHBondContact O-N 3.03Å; T115-W117 VanDerWaalsContact O-N 3.11Å; W117-L120 HydrophobicContact CE3-CD2 4.2Å; W117-L120 HydrophobicContact CZ3-CD2 4.09Å; W117-K121 VanDerWaalsContact O-CB 3.22Å; W117-K121 WeakPolarHBondContact O-CB 3.46Å; W117-K121 PolarHBondContact O-N 3.4Å |
| 118 | A | 85.6 | Confident | 83.1 | Confident | 35 Ų | 35 | 99.3 Ų | 99.3 | 29% | 0.289 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -69.2 | -37.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | R114 T115 R116 S122 | R114-A118 HydrophobicContact CG-CB 3.92Å; T115-A118 WeakPolarHBondContact O-CA 3.47Å; T115-A118 VanDerWaalsContact O-CB 3.27Å; T115-A118 WeakPolarHBondContact O-CB 3.45Å; T115-A118 PolarHBondContact O-N 3.14Å; R116-A118 VanDerWaalsContact C-N 3.34Å; A118-S122 WeakPolarHBondContact O-CB 3.39Å; A118-S122 PolarHBondContact O-N 3.46Å |
| 119 | D | 86.3 | Confident | 84 | Confident | 37 Ų | 37 | 105.1 Ų | 105.1 | 20% | 0.198 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -63.6 | -49.8 | 173.1 | -66.1 | -23.6 | 0 | 0 | 0 | 110.9 | Y97 R114 T115 R116 K121 S122 T123 | Y97-D119 PolarHBondContact OH-OD2 3.41Å; R114-D119 IonicContact CZ-OD1 3.21Å; R114-D119 IonicContact NE-OD1 2.74Å; R114-D119 PolarHBondContact NE-OD1 2.99Å; R114-D119 IonicContact NH2-OD1 2.79Å; R114-D119 PolarHBondContact NH2-OD1 3.08Å; T115-D119 PolarHBondContact O-N 3.3Å; R116-D119 PolarHBondContact O-N 2.95Å; D119-K121 VanDerWaalsContact C-N 3.34Å; D119-K121 PolarHBondContact O-N 3.22Å; D119-S122 WeakPolarHBondContact O-CA 3.34Å; D119-S122 WeakPolarHBondContact O-CB 3.44Å; D119-S122 PolarHBondContact O-N 2.87Å; D119-S122 VanDerWaalsContact O-N 3.09Å; D119-T123 PolarHBondContact O-N 3.33Å; D119-T123 PolarHBondContact O-OG1 2.86Å; D119-T123 VanDerWaalsContact O-OG1 3.05Å |
| 120 | L | 87.6 | Confident | 84.8 | Confident | 103 Ų | 103 | 104.5 Ų | 104.5 | 54% | 0.539 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.6 | -42.6 | 178.2 | -174.6 | 65.5 | 0 | 0 | 0 | 112.2 | R116 W117 S122 T123 L124 | R116-L120 PolarHBondContact O-N 3.25Å; W117-L120 HydrophobicContact CE3-CD2 4.2Å; W117-L120 HydrophobicContact CZ3-CD2 4.09Å; L120-S122 VanDerWaalsContact C-N 3.31Å; L120-S122 PolarHBondContact O-N 3.31Å; L120-T123 PolarHBondContact O-N 2.96Å; L120-L124 WeakPolarHBondContact O-CB 3.48Å; L120-L124 PolarHBondContact O-N 3.16Å |
| 121 | K | 90.3 | Very high | 85.3 | Confident | 153 Ų | 153 | 104.5 Ų | 104.5 | 67% | 0.665 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.1 | -42.4 | 175 | -176.8 | 178.9 | 178.2 | 179.4 | 0 | 111.1 | W117 D119 L124 V125 | W117-K121 VanDerWaalsContact O-CB 3.22Å; W117-K121 WeakPolarHBondContact O-CB 3.46Å; W117-K121 PolarHBondContact O-N 3.4Å; D119-K121 VanDerWaalsContact C-N 3.34Å; D119-K121 PolarHBondContact O-N 3.22Å; K121-L124 PolarHBondContact O-N 3.2Å; K121-V125 VanDerWaalsContact O-CG2 3.29Å; K121-V125 WeakPolarHBondContact O-CG2 3.37Å; K121-V125 PolarHBondContact O-N 2.9Å |
| 122 | S | 88.3 | Confident | 85.4 | Confident | 42 Ų | 42 | 99.3 Ų | 99.3 | 29% | 0.294 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.8 | -46.2 | 176.2 | -162.9 | 0 | 0 | 0 | 0 | 110.9 | A118 D119 L120 L124 V125 F126 | A118-S122 WeakPolarHBondContact O-CB 3.39Å; A118-S122 PolarHBondContact O-N 3.46Å; D119-S122 WeakPolarHBondContact O-CA 3.34Å; D119-S122 WeakPolarHBondContact O-CB 3.44Å; D119-S122 PolarHBondContact O-N 2.87Å; D119-S122 VanDerWaalsContact O-N 3.09Å; L120-S122 VanDerWaalsContact C-N 3.31Å; L120-S122 PolarHBondContact O-N 3.31Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact O-N 3.2Å; S122-V125 PolarHBondContact O-N 3.3Å; S122-F126 WeakPolarHBondContact O-CD2 3.3Å; S122-F126 PolarHBondContact O-N 3.07Å |
| 123 | T | 88.9 | Confident | 84.5 | Confident | 75 Ų | 75 | 107 Ų | 107 | 46% | 0.46 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.3 | -43.5 | 176.8 | -55.2 | 0 | 0 | 0 | 0 | 111.5 | D119 L120 F126 I127 | D119-T123 PolarHBondContact O-N 3.33Å; D119-T123 PolarHBondContact O-OG1 2.86Å; D119-T123 VanDerWaalsContact O-OG1 3.05Å; L120-T123 PolarHBondContact O-N 2.96Å; T123-F126 PolarHBondContact O-N 3.08Å; T123-I127 HydrophobicContact CG2-CD1 3.9Å; T123-I127 HydrophobicContact CG2-CG1 4.45Å; T123-I127 WeakPolarHBondContact O-CG1 3.43Å; T123-I127 PolarHBondContact O-N 3.24Å |
| 124 | L | 90.1 | Very high | 84.9 | Confident | 109 Ų | 109 | 109.1 Ų | 109.1 | 57% | 0.571 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -59.9 | -49 | 176.5 | -171.4 | 82.9 | 0 | 0 | 0 | 111.1 | L120 K121 S122 F126 I127 T128 | L120-L124 WeakPolarHBondContact O-CB 3.48Å; L120-L124 PolarHBondContact O-N 3.16Å; K121-L124 PolarHBondContact O-N 3.2Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact O-N 3.2Å; L124-F126 VanDerWaalsContact C-N 3.28Å; L124-F126 PolarHBondContact O-N 3.37Å; L124-I127 PolarHBondContact O-N 3.2Å; L124-T128 WeakPolarHBondContact O-CB 3.49Å; L124-T128 PolarHBondContact O-N 2.93Å; L124-T128 PolarHBondContact O-OG1 3.4Å |
| 125 | V | 92.4 | Very high | 85.4 | Confident | 90 Ų | 90 | 109.2 Ų | 109.2 | 55% | 0.545 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -58.6 | -42.2 | 177.8 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | K121 S122 F129 | K121-V125 VanDerWaalsContact O-CG2 3.29Å; K121-V125 WeakPolarHBondContact O-CG2 3.37Å; K121-V125 PolarHBondContact O-N 2.9Å; S122-V125 PolarHBondContact O-N 3.3Å; V125-F129 VanDerWaalsContact O-CB 3.3Å; V125-F129 WeakPolarHBondContact O-CB 3.42Å; V125-F129 PolarHBondContact O-N 3.04Å |
| 126 | F | 89.1 | Confident | 85.5 | Confident | 135 Ų | 135 | 110.7 Ų | 110.7 | 59% | 0.592 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -63.2 | -47.8 | 176 | -95 | -79.3 | 0 | 0 | 0 | 112.4 | S122 T123 L124 T128 F129 T130 | S122-F126 WeakPolarHBondContact O-CD2 3.3Å; S122-F126 PolarHBondContact O-N 3.07Å; T123-F126 PolarHBondContact O-N 3.08Å; L124-F126 VanDerWaalsContact C-N 3.28Å; L124-F126 PolarHBondContact O-N 3.37Å; F126-T128 VanDerWaalsContact C-N 3.35Å; F126-T128 PolarHBondContact O-N 2.93Å; F126-F129 PolarHBondContact O-N 2.95Å; F126-T130 WeakPolarHBondContact O-CB 3.5Å; F126-T130 PolarHBondContact O-N 3.47Å; F126-T130 PolarHBondContact O-OG1 3.15Å; F126-T130 VanDerWaalsContact O-OG1 3.08Å |
| 127 | I | 89.7 | Confident | 85.8 | Confident | 91 Ų | 91 | 109.3 Ų | 109.3 | 47% | 0.467 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61 | -46.5 | 178.2 | -68.6 | 168.8 | 0 | 0 | 0 | 110.3 | T123 L124 F129 T130 Y131 | T123-I127 HydrophobicContact CG2-CD1 3.9Å; T123-I127 HydrophobicContact CG2-CG1 4.45Å; T123-I127 WeakPolarHBondContact O-CG1 3.43Å; T123-I127 PolarHBondContact O-N 3.24Å; L124-I127 PolarHBondContact O-N 3.2Å; I127-F129 VanDerWaalsContact C-N 3.29Å; I127-F129 PolarHBondContact O-N 2.87Å; I127-T130 PolarHBondContact O-N 2.94Å; I127-Y131 HydrophobicContact CG2-CD2 4.02Å; I127-Y131 WeakPolarHBondContact O-CD2 3.45Å; I127-Y131 PolarHBondContact O-N 3.08Å |
| 128 | T | 90.3 | Very high | 86 | Confident | 87 Ų | 87 | 103.6 Ų | 103.6 | 53% | 0.534 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.1 | -37.8 | 177.8 | -55.4 | 0 | 0 | 0 | 0 | 111.7 | L124 F126 G132 | L124-T128 WeakPolarHBondContact O-CB 3.49Å; L124-T128 PolarHBondContact O-N 2.93Å; L124-T128 PolarHBondContact O-OG1 3.4Å; F126-T128 VanDerWaalsContact C-N 3.35Å; F126-T128 PolarHBondContact O-N 2.93Å; T128-G132 WeakPolarHBondContact O-CA 3.11Å; T128-G132 PolarHBondContact O-N 3.07Å |
| 129 | F | 92.2 | Very high | 86.1 | Confident | 149 Ų | 149 | 108.2 Ų | 108.2 | 65% | 0.654 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.3 | -40 | 176.7 | -177.1 | -102 | 0 | 0 | 0 | 112.7 | V125 F126 I127 | V125-F129 VanDerWaalsContact O-CB 3.3Å; V125-F129 WeakPolarHBondContact O-CB 3.42Å; V125-F129 PolarHBondContact O-N 3.04Å; F126-F129 PolarHBondContact O-N 2.95Å; I127-F129 VanDerWaalsContact C-N 3.29Å; I127-F129 PolarHBondContact O-N 2.87Å |
| 130 | T | 88.6 | Confident | 86.1 | Confident | 86 Ų | 86 | 113.3 Ų | 113.3 | 53% | 0.528 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -75 | -31.8 | -177.5 | -62.8 | 0 | 0 | 0 | 0 | 113.3 | F126 I127 | F126-T130 WeakPolarHBondContact O-CB 3.5Å; F126-T130 PolarHBondContact O-N 3.47Å; F126-T130 PolarHBondContact O-OG1 3.15Å; F126-T130 VanDerWaalsContact O-OG1 3.08Å; I127-T130 PolarHBondContact O-N 2.94Å |
| 131 | Y | 83.6 | Confident | 86 | Confident | 167 Ų | 167 | 114.1 Ų | 114.1 | 66% | 0.655 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -115.5 | -5.2 | -176.1 | -65.5 | -78.9 | 0 | 0 | 0 | 114.3 | I127 | I127-Y131 HydrophobicContact CG2-CD2 4.02Å; I127-Y131 WeakPolarHBondContact O-CD2 3.45Å; I127-Y131 PolarHBondContact O-N 3.08Å |
| 132 | G | 78.8 | Confident | 85.6 | Confident | 58 Ų | 58 | 110.8 Ų | 110.8 | 60% | 0.598 | 58% | 0.579 | S | S | * | * | trans | -98.3 | 5.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115 | T128 | T128-G132 WeakPolarHBondContact O-CA 3.11Å; T128-G132 PolarHBondContact O-N 3.07Å | ||
| 133 | F | 55.1 | Low | 85.3 | Confident | 241 Ų | 241 | 117.1 Ų | 117.1 | 100% | 1.057 | 61% | 0.605 | S | S | * | * | trans | -118.1 | 0 | 168.6 | -110.5 | -80.7 | 0 | 0 | 0 | 109.2 |
Retrieved 133 of 133 residues in 24.5 ms
(Link to these results)