| 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 | L | 37.9 | Very low | 44.2 | Very low | 228 Ų | 228 | 146.1 Ų | 146.1 | 100% | 1.194 | 76% | 0.758 | S | S | * | * | 0 | 79.4 | 0 | -82.5 | 153.2 | 0 | 0 | 0 | 107.4 | |||||
| 2 | V | 35.5 | Very low | 45.2 | Very low | 134 Ų | 134 | 142.6 Ų | 142.6 | 81% | 0.812 | 75% | 0.748 | S | S | * | * | trans | -89.4 | 110.9 | 170.5 | -179.9 | 0 | 0 | 0 | 0 | 104.6 | E4 | V2-E4 HydrophobicContact CG1-CG 4.46Å; V2-E4 PolarHBondContact O-N 3.11Å | ||
| 3 | M | 41.4 | Very low | 46.5 | Very low | 163 Ų | 163 | 137.5 Ų | 137.5 | 80% | 0.803 | 74% | 0.739 | S | S | * | * | trans | -80.5 | 92.8 | 176.3 | -160.1 | 171.4 | 88.1 | 0 | 0 | 106.4 | L5 | M3-L5 HydrophobicContact CE-CD1 4.17Å; M3-L5 PolarHBondContact O-N 2.87Å; M3-L5 VanDerWaalsContact O-N 3.1Å | ||
| 4 | E | 43.7 | Very low | 48.2 | Very low | 141 Ų | 141 | 137.6 Ų | 137.6 | 66% | 0.659 | 75% | 0.746 | S | S | * | * | trans | -66.8 | 104.6 | 169.7 | -72.7 | 179.8 | 161.8 | 0 | 0 | 107.7 | V2 Y6 | V2-E4 HydrophobicContact CG1-CG 4.46Å; V2-E4 PolarHBondContact O-N 3.11Å; E4-Y6 VanDerWaalsContact C-N 3.34Å; E4-Y6 HydrophobicContact CB-CD2 4.45Å; E4-Y6 HydrophobicContact CB-CE2 4.41Å; E4-Y6 PolarHBondContact O-N 3.25Å | ||
| 5 | L | 42.7 | Very low | 49.9 | Very low | 134 Ų | 134 | 139.9 Ų | 139.9 | 70% | 0.702 | 75% | 0.747 | S | S | * | * | trans | -64 | 99.7 | 164.2 | -94.4 | 96.1 | 0 | 0 | 0 | 107.5 | M3 C7 | M3-L5 HydrophobicContact CE-CD1 4.17Å; M3-L5 PolarHBondContact O-N 2.87Å; M3-L5 VanDerWaalsContact O-N 3.1Å; L5-C7 PolarHBondContact O-N 2.89Å | ||
| 6 | Y | 44.3 | Very low | 51.7 | Low | 183 Ų | 183 | 137.3 Ų | 137.3 | 72% | 0.718 | 75% | 0.751 | S | S | * | * | trans | -68.6 | 73.4 | 161 | -84.3 | -92.5 | 0 | 0 | 0 | 109.1 | E4 L8 | E4-Y6 VanDerWaalsContact C-N 3.34Å; E4-Y6 HydrophobicContact CB-CD2 4.45Å; E4-Y6 HydrophobicContact CB-CE2 4.41Å; E4-Y6 PolarHBondContact O-N 3.25Å; Y6-L8 PolarHBondContact O-N 2.65Å | ||
| 7 | C | 42.4 | Very low | 53.4 | Low | 99 Ų | 99 | 138.9 Ų | 138.9 | 67% | 0.669 | 75% | 0.752 | S | S | * | * | trans | -72.4 | 84.2 | 154.4 | -70.6 | 0 | 0 | 0 | 0 | 106.4 | L5 E9 | L5-C7 PolarHBondContact O-N 2.89Å; C7-E9 PolarHBondContact O-N 2.68Å | ||
| 8 | L | 44.5 | Very low | 55 | Low | 137 Ų | 137 | 136.1 Ų | 136.1 | 72% | 0.717 | 74% | 0.742 | S | S | * | * | trans | -61.7 | 92.2 | 160.7 | -77.4 | 155.3 | 0 | 0 | 0 | 106.4 | Y6 S10 | Y6-L8 PolarHBondContact O-N 2.65Å; L8-S10 PolarHBondContact O-N 3.41Å | ||
| 9 | E | 50.1 | Low | 56.7 | Low | 188 Ų | 188 | 132.5 Ų | 132.5 | 88% | 0.879 | 72% | 0.722 | S | S | * | * | trans | -66.1 | 70.7 | 159.3 | -75.8 | -176.9 | 160.7 | 0 | 0 | 107.6 | C7 D11 | C7-E9 PolarHBondContact O-N 2.68Å; E9-D11 PolarHBondContact O-N 3.2Å | ||
| 10 | S | 49.1 | Very low | 58.1 | Low | 73 Ų | 73 | 129.2 Ų | 129.2 | 51% | 0.51 | 71% | 0.707 | S | S | . | * | trans | -65.2 | 118.4 | 161.5 | -50.6 | 0 | 0 | 0 | 0 | 105.6 | L8 T12 | L8-S10 PolarHBondContact O-N 3.41Å; S10-T12 WeakPolarHBondContact CB-OG1 3.16Å; S10-T12 PolarHBondContact O-N 2.87Å; S10-T12 PolarHBondContact O-OG1 3.36Å | ||
| 11 | D | 54.8 | Low | 59.5 | Low | 127 Ų | 127 | 129 Ų | 129 | 68% | 0.679 | 71% | 0.706 | S | S | * | * | trans | -64 | 6.9 | 177.4 | -143.7 | 1.6 | 0 | 0 | 0 | 113.2 | E9 A13 R118 | E9-D11 PolarHBondContact O-N 3.2Å; D11-A13 PolarHBondContact O-N 2.98Å; D11-R118 IonicContact OD1-CZ 3.27Å; D11-R118 IonicContact OD1-NH1 2.82Å; D11-R118 PolarHBondContact OD1-NH1 2.86Å; D11-R118 IonicContact OD1-NH2 2.86Å; D11-R118 PolarHBondContact OD1-NH2 3.01Å | ||
| 12 | T | 56.5 | Low | 61.7 | Low | 104 Ų | 104 | 122.5 Ų | 122.5 | 64% | 0.638 | 67% | 0.671 | S | S | * | * | trans | -63.3 | 103.3 | 168.2 | 37.7 | 0 | 0 | 0 | 0 | 110.3 | S10 V14 | S10-T12 WeakPolarHBondContact CB-OG1 3.16Å; S10-T12 PolarHBondContact O-N 2.87Å; S10-T12 PolarHBondContact O-OG1 3.36Å; T12-V14 PolarHBondContact O-N 2.97Å | ||
| 13 | A | 62 | Low | 64 | Low | 76 Ų | 76 | 117 Ų | 117 | 63% | 0.628 | 64% | 0.637 | S | S | * | * | trans | -51.6 | 111.4 | 165.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | D11 K15 | D11-A13 PolarHBondContact O-N 2.98Å; A13-K15 PolarHBondContact O-N 3.42Å; A13-K15 VanDerWaalsContact O-N 3.17Å | ||
| 14 | V | 70.3 | Confident | 65.9 | Low | 139 Ų | 139 | 117.4 Ų | 117.4 | 84% | 0.842 | 63% | 0.631 | S | S | * | * | trans | -69.5 | 110.9 | 174.9 | 179.9 | 0 | 0 | 0 | 0 | 107.6 | T12 | T12-V14 PolarHBondContact O-N 2.97Š| ||
| 15 | K | 73.3 | Confident | 68 | Low | 172 Ų | 172 | 112.8 Ų | 112.8 | 75% | 0.748 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 139.6 | 174.4 | -65.9 | -168.9 | 177.3 | -170.5 | 0 | 110.1 | A13 Q17 | A13-K15 PolarHBondContact O-N 3.42Å; A13-K15 VanDerWaalsContact O-N 3.17Å; K15-Q17 PolarHBondContact O-N 3.31Å |
| 16 | A | 78.6 | Confident | 70.1 | Confident | 99 Ų | 99 | 111.3 Ų | 111.3 | 82% | 0.818 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 136.8 | 172 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 17 | Q | 81.8 | Confident | 72.4 | Confident | 165 Ų | 165 | 111.5 Ų | 111.5 | 77% | 0.771 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -74 | 149 | 172.9 | -66.6 | -63.5 | -42.6 | 0 | 0 | 109.6 | K15 D19 | K15-Q17 PolarHBondContact O-N 3.31Å; Q17-D19 PolarHBondContact O-N 3.29Å |
| 18 | P | 81.8 | Confident | 74.7 | Confident | 88 Ų | 88 | 108.8 Ų | 108.8 | 57% | 0.571 | 58% | 0.584 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 123.4 | 175.9 | -23.3 | 33.5 | 0 | 0 | 0 | 111 | P20 L23 | P18-P20 WeakPolarHBondContact O-CD 3.11Å; P18-L23 HydrophobicContact CB-CD1 3.62Å |
| 19 | D | 86.9 | Confident | 76.9 | Confident | 67 Ų | 67 | 102.7 Ų | 102.7 | 36% | 0.358 | 55% | 0.551 | S | S | . | * | P | Polyproline II helix | trans | -90.3 | 116.1 | 176.8 | -173.2 | -25 | 0 | 0 | 0 | 110.2 | Q17 N21 I22 L23 | Q17-D19 PolarHBondContact O-N 3.29Å; D19-N21 PolarHBondContact O-N 3.19Å; D19-N21 WeakPolarHBondContact OD1-CB 3.43Å; D19-N21 PolarHBondContact OD1-N 2.67Å; D19-N21 PolarHBondContact OD1-ND2 2.74Å; D19-I22 HydrophobicContact CB-CB 4.15Å; D19-I22 HydrophobicContact CB-CD1 3.95Å; D19-I22 HydrophobicContact CB-CG1 4Å; D19-I22 PolarHBondContact O-N 2.91Å; D19-L23 WeakPolarHBondContact O-CB 3.41Å; D19-L23 WeakPolarHBondContact O-CG 3.18Å; D19-L23 PolarHBondContact O-N 2.79Å |
| 20 | P | 85.5 | Confident | 78.9 | Confident | 66 Ų | 66 | 99 Ų | 99 | 43% | 0.429 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -54.8 | -33 | 176.2 | -28.3 | 37.8 | 0 | 0 | 0 | 114.4 | P18 Y24 | P18-P20 WeakPolarHBondContact O-CD 3.11Å; P20-Y24 HydrophobicContact CB-CD2 3.56Å; P20-Y24 HydrophobicContact CB-CE2 3.6Å; P20-Y24 HydrophobicContact CG-CE2 4.22Å; P20-Y24 WeakPolarHBondContact O-CA 3.48Å; P20-Y24 WeakPolarHBondContact O-CB 3.29Å; P20-Y24 WeakPolarHBondContact O-CD2 3.2Å; P20-Y24 PolarHBondContact O-N 3.2Å |
| 21 | N | 85.8 | Confident | 81 | Confident | 126 Ų | 126 | 98.5 Ų | 98.5 | 67% | 0.674 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -75 | -34.3 | -178.1 | -61.5 | -56.4 | 0 | 0 | 0 | 111.7 | D19 D25 | D19-N21 PolarHBondContact O-N 3.19Å; D19-N21 WeakPolarHBondContact OD1-CB 3.43Å; D19-N21 PolarHBondContact OD1-N 2.67Å; D19-N21 PolarHBondContact OD1-ND2 2.74Å; N21-D25 WeakPolarHBondContact O-CB 3.41Å |
| 22 | I | 85.8 | Confident | 82.8 | Confident | 92 Ų | 92 | 93.9 Ų | 93.9 | 47% | 0.472 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -75.9 | -38.9 | 175.8 | -60.2 | 178.5 | 0 | 0 | 0 | 109.7 | D19 V28 H164 | D19-I22 HydrophobicContact CB-CB 4.15Å; D19-I22 HydrophobicContact CB-CD1 3.95Å; D19-I22 HydrophobicContact CB-CG1 4Å; D19-I22 PolarHBondContact O-N 2.91Å; I22-V28 HydrophobicContact CG2-CG1 4.38Å; I22-H164 PolarHBondContact O-CE1 3.39Å |
| 23 | L | 82.4 | Confident | 84.6 | Confident | 19 Ų | 19 | 89.9 Ų | 89.9 | 10% | 0.099 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -92.8 | -21 | -173.3 | -65 | 178.4 | 0 | 0 | 0 | 114.7 | P18 D19 E163 R167 | P18-L23 HydrophobicContact CB-CD1 3.62Å; D19-L23 WeakPolarHBondContact O-CB 3.41Å; D19-L23 WeakPolarHBondContact O-CG 3.18Å; D19-L23 PolarHBondContact O-N 2.79Å; L23-E163 HydrophobicContact CD2-CB 3.94Å; L23-E163 WeakPolarHBondContact CD2-OE2 3.44Å; L23-R167 WeakPolarHBondContact O-CD 3.22Å; L23-R167 PolarHBondContact O-NE 3.24Å; L23-R167 PolarHBondContact O-NH1 3.29Å; L23-R167 PolarHBondContact O-NH2 2.81Å |
| 24 | Y | 82.5 | Confident | 86 | Confident | 171 Ų | 171 | 90.7 Ų | 90.7 | 67% | 0.671 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -104.2 | -9.7 | -179 | -56.4 | -29.1 | 0 | 0 | 0 | 113.4 | P20 | P20-Y24 HydrophobicContact CB-CD2 3.56Å; P20-Y24 HydrophobicContact CB-CE2 3.6Å; P20-Y24 HydrophobicContact CG-CE2 4.22Å; P20-Y24 WeakPolarHBondContact O-CA 3.48Å; P20-Y24 WeakPolarHBondContact O-CB 3.29Å; P20-Y24 WeakPolarHBondContact O-CD2 3.2Å; P20-Y24 PolarHBondContact O-N 3.2Å |
| 25 | D | 87.2 | Confident | 87.1 | Confident | 43 Ų | 43 | 87.1 Ų | 87.1 | 23% | 0.23 | 45% | 0.453 | C | S | . | . | trans | -85.6 | 116 | 177.4 | -165.4 | -20.3 | 0 | 0 | 0 | 111.1 | N21 R27 V28 | N21-D25 WeakPolarHBondContact O-CB 3.41Å; D25-R27 PolarHBondContact O-N 2.79Å; D25-R27 WeakPolarHBondContact OD1-CB 3.49Å; D25-R27 WeakPolarHBondContact OD1-CG 3.4Å; D25-R27 PolarHBondContact OD1-N 3.22Å; D25-R27 IonicContact OD1-NE 3.11Å; D25-R27 PolarHBondContact OD1-NE 3.36Å; D25-R27 VanDerWaalsContact OD1-NE 3.11Å; D25-R27 IonicContact OD2-CZ 3.16Å; D25-R27 IonicContact OD2-NE 2.87Å; D25-R27 PolarHBondContact OD2-NE 3Å; D25-R27 IonicContact OD2-NH2 2.65Å; D25-R27 PolarHBondContact OD2-NH2 2.95Å; D25-V28 HydrophobicContact CB-CG2 4.08Å; D25-V28 PolarHBondContact O-N 3.33Å | ||
| 26 | D | 86.5 | Confident | 88 | Confident | 104 Ų | 104 | 79.5 Ų | 79.5 | 56% | 0.556 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -62.3 | -24.9 | 176.2 | -72.8 | -29.8 | 0 | 0 | 0 | 112.4 | V28 L29 Q30 R168 | D26-V28 PolarHBondContact O-N 3.29Å; D26-L29 PolarHBondContact O-N 3.09Å; D26-Q30 PolarHBondContact O-N 2.9Å; D26-R168 IonicContact OD1-CZ 3.59Å; D26-R168 IonicContact OD1-NE 3.69Å; D26-R168 IonicContact OD1-NH2 2.67Å; D26-R168 PolarHBondContact OD1-NH2 2.88Å |
| 27 | R | 91.8 | Very high | 88.5 | Confident | 186 Ų | 186 | 79.7 Ų | 79.7 | 70% | 0.702 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -62.7 | -30.5 | 177.2 | -60 | 179.3 | -63 | 166 | 1.7 | 112.2 | D25 S31 | D25-R27 PolarHBondContact O-N 2.79Å; D25-R27 WeakPolarHBondContact OD1-CB 3.49Å; D25-R27 WeakPolarHBondContact OD1-CG 3.4Å; D25-R27 PolarHBondContact OD1-N 3.22Å; D25-R27 IonicContact OD1-NE 3.11Å; D25-R27 PolarHBondContact OD1-NE 3.36Å; D25-R27 VanDerWaalsContact OD1-NE 3.11Å; D25-R27 IonicContact OD2-CZ 3.16Å; D25-R27 IonicContact OD2-NE 2.87Å; D25-R27 PolarHBondContact OD2-NE 3Å; D25-R27 IonicContact OD2-NH2 2.65Å; D25-R27 PolarHBondContact OD2-NH2 2.95Å; R27-S31 VanDerWaalsContact O-CB 3.29Å; R27-S31 WeakPolarHBondContact O-CB 3.45Å; R27-S31 PolarHBondContact O-N 3.35Å |
| 28 | V | 92 | Very high | 88.7 | Confident | 43 Ų | 43 | 75.8 Ų | 75.8 | 26% | 0.261 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -68.4 | -49.5 | 178.5 | -179.8 | 0 | 0 | 0 | 0 | 109.9 | I22 D25 D26 Q30 S31 L32 H164 | I22-V28 HydrophobicContact CG2-CG1 4.38Å; D25-V28 HydrophobicContact CB-CG2 4.08Å; D25-V28 PolarHBondContact O-N 3.33Å; D26-V28 PolarHBondContact O-N 3.29Å; V28-Q30 VanDerWaalsContact C-N 3.32Å; V28-Q30 PolarHBondContact O-N 3.32Å; V28-S31 WeakPolarHBondContact O-CB 3.44Å; V28-S31 PolarHBondContact O-N 3.19Å; V28-L32 HydrophobicContact CG1-CD1 4.41Å; V28-L32 WeakPolarHBondContact O-CG 3.18Å; V28-L32 PolarHBondContact O-N 3.07Å; V28-H164 WeakPolarHBondContact CG1-NE2 3.37Å |
| 29 | L | 91.3 | Very high | 88.9 | Confident | 8 Ų | 8 | 72.2 Ų | 72.2 | 4% | 0.042 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -59.5 | -45.6 | 175 | 175.5 | 63.5 | 0 | 0 | 0 | 110.8 | D26 S31 L32 L33 F161 H164 I237 | D26-L29 PolarHBondContact O-N 3.09Å; L29-S31 VanDerWaalsContact C-N 3.27Å; L29-S31 PolarHBondContact O-N 2.96Å; L29-L32 PolarHBondContact O-N 2.95Å; L29-L32 VanDerWaalsContact O-N 3.16Å; L29-L33 HydrophobicContact CD1-CD1 4.25Å; L29-L33 HydrophobicContact CD1-CG 4.13Å; L29-L33 HydrophobicContact CD2-CD1 4.49Å; L29-L33 HydrophobicContact CG-CD1 4.01Å; L29-L33 HydrophobicContact CG-CG 4.35Å; L29-L33 WeakPolarHBondContact O-CG 3.29Å; L29-L33 PolarHBondContact O-N 3.08Å; L29-F161 HydrophobicContact CD1-CD1 3.58Å; L29-F161 HydrophobicContact CD1-CE1 3.76Å; L29-H164 HydrophobicContact CD1-CB 4.17Å; L29-I237 HydrophobicContact CD2-CG2 3.95Å |
| 30 | Q | 91.4 | Very high | 88.9 | Confident | 110 Ų | 110 | 70.6 Ų | 70.6 | 51% | 0.514 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.9 | -39 | 179.1 | -171 | 61.8 | 43.1 | 0 | 0 | 111.8 | D26 V28 T34 | D26-Q30 PolarHBondContact O-N 2.9Å; V28-Q30 VanDerWaalsContact C-N 3.32Å; V28-Q30 PolarHBondContact O-N 3.32Å; Q30-T34 WeakPolarHBondContact O-CB 3.18Å; Q30-T34 PolarHBondContact O-N 3.11Å; Q30-T34 PolarHBondContact O-OG1 3.04Å |
| 31 | S | 92.9 | Very high | 88.8 | Confident | 64 Ų | 64 | 67.7 Ų | 67.7 | 45% | 0.448 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 175.3 | -171 | 0 | 0 | 0 | 0 | 111.4 | R27 V28 L29 T34 I35 | R27-S31 VanDerWaalsContact O-CB 3.29Å; R27-S31 WeakPolarHBondContact O-CB 3.45Å; R27-S31 PolarHBondContact O-N 3.35Å; V28-S31 WeakPolarHBondContact O-CB 3.44Å; V28-S31 PolarHBondContact O-N 3.19Å; L29-S31 VanDerWaalsContact C-N 3.27Å; L29-S31 PolarHBondContact O-N 2.96Å; S31-T34 PolarHBondContact O-N 3.04Å; S31-I35 WeakPolarHBondContact O-CG1 3.4Å; S31-I35 PolarHBondContact O-N 2.89Å; S31-I35 VanDerWaalsContact O-N 3.11Å |
| 32 | L | 93.1 | Very high | 88.1 | Confident | 29 Ų | 29 | 70.4 Ų | 70.4 | 15% | 0.152 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 177.1 | -69.8 | 170.8 | 0 | 0 | 0 | 111.6 | V28 L29 T34 I35 E36 V156 F161 H164 | V28-L32 HydrophobicContact CG1-CD1 4.41Å; V28-L32 WeakPolarHBondContact O-CG 3.18Å; V28-L32 PolarHBondContact O-N 3.07Å; L29-L32 PolarHBondContact O-N 2.95Å; L29-L32 VanDerWaalsContact O-N 3.16Å; L32-T34 VanDerWaalsContact C-N 3.26Å; L32-T34 PolarHBondContact O-N 3.05Å; L32-I35 PolarHBondContact O-N 2.96Å; L32-E36 WeakPolarHBondContact O-CB 3.4Å; L32-E36 PolarHBondContact O-N 3.16Å; L32-V156 HydrophobicContact CD2-CG1 4.18Å; L32-V156 HydrophobicContact CD2-CG2 3.84Å; L32-F161 HydrophobicContact CB-CE1 3.72Å; L32-F161 HydrophobicContact CB-CZ 3.83Å; L32-H164 VanDerWaalsContact CD1-CD2 3.45Å; L32-H164 WeakPolarHBondContact CD1-CD2 3.23Å; L32-H164 WeakPolarHBondContact CD1-NE2 3.3Å |
| 33 | L | 93.1 | Very high | 87.5 | Confident | 20 Ų | 20 | 66.9 Ų | 66.9 | 11% | 0.105 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.8 | -33 | 175.2 | -66.9 | 171.8 | 0 | 0 | 0 | 112.4 | L29 E36 F161 T238 | L29-L33 HydrophobicContact CD1-CD1 4.25Å; L29-L33 HydrophobicContact CD1-CG 4.13Å; L29-L33 HydrophobicContact CD2-CD1 4.49Å; L29-L33 HydrophobicContact CG-CD1 4.01Å; L29-L33 HydrophobicContact CG-CG 4.35Å; L29-L33 WeakPolarHBondContact O-CG 3.29Å; L29-L33 PolarHBondContact O-N 3.08Å; L33-E36 WeakPolarHBondContact CD2-OE1 3.49Å; L33-F161 HydrophobicContact CD2-CD1 4.45Å; L33-F161 HydrophobicContact CD2-CE1 3.61Å; L33-F161 HydrophobicContact CD2-CZ 4.13Å; L33-F161 HydrophobicContact CG-CE1 3.99Å; L33-T238 HydrophobicContact CD2-CG2 4.33Å |
| 34 | T | 92.5 | Very high | 87.6 | Confident | 93 Ų | 93 | 68.5 Ų | 68.5 | 57% | 0.571 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -74.1 | -33.5 | -179.4 | -56.7 | 0 | 0 | 0 | 0 | 112.2 | Q30 S31 L32 | Q30-T34 WeakPolarHBondContact O-CB 3.18Å; Q30-T34 PolarHBondContact O-N 3.11Å; Q30-T34 PolarHBondContact O-OG1 3.04Å; S31-T34 PolarHBondContact O-N 3.04Å; L32-T34 VanDerWaalsContact C-N 3.26Å; L32-T34 PolarHBondContact O-N 3.05Å |
| 35 | I | 93.1 | Very high | 87.8 | Confident | 65 Ų | 65 | 60.6 Ų | 60.6 | 33% | 0.333 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -94.8 | -16.8 | -175 | 69.1 | 178.9 | 0 | 0 | 0 | 113.3 | S31 L32 D37 S38 F39 V156 | S31-I35 WeakPolarHBondContact O-CG1 3.4Å; S31-I35 PolarHBondContact O-N 2.89Å; S31-I35 VanDerWaalsContact O-N 3.11Å; L32-I35 PolarHBondContact O-N 2.96Å; I35-D37 VanDerWaalsContact C-N 3.26Å; I35-D37 PolarHBondContact O-N 3.15Å; I35-S38 VanDerWaalsContact O-CB 3.23Å; I35-S38 WeakPolarHBondContact O-CB 3.32Å; I35-S38 PolarHBondContact O-N 2.88Å; I35-S38 PolarHBondContact O-OG 3.47Å; I35-F39 HydrophobicContact CB-CE2 4.25Å; I35-F39 HydrophobicContact CD1-CE2 4.33Å; I35-F39 HydrophobicContact CG1-CE2 4.18Å; I35-F39 WeakPolarHBondContact O-CD2 3.49Å; I35-F39 WeakPolarHBondContact O-CE2 3.28Å; I35-V156 HydrophobicContact CD1-CG2 3.44Å; I35-V156 VanDerWaalsContact CD1-CG2 3.44Å; I35-V156 HydrophobicContact CG1-CG2 3.45Å; I35-V156 VanDerWaalsContact CG1-CG2 3.45Å |
| 36 | E | 93.1 | Very high | 87.8 | Confident | 11 Ų | 11 | 60.1 Ų | 60.1 | 5% | 0.051 | 32% | 0.316 | C | S | . | . | G | 310 helix | trans | -57.5 | -37.1 | -173 | 74.2 | 178.6 | 139.7 | 0 | 0 | 113.4 | L32 L33 S38 F39 V156 F161 P200 P201 S202 | L32-E36 WeakPolarHBondContact O-CB 3.4Å; L32-E36 PolarHBondContact O-N 3.16Å; L33-E36 WeakPolarHBondContact CD2-OE1 3.49Å; E36-S38 PolarHBondContact O-N 3.23Å; E36-S38 VanDerWaalsContact O-N 3.16Å; E36-F39 PolarHBondContact O-N 3.27Å; E36-V156 HydrophobicContact CB-CB 4.42Å; E36-V156 HydrophobicContact CB-CG1 4.33Å; E36-F161 HydrophobicContact CB-CZ 4.49Å; E36-P200 HydrophobicContact CG-CB 4.45Å; E36-P200 WeakPolarHBondContact OE2-CB 3.49Å; E36-P201 HydrophobicContact CB-CG 4.39Å; E36-P201 WeakPolarHBondContact OE2-CD 3.3Å; E36-S202 VanDerWaalsContact OE1-CB 3.29Å; E36-S202 WeakPolarHBondContact OE1-CB 3.39Å; E36-S202 PolarHBondContact OE1-OG 3.22Å; E36-S202 WeakPolarHBondContact OE2-CB 3.44Å; E36-S202 PolarHBondContact OE2-N 3Å; E36-S202 PolarHBondContact OE2-OG 3.34Å |
| 37 | D | 87.1 | Confident | 87.9 | Confident | 103 Ų | 103 | 63 Ų | 63 | 55% | 0.551 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -62.5 | -24.2 | 178.2 | -72.5 | -23.8 | 0 | 0 | 0 | 113 | I35 F39 L40 | I35-D37 VanDerWaalsContact C-N 3.26Å; I35-D37 PolarHBondContact O-N 3.15Å; D37-F39 PolarHBondContact O-N 3.28Å; D37-L40 PolarHBondContact O-N 2.73Å |
| 38 | S | 87.8 | Confident | 87.7 | Confident | 84 Ų | 84 | 63.2 Ų | 63.2 | 59% | 0.587 | 33% | 0.328 | S | S | * | . | G | 310 helix | trans | -70.4 | -14.7 | 177.7 | -59.4 | 0 | 0 | 0 | 0 | 112.9 | I35 E36 | I35-S38 VanDerWaalsContact O-CB 3.23Å; I35-S38 WeakPolarHBondContact O-CB 3.32Å; I35-S38 PolarHBondContact O-N 2.88Å; I35-S38 PolarHBondContact O-OG 3.47Å; E36-S38 PolarHBondContact O-N 3.23Å; E36-S38 VanDerWaalsContact O-N 3.16Å |
| 39 | F | 86 | Confident | 87.6 | Confident | 12 Ų | 12 | 62.7 Ų | 62.7 | 5% | 0.053 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -110.7 | 3.5 | -175.3 | -57.2 | -76.2 | 0 | 0 | 0 | 113.4 | I35 E36 D37 N84 R88 N152 A154 S155 V156 | I35-F39 HydrophobicContact CB-CE2 4.25Å; I35-F39 HydrophobicContact CD1-CE2 4.33Å; I35-F39 HydrophobicContact CG1-CE2 4.18Å; I35-F39 WeakPolarHBondContact O-CD2 3.49Å; I35-F39 WeakPolarHBondContact O-CE2 3.28Å; E36-F39 PolarHBondContact O-N 3.27Å; D37-F39 PolarHBondContact O-N 3.28Å; F39-N84 PolarHBondContact O-ND2 2.94Å; F39-R88 WeakPolarHBondContact O-CD 3.49Å; F39-N152 WeakPolarHBondContact CE1-ND2 3.47Å; F39-N152 VanDerWaalsContact CE1-OD1 3.26Å; F39-N152 WeakPolarHBondContact CE1-OD1 3.46Å; F39-A154 WeakPolarHBondContact CZ-O 3.37Å; F39-S155 VanDerWaalsContact CD1-CB 3.43Å; F39-S155 VanDerWaalsContact CD1-OG 3.27Å; F39-S155 WeakPolarHBondContact CD1-OG 3.45Å; F39-V156 HydrophobicContact CD2-CB 4.38Å; F39-V156 HydrophobicContact CD2-CG2 4.35Å; F39-V156 HydrophobicContact CE2-CG2 4.17Å |
| 40 | L | 86.9 | Confident | 87.7 | Confident | 33 Ų | 33 | 62.7 Ų | 62.7 | 17% | 0.173 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -79.2 | 147.5 | 174.7 | -71.4 | 176 | 0 | 0 | 0 | 111.9 | D37 Q42 N199 P200 | D37-L40 PolarHBondContact O-N 2.73Å; L40-Q42 PolarHBondContact O-N 3.2Å; L40-N199 WeakPolarHBondContact CD2-O 3.46Å; L40-P200 HydrophobicContact CD1-CB 4.48Å; L40-P200 HydrophobicContact CD1-CG 4.14Å |
| 41 | P | 82.3 | Confident | 87.7 | Confident | 6 Ų | 6 | 65.9 Ų | 65.9 | 4% | 0.039 | 34% | 0.336 | C | S | . | . | trans | -60.6 | 127.1 | 168.2 | -14.2 | 28 | 0 | 0 | 0 | 109.1 | C43 Y45 D87 A91 M198 | P41-C43 PolarHBondContact O-N 3.18Å; P41-C43 VanDerWaalsContact O-N 3.08Å; P41-Y45 HydrophobicContact CB-CD1 4.07Å; P41-Y45 HydrophobicContact CB-CE1 4.35Å; P41-D87 HydrophobicContact CG-CB 3.88Å; P41-A91 HydrophobicContact CB-CB 4.21Å; P41-M198 HydrophobicContact CB-SD 4Å; P41-M198 HydrophobicContact CG-SD 4.3Å; P41-M198 WeakPolarHBondContact O-CE 3.44Å | ||
| 42 | Q | 71 | Confident | 87.8 | Confident | 182 Ų | 182 | 66.6 Ų | 66.6 | 85% | 0.85 | 34% | 0.335 | S | S | * | . | S | Bend | trans | -70.3 | -9.6 | -170.7 | -66.4 | -173.6 | -20.1 | 0 | 0 | 114.6 | L40 | L40-Q42 PolarHBondContact O-N 3.2Š|
| 43 | C | 74.7 | Confident | 87.8 | Confident | 18 Ų | 18 | 65.2 Ų | 65.2 | 12% | 0.122 | 33% | 0.328 | C | S | . | . | S | Bend | trans | -163.8 | 170.4 | 179.9 | 66.8 | 0 | 0 | 0 | 0 | 112.6 | P41 Y45 | P41-C43 PolarHBondContact O-N 3.18Å; P41-C43 VanDerWaalsContact O-N 3.08Å; C43-Y45 PolarHBondContact O-N 3.05Å |
| 44 | S | 83 | Confident | 87.9 | Confident | 54 Ų | 54 | 68.5 Ų | 68.5 | 38% | 0.378 | 34% | 0.343 | S | S | . | . | trans | -62.7 | 85.6 | 164 | -172 | 0 | 0 | 0 | 0 | 109.9 | F46 Q47 R48 | S44-F46 PolarHBondContact O-N 2.99Å; S44-Q47 PolarHBondContact O-N 3.43Å; S44-Q47 VanDerWaalsContact O-N 3.11Å; S44-R48 PolarHBondContact O-N 3.38Å | ||
| 45 | Y | 86.7 | Confident | 87.9 | Confident | 5 Ų | 5 | 65.9 Ų | 65.9 | 2% | 0.02 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -68.7 | -23.2 | -169.9 | 58.9 | -101.3 | 0 | 0 | 0 | 112.5 | P41 C43 Q47 V49 Q50 D87 L90 A91 | P41-Y45 HydrophobicContact CB-CD1 4.07Å; P41-Y45 HydrophobicContact CB-CE1 4.35Å; C43-Y45 PolarHBondContact O-N 3.05Å; Y45-Q47 VanDerWaalsContact C-N 3.28Å; Y45-Q47 PolarHBondContact O-N 3.46Å; Y45-V49 PolarHBondContact O-N 2.83Å; Y45-Q50 HydrophobicContact CD2-CG 4Å; Y45-Q50 PolarHBondContact O-N 3.24Å; Y45-D87 HydrophobicContact CE1-CB 4.11Å; Y45-D87 PolarHBondContact OH-OD1 2.84Å; Y45-L90 HydrophobicContact CD2-CB 3.74Å; Y45-L90 HydrophobicContact CE2-CB 3.79Å; Y45-L90 HydrophobicContact CE2-CD1 3.95Å; Y45-L90 HydrophobicContact CG-CB 4.38Å; Y45-A91 HydrophobicContact CD1-CB 4.43Å |
| 46 | F | 88.7 | Confident | 87.9 | Confident | 32 Ų | 32 | 69.6 Ų | 69.6 | 14% | 0.14 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.1 | -32.4 | 171.6 | -67.4 | -69.4 | 0 | 0 | 0 | 113.4 | S44 I53 P55 R58 D194 | S44-F46 PolarHBondContact O-N 2.99Å; F46-I53 HydrophobicContact CE1-CG2 4.06Å; F46-P55 HydrophobicContact CB-CG 4.49Å; F46-P55 HydrophobicContact CD1-CG 4.07Å; F46-P55 HydrophobicContact CD2-CG 4.07Å; F46-P55 HydrophobicContact CE1-CB 4.49Å; F46-P55 HydrophobicContact CE1-CG 4.29Å; F46-P55 HydrophobicContact CE2-CB 4.39Å; F46-P55 HydrophobicContact CE2-CG 4.3Å; F46-P55 HydrophobicContact CG-CG 3.95Å; F46-P55 HydrophobicContact CZ-CB 4.32Å; F46-P55 HydrophobicContact CZ-CG 4.41Å; F46-R58 HydrophobicContact CE1-CB 4.1Å; F46-R58 HydrophobicContact CZ-CB 3.71Å; F46-R58 HydrophobicContact CZ-CG 4.02Å; F46-D194 HydrophobicContact CE2-CB 4.01Å; F46-D194 HydrophobicContact CZ-CB 4.48Å |
| 47 | Q | 86.9 | Confident | 88 | Confident | 166 Ų | 166 | 70.7 Ų | 70.7 | 78% | 0.776 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -92.3 | -33.3 | -179 | -63.8 | 179.2 | 4.2 | 0 | 0 | 112.2 | S44 Y45 | S44-Q47 PolarHBondContact O-N 3.43Å; S44-Q47 VanDerWaalsContact O-N 3.11Å; Y45-Q47 VanDerWaalsContact C-N 3.28Å; Y45-Q47 PolarHBondContact O-N 3.46Å |
| 48 | R | 87.9 | Confident | 88.3 | Confident | 190 Ų | 190 | 65.8 Ų | 65.8 | 72% | 0.717 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -98.4 | -29.9 | -169.2 | -66.7 | -178 | 66.8 | -169.8 | -1.5 | 114.4 | S44 | S44-R48 PolarHBondContact O-N 3.38Å |
| 49 | V | 91.1 | Very high | 88.6 | Confident | 31 Ų | 31 | 66.2 Ų | 66.2 | 19% | 0.188 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -123 | -49.4 | -169 | -177 | 0 | 0 | 0 | 0 | 111.2 | Y45 P94 | Y45-V49 PolarHBondContact O-N 2.83Å; V49-P94 HydrophobicContact CG1-CG 4.04Å |
| 50 | Q | 93.4 | Very high | 89 | Confident | 9 Ų | 9 | 72 Ų | 72 | 4% | 0.042 | 34% | 0.335 | C | S | . | . | trans | -78.5 | 132.9 | -177.2 | -57.7 | -54.8 | -43.7 | 0 | 0 | 111 | Y45 I53 L90 M93 | Y45-Q50 HydrophobicContact CD2-CG 4Å; Y45-Q50 PolarHBondContact O-N 3.24Å; Q50-I53 HydrophobicContact CB-CB 4.09Å; Q50-I53 HydrophobicContact CG-CB 4.2Å; Q50-L90 PolarHBondContact NE2-O 2.96Å; Q50-M93 PolarHBondContact NE2-O 3.18Å | ||
| 51 | K | 91.5 | Very high | 89.5 | Confident | 177 Ų | 177 | 71.2 Ų | 71.2 | 77% | 0.77 | 33% | 0.332 | S | S | * | . | S | Bend | trans | -107 | -39.9 | 173.2 | -62.3 | -177 | -179.1 | -179.2 | 0 | 111.4 | ||
| 52 | D | 93.1 | Very high | 90.2 | Very high | 79 Ų | 79 | 71 Ų | 71 | 42% | 0.422 | 33% | 0.33 | S | S | . | . | S | Bend | trans | -96.8 | -28.5 | -173.5 | -65.5 | 10.7 | 0 | 0 | 0 | 112.4 | ||
| 53 | I | 94.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 30% | 0.301 | C | S | . | . | trans | -86.9 | 127 | -177 | -48.7 | -55.8 | 0 | 0 | 0 | 110 | F46 Q50 M57 L90 T95 K97 L100 | F46-I53 HydrophobicContact CE1-CG2 4.06Å; Q50-I53 HydrophobicContact CB-CB 4.09Å; Q50-I53 HydrophobicContact CG-CB 4.2Å; I53-M57 HydrophobicContact CG2-CB 4.44Å; I53-L90 HydrophobicContact CG1-CD2 4.48Å; I53-T95 WeakPolarHBondContact CG1-O 3.31Å; I53-K97 VanDerWaalsContact CD1-CA 3.46Å; I53-K97 HydrophobicContact CD1-CB 4.15Å; I53-L100 HydrophobicContact CD1-CB 4.31Å; I53-L100 HydrophobicContact CD1-CD1 4.2Å; I53-L100 HydrophobicContact CD1-CD2 4.33Å; I53-L100 HydrophobicContact CG2-CD1 4.26Å; I53-L100 HydrophobicContact CG2-CD2 4.11Å | ||
| 54 | Q | 93.6 | Very high | 92.4 | Very high | 89 Ų | 89 | 64.4 Ų | 64.4 | 42% | 0.416 | 30% | 0.302 | S | S | . | . | trans | -108 | 155.7 | 175.6 | -61.7 | -60.7 | -44.2 | 0 | 0 | 110.8 | Y56 M57 R58 | Q54-Y56 VanDerWaalsContact C-N 3.27Å; Q54-Y56 HydrophobicContact CB-CD1 3.57Å; Q54-Y56 HydrophobicContact CB-CE1 3.49Å; Q54-Y56 VanDerWaalsContact CB-CE1 3.49Å; Q54-Y56 HydrophobicContact CG-CE1 4.02Å; Q54-Y56 PolarHBondContact O-N 3.32Å; Q54-M57 HydrophobicContact CB-CE 4.34Å; Q54-M57 HydrophobicContact CB-CG 4.27Å; Q54-M57 HydrophobicContact CB-SD 4.37Å; Q54-M57 HydrophobicContact CG-CE 4.15Å; Q54-M57 WeakPolarHBondContact O-CB 3.45Å; Q54-M57 PolarHBondContact O-N 3.04Å; Q54-R58 PolarHBondContact O-N 3.26Å | ||
| 55 | P | 92.7 | Very high | 93.1 | Very high | 38 Ų | 38 | 61.8 Ų | 61.8 | 25% | 0.247 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -53.1 | -39.9 | -178.6 | -29.3 | 35.5 | 0 | 0 | 0 | 114.5 | F46 M57 R58 R59 D194 | F46-P55 HydrophobicContact CB-CG 4.49Å; F46-P55 HydrophobicContact CD1-CG 4.07Å; F46-P55 HydrophobicContact CD2-CG 4.07Å; F46-P55 HydrophobicContact CE1-CB 4.49Å; F46-P55 HydrophobicContact CE1-CG 4.29Å; F46-P55 HydrophobicContact CE2-CB 4.39Å; F46-P55 HydrophobicContact CE2-CG 4.3Å; F46-P55 HydrophobicContact CG-CG 3.95Å; F46-P55 HydrophobicContact CZ-CB 4.32Å; F46-P55 HydrophobicContact CZ-CG 4.41Å; P55-M57 VanDerWaalsContact C-N 3.3Å; P55-M57 PolarHBondContact O-N 3.45Å; P55-R58 PolarHBondContact O-N 3.23Å; P55-R59 PolarHBondContact O-N 3.46Å; P55-D194 HydrophobicContact CB-CB 4.28Å |
| 56 | Y | 92.7 | Very high | 93.6 | Very high | 142 Ų | 142 | 64.2 Ų | 64.2 | 56% | 0.557 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -64.1 | -33.3 | 177.7 | 81.7 | -91.4 | 0 | 0 | 0 | 112.7 | Q54 R59 M60 | Q54-Y56 VanDerWaalsContact C-N 3.27Å; Q54-Y56 HydrophobicContact CB-CD1 3.57Å; Q54-Y56 HydrophobicContact CB-CE1 3.49Å; Q54-Y56 VanDerWaalsContact CB-CE1 3.49Å; Q54-Y56 HydrophobicContact CG-CE1 4.02Å; Q54-Y56 PolarHBondContact O-N 3.32Å; Y56-R59 PolarHBondContact O-N 3.34Å; Y56-M60 VanDerWaalsContact O-CG 3.31Å; Y56-M60 WeakPolarHBondContact O-CG 3.15Å; Y56-M60 PolarHBondContact O-N 2.9Å |
| 57 | M | 95.3 | Very high | 94 | Very high | 34 Ų | 34 | 68.9 Ų | 68.9 | 17% | 0.167 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -67.8 | -40 | 177.6 | -58.7 | 177.5 | -178 | 0 | 0 | 110.8 | I53 Q54 P55 R59 M60 V61 K97 L100 | I53-M57 HydrophobicContact CG2-CB 4.44Å; Q54-M57 HydrophobicContact CB-CE 4.34Å; Q54-M57 HydrophobicContact CB-CG 4.27Å; Q54-M57 HydrophobicContact CB-SD 4.37Å; Q54-M57 HydrophobicContact CG-CE 4.15Å; Q54-M57 WeakPolarHBondContact O-CB 3.45Å; Q54-M57 PolarHBondContact O-N 3.04Å; P55-M57 VanDerWaalsContact C-N 3.3Å; P55-M57 PolarHBondContact O-N 3.45Å; M57-R59 VanDerWaalsContact C-N 3.35Å; M57-M60 PolarHBondContact O-N 3.46Å; M57-V61 PolarHBondContact O-N 2.97Å; M57-K97 HydrophobicContact SD-CB 4.12Å; M57-L100 HydrophobicContact CB-CD2 3.84Å |
| 58 | R | 95.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 61.1 Ų | 61.1 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.2 | -40.1 | 174.4 | -178.3 | -96.8 | -178.7 | -133.8 | 4.9 | 111.2 | F46 Q54 P55 V61 A62 L86 D87 A191 T192 | F46-R58 HydrophobicContact CE1-CB 4.1Å; F46-R58 HydrophobicContact CZ-CB 3.71Å; F46-R58 HydrophobicContact CZ-CG 4.02Å; Q54-R58 PolarHBondContact O-N 3.26Å; P55-R58 PolarHBondContact O-N 3.23Å; R58-V61 PolarHBondContact O-N 2.81Å; R58-A62 VanDerWaalsContact O-CB 3.29Å; R58-A62 WeakPolarHBondContact O-CB 3.46Å; R58-A62 PolarHBondContact O-N 3.5Å; R58-L86 HydrophobicContact CG-CD2 4.34Å; R58-D87 IonicContact CZ-OD1 3.49Å; R58-D87 IonicContact CZ-OD2 3.69Å; R58-D87 IonicContact NE-OD1 3.78Å; R58-D87 PolarHBondContact NE-OD1 2.85Å; R58-D87 IonicContact NE-OD2 3.82Å; R58-D87 IonicContact NH2-OD1 3.02Å; R58-D87 PolarHBondContact NH2-OD1 3.38Å; R58-D87 IonicContact NH2-OD2 2.78Å; R58-D87 PolarHBondContact NH2-OD2 3.13Å; R58-A191 VanDerWaalsContact CZ-O 3.25Å; R58-A191 PolarHBondContact NH1-O 3.3Å; R58-A191 PolarHBondContact NH2-O 2.98Å; R58-T192 PolarHBondContact NH1-O 3.26Å |
| 59 | R | 93.6 | Very high | 94.8 | Very high | 93 Ų | 93 | 52.3 Ų | 52.3 | 35% | 0.351 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.8 | -44.7 | 173.6 | -170.6 | -180 | -54.2 | 166.3 | 4.1 | 112.6 | P55 Y56 M57 A62 G63 D194 | P55-R59 PolarHBondContact O-N 3.46Å; Y56-R59 PolarHBondContact O-N 3.34Å; M57-R59 VanDerWaalsContact C-N 3.35Å; R59-A62 PolarHBondContact O-N 3.21Å; R59-G63 PolarHBondContact O-N 3.03Å; R59-D194 IonicContact CZ-OD1 3.91Å; R59-D194 IonicContact NH2-OD1 2.94Å; R59-D194 PolarHBondContact NH2-OD1 3.35Å |
| 60 | M | 94.4 | Very high | 95 | Very high | 134 Ų | 134 | 56.7 Ų | 56.7 | 66% | 0.66 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -59.6 | -46.9 | 176.3 | -70.9 | -62.2 | -58.3 | 0 | 0 | 111.7 | Y56 M57 G63 W64 | Y56-M60 VanDerWaalsContact O-CG 3.31Å; Y56-M60 WeakPolarHBondContact O-CG 3.15Å; Y56-M60 PolarHBondContact O-N 2.9Å; M57-M60 PolarHBondContact O-N 3.46Å; M60-G63 PolarHBondContact O-N 2.89Å; M60-W64 PolarHBondContact O-N 3.44Å |
| 61 | V | 96.9 | Very high | 95 | Very high | 17 Ų | 17 | 63.1 Ų | 63.1 | 10% | 0.103 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -68.7 | -37.6 | 178.7 | 171.4 | 0 | 0 | 0 | 0 | 111.6 | M57 R58 G63 W64 M65 L100 | M57-V61 PolarHBondContact O-N 2.97Å; R58-V61 PolarHBondContact O-N 2.81Å; V61-G63 VanDerWaalsContact C-N 3.35Å; V61-G63 PolarHBondContact O-N 3.41Å; V61-W64 HydrophobicContact CG1-CE3 4.27Å; V61-W64 PolarHBondContact O-N 3.16Å; V61-M65 HydrophobicContact CG1-CG 4.17Å; V61-M65 HydrophobicContact CG1-SD 3.87Å; V61-M65 WeakPolarHBondContact O-CB 3.29Å; V61-M65 WeakPolarHBondContact O-CG 3.45Å; V61-M65 PolarHBondContact O-N 3.41Å; V61-L100 HydrophobicContact CB-CD2 4.26Å; V61-L100 HydrophobicContact CB-CG 4.29Å; V61-L100 HydrophobicContact CG1-CG 4.45Å; V61-L100 HydrophobicContact CG2-CB 4.38Å; V61-L100 HydrophobicContact CG2-CD2 3.67Å; V61-L100 HydrophobicContact CG2-CG 3.78Å |
| 62 | A | 96.7 | Very high | 95.1 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -63.6 | -38.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | R58 R59 M65 H66 F79 I83 T192 | R58-A62 VanDerWaalsContact O-CB 3.29Å; R58-A62 WeakPolarHBondContact O-CB 3.46Å; R58-A62 PolarHBondContact O-N 3.5Å; R59-A62 PolarHBondContact O-N 3.21Å; A62-M65 PolarHBondContact O-N 3.41Å; A62-H66 PolarHBondContact O-N 2.66Å; A62-F79 VanDerWaalsContact O-CE2 3.29Å; A62-F79 WeakPolarHBondContact O-CE2 3.49Å; A62-I83 HydrophobicContact CB-CD1 3.6Å; A62-T192 HydrophobicContact CB-CG2 4.5Å |
| 63 | G | 95.7 | Very high | 95 | Very high | 23 Ų | 23 | 60.6 Ų | 60.6 | 24% | 0.237 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.9 | -50.2 | 173 | 0 | 0 | 0 | 0 | 0 | 112 | R59 M60 V61 M65 H66 E67 | R59-G63 PolarHBondContact O-N 3.03Å; M60-G63 PolarHBondContact O-N 2.89Å; V61-G63 VanDerWaalsContact C-N 3.35Å; V61-G63 PolarHBondContact O-N 3.41Å; G63-M65 VanDerWaalsContact C-N 3.32Å; G63-M65 PolarHBondContact O-N 3.08Å; G63-H66 WeakPolarHBondContact O-CB 3.23Å; G63-H66 PolarHBondContact O-N 3.02Å; G63-H66 VanDerWaalsContact O-N 3.16Å; G63-E67 WeakPolarHBondContact O-CG 3.49Å; G63-E67 PolarHBondContact O-N 3.48Å |
| 64 | W | 97.1 | Very high | 94.9 | Very high | 39 Ų | 39 | 61.4 Ų | 61.4 | 15% | 0.148 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -57.7 | -43.3 | 173.7 | 167.6 | 78.8 | 0 | 0 | 0 | 112 | M60 V61 H66 E67 V68 Q101 A105 I108 Y128 T129 | M60-W64 PolarHBondContact O-N 3.44Å; V61-W64 HydrophobicContact CG1-CE3 4.27Å; V61-W64 PolarHBondContact O-N 3.16Å; W64-H66 VanDerWaalsContact C-N 3.3Å; W64-H66 PolarHBondContact O-N 2.96Å; W64-E67 PolarHBondContact O-N 2.81Å; W64-V68 HydrophobicContact CD2-CG2 4.28Å; W64-V68 HydrophobicContact CZ2-CG2 3.88Å; W64-V68 WeakPolarHBondContact O-CG2 3.26Å; W64-V68 PolarHBondContact O-N 3.06Å; W64-Q101 HydrophobicContact CE3-CG 4.4Å; W64-Q101 HydrophobicContact CH2-CG 4.21Å; W64-Q101 HydrophobicContact CZ2-CG 4.29Å; W64-Q101 HydrophobicContact CZ3-CG 4.25Å; W64-A105 HydrophobicContact CH2-CB 3.91Å; W64-I108 HydrophobicContact CH2-CD1 4.48Å; W64-I108 HydrophobicContact CZ3-CD1 4.34Å; W64-Y128 PolarHBondContact NE1-O 3Å; W64-T129 HydrophobicContact CH2-CG2 4.08Å; W64-T129 HydrophobicContact CZ2-CG2 3.72Å |
| 65 | M | 98.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.1 | -39.6 | 177.8 | -74.1 | 168.4 | 69.6 | 0 | 0 | 112.1 | V61 A62 G63 C69 F79 A82 I83 L86 C107 I108 | V61-M65 HydrophobicContact CG1-CG 4.17Å; V61-M65 HydrophobicContact CG1-SD 3.87Å; V61-M65 WeakPolarHBondContact O-CB 3.29Å; V61-M65 WeakPolarHBondContact O-CG 3.45Å; V61-M65 PolarHBondContact O-N 3.41Å; A62-M65 PolarHBondContact O-N 3.41Å; G63-M65 VanDerWaalsContact C-N 3.32Å; G63-M65 PolarHBondContact O-N 3.08Å; M65-C69 PolarHBondContact O-N 3.39Å; M65-C69 VanDerWaalsContact O-N 3.09Å; M65-C69 PolarHBondContact O-SG 2.96Å; M65-F79 HydrophobicContact CB-CD2 4.19Å; M65-F79 HydrophobicContact CB-CE2 3.86Å; M65-A82 HydrophobicContact CE-CB 3.6Å; M65-I83 HydrophobicContact CE-CD1 3.98Å; M65-I83 HydrophobicContact CE-CG1 4.49Å; M65-I83 HydrophobicContact SD-CD1 4.05Å; M65-L86 HydrophobicContact SD-CD2 3.97Å; M65-C107 HydrophobicContact CE-CB 4.13Å; M65-I108 HydrophobicContact CB-CD1 3.85Å; M65-I108 HydrophobicContact CB-CG1 4.34Å; M65-I108 HydrophobicContact CE-CG1 4.07Å; M65-I108 HydrophobicContact CG-CD1 3.78Å; M65-I108 HydrophobicContact CG-CG1 4.22Å |
| 66 | H | 96.1 | Very high | 94.8 | Very high | 56 Ų | 56 | 63.6 Ų | 63.6 | 26% | 0.259 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.2 | -48.1 | 175.9 | -177.8 | -72.9 | 0 | 0 | 0 | 111.2 | A62 G63 W64 V68 C69 E70 F79 | A62-H66 PolarHBondContact O-N 2.66Å; G63-H66 WeakPolarHBondContact O-CB 3.23Å; G63-H66 PolarHBondContact O-N 3.02Å; G63-H66 VanDerWaalsContact O-N 3.16Å; W64-H66 VanDerWaalsContact C-N 3.3Å; W64-H66 PolarHBondContact O-N 2.96Å; H66-V68 VanDerWaalsContact C-N 3.32Å; H66-V68 PolarHBondContact O-N 2.96Å; H66-C69 PolarHBondContact O-N 3.01Å; H66-C69 VanDerWaalsContact O-N 3.16Å; H66-E70 WeakPolarHBondContact O-CG 3.46Å; H66-E70 PolarHBondContact O-N 2.8Å; H66-F79 HydrophobicContact CB-CD2 4.14Å; H66-F79 HydrophobicContact CB-CE1 4.15Å; H66-F79 HydrophobicContact CB-CE2 3.72Å; H66-F79 HydrophobicContact CB-CZ 3.72Å; H66-F79 AromaticContact CD2-CD1 3.81Å; H66-F79 AromaticContact CD2-CE1 3.63Å |
| 67 | E | 96.3 | Very high | 94.9 | Very high | 130 Ų | 130 | 58.3 Ų | 58.3 | 61% | 0.607 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -57.6 | -44.2 | 177.8 | -69.6 | 167.9 | -173.6 | 0 | 0 | 111.8 | G63 W64 C69 E70 E71 | G63-E67 WeakPolarHBondContact O-CG 3.49Å; G63-E67 PolarHBondContact O-N 3.48Å; W64-E67 PolarHBondContact O-N 2.81Å; E67-C69 VanDerWaalsContact C-N 3.35Å; E67-C69 PolarHBondContact O-N 3.4Å; E67-E70 PolarHBondContact O-N 3.39Å; E67-E71 WeakPolarHBondContact O-CB 3.47Å; E67-E71 PolarHBondContact O-N 3.12Å |
| 68 | V | 96.6 | Very high | 94.9 | Very high | 3 Ų | 3 | 56.7 Ų | 56.7 | 2% | 0.018 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 176.1 | 174 | 0 | 0 | 0 | 0 | 111.7 | W64 H66 E70 E71 E72 I108 L125 Y128 | W64-V68 HydrophobicContact CD2-CG2 4.28Å; W64-V68 HydrophobicContact CZ2-CG2 3.88Å; W64-V68 WeakPolarHBondContact O-CG2 3.26Å; W64-V68 PolarHBondContact O-N 3.06Å; H66-V68 VanDerWaalsContact C-N 3.32Å; H66-V68 PolarHBondContact O-N 2.96Å; V68-E70 VanDerWaalsContact C-N 3.33Å; V68-E70 PolarHBondContact O-N 2.87Å; V68-E71 PolarHBondContact O-N 3.32Å; V68-E72 WeakPolarHBondContact O-CB 3.4Å; V68-E72 PolarHBondContact O-N 3.07Å; V68-I108 HydrophobicContact CB-CD1 4.19Å; V68-I108 HydrophobicContact CG1-CD1 4.11Å; V68-L125 HydrophobicContact CG1-CD2 3.96Å; V68-Y128 HydrophobicContact CB-CG 4.45Å; V68-Y128 HydrophobicContact CG1-CD1 4.38Å; V68-Y128 HydrophobicContact CG1-CD2 3.78Å; V68-Y128 HydrophobicContact CG1-CE2 4.11Å; V68-Y128 HydrophobicContact CG1-CG 3.93Å; V68-Y128 HydrophobicContact CG2-CD1 3.82Å; V68-Y128 HydrophobicContact CG2-CD2 4.48Å; V68-Y128 HydrophobicContact CG2-CG 3.79Å |
| 69 | C | 96.3 | Very high | 95 | Very high | 5 Ų | 5 | 57.1 Ų | 57.1 | 3% | 0.034 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.1 | -35.6 | 179.4 | -68.2 | 0 | 0 | 0 | 0 | 112.4 | M65 H66 E67 N73 T74 F79 | M65-C69 PolarHBondContact O-N 3.39Å; M65-C69 VanDerWaalsContact O-N 3.09Å; M65-C69 PolarHBondContact O-SG 2.96Å; H66-C69 PolarHBondContact O-N 3.01Å; H66-C69 VanDerWaalsContact O-N 3.16Å; E67-C69 VanDerWaalsContact C-N 3.35Å; E67-C69 PolarHBondContact O-N 3.4Å; C69-N73 PolarHBondContact O-N 2.88Å; C69-T74 WeakPolarHBondContact CA-OG1 3.27Å; C69-T74 VanDerWaalsContact CB-OG1 3.31Å; C69-T74 WeakPolarHBondContact CB-OG1 3.25Å; C69-T74 PolarHBondContact O-N 3.05Å; C69-T74 PolarHBondContact O-OG1 3.27Å; C69-F79 HydrophobicContact CB-CB 4.16Å |
| 70 | E | 94.3 | Very high | 95.2 | Very high | 122 Ų | 122 | 53.2 Ų | 53.2 | 57% | 0.57 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -72.3 | -43.7 | 176.2 | -70.7 | -73.8 | 117.9 | 0 | 0 | 111.8 | H66 E67 V68 E72 N73 | H66-E70 WeakPolarHBondContact O-CG 3.46Å; H66-E70 PolarHBondContact O-N 2.8Å; E67-E70 PolarHBondContact O-N 3.39Å; V68-E70 VanDerWaalsContact C-N 3.33Å; V68-E70 PolarHBondContact O-N 2.87Å; E70-E72 PolarHBondContact O-N 3.08Å; E70-N73 WeakPolarHBondContact O-CA 3.36Å; E70-N73 PolarHBondContact O-N 3.16Å |
| 71 | E | 95.1 | Very high | 95.3 | Very high | 145 Ų | 145 | 46.9 Ų | 46.9 | 68% | 0.678 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -65.8 | -38.2 | 179.6 | -170.4 | 68.5 | -157.8 | 0 | 0 | 111.9 | E67 V68 N73 Y128 | E67-E71 WeakPolarHBondContact O-CB 3.47Å; E67-E71 PolarHBondContact O-N 3.12Å; V68-E71 PolarHBondContact O-N 3.32Å; E71-N73 PolarHBondContact O-N 3.46Å; E71-Y128 HydrophobicContact CB-CE1 4.14Å; E71-Y128 HydrophobicContact CG-CE1 3.94Å; E71-Y128 WeakPolarHBondContact CG-OH 3.12Å |
| 72 | E | 92.7 | Very high | 95.3 | Very high | 57 Ų | 57 | 46 Ų | 46 | 27% | 0.266 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -1.3 | 172.9 | -70.2 | -62.8 | 114 | 0 | 0 | 113.2 | V68 E70 T74 P120 K124 Y128 | V68-E72 WeakPolarHBondContact O-CB 3.4Å; V68-E72 PolarHBondContact O-N 3.07Å; E70-E72 PolarHBondContact O-N 3.08Å; E72-T74 HydrophobicContact CB-CG2 3.75Å; E72-T74 PolarHBondContact O-N 2.89Å; E72-P120 HydrophobicContact CG-CB 4.36Å; E72-K124 WeakPolarHBondContact OE1-CE 3.21Å; E72-K124 IonicContact OE1-NZ 3.69Å; E72-Y128 HydrophobicContact CG-CE2 3.58Å; E72-Y128 WeakPolarHBondContact OE1-CE2 3.24Å; E72-Y128 VanDerWaalsContact OE1-CZ 3.28Å; E72-Y128 PolarHBondContact OE1-OH 2.93Å |
| 73 | N | 91.5 | Very high | 95.3 | Very high | 145 Ų | 145 | 46.4 Ų | 46.4 | 78% | 0.775 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 48.6 | 42.9 | -177.3 | -171 | 45.3 | 0 | 0 | 0 | 112.3 | C69 E70 E71 | C69-N73 PolarHBondContact O-N 2.88Å; E70-N73 WeakPolarHBondContact O-CA 3.36Å; E70-N73 PolarHBondContact O-N 3.16Å; E71-N73 PolarHBondContact O-N 3.46Å |
| 74 | T | 91.6 | Very high | 95.3 | Very high | 18 Ų | 18 | 46.3 Ų | 46.3 | 11% | 0.11 | 23% | 0.226 | C | C | . | . | trans | -68.7 | 161.8 | -178.6 | 58.4 | 0 | 0 | 0 | 0 | 111.6 | C69 E72 Q76 D116 | C69-T74 WeakPolarHBondContact CA-OG1 3.27Å; C69-T74 VanDerWaalsContact CB-OG1 3.31Å; C69-T74 WeakPolarHBondContact CB-OG1 3.25Å; C69-T74 PolarHBondContact O-N 3.05Å; C69-T74 PolarHBondContact O-OG1 3.27Å; E72-T74 HydrophobicContact CB-CG2 3.75Å; E72-T74 PolarHBondContact O-N 2.89Å; T74-Q76 PolarHBondContact O-N 2.87Å; T74-D116 WeakPolarHBondContact CA-OD2 3.19Å; T74-D116 WeakPolarHBondContact CB-OD2 3.49Å | ||
| 75 | N | 92.1 | Very high | 95.4 | Very high | 69 Ų | 69 | 44.4 Ų | 44.4 | 37% | 0.369 | 22% | 0.219 | S | C | . | . | trans | -55.6 | 136.1 | 170.7 | -175.1 | -18.3 | 0 | 0 | 0 | 110.6 | D77 V78 K115 D116 | N75-D77 PolarHBondContact O-N 3.28Å; N75-D77 PolarHBondContact OD1-N 3.2Å; N75-D77 VanDerWaalsContact OD1-N 3.16Å; N75-V78 HydrophobicContact CB-CG2 4.11Å; N75-V78 VanDerWaalsContact O-CB 3.24Å; N75-V78 WeakPolarHBondContact O-CB 3.32Å; N75-V78 WeakPolarHBondContact O-CG2 3.41Å; N75-V78 PolarHBondContact O-N 3.15Å; N75-K115 PolarHBondContact ND2-O 3.19Å; N75-D116 PolarHBondContact N-OD2 3.37Å | ||
| 76 | Q | 92.2 | Very high | 95.3 | Very high | 103 Ų | 103 | 44.4 Ų | 44.4 | 48% | 0.481 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | -16.3 | -179.4 | -66.6 | 179.1 | -37 | 0 | 0 | 114.1 | T74 P80 N159 L184 | T74-Q76 PolarHBondContact O-N 2.87Å; Q76-P80 WeakPolarHBondContact O-CD 3.22Å; Q76-N159 VanDerWaalsContact C-ND2 3.34Å; Q76-N159 PolarHBondContact O-ND2 3.22Å; Q76-L184 HydrophobicContact CB-CD2 4.27Å |
| 77 | D | 94.7 | Very high | 95.3 | Very high | 31 Ų | 31 | 42 Ų | 42 | 17% | 0.166 | 21% | 0.208 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -23.9 | 172 | -74.7 | 2.8 | 0 | 0 | 0 | 113.8 | N75 L81 K115 I157 N159 | N75-D77 PolarHBondContact O-N 3.28Å; N75-D77 PolarHBondContact OD1-N 3.2Å; N75-D77 VanDerWaalsContact OD1-N 3.16Å; D77-L81 WeakPolarHBondContact O-CB 3.42Å; D77-L81 PolarHBondContact O-N 3.39Å; D77-K115 HydrophobicContact CB-CB 4.07Å; D77-K115 HydrophobicContact CB-CD 3.78Å; D77-K115 HydrophobicContact CB-CG 3.9Å; D77-K115 IonicContact OD2-NZ 2.81Å; D77-K115 PolarHBondContact OD2-NZ 3.17Å; D77-I157 HydrophobicContact CB-CD1 3.65Å; D77-N159 WeakPolarHBondContact CA-ND2 3.2Å; D77-N159 WeakPolarHBondContact OD1-CB 3.18Å; D77-N159 PolarHBondContact OD1-ND2 2.93Å |
| 78 | V | 96.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.6 | -48.3 | -173.4 | 173.3 | 0 | 0 | 0 | 0 | 110.8 | N75 L81 A82 A111 A112 K115 D116 | N75-V78 HydrophobicContact CB-CG2 4.11Å; N75-V78 VanDerWaalsContact O-CB 3.24Å; N75-V78 WeakPolarHBondContact O-CB 3.32Å; N75-V78 WeakPolarHBondContact O-CG2 3.41Å; N75-V78 PolarHBondContact O-N 3.15Å; V78-L81 PolarHBondContact O-N 2.93Å; V78-A82 VanDerWaalsContact O-CB 3.31Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 2.87Å; V78-A111 HydrophobicContact CG1-CB 3.99Å; V78-A111 WeakPolarHBondContact O-CB 3.27Å; V78-A112 HydrophobicContact CG1-CB 4.02Å; V78-A112 HydrophobicContact CG2-CB 4.41Å; V78-K115 HydrophobicContact CG2-CB 3.97Å; V78-D116 HydrophobicContact CG2-CB 4.23Å |
| 79 | F | 97.1 | Very high | 95.1 | Very high | 10 Ų | 10 | 36.9 Ų | 36.9 | 4% | 0.044 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65.7 | -51.6 | -175 | 173.3 | -110.3 | 0 | 0 | 0 | 113.4 | A62 M65 H66 C69 L81 A82 I83 A188 A191 T192 | A62-F79 VanDerWaalsContact O-CE2 3.29Å; A62-F79 WeakPolarHBondContact O-CE2 3.49Å; M65-F79 HydrophobicContact CB-CD2 4.19Å; M65-F79 HydrophobicContact CB-CE2 3.86Å; H66-F79 HydrophobicContact CB-CD2 4.14Å; H66-F79 HydrophobicContact CB-CE1 4.15Å; H66-F79 HydrophobicContact CB-CE2 3.72Å; H66-F79 HydrophobicContact CB-CZ 3.72Å; H66-F79 AromaticContact CD2-CD1 3.81Å; H66-F79 AromaticContact CD2-CE1 3.63Å; C69-F79 HydrophobicContact CB-CB 4.16Å; F79-L81 PolarHBondContact O-N 2.91Å; F79-A82 PolarHBondContact O-N 3.21Å; F79-I83 HydrophobicContact CD2-CG1 4.17Å; F79-I83 HydrophobicContact CE1-CG1 4.34Å; F79-I83 HydrophobicContact CE2-CD1 3.86Å; F79-I83 HydrophobicContact CE2-CG1 3.64Å; F79-I83 HydrophobicContact CZ-CD1 4.08Å; F79-I83 HydrophobicContact CZ-CG1 3.74Å; F79-I83 WeakPolarHBondContact O-CG1 3.25Å; F79-I83 PolarHBondContact O-N 3.07Å; F79-A188 HydrophobicContact CD1-CB 4.16Å; F79-A188 HydrophobicContact CE1-CB 4.2Å; F79-A188 WeakPolarHBondContact CE1-O 3.46Å; F79-A191 HydrophobicContact CD1-CB 4.43Å; F79-A191 HydrophobicContact CE1-CB 3.73Å; F79-A191 HydrophobicContact CZ-CB 4.24Å; F79-T192 HydrophobicContact CZ-CG2 4.14Å |
| 80 | P | 96.2 | Very high | 95.1 | Very high | 10 Ų | 10 | 36.7 Ų | 36.7 | 7% | 0.065 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.1 | -36.7 | 175.6 | -25.1 | 35.2 | 0 | 0 | 0 | 113 | Q76 I83 N84 I157 I187 | Q76-P80 WeakPolarHBondContact O-CD 3.22Å; P80-I83 PolarHBondContact O-N 3.1Å; P80-N84 PolarHBondContact O-N 3.03Å; P80-I157 HydrophobicContact CB-CB 4.41Å; P80-I187 HydrophobicContact CB-CG2 4.4Å; P80-I187 HydrophobicContact CG-CG2 3.97Å |
| 81 | L | 97 | Very high | 95.1 | Very high | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.005 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -69.3 | -42.4 | 177.3 | -176.9 | 62 | 0 | 0 | 0 | 112.2 | D77 V78 F79 I83 N84 Y85 A111 L114 K115 I157 | D77-L81 WeakPolarHBondContact O-CB 3.42Å; D77-L81 PolarHBondContact O-N 3.39Å; V78-L81 PolarHBondContact O-N 2.93Å; F79-L81 PolarHBondContact O-N 2.91Å; L81-I83 VanDerWaalsContact C-N 3.29Å; L81-I83 PolarHBondContact O-N 3.41Å; L81-N84 WeakPolarHBondContact O-CB 3.44Å; L81-N84 PolarHBondContact O-N 2.88Å; L81-N84 VanDerWaalsContact O-N 3.17Å; L81-Y85 HydrophobicContact CD1-CD1 4.43Å; L81-Y85 HydrophobicContact CD1-CE1 3.56Å; L81-Y85 HydrophobicContact CD1-CE2 4.41Å; L81-Y85 WeakPolarHBondContact CD1-OH 3.38Å; L81-Y85 HydrophobicContact CD2-CE2 4.37Å; L81-Y85 WeakPolarHBondContact CD2-OH 3.44Å; L81-Y85 HydrophobicContact CG-CE1 3.98Å; L81-Y85 HydrophobicContact CG-CE2 3.91Å; L81-Y85 WeakPolarHBondContact CG-OH 3.41Å; L81-Y85 PolarHBondContact O-N 3.26Å; L81-A111 HydrophobicContact CB-CB 4.06Å; L81-A111 HydrophobicContact CD2-CB 3.95Å; L81-A111 HydrophobicContact CG-CB 3.95Å; L81-L114 HydrophobicContact CD2-CB 4.43Å; L81-L114 HydrophobicContact CD2-CD2 4Å; L81-K115 HydrophobicContact CD2-CG 3.54Å; L81-I157 HydrophobicContact CB-CG2 4.01Å; L81-I157 HydrophobicContact CD1-CG2 3.94Å |
| 82 | A | 97.9 | Very high | 95 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.8 | -39.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | M65 V78 F79 Y85 L86 C107 I108 A111 | M65-A82 HydrophobicContact CE-CB 3.6Å; V78-A82 VanDerWaalsContact O-CB 3.31Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 2.87Å; F79-A82 PolarHBondContact O-N 3.21Å; A82-Y85 PolarHBondContact O-N 2.96Å; A82-L86 PolarHBondContact O-N 2.98Å; A82-C107 HydrophobicContact CB-CB 4.16Å; A82-C107 WeakPolarHBondContact O-CB 3.19Å; A82-I108 HydrophobicContact CB-CG1 4.22Å; A82-A111 HydrophobicContact CB-CB 3.87Å |
| 83 | I | 97.1 | Very high | 95.1 | Very high | 8 Ų | 8 | 27.9 Ų | 27.9 | 4% | 0.041 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.7 | -42.4 | 173.5 | -70.5 | -62.8 | 0 | 0 | 0 | 111.5 | A62 M65 F79 P80 L81 Y85 L86 D87 A191 | A62-I83 HydrophobicContact CB-CD1 3.6Å; M65-I83 HydrophobicContact CE-CD1 3.98Å; M65-I83 HydrophobicContact CE-CG1 4.49Å; M65-I83 HydrophobicContact SD-CD1 4.05Å; F79-I83 HydrophobicContact CD2-CG1 4.17Å; F79-I83 HydrophobicContact CE1-CG1 4.34Å; F79-I83 HydrophobicContact CE2-CD1 3.86Å; F79-I83 HydrophobicContact CE2-CG1 3.64Å; F79-I83 HydrophobicContact CZ-CD1 4.08Å; F79-I83 HydrophobicContact CZ-CG1 3.74Å; F79-I83 WeakPolarHBondContact O-CG1 3.25Å; F79-I83 PolarHBondContact O-N 3.07Å; P80-I83 PolarHBondContact O-N 3.1Å; L81-I83 VanDerWaalsContact C-N 3.29Å; L81-I83 PolarHBondContact O-N 3.41Å; I83-Y85 VanDerWaalsContact C-N 3.28Å; I83-Y85 PolarHBondContact O-N 3.02Å; I83-L86 HydrophobicContact CD1-CD2 4.24Å; I83-L86 WeakPolarHBondContact O-CB 3.49Å; I83-L86 PolarHBondContact O-N 3.22Å; I83-L86 VanDerWaalsContact O-N 3.17Å; I83-D87 WeakPolarHBondContact CG2-OD2 3.44Å; I83-D87 PolarHBondContact O-N 3.05Å; I83-A191 HydrophobicContact CB-CB 4.33Å; I83-A191 HydrophobicContact CG1-CB 4.11Å; I83-A191 HydrophobicContact CG2-CB 4.16Å |
| 84 | N | 95.7 | Very high | 95.2 | Very high | 20 Ų | 20 | 25.1 Ų | 25.1 | 11% | 0.107 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57 | -43.1 | 174.2 | -177.5 | -93.7 | 0 | 0 | 0 | 111.7 | F39 P80 L81 R88 S155 | F39-N84 PolarHBondContact O-ND2 2.94Å; P80-N84 PolarHBondContact O-N 3.03Å; L81-N84 WeakPolarHBondContact O-CB 3.44Å; L81-N84 PolarHBondContact O-N 2.88Å; L81-N84 VanDerWaalsContact O-N 3.17Å; N84-R88 VanDerWaalsContact O-CB 3.3Å; N84-R88 WeakPolarHBondContact O-CB 3.38Å; N84-R88 VanDerWaalsContact O-CG 3.26Å; N84-R88 WeakPolarHBondContact O-CG 3.41Å; N84-R88 PolarHBondContact O-N 3.38Å; N84-R88 WeakPolarHBondContact OD1-CD 3.44Å; N84-R88 PolarHBondContact OD1-NH1 3.39Å; N84-S155 WeakPolarHBondContact OD1-CB 3.45Å; N84-S155 PolarHBondContact OD1-OG 2.98Å; N84-S155 VanDerWaalsContact OD1-OG 3.13Å |
| 85 | Y | 97.2 | Very high | 95.4 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -64.3 | -43.5 | 175.9 | -60.1 | -18.7 | 0 | 0 | 0 | 112.5 | L81 A82 I83 F89 L110 A111 L114 L149 M153 | L81-Y85 HydrophobicContact CD1-CD1 4.43Å; L81-Y85 HydrophobicContact CD1-CE1 3.56Å; L81-Y85 HydrophobicContact CD1-CE2 4.41Å; L81-Y85 WeakPolarHBondContact CD1-OH 3.38Å; L81-Y85 HydrophobicContact CD2-CE2 4.37Å; L81-Y85 WeakPolarHBondContact CD2-OH 3.44Å; L81-Y85 HydrophobicContact CG-CE1 3.98Å; L81-Y85 HydrophobicContact CG-CE2 3.91Å; L81-Y85 WeakPolarHBondContact CG-OH 3.41Å; L81-Y85 PolarHBondContact O-N 3.26Å; A82-Y85 PolarHBondContact O-N 2.96Å; I83-Y85 VanDerWaalsContact C-N 3.28Å; I83-Y85 PolarHBondContact O-N 3.02Å; Y85-F89 WeakPolarHBondContact O-CB 3.22Å; Y85-F89 PolarHBondContact O-N 2.9Å; Y85-L110 HydrophobicContact CD2-CB 4.14Å; Y85-L110 HydrophobicContact CE2-CB 3.98Å; Y85-A111 HydrophobicContact CD2-CB 4.32Å; Y85-A111 HydrophobicContact CE2-CB 3.88Å; Y85-L114 WeakPolarHBondContact OH-CD2 3.21Å; Y85-L149 HydrophobicContact CD1-CD1 4.07Å; Y85-L149 HydrophobicContact CG-CD1 4.22Å; Y85-M153 HydrophobicContact CD1-CE 4.07Å; Y85-M153 HydrophobicContact CD2-CE 3.72Å; Y85-M153 HydrophobicContact CE1-CB 4.38Å; Y85-M153 HydrophobicContact CE1-CE 3.82Å; Y85-M153 WeakPolarHBondContact CE1-O 3.29Å; Y85-M153 HydrophobicContact CE1-SD 4.34Å; Y85-M153 HydrophobicContact CE2-CE 3.43Å; Y85-M153 VanDerWaalsContact CE2-CE 3.43Å; Y85-M153 HydrophobicContact CG-CE 4.02Å; Y85-M153 VanDerWaalsContact CZ-CE 3.48Å; Y85-M153 VanDerWaalsContact CZ-O 3.29Å; Y85-M153 PolarHBondContact OH-O 2.93Å |
| 86 | L | 96.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -57.8 | -54.2 | 177.5 | 178.9 | 68.9 | 0 | 0 | 0 | 110.6 | R58 M65 A82 I83 F89 L90 L100 L103 C107 | R58-L86 HydrophobicContact CG-CD2 4.34Å; M65-L86 HydrophobicContact SD-CD2 3.97Å; A82-L86 PolarHBondContact O-N 2.98Å; I83-L86 HydrophobicContact CD1-CD2 4.24Å; I83-L86 WeakPolarHBondContact O-CB 3.49Å; I83-L86 PolarHBondContact O-N 3.22Å; I83-L86 VanDerWaalsContact O-N 3.17Å; L86-F89 PolarHBondContact O-N 2.89Å; L86-L90 HydrophobicContact CD1-CD1 4.15Å; L86-L90 HydrophobicContact CD1-CG 4.47Å; L86-L90 HydrophobicContact CG-CD1 4.1Å; L86-L90 VanDerWaalsContact O-CG 3.29Å; L86-L90 WeakPolarHBondContact O-CG 3.38Å; L86-L90 PolarHBondContact O-N 3.41Å; L86-L100 HydrophobicContact CD1-CD1 4.34Å; L86-L103 HydrophobicContact CD1-CB 4.48Å; L86-L103 HydrophobicContact CD1-CD2 3.58Å; L86-L103 HydrophobicContact CD1-CG 3.68Å; L86-C107 PolarHBondContact N-SG 2.92Å |
| 87 | D | 95.5 | Very high | 95.6 | Very high | 4 Ų | 4 | 30.6 Ų | 30.6 | 2% | 0.021 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.1 | -40.5 | -175.7 | -69.6 | -37 | 0 | 0 | 0 | 111.7 | P41 Y45 R58 I83 F89 L90 A91 | P41-D87 HydrophobicContact CG-CB 3.88Å; Y45-D87 HydrophobicContact CE1-CB 4.11Å; Y45-D87 PolarHBondContact OH-OD1 2.84Å; R58-D87 IonicContact CZ-OD1 3.49Å; R58-D87 IonicContact CZ-OD2 3.69Å; R58-D87 IonicContact NE-OD1 3.78Å; R58-D87 PolarHBondContact NE-OD1 2.85Å; R58-D87 IonicContact NE-OD2 3.82Å; R58-D87 IonicContact NH2-OD1 3.02Å; R58-D87 PolarHBondContact NH2-OD1 3.38Å; R58-D87 IonicContact NH2-OD2 2.78Å; R58-D87 PolarHBondContact NH2-OD2 3.13Å; I83-D87 WeakPolarHBondContact CG2-OD2 3.44Å; I83-D87 PolarHBondContact O-N 3.05Å; D87-F89 PolarHBondContact O-N 3.49Å; D87-L90 PolarHBondContact O-N 3.29Å; D87-A91 WeakPolarHBondContact O-CB 3.48Å; D87-A91 PolarHBondContact O-N 2.9Å |
| 88 | R | 94.6 | Very high | 95.5 | Very high | 25 Ų | 25 | 35.4 Ų | 35.4 | 9% | 0.094 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.3 | -37.8 | 174.9 | -74 | 170.6 | 62.8 | -156.2 | -6.1 | 112.5 | F39 N84 A91 L149 N152 S155 | F39-R88 WeakPolarHBondContact O-CD 3.49Å; N84-R88 VanDerWaalsContact O-CB 3.3Å; N84-R88 WeakPolarHBondContact O-CB 3.38Å; N84-R88 VanDerWaalsContact O-CG 3.26Å; N84-R88 WeakPolarHBondContact O-CG 3.41Å; N84-R88 PolarHBondContact O-N 3.38Å; N84-R88 WeakPolarHBondContact OD1-CD 3.44Å; N84-R88 PolarHBondContact OD1-NH1 3.39Å; R88-A91 PolarHBondContact O-N 2.94Å; R88-L149 HydrophobicContact CB-CD2 3.67Å; R88-N152 PolarHBondContact NH1-O 3.09Å; R88-N152 PolarHBondContact NH2-O 2.82Å; R88-S155 PolarHBondContact NH1-OG 2.7Å |
| 89 | F | 95.8 | Very high | 95.5 | Very high | 2 Ų | 2 | 40.1 Ų | 40.1 | 1% | 0.009 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -66.4 | -46.2 | 176 | -174.3 | -85.9 | 0 | 0 | 0 | 111.1 | Y85 L86 D87 A91 V92 M93 L103 W141 V144 V145 K148 | Y85-F89 WeakPolarHBondContact O-CB 3.22Å; Y85-F89 PolarHBondContact O-N 2.9Å; L86-F89 PolarHBondContact O-N 2.89Å; D87-F89 PolarHBondContact O-N 3.49Å; F89-A91 PolarHBondContact O-N 2.83Å; F89-V92 WeakPolarHBondContact O-CG2 3.4Å; F89-V92 PolarHBondContact O-N 3.3Å; F89-M93 HydrophobicContact CD1-CB 4.11Å; F89-M93 HydrophobicContact CE1-CB 3.68Å; F89-M93 HydrophobicContact CE1-CG 4.3Å; F89-M93 HydrophobicContact CE2-CB 4.47Å; F89-M93 HydrophobicContact CE2-CG 4.24Å; F89-M93 HydrophobicContact CZ-CB 3.89Å; F89-M93 HydrophobicContact CZ-CG 4Å; F89-M93 PolarHBondContact O-N 3.44Å; F89-L103 HydrophobicContact CB-CD1 4.3Å; F89-L103 HydrophobicContact CD1-CD1 3.65Å; F89-L103 HydrophobicContact CD1-CD2 3.43Å; F89-L103 VanDerWaalsContact CD1-CD2 3.43Å; F89-L103 HydrophobicContact CD1-CG 4.21Å; F89-L103 HydrophobicContact CD2-CD1 4.26Å; F89-L103 HydrophobicContact CE1-CD1 3.94Å; F89-L103 HydrophobicContact CE1-CD2 3.91Å; F89-L103 HydrophobicContact CG-CD1 3.81Å; F89-L103 HydrophobicContact CG-CD2 4.23Å; F89-L103 HydrophobicContact CZ-CD1 4.36Å; F89-W141 HydrophobicContact CE1-CZ3 4.08Å; F89-W141 AromaticContact CZ-CZ3 3.98Å; F89-W141 HydrophobicContact CZ-CZ3 3.98Å; F89-V144 HydrophobicContact CE2-CG1 4.16Å; F89-V144 HydrophobicContact CZ-CG1 4.22Å; F89-V145 HydrophobicContact CD2-CB 4.28Å; F89-V145 HydrophobicContact CD2-CG1 4.28Å; F89-V145 HydrophobicContact CD2-CG2 3.89Å; F89-V145 HydrophobicContact CE2-CB 4.39Å; F89-V145 HydrophobicContact CE2-CG2 3.84Å; F89-K148 HydrophobicContact CD2-CB 4.03Å; F89-K148 HydrophobicContact CE2-CB 3.93Å; F89-K148 HydrophobicContact CE2-CG 3.91Å |
| 90 | L | 95.2 | Very high | 95.5 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64 | -24.2 | 175.7 | -66.5 | 175.8 | 0 | 0 | 0 | 112.4 | Y45 Q50 I53 L86 D87 V92 L100 L103 | Y45-L90 HydrophobicContact CD2-CB 3.74Å; Y45-L90 HydrophobicContact CE2-CB 3.79Å; Y45-L90 HydrophobicContact CE2-CD1 3.95Å; Y45-L90 HydrophobicContact CG-CB 4.38Å; Q50-L90 PolarHBondContact NE2-O 2.96Å; I53-L90 HydrophobicContact CG1-CD2 4.48Å; L86-L90 HydrophobicContact CD1-CD1 4.15Å; L86-L90 HydrophobicContact CD1-CG 4.47Å; L86-L90 HydrophobicContact CG-CD1 4.1Å; L86-L90 VanDerWaalsContact O-CG 3.29Å; L86-L90 WeakPolarHBondContact O-CG 3.38Å; L86-L90 PolarHBondContact O-N 3.41Å; D87-L90 PolarHBondContact O-N 3.29Å; L90-V92 VanDerWaalsContact C-N 3.29Å; L90-V92 PolarHBondContact O-N 3.4Å; L90-L100 HydrophobicContact CD1-CD1 4.26Å; L90-L100 HydrophobicContact CD2-CD1 4.24Å; L90-L103 HydrophobicContact CD2-CD2 3.95Å; L90-L103 HydrophobicContact CG-CD2 4.26Å |
| 91 | A | 93.6 | Very high | 95.5 | Very high | 15 Ų | 15 | 42.5 Ų | 42.5 | 12% | 0.124 | 21% | 0.207 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -16.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | P41 Y45 D87 R88 F89 | P41-A91 HydrophobicContact CB-CB 4.21Å; Y45-A91 HydrophobicContact CD1-CB 4.43Å; D87-A91 WeakPolarHBondContact O-CB 3.48Å; D87-A91 PolarHBondContact O-N 2.9Å; R88-A91 PolarHBondContact O-N 2.94Å; F89-A91 PolarHBondContact O-N 2.83Å |
| 92 | V | 93.9 | Very high | 95.6 | Very high | 75 Ų | 75 | 42.7 Ų | 42.7 | 46% | 0.455 | 21% | 0.208 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -121.8 | -19.7 | -176.5 | -60.2 | 0 | 0 | 0 | 0 | 114.4 | F89 L90 K148 | F89-V92 WeakPolarHBondContact O-CG2 3.4Å; F89-V92 PolarHBondContact O-N 3.3Å; L90-V92 VanDerWaalsContact C-N 3.29Å; L90-V92 PolarHBondContact O-N 3.4Å; V92-K148 HydrophobicContact CG2-CB 4.4Å |
| 93 | M | 94.1 | Very high | 95.6 | Very high | 50 Ų | 50 | 42.7 Ų | 42.7 | 25% | 0.246 | 21% | 0.208 | C | C | . | . | S | Bend | trans | -126.8 | 119.2 | -176.1 | -77.9 | -59.8 | -62.5 | 0 | 0 | 111.9 | Q50 F89 T95 K148 | Q50-M93 PolarHBondContact NE2-O 3.18Å; F89-M93 HydrophobicContact CD1-CB 4.11Å; F89-M93 HydrophobicContact CE1-CB 3.68Å; F89-M93 HydrophobicContact CE1-CG 4.3Å; F89-M93 HydrophobicContact CE2-CB 4.47Å; F89-M93 HydrophobicContact CE2-CG 4.24Å; F89-M93 HydrophobicContact CZ-CB 3.89Å; F89-M93 HydrophobicContact CZ-CG 4Å; F89-M93 PolarHBondContact O-N 3.44Å; M93-T95 PolarHBondContact O-N 2.89Å; M93-T95 PolarHBondContact O-OG1 2.59Å; M93-K148 HydrophobicContact CG-CB 4.43Å; M93-K148 HydrophobicContact CG-CD 3.63Å; M93-K148 HydrophobicContact CG-CG 3.79Å; M93-K148 HydrophobicContact SD-CD 3.62Å; M93-K148 WeakPolarHBondContact SD-CE 3.48Å; M93-K148 HydrophobicContact SD-CG 4.34Å; M93-K148 PolarHBondContact SD-NZ 2.84Å |
| 94 | P | 94.3 | Very high | 95.7 | Very high | 87 Ų | 87 | 42.3 Ų | 42.3 | 57% | 0.565 | 21% | 0.206 | S | C | * | . | trans | -62.4 | 121.3 | 168.2 | -20 | 32.1 | 0 | 0 | 0 | 110.3 | V49 | V49-P94 HydrophobicContact CG1-CG 4.04Š| ||
| 95 | T | 94.9 | Very high | 95.8 | Very high | 10 Ų | 10 | 41.4 Ų | 41.4 | 6% | 0.061 | 20% | 0.201 | C | C | . | . | trans | -118 | 140.6 | -173.8 | -60.2 | 0 | 0 | 0 | 0 | 109.8 | I53 M93 | I53-T95 WeakPolarHBondContact CG1-O 3.31Å; M93-T95 PolarHBondContact O-N 2.89Å; M93-T95 PolarHBondContact O-OG1 2.59Å | ||
| 96 | R | 95.1 | Very high | 95.8 | Very high | 166 Ų | 166 | 41.4 Ų | 41.4 | 63% | 0.626 | 20% | 0.201 | S | C | * | . | trans | -82.9 | 147 | 173.1 | -59.7 | -178.7 | 179.2 | 164.9 | -0.5 | 109.7 | N98 Y99 | R96-N98 PolarHBondContact O-N 3.45Å; R96-N98 VanDerWaalsContact O-N 3.07Å; R96-Y99 HydrophobicContact CB-CD2 4.04Å; R96-Y99 PolarHBondContact O-N 2.79Å | ||
| 97 | K | 94.3 | Very high | 95.9 | Very high | 129 Ų | 129 | 41.4 Ų | 41.4 | 56% | 0.561 | 20% | 0.201 | S | C | * | . | G | 310 helix | trans | -51.5 | -35.3 | -179.8 | 67.1 | -175.9 | -177.3 | 176.3 | 0 | 114.4 | I53 M57 Y99 L100 | I53-K97 VanDerWaalsContact CD1-CA 3.46Å; I53-K97 HydrophobicContact CD1-CB 4.15Å; M57-K97 HydrophobicContact SD-CB 4.12Å; K97-Y99 PolarHBondContact O-N 3.13Å; K97-L100 WeakPolarHBondContact O-CB 3.21Å; K97-L100 PolarHBondContact O-N 2.97Å |
| 98 | N | 93.8 | Very high | 96 | Very high | 132 Ų | 132 | 41.2 Ų | 41.2 | 71% | 0.706 | 20% | 0.2 | S | C | * | . | G | 310 helix | trans | -67 | -21.3 | -179.4 | -61.6 | 6.3 | 0 | 0 | 0 | 113.4 | R96 | R96-N98 PolarHBondContact O-N 3.45Å; R96-N98 VanDerWaalsContact O-N 3.07Å |
| 99 | Y | 95.9 | Very high | 96.2 | Very high | 99 Ų | 99 | 40.7 Ų | 40.7 | 39% | 0.388 | 20% | 0.198 | S | C | . | . | G | 310 helix | trans | -96.5 | -0.7 | 178.2 | -65.2 | -66.6 | 0 | 0 | 0 | 113 | R96 K97 L102 L103 W141 | R96-Y99 HydrophobicContact CB-CD2 4.04Å; R96-Y99 PolarHBondContact O-N 2.79Å; K97-Y99 PolarHBondContact O-N 3.13Å; Y99-L102 HydrophobicContact CD1-CD2 4.05Å; Y99-L102 PolarHBondContact O-N 2.95Å; Y99-L103 WeakPolarHBondContact O-CB 3.35Å; Y99-L103 PolarHBondContact O-N 3.32Å; Y99-W141 HydrophobicContact CD1-CH2 4.38Å; Y99-W141 AromaticContact CD1-CZ2 3.6Å; Y99-W141 HydrophobicContact CD1-CZ2 3.6Å; Y99-W141 HydrophobicContact CD2-CZ2 4.25Å; Y99-W141 HydrophobicContact CE1-CZ2 4.23Å; Y99-W141 AromaticContact CG-CH2 4Å; Y99-W141 HydrophobicContact CG-CH2 4Å; Y99-W141 AromaticContact CG-CZ2 3.62Å; Y99-W141 HydrophobicContact CG-CZ2 3.62Å |
| 100 | L | 96.5 | Very high | 96.3 | Very high | 6 Ų | 6 | 41.1 Ų | 41.1 | 3% | 0.031 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.2 | -39.9 | -174.2 | -167.4 | 67.4 | 0 | 0 | 0 | 112 | I53 M57 V61 L86 L90 K97 L103 G104 | I53-L100 HydrophobicContact CD1-CB 4.31Å; I53-L100 HydrophobicContact CD1-CD1 4.2Å; I53-L100 HydrophobicContact CD1-CD2 4.33Å; I53-L100 HydrophobicContact CG2-CD1 4.26Å; I53-L100 HydrophobicContact CG2-CD2 4.11Å; M57-L100 HydrophobicContact CB-CD2 3.84Å; V61-L100 HydrophobicContact CB-CD2 4.26Å; V61-L100 HydrophobicContact CB-CG 4.29Å; V61-L100 HydrophobicContact CG1-CG 4.45Å; V61-L100 HydrophobicContact CG2-CB 4.38Å; V61-L100 HydrophobicContact CG2-CD2 3.67Å; V61-L100 HydrophobicContact CG2-CG 3.78Å; L86-L100 HydrophobicContact CD1-CD1 4.34Å; L90-L100 HydrophobicContact CD1-CD1 4.26Å; L90-L100 HydrophobicContact CD2-CD1 4.24Å; K97-L100 WeakPolarHBondContact O-CB 3.21Å; K97-L100 PolarHBondContact O-N 2.97Å; L100-L103 PolarHBondContact O-N 2.98Å; L100-G104 PolarHBondContact O-N 3.26Å |
| 101 | Q | 97.5 | Very high | 96.5 | Very high | 64 Ų | 64 | 41.1 Ų | 41.1 | 30% | 0.299 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -67.2 | -41.3 | 175.5 | -168.6 | 177.3 | 33.6 | 0 | 0 | 111.6 | W64 G104 A105 T129 S132 | W64-Q101 HydrophobicContact CE3-CG 4.4Å; W64-Q101 HydrophobicContact CH2-CG 4.21Å; W64-Q101 HydrophobicContact CZ2-CG 4.29Å; W64-Q101 HydrophobicContact CZ3-CG 4.25Å; Q101-G104 PolarHBondContact O-N 3.37Å; Q101-A105 PolarHBondContact O-N 3.22Å; Q101-T129 HydrophobicContact CG-CG2 4.08Å; Q101-S132 PolarHBondContact OE1-OG 3.29Å |
| 102 | L | 97.9 | Very high | 96.6 | Very high | 5 Ų | 5 | 40.4 Ų | 40.4 | 3% | 0.026 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.4 | -48.2 | 173.1 | 176.3 | 56.7 | 0 | 0 | 0 | 111.5 | Y99 G104 A105 V106 I133 E137 L138 W141 | Y99-L102 HydrophobicContact CD1-CD2 4.05Å; Y99-L102 PolarHBondContact O-N 2.95Å; L102-G104 VanDerWaalsContact C-N 3.32Å; L102-G104 PolarHBondContact O-N 3.46Å; L102-A105 WeakPolarHBondContact O-CB 3.03Å; L102-A105 PolarHBondContact O-N 3.44Å; L102-V106 HydrophobicContact CD1-CG2 4.12Å; L102-V106 VanDerWaalsContact O-CG2 3.26Å; L102-V106 WeakPolarHBondContact O-CG2 3.37Å; L102-V106 PolarHBondContact O-N 2.86Å; L102-I133 HydrophobicContact CB-CG2 3.89Å; L102-I133 HydrophobicContact CD1-CB 4.06Å; L102-I133 HydrophobicContact CD1-CD1 3.67Å; L102-I133 HydrophobicContact CD1-CG1 4.4Å; L102-I133 HydrophobicContact CD1-CG2 3.99Å; L102-I133 HydrophobicContact CG-CG2 4.42Å; L102-E137 HydrophobicContact CD2-CB 4.43Å; L102-L138 HydrophobicContact CD1-CB 4.41Å; L102-W141 HydrophobicContact CD2-CB 4.47Å; L102-W141 VanDerWaalsContact CD2-CD1 3.44Å; L102-W141 HydrophobicContact CD2-CD2 3.86Å; L102-W141 HydrophobicContact CD2-CG 3.69Å; L102-W141 HydrophobicContact CD2-CZ2 4.49Å; L102-W141 HydrophobicContact CG-CB 4.42Å; L102-W141 HydrophobicContact CG-CD2 4.16Å; L102-W141 HydrophobicContact CG-CG 4.03Å |
| 103 | L | 98.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.3 | -43.9 | 176.7 | 177.5 | 61.5 | 0 | 0 | 0 | 111.3 | L86 F89 L90 Y99 L100 V106 C107 W141 V145 | L86-L103 HydrophobicContact CD1-CB 4.48Å; L86-L103 HydrophobicContact CD1-CD2 3.58Å; L86-L103 HydrophobicContact CD1-CG 3.68Å; F89-L103 HydrophobicContact CB-CD1 4.3Å; F89-L103 HydrophobicContact CD1-CD1 3.65Å; F89-L103 HydrophobicContact CD1-CD2 3.43Å; F89-L103 VanDerWaalsContact CD1-CD2 3.43Å; F89-L103 HydrophobicContact CD1-CG 4.21Å; F89-L103 HydrophobicContact CD2-CD1 4.26Å; F89-L103 HydrophobicContact CE1-CD1 3.94Å; F89-L103 HydrophobicContact CE1-CD2 3.91Å; F89-L103 HydrophobicContact CG-CD1 3.81Å; F89-L103 HydrophobicContact CG-CD2 4.23Å; F89-L103 HydrophobicContact CZ-CD1 4.36Å; L90-L103 HydrophobicContact CD2-CD2 3.95Å; L90-L103 HydrophobicContact CG-CD2 4.26Å; Y99-L103 WeakPolarHBondContact O-CB 3.35Å; Y99-L103 PolarHBondContact O-N 3.32Å; L100-L103 PolarHBondContact O-N 2.98Å; L103-V106 PolarHBondContact O-N 2.82Å; L103-C107 WeakPolarHBondContact O-CB 3.49Å; L103-C107 PolarHBondContact O-N 3.38Å; L103-C107 PolarHBondContact O-SG 2.85Å; L103-W141 HydrophobicContact CB-CZ3 4.2Å; L103-W141 HydrophobicContact CD1-CE3 4.38Å; L103-W141 HydrophobicContact CD1-CZ3 4.24Å; L103-V145 HydrophobicContact CD1-CG2 3.62Å |
| 104 | G | 98.1 | Very high | 96.8 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.6 | -46.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L100 Q101 L102 V106 C107 I108 | L100-G104 PolarHBondContact O-N 3.26Å; Q101-G104 PolarHBondContact O-N 3.37Å; L102-G104 VanDerWaalsContact C-N 3.32Å; L102-G104 PolarHBondContact O-N 3.46Å; G104-V106 VanDerWaalsContact C-N 3.34Å; G104-V106 PolarHBondContact O-N 2.97Å; G104-C107 PolarHBondContact O-N 2.93Å; G104-I108 WeakPolarHBondContact O-CG1 3.45Å; G104-I108 PolarHBondContact O-N 3.39Å |
| 105 | A | 98.3 | Very high | 96.8 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -59.4 | -44.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | W64 Q101 L102 I108 F109 T129 I133 L138 | W64-A105 HydrophobicContact CH2-CB 3.91Å; Q101-A105 PolarHBondContact O-N 3.22Å; L102-A105 WeakPolarHBondContact O-CB 3.03Å; L102-A105 PolarHBondContact O-N 3.44Å; A105-I108 PolarHBondContact O-N 3.17Å; A105-F109 WeakPolarHBondContact O-CB 3.47Å; A105-F109 PolarHBondContact O-N 3.36Å; A105-T129 HydrophobicContact CB-CG2 4.48Å; A105-I133 HydrophobicContact CB-CD1 3.72Å; A105-L138 HydrophobicContact CB-CD1 4.25Å |
| 106 | V | 98.4 | Very high | 96.6 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.5 | -39.5 | 178.1 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | L102 L103 G104 F109 L110 L138 W141 E142 V145 | L102-V106 HydrophobicContact CD1-CG2 4.12Å; L102-V106 VanDerWaalsContact O-CG2 3.26Å; L102-V106 WeakPolarHBondContact O-CG2 3.37Å; L102-V106 PolarHBondContact O-N 2.86Å; L103-V106 PolarHBondContact O-N 2.82Å; G104-V106 VanDerWaalsContact C-N 3.34Å; G104-V106 PolarHBondContact O-N 2.97Å; V106-F109 WeakPolarHBondContact O-CB 3.41Å; V106-F109 PolarHBondContact O-N 2.96Å; V106-L110 HydrophobicContact CG1-CD1 3.89Å; V106-L110 HydrophobicContact CG1-CG 4.45Å; V106-L110 WeakPolarHBondContact O-CB 3.08Å; V106-L110 WeakPolarHBondContact O-CG 3.41Å; V106-L110 PolarHBondContact O-N 3.25Å; V106-L138 HydrophobicContact CG2-CG 4Å; V106-W141 HydrophobicContact CG2-CB 3.72Å; V106-E142 HydrophobicContact CG1-CB 4.37Å; V106-V145 HydrophobicContact CG1-CB 4.15Å; V106-V145 HydrophobicContact CG1-CG2 3.73Å |
| 107 | C | 98.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.2 | -42.3 | 175.7 | -71.7 | 0 | 0 | 0 | 0 | 112.1 | M65 A82 L86 L103 G104 A111 | M65-C107 HydrophobicContact CE-CB 4.13Å; A82-C107 HydrophobicContact CB-CB 4.16Å; A82-C107 WeakPolarHBondContact O-CB 3.19Å; L86-C107 PolarHBondContact N-SG 2.92Å; L103-C107 WeakPolarHBondContact O-CB 3.49Å; L103-C107 PolarHBondContact O-N 3.38Å; L103-C107 PolarHBondContact O-SG 2.85Å; G104-C107 PolarHBondContact O-N 2.93Å; C107-A111 VanDerWaalsContact O-CB 3.3Å; C107-A111 WeakPolarHBondContact O-CB 3.44Å; C107-A111 PolarHBondContact O-N 2.85Å |
| 108 | I | 98.3 | Very high | 96 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.005 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.3 | -48.5 | 172.9 | -66.2 | 167.1 | 0 | 0 | 0 | 109.9 | W64 M65 V68 A82 G104 A105 L110 A111 A112 L125 | W64-I108 HydrophobicContact CH2-CD1 4.48Å; W64-I108 HydrophobicContact CZ3-CD1 4.34Å; M65-I108 HydrophobicContact CB-CD1 3.85Å; M65-I108 HydrophobicContact CB-CG1 4.34Å; M65-I108 HydrophobicContact CE-CG1 4.07Å; M65-I108 HydrophobicContact CG-CD1 3.78Å; M65-I108 HydrophobicContact CG-CG1 4.22Å; V68-I108 HydrophobicContact CB-CD1 4.19Å; V68-I108 HydrophobicContact CG1-CD1 4.11Å; A82-I108 HydrophobicContact CB-CG1 4.22Å; G104-I108 WeakPolarHBondContact O-CG1 3.45Å; G104-I108 PolarHBondContact O-N 3.39Å; A105-I108 PolarHBondContact O-N 3.17Å; I108-L110 VanDerWaalsContact C-N 3.32Å; I108-L110 PolarHBondContact O-N 3.17Å; I108-A111 PolarHBondContact O-N 3.37Å; I108-A112 VanDerWaalsContact O-CB 3.25Å; I108-A112 WeakPolarHBondContact O-CB 3.4Å; I108-A112 PolarHBondContact O-N 3.19Å; I108-L125 HydrophobicContact CG2-CD2 4.05Å |
| 109 | F | 98.2 | Very high | 95.9 | Very high | 13 Ų | 13 | 38.9 Ų | 38.9 | 6% | 0.057 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -56.3 | -46.4 | -178.7 | -169.4 | -129 | 0 | 0 | 0 | 112.1 | A105 V106 K113 P120 A122 L125 L138 L139 | A105-F109 WeakPolarHBondContact O-CB 3.47Å; A105-F109 PolarHBondContact O-N 3.36Å; V106-F109 WeakPolarHBondContact O-CB 3.41Å; V106-F109 PolarHBondContact O-N 2.96Å; F109-K113 HydrophobicContact CE1-CD 4.43Å; F109-K113 VanDerWaalsContact CZ-NZ 3.34Å; F109-K113 VanDerWaalsContact O-CG 3.32Å; F109-K113 WeakPolarHBondContact O-CG 3.3Å; F109-K113 PolarHBondContact O-N 3.13Å; F109-K113 VanDerWaalsContact O-N 3.09Å; F109-P120 WeakPolarHBondContact CE2-O 3.35Å; F109-A122 HydrophobicContact CE2-CB 4.42Å; F109-A122 HydrophobicContact CZ-CB 4.2Å; F109-L125 HydrophobicContact CB-CD1 3.52Å; F109-L125 HydrophobicContact CD2-CD1 3.67Å; F109-L125 HydrophobicContact CG-CD1 3.95Å; F109-L138 HydrophobicContact CB-CD2 4.32Å; F109-L138 HydrophobicContact CD1-CD2 3.46Å; F109-L138 VanDerWaalsContact CD1-CD2 3.46Å; F109-L138 HydrophobicContact CE1-CD2 3.7Å; F109-L138 HydrophobicContact CG-CD2 3.88Å; F109-L138 HydrophobicContact CZ-CD2 4.35Å; F109-L139 HydrophobicContact CE1-CD2 3.99Å; F109-L139 HydrophobicContact CZ-CD2 4.39Å |
| 110 | L | 98.3 | Very high | 95.7 | Very high | 12 Ų | 12 | 34.5 Ų | 34.5 | 6% | 0.063 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.7 | -44.2 | 178 | -75.6 | 169.4 | 0 | 0 | 0 | 112.4 | Y85 V106 I108 K113 L114 E142 V145 L146 M153 | Y85-L110 HydrophobicContact CD2-CB 4.14Å; Y85-L110 HydrophobicContact CE2-CB 3.98Å; V106-L110 HydrophobicContact CG1-CD1 3.89Å; V106-L110 HydrophobicContact CG1-CG 4.45Å; V106-L110 WeakPolarHBondContact O-CB 3.08Å; V106-L110 WeakPolarHBondContact O-CG 3.41Å; V106-L110 PolarHBondContact O-N 3.25Å; I108-L110 VanDerWaalsContact C-N 3.32Å; I108-L110 PolarHBondContact O-N 3.17Å; L110-K113 PolarHBondContact O-N 2.98Å; L110-L114 PolarHBondContact O-N 3.44Å; L110-E142 HydrophobicContact CD1-CG 4.44Å; L110-E142 HydrophobicContact CD2-CG 3.59Å; L110-E142 WeakPolarHBondContact CD2-OE1 3.5Å; L110-E142 HydrophobicContact CG-CG 4.08Å; L110-V145 HydrophobicContact CD1-CB 3.91Å; L110-V145 HydrophobicContact CD1-CG1 3.61Å; L110-L146 HydrophobicContact CD1-CG 4.38Å; L110-L146 HydrophobicContact CD2-CD1 4.06Å; L110-L146 HydrophobicContact CD2-CD2 3.82Å; L110-L146 HydrophobicContact CD2-CG 3.89Å; L110-M153 HydrophobicContact CB-CE 3.92Å; L110-M153 HydrophobicContact CD1-CE 3.78Å; L110-M153 HydrophobicContact CD2-CE 4.32Å; L110-M153 HydrophobicContact CG-CE 4.23Å |
| 111 | A | 97.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.7 | -41.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | V78 L81 A82 Y85 C107 I108 L114 K115 | V78-A111 HydrophobicContact CG1-CB 3.99Å; V78-A111 WeakPolarHBondContact O-CB 3.27Å; L81-A111 HydrophobicContact CB-CB 4.06Å; L81-A111 HydrophobicContact CD2-CB 3.95Å; L81-A111 HydrophobicContact CG-CB 3.95Å; A82-A111 HydrophobicContact CB-CB 3.87Å; Y85-A111 HydrophobicContact CD2-CB 4.32Å; Y85-A111 HydrophobicContact CE2-CB 3.88Å; C107-A111 VanDerWaalsContact O-CB 3.3Å; C107-A111 WeakPolarHBondContact O-CB 3.44Å; C107-A111 PolarHBondContact O-N 2.85Å; I108-A111 PolarHBondContact O-N 3.37Å; A111-L114 PolarHBondContact O-N 2.94Å; A111-L114 VanDerWaalsContact O-N 3.08Å; A111-K115 PolarHBondContact O-N 3.38Å |
| 112 | A | 96.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | V78 I108 L114 K115 D116 P119 P120 | V78-A112 HydrophobicContact CG1-CB 4.02Å; V78-A112 HydrophobicContact CG2-CB 4.41Å; I108-A112 VanDerWaalsContact O-CB 3.25Å; I108-A112 WeakPolarHBondContact O-CB 3.4Å; I108-A112 PolarHBondContact O-N 3.19Å; A112-L114 PolarHBondContact O-N 3.06Å; A112-K115 PolarHBondContact O-N 3.4Å; A112-D116 HydrophobicContact CB-CB 4.42Å; A112-D116 WeakPolarHBondContact O-CA 3.44Å; A112-D116 WeakPolarHBondContact O-CB 3.26Å; A112-D116 PolarHBondContact O-N 3.02Å; A112-P119 HydrophobicContact CB-CB 3.92Å; A112-P120 HydrophobicContact CB-CG 4.33Å |
| 113 | K | 96.3 | Very high | 95.6 | Very high | 98 Ų | 98 | 41.4 Ų | 41.4 | 43% | 0.426 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -59 | -26.8 | 173.4 | -77.7 | 178.9 | -179.2 | -176.9 | 0 | 113.5 | F109 L110 P119 E142 | F109-K113 HydrophobicContact CE1-CD 4.43Å; F109-K113 VanDerWaalsContact CZ-NZ 3.34Å; F109-K113 VanDerWaalsContact O-CG 3.32Å; F109-K113 WeakPolarHBondContact O-CG 3.3Å; F109-K113 PolarHBondContact O-N 3.13Å; F109-K113 VanDerWaalsContact O-N 3.09Å; L110-K113 PolarHBondContact O-N 2.98Å; K113-P119 HydrophobicContact CG-CB 4.26Å; K113-P119 HydrophobicContact CG-CG 4.37Å; K113-E142 IonicContact NZ-OE1 3.69Å; K113-E142 PolarHBondContact NZ-OE1 3.27Å; K113-E142 IonicContact NZ-OE2 3.29Å; K113-E142 PolarHBondContact NZ-OE2 3.39Å |
| 114 | L | 95.9 | Very high | 95.5 | Very high | 88 Ų | 88 | 45.6 Ų | 45.6 | 46% | 0.461 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -91.1 | -37.3 | -178.4 | -167.5 | 66.1 | 0 | 0 | 0 | 113.3 | L81 Y85 L110 A111 A112 M153 A154 | L81-L114 HydrophobicContact CD2-CB 4.43Å; L81-L114 HydrophobicContact CD2-CD2 4Å; Y85-L114 WeakPolarHBondContact OH-CD2 3.21Å; L110-L114 PolarHBondContact O-N 3.44Å; A111-L114 PolarHBondContact O-N 2.94Å; A111-L114 VanDerWaalsContact O-N 3.08Å; A112-L114 PolarHBondContact O-N 3.06Å; L114-M153 HydrophobicContact CD2-CB 4.44Å; L114-A154 HydrophobicContact CD2-CB 4.48Å |
| 115 | K | 94.3 | Very high | 95.3 | Very high | 56 Ų | 56 | 45.6 Ų | 45.6 | 24% | 0.243 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -112.5 | -14.6 | -169.1 | -73 | -71.3 | -161.7 | 154.5 | 0 | 114.4 | N75 D77 V78 L81 A111 A112 D160 | N75-K115 PolarHBondContact ND2-O 3.19Å; D77-K115 HydrophobicContact CB-CB 4.07Å; D77-K115 HydrophobicContact CB-CD 3.78Å; D77-K115 HydrophobicContact CB-CG 3.9Å; D77-K115 IonicContact OD2-NZ 2.81Å; D77-K115 PolarHBondContact OD2-NZ 3.17Å; V78-K115 HydrophobicContact CG2-CB 3.97Å; L81-K115 HydrophobicContact CD2-CG 3.54Å; A111-K115 PolarHBondContact O-N 3.38Å; A112-K115 PolarHBondContact O-N 3.4Å; K115-D160 IonicContact NZ-OD1 3.39Å; K115-D160 PolarHBondContact NZ-OD1 3.17Å |
| 116 | D | 90.5 | Very high | 95.3 | Very high | 36 Ų | 36 | 45.7 Ų | 45.7 | 19% | 0.193 | 23% | 0.234 | C | C | . | . | trans | -109.1 | 141.6 | -178.1 | -147.6 | -45.3 | 0 | 0 | 0 | 111.9 | T74 N75 V78 A112 R118 | T74-D116 WeakPolarHBondContact CA-OD2 3.19Å; T74-D116 WeakPolarHBondContact CB-OD2 3.49Å; N75-D116 PolarHBondContact N-OD2 3.37Å; V78-D116 HydrophobicContact CG2-CB 4.23Å; A112-D116 HydrophobicContact CB-CB 4.42Å; A112-D116 WeakPolarHBondContact O-CA 3.44Å; A112-D116 WeakPolarHBondContact O-CB 3.26Å; A112-D116 PolarHBondContact O-N 3.02Å; D116-R118 VanDerWaalsContact C-N 3.32Å; D116-R118 PolarHBondContact OD1-N 2.8Å; D116-R118 VanDerWaalsContact OD1-N 3.1Å | ||
| 117 | C | 87.4 | Confident | 95.2 | Very high | 124 Ų | 124 | 49.5 Ų | 49.5 | 84% | 0.838 | 26% | 0.257 | S | S | * | . | S | Bend | trans | -73 | -28.8 | 174.6 | -65.7 | 0 | 0 | 0 | 0 | 111.6 | ||
| 118 | R | 88.6 | Confident | 95.1 | Very high | 159 Ų | 159 | 52 Ų | 52 | 60% | 0.6 | 27% | 0.267 | S | S | * | . | S | Bend | trans | -129.2 | 74 | -178.5 | -58.5 | -172.9 | -137 | 175 | 6.2 | 109.6 | D11 D116 | D11-R118 IonicContact OD1-CZ 3.27Å; D11-R118 IonicContact OD1-NH1 2.82Å; D11-R118 PolarHBondContact OD1-NH1 2.86Å; D11-R118 IonicContact OD1-NH2 2.86Å; D11-R118 PolarHBondContact OD1-NH2 3.01Å; D116-R118 VanDerWaalsContact C-N 3.32Å; D116-R118 PolarHBondContact OD1-N 2.8Å; D116-R118 VanDerWaalsContact OD1-N 3.1Å |
| 119 | P | 91.8 | Very high | 94.9 | Very high | 55 Ų | 55 | 52.1 Ų | 52.1 | 36% | 0.357 | 27% | 0.268 | S | S | . | . | P | Polyproline II helix | trans | -63.3 | 146.3 | -179.3 | 26.5 | -34.7 | 0 | 0 | 0 | 111.8 | A112 K113 | A112-P119 HydrophobicContact CB-CB 3.92Å; K113-P119 HydrophobicContact CG-CB 4.26Å; K113-P119 HydrophobicContact CG-CG 4.37Å |
| 120 | P | 93.1 | Very high | 94.8 | Very high | 8 Ų | 8 | 58.6 Ų | 58.6 | 5% | 0.052 | 30% | 0.303 | C | S | . | . | P | Polyproline II helix | trans | -64.3 | 146 | 177.3 | 28.3 | -34.2 | 0 | 0 | 0 | 110.5 | E72 F109 A112 L125 | E72-P120 HydrophobicContact CG-CB 4.36Å; F109-P120 WeakPolarHBondContact CE2-O 3.35Å; A112-P120 HydrophobicContact CB-CG 4.33Å; P120-L125 HydrophobicContact CB-CD2 4.43Å; P120-L125 HydrophobicContact CB-CG 4.27Å; P120-L125 HydrophobicContact CG-CD1 4.25Å; P120-L125 HydrophobicContact CG-CD2 4.12Å; P120-L125 HydrophobicContact CG-CG 4.13Å |
| 121 | S | 95.8 | Very high | 94.6 | Very high | 62 Ų | 62 | 63.5 Ų | 63.5 | 43% | 0.434 | 33% | 0.329 | S | S | . | . | P | Polyproline II helix | trans | -71.1 | 156.4 | 176.9 | 74.9 | 0 | 0 | 0 | 0 | 111.4 | E123 K124 L125 | S121-E123 PolarHBondContact O-N 3.45Å; S121-K124 PolarHBondContact O-N 3.05Å; S121-K124 VanDerWaalsContact O-N 3.14Å; S121-K124 WeakPolarHBondContact OG-CB 3.34Å; S121-K124 PolarHBondContact OG-N 2.75Å; S121-K124 VanDerWaalsContact OG-N 3.13Å; S121-L125 PolarHBondContact O-N 3.08Å |
| 122 | A | 96.6 | Very high | 94.4 | Very high | 15 Ų | 15 | 67 Ų | 67 | 12% | 0.124 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -57.9 | -38.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F109 L125 C126 P135 L138 | F109-A122 HydrophobicContact CE2-CB 4.42Å; F109-A122 HydrophobicContact CZ-CB 4.2Å; A122-L125 PolarHBondContact O-N 2.99Å; A122-C126 PolarHBondContact O-N 3.19Å; A122-C126 PolarHBondContact O-SG 3.43Å; A122-P135 HydrophobicContact CB-CB 4.25Å; A122-L138 HydrophobicContact CB-CD2 4.04Å |
| 123 | E | 96.6 | Very high | 94.4 | Very high | 142 Ų | 142 | 67.6 Ų | 67.6 | 66% | 0.664 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -61.4 | -45.1 | 176.1 | -63.7 | 178 | 174.9 | 0 | 0 | 111.5 | S121 L125 C126 V127 P135 | S121-E123 PolarHBondContact O-N 3.45Å; E123-L125 PolarHBondContact O-N 3.3Å; E123-C126 WeakPolarHBondContact O-CB 3.48Å; E123-C126 PolarHBondContact O-N 2.82Å; E123-C126 VanDerWaalsContact O-N 3.17Å; E123-V127 WeakPolarHBondContact O-CG2 3.4Å; E123-V127 PolarHBondContact O-N 2.91Å; E123-V127 VanDerWaalsContact O-N 3.1Å; E123-P135 HydrophobicContact CG-CG 4.17Å |
| 124 | K | 95.5 | Very high | 94.4 | Very high | 88 Ų | 88 | 66 Ų | 66 | 38% | 0.383 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 179.3 | -172.8 | 67.2 | 175.8 | -178.7 | 0 | 111.6 | E72 S121 C126 V127 Y128 | E72-K124 WeakPolarHBondContact OE1-CE 3.21Å; E72-K124 IonicContact OE1-NZ 3.69Å; S121-K124 PolarHBondContact O-N 3.05Å; S121-K124 VanDerWaalsContact O-N 3.14Å; S121-K124 WeakPolarHBondContact OG-CB 3.34Å; S121-K124 PolarHBondContact OG-N 2.75Å; S121-K124 VanDerWaalsContact OG-N 3.13Å; K124-C126 VanDerWaalsContact C-N 3.32Å; K124-C126 PolarHBondContact O-N 3.2Å; K124-V127 WeakPolarHBondContact O-CB 3.45Å; K124-V127 PolarHBondContact O-N 3.3Å; K124-Y128 HydrophobicContact CD-CE2 4.41Å; K124-Y128 HydrophobicContact CG-CE2 4.06Å; K124-Y128 VanDerWaalsContact O-CD2 3.28Å; K124-Y128 WeakPolarHBondContact O-CD2 3.31Å; K124-Y128 PolarHBondContact O-N 3.49Å |
| 125 | L | 95.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.9 | -35.7 | 174.4 | -73.4 | 176.3 | 0 | 0 | 0 | 112.8 | V68 I108 F109 P120 S121 A122 E123 V127 Y128 L138 | V68-L125 HydrophobicContact CG1-CD2 3.96Å; I108-L125 HydrophobicContact CG2-CD2 4.05Å; F109-L125 HydrophobicContact CB-CD1 3.52Å; F109-L125 HydrophobicContact CD2-CD1 3.67Å; F109-L125 HydrophobicContact CG-CD1 3.95Å; P120-L125 HydrophobicContact CB-CD2 4.43Å; P120-L125 HydrophobicContact CB-CG 4.27Å; P120-L125 HydrophobicContact CG-CD1 4.25Å; P120-L125 HydrophobicContact CG-CD2 4.12Å; P120-L125 HydrophobicContact CG-CG 4.13Å; S121-L125 PolarHBondContact O-N 3.08Å; A122-L125 PolarHBondContact O-N 2.99Å; E123-L125 PolarHBondContact O-N 3.3Å; L125-V127 VanDerWaalsContact C-N 3.29Å; L125-V127 PolarHBondContact O-N 2.99Å; L125-Y128 PolarHBondContact O-N 3.49Å; L125-L138 HydrophobicContact CB-CD1 3.93Å; L125-L138 HydrophobicContact CD1-CD1 4.29Å |
| 126 | C | 96.6 | Very high | 94.6 | Very high | 3 Ų | 3 | 70.3 Ų | 70.3 | 2% | 0.02 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.7 | -36.8 | 174.5 | -63.5 | 0 | 0 | 0 | 0 | 111.6 | A122 E123 K124 Y128 T129 N131 I133 | A122-C126 PolarHBondContact O-N 3.19Å; A122-C126 PolarHBondContact O-SG 3.43Å; E123-C126 WeakPolarHBondContact O-CB 3.48Å; E123-C126 PolarHBondContact O-N 2.82Å; E123-C126 VanDerWaalsContact O-N 3.17Å; K124-C126 VanDerWaalsContact C-N 3.32Å; K124-C126 PolarHBondContact O-N 3.2Å; C126-Y128 VanDerWaalsContact C-N 3.32Å; C126-Y128 PolarHBondContact O-N 3.34Å; C126-T129 PolarHBondContact O-N 3.4Å; C126-T129 VanDerWaalsContact O-N 3.08Å; C126-T129 PolarHBondContact O-OG1 3.1Å; C126-N131 WeakPolarHBondContact O-CA 3.42Å; C126-N131 PolarHBondContact O-N 3.46Å; C126-I133 HydrophobicContact CB-CG1 4.34Å |
| 127 | V | 97 | Very high | 94.9 | Very high | 80 Ų | 80 | 72.4 Ų | 72.4 | 49% | 0.485 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.2 | -41.4 | 175.2 | 174.8 | 0 | 0 | 0 | 0 | 111.5 | E123 K124 L125 T129 D130 | E123-V127 WeakPolarHBondContact O-CG2 3.4Å; E123-V127 PolarHBondContact O-N 2.91Å; E123-V127 VanDerWaalsContact O-N 3.1Å; K124-V127 WeakPolarHBondContact O-CB 3.45Å; K124-V127 PolarHBondContact O-N 3.3Å; L125-V127 VanDerWaalsContact C-N 3.29Å; L125-V127 PolarHBondContact O-N 2.99Å; V127-T129 PolarHBondContact O-N 3.15Å; V127-T129 VanDerWaalsContact O-N 3.12Å; V127-D130 PolarHBondContact O-N 3.17Å |
| 128 | Y | 96.6 | Very high | 95.4 | Very high | 52 Ų | 52 | 66.5 Ų | 66.5 | 20% | 0.204 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -14.3 | 176.6 | -77.6 | -67.2 | 0 | 0 | 0 | 115 | W64 V68 E71 E72 K124 L125 C126 D130 | W64-Y128 PolarHBondContact NE1-O 3Å; V68-Y128 HydrophobicContact CB-CG 4.45Å; V68-Y128 HydrophobicContact CG1-CD1 4.38Å; V68-Y128 HydrophobicContact CG1-CD2 3.78Å; V68-Y128 HydrophobicContact CG1-CE2 4.11Å; V68-Y128 HydrophobicContact CG1-CG 3.93Å; V68-Y128 HydrophobicContact CG2-CD1 3.82Å; V68-Y128 HydrophobicContact CG2-CD2 4.48Å; V68-Y128 HydrophobicContact CG2-CG 3.79Å; E71-Y128 HydrophobicContact CB-CE1 4.14Å; E71-Y128 HydrophobicContact CG-CE1 3.94Å; E71-Y128 WeakPolarHBondContact CG-OH 3.12Å; E72-Y128 HydrophobicContact CG-CE2 3.58Å; E72-Y128 WeakPolarHBondContact OE1-CE2 3.24Å; E72-Y128 VanDerWaalsContact OE1-CZ 3.28Å; E72-Y128 PolarHBondContact OE1-OH 2.93Å; K124-Y128 HydrophobicContact CD-CE2 4.41Å; K124-Y128 HydrophobicContact CG-CE2 4.06Å; K124-Y128 VanDerWaalsContact O-CD2 3.28Å; K124-Y128 WeakPolarHBondContact O-CD2 3.31Å; K124-Y128 PolarHBondContact O-N 3.49Å; L125-Y128 PolarHBondContact O-N 3.49Å; C126-Y128 VanDerWaalsContact C-N 3.32Å; C126-Y128 PolarHBondContact O-N 3.34Å; Y128-D130 VanDerWaalsContact C-N 3.35Å |
| 129 | T | 94.4 | Very high | 95.8 | Very high | 4 Ų | 4 | 62.9 Ų | 62.9 | 3% | 0.025 | 33% | 0.331 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.5 | 13.5 | 174.5 | 70.4 | 0 | 0 | 0 | 0 | 113.1 | W64 Q101 A105 C126 V127 N131 S132 I133 | W64-T129 HydrophobicContact CH2-CG2 4.08Å; W64-T129 HydrophobicContact CZ2-CG2 3.72Å; Q101-T129 HydrophobicContact CG-CG2 4.08Å; A105-T129 HydrophobicContact CB-CG2 4.48Å; C126-T129 PolarHBondContact O-N 3.4Å; C126-T129 VanDerWaalsContact O-N 3.08Å; C126-T129 PolarHBondContact O-OG1 3.1Å; V127-T129 PolarHBondContact O-N 3.15Å; V127-T129 VanDerWaalsContact O-N 3.12Å; T129-N131 PolarHBondContact O-N 2.97Å; T129-S132 WeakPolarHBondContact CB-OG 3.39Å; T129-S132 WeakPolarHBondContact O-CB 3.16Å; T129-S132 PolarHBondContact O-N 3.14Å; T129-S132 PolarHBondContact O-OG 2.99Å; T129-S132 PolarHBondContact OG1-N 3.31Å; T129-I133 HydrophobicContact CG2-CD1 3.77Å; T129-I133 HydrophobicContact CG2-CG1 3.95Å; T129-I133 WeakPolarHBondContact OG1-CG1 3.23Å |
| 130 | D | 95.1 | Very high | 96.1 | Very high | 149 Ų | 149 | 64.7 Ų | 64.7 | 80% | 0.797 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 34.5 | -167.5 | -67.6 | -31.8 | 0 | 0 | 0 | 112.6 | V127 Y128 S132 | V127-D130 PolarHBondContact O-N 3.17Å; Y128-D130 VanDerWaalsContact C-N 3.35Å; D130-S132 PolarHBondContact O-N 3Å |
| 131 | N | 94.3 | Very high | 96.4 | Very high | 114 Ų | 114 | 66.6 Ų | 66.6 | 61% | 0.61 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.3 | 27.9 | -174.2 | -51.7 | -72.3 | 0 | 0 | 0 | 113.7 | C126 T129 I133 | C126-N131 WeakPolarHBondContact O-CA 3.42Å; C126-N131 PolarHBondContact O-N 3.46Å; T129-N131 PolarHBondContact O-N 2.97Å; N131-I133 PolarHBondContact O-N 3.46Å |
| 132 | S | 94 | Very high | 96.5 | Very high | 74 Ų | 74 | 64.7 Ų | 64.7 | 52% | 0.517 | 33% | 0.326 | S | S | . | . | trans | -69.3 | -19.8 | 173.6 | 74.4 | 0 | 0 | 0 | 0 | 112.6 | Q101 T129 D130 | Q101-S132 PolarHBondContact OE1-OG 3.29Å; T129-S132 WeakPolarHBondContact CB-OG 3.39Å; T129-S132 WeakPolarHBondContact O-CB 3.16Å; T129-S132 PolarHBondContact O-N 3.14Å; T129-S132 PolarHBondContact O-OG 2.99Å; T129-S132 PolarHBondContact OG1-N 3.31Å; D130-S132 PolarHBondContact O-N 3Å | ||
| 133 | I | 95.8 | Very high | 96.5 | Very high | 12 Ų | 12 | 69.5 Ų | 69.5 | 6% | 0.062 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -119.1 | 154.4 | 173 | 72.9 | 176.8 | 0 | 0 | 0 | 110.8 | L102 A105 C126 T129 N131 L138 | L102-I133 HydrophobicContact CB-CG2 3.89Å; L102-I133 HydrophobicContact CD1-CB 4.06Å; L102-I133 HydrophobicContact CD1-CD1 3.67Å; L102-I133 HydrophobicContact CD1-CG1 4.4Å; L102-I133 HydrophobicContact CD1-CG2 3.99Å; L102-I133 HydrophobicContact CG-CG2 4.42Å; A105-I133 HydrophobicContact CB-CD1 3.72Å; C126-I133 HydrophobicContact CB-CG1 4.34Å; T129-I133 HydrophobicContact CG2-CD1 3.77Å; T129-I133 HydrophobicContact CG2-CG1 3.95Å; T129-I133 WeakPolarHBondContact OG1-CG1 3.23Å; N131-I133 PolarHBondContact O-N 3.46Å; I133-L138 HydrophobicContact CD1-CD1 3.98Å |
| 134 | T | 96.9 | Very high | 96.6 | Very high | 66 Ų | 66 | 65.7 Ų | 65.7 | 41% | 0.405 | 34% | 0.335 | S | S | . | . | trans | -100.5 | 153.8 | 174.7 | 64.5 | 0 | 0 | 0 | 0 | 112.3 | R136 E137 L138 | T134-R136 PolarHBondContact O-N 3.37Å; T134-E137 PolarHBondContact N-OE2 3.35Å; T134-E137 PolarHBondContact O-N 2.89Å; T134-E137 VanDerWaalsContact O-N 3.11Å; T134-E137 WeakPolarHBondContact OG1-CB 3.44Å; T134-E137 VanDerWaalsContact OG1-CD 3.29Å; T134-E137 WeakPolarHBondContact OG1-CG 3.3Å; T134-E137 PolarHBondContact OG1-N 3.2Å; T134-E137 PolarHBondContact OG1-OE2 3.29Å; T134-L138 PolarHBondContact O-N 3.03Å | ||
| 135 | P | 97.4 | Very high | 96.7 | Very high | 50 Ų | 50 | 61.5 Ų | 61.5 | 33% | 0.325 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.4 | -33.3 | 176.2 | -26.2 | 34.3 | 0 | 0 | 0 | 112.6 | A122 E123 L138 L139 | A122-P135 HydrophobicContact CB-CB 4.25Å; E123-P135 HydrophobicContact CG-CG 4.17Å; P135-L138 PolarHBondContact O-N 2.9Å; P135-L139 VanDerWaalsContact O-CG 3.26Å; P135-L139 WeakPolarHBondContact O-CG 3.29Å; P135-L139 PolarHBondContact O-N 3.17Å |
| 136 | R | 97.4 | Very high | 96.8 | Very high | 184 Ų | 184 | 62.1 Ų | 62.1 | 69% | 0.694 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -64 | -48.3 | 175.9 | -179.4 | 179.2 | 171.9 | 175.2 | 0.3 | 111.7 | T134 L138 L139 E140 | T134-R136 PolarHBondContact O-N 3.37Å; R136-L138 VanDerWaalsContact C-N 3.28Å; R136-L138 PolarHBondContact O-N 3.38Å; R136-L139 PolarHBondContact O-N 3.02Å; R136-E140 IonicContact CZ-OE1 3.56Å; R136-E140 IonicContact NE-OE1 2.85Å; R136-E140 PolarHBondContact NE-OE1 2.92Å; R136-E140 IonicContact NH2-OE1 3.38Å; R136-E140 PolarHBondContact NH2-OE1 2.98Å; R136-E140 WeakPolarHBondContact O-CG 3.45Å; R136-E140 PolarHBondContact O-N 3.05Å |
| 137 | E | 96.8 | Very high | 96.9 | Very high | 79 Ų | 79 | 64.1 Ų | 64.1 | 37% | 0.369 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.8 | -38.9 | 177.1 | -73.7 | 166 | 143.4 | 0 | 0 | 111.5 | L102 T134 E140 W141 | L102-E137 HydrophobicContact CD2-CB 4.43Å; T134-E137 PolarHBondContact N-OE2 3.35Å; T134-E137 PolarHBondContact O-N 2.89Å; T134-E137 VanDerWaalsContact O-N 3.11Å; T134-E137 WeakPolarHBondContact OG1-CB 3.44Å; T134-E137 VanDerWaalsContact OG1-CD 3.29Å; T134-E137 WeakPolarHBondContact OG1-CG 3.3Å; T134-E137 PolarHBondContact OG1-N 3.2Å; T134-E137 PolarHBondContact OG1-OE2 3.29Å; E137-E140 PolarHBondContact O-N 2.94Å; E137-W141 WeakPolarHBondContact O-CB 3.39Å; E137-W141 PolarHBondContact O-N 3.44Å |
| 138 | L | 98 | Very high | 96.8 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.4 | -47.1 | 175.7 | -170.8 | 153.7 | 0 | 0 | 0 | 111.4 | L102 A105 V106 F109 A122 L125 I133 T134 P135 R136 W141 E142 | L102-L138 HydrophobicContact CD1-CB 4.41Å; A105-L138 HydrophobicContact CB-CD1 4.25Å; V106-L138 HydrophobicContact CG2-CG 4Å; F109-L138 HydrophobicContact CB-CD2 4.32Å; F109-L138 HydrophobicContact CD1-CD2 3.46Å; F109-L138 VanDerWaalsContact CD1-CD2 3.46Å; F109-L138 HydrophobicContact CE1-CD2 3.7Å; F109-L138 HydrophobicContact CG-CD2 3.88Å; F109-L138 HydrophobicContact CZ-CD2 4.35Å; A122-L138 HydrophobicContact CB-CD2 4.04Å; L125-L138 HydrophobicContact CB-CD1 3.93Å; L125-L138 HydrophobicContact CD1-CD1 4.29Å; I133-L138 HydrophobicContact CD1-CD1 3.98Å; T134-L138 PolarHBondContact O-N 3.03Å; P135-L138 PolarHBondContact O-N 2.9Å; R136-L138 VanDerWaalsContact C-N 3.28Å; R136-L138 PolarHBondContact O-N 3.38Å; L138-W141 PolarHBondContact O-N 2.84Å; L138-E142 PolarHBondContact O-N 3.19Å |
| 139 | L | 97.8 | Very high | 96.8 | Very high | 83 Ų | 83 | 63 Ų | 63 | 44% | 0.435 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -68 | -35.9 | 177.7 | -66.9 | 172.8 | 0 | 0 | 0 | 112.9 | F109 P135 R136 E142 | F109-L139 HydrophobicContact CE1-CD2 3.99Å; F109-L139 HydrophobicContact CZ-CD2 4.39Å; P135-L139 VanDerWaalsContact O-CG 3.26Å; P135-L139 WeakPolarHBondContact O-CG 3.29Å; P135-L139 PolarHBondContact O-N 3.17Å; R136-L139 PolarHBondContact O-N 3.02Å; L139-E142 WeakPolarHBondContact O-CB 3.26Å; L139-E142 PolarHBondContact O-N 3.43Å |
| 140 | E | 97.8 | Very high | 96.8 | Very high | 93 Ų | 93 | 71.3 Ų | 71.3 | 44% | 0.435 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66 | -43.2 | 174.7 | -73.8 | 175.8 | -174.6 | 0 | 0 | 110.9 | R136 E137 L143 V144 | R136-E140 IonicContact CZ-OE1 3.56Å; R136-E140 IonicContact NE-OE1 2.85Å; R136-E140 PolarHBondContact NE-OE1 2.92Å; R136-E140 IonicContact NH2-OE1 3.38Å; R136-E140 PolarHBondContact NH2-OE1 2.98Å; R136-E140 WeakPolarHBondContact O-CG 3.45Å; R136-E140 PolarHBondContact O-N 3.05Å; E137-E140 PolarHBondContact O-N 2.94Å; E140-L143 PolarHBondContact O-N 3.5Å; E140-V144 PolarHBondContact O-N 2.95Å |
| 141 | W | 97.9 | Very high | 96.9 | Very high | 48 Ų | 48 | 72.8 Ų | 72.8 | 18% | 0.182 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -71.2 | -28.2 | 176.7 | -90.1 | 69.9 | 0 | 0 | 0 | 113.6 | F89 Y99 L102 L103 V106 E137 L138 L143 V144 V145 | F89-W141 HydrophobicContact CE1-CZ3 4.08Å; F89-W141 AromaticContact CZ-CZ3 3.98Å; F89-W141 HydrophobicContact CZ-CZ3 3.98Å; Y99-W141 HydrophobicContact CD1-CH2 4.38Å; Y99-W141 AromaticContact CD1-CZ2 3.6Å; Y99-W141 HydrophobicContact CD1-CZ2 3.6Å; Y99-W141 HydrophobicContact CD2-CZ2 4.25Å; Y99-W141 HydrophobicContact CE1-CZ2 4.23Å; Y99-W141 AromaticContact CG-CH2 4Å; Y99-W141 HydrophobicContact CG-CH2 4Å; Y99-W141 AromaticContact CG-CZ2 3.62Å; Y99-W141 HydrophobicContact CG-CZ2 3.62Å; L102-W141 HydrophobicContact CD2-CB 4.47Å; L102-W141 VanDerWaalsContact CD2-CD1 3.44Å; L102-W141 HydrophobicContact CD2-CD2 3.86Å; L102-W141 HydrophobicContact CD2-CG 3.69Å; L102-W141 HydrophobicContact CD2-CZ2 4.49Å; L102-W141 HydrophobicContact CG-CB 4.42Å; L102-W141 HydrophobicContact CG-CD2 4.16Å; L102-W141 HydrophobicContact CG-CG 4.03Å; L103-W141 HydrophobicContact CB-CZ3 4.2Å; L103-W141 HydrophobicContact CD1-CE3 4.38Å; L103-W141 HydrophobicContact CD1-CZ3 4.24Å; V106-W141 HydrophobicContact CG2-CB 3.72Å; E137-W141 WeakPolarHBondContact O-CB 3.39Å; E137-W141 PolarHBondContact O-N 3.44Å; L138-W141 PolarHBondContact O-N 2.84Å; W141-L143 VanDerWaalsContact C-N 3.26Å; W141-L143 PolarHBondContact O-N 3.4Å; W141-V144 WeakPolarHBondContact O-CB 3.46Å; W141-V144 PolarHBondContact O-N 3.47Å; W141-V144 VanDerWaalsContact O-N 3.08Å; W141-V145 WeakPolarHBondContact O-CG2 3.42Å; W141-V145 PolarHBondContact O-N 3.47Å |
| 142 | E | 98.1 | Very high | 96.9 | Very high | 23 Ų | 23 | 70.5 Ų | 70.5 | 11% | 0.107 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -51.9 | -48.8 | 171.3 | -173.6 | -179.3 | -160.8 | 0 | 0 | 110.8 | V106 L110 K113 L138 L139 V144 V145 L146 | V106-E142 HydrophobicContact CG1-CB 4.37Å; L110-E142 HydrophobicContact CD1-CG 4.44Å; L110-E142 HydrophobicContact CD2-CG 3.59Å; L110-E142 WeakPolarHBondContact CD2-OE1 3.5Å; L110-E142 HydrophobicContact CG-CG 4.08Å; K113-E142 IonicContact NZ-OE1 3.69Å; K113-E142 PolarHBondContact NZ-OE1 3.27Å; K113-E142 IonicContact NZ-OE2 3.29Å; K113-E142 PolarHBondContact NZ-OE2 3.39Å; L138-E142 PolarHBondContact O-N 3.19Å; L139-E142 WeakPolarHBondContact O-CB 3.26Å; L139-E142 PolarHBondContact O-N 3.43Å; E142-V144 VanDerWaalsContact C-N 3.33Å; E142-V144 PolarHBondContact O-N 3.27Å; E142-V145 PolarHBondContact O-N 2.88Å; E142-L146 HydrophobicContact CG-CD1 4.05Å; E142-L146 WeakPolarHBondContact O-CB 3.45Å; E142-L146 VanDerWaalsContact O-CG 3.29Å; E142-L146 WeakPolarHBondContact O-CG 3.41Å; E142-L146 PolarHBondContact O-N 3.28Å |
| 143 | L | 97.8 | Very high | 96.9 | Very high | 116 Ų | 116 | 68 Ų | 68 | 61% | 0.607 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -65.7 | -35.7 | 178.2 | -62.1 | 175.3 | 0 | 0 | 0 | 112.4 | E140 W141 G147 | E140-L143 PolarHBondContact O-N 3.5Å; W141-L143 VanDerWaalsContact C-N 3.26Å; W141-L143 PolarHBondContact O-N 3.4Å; L143-G147 PolarHBondContact O-N 3.25Å |
| 144 | V | 97.9 | Very high | 96.7 | Very high | 61 Ų | 61 | 71 Ų | 71 | 37% | 0.37 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.9 | -47.4 | 176.5 | 177.2 | 0 | 0 | 0 | 0 | 110.7 | F89 E140 W141 E142 G147 K148 | F89-V144 HydrophobicContact CE2-CG1 4.16Å; F89-V144 HydrophobicContact CZ-CG1 4.22Å; E140-V144 PolarHBondContact O-N 2.95Å; W141-V144 WeakPolarHBondContact O-CB 3.46Å; W141-V144 PolarHBondContact O-N 3.47Å; W141-V144 VanDerWaalsContact O-N 3.08Å; E142-V144 VanDerWaalsContact C-N 3.33Å; E142-V144 PolarHBondContact O-N 3.27Å; V144-G147 PolarHBondContact O-N 3.22Å; V144-K148 HydrophobicContact CG1-CG 4.39Å; V144-K148 WeakPolarHBondContact O-CB 3.22Å; V144-K148 VanDerWaalsContact O-CG 3.23Å; V144-K148 WeakPolarHBondContact O-CG 3.37Å; V144-K148 PolarHBondContact O-N 2.92Å |
| 145 | V | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.2 | -48.7 | 179 | 175.5 | 0 | 0 | 0 | 0 | 110.4 | F89 L103 V106 L110 W141 E142 G147 K148 L149 | F89-V145 HydrophobicContact CD2-CB 4.28Å; F89-V145 HydrophobicContact CD2-CG1 4.28Å; F89-V145 HydrophobicContact CD2-CG2 3.89Å; F89-V145 HydrophobicContact CE2-CB 4.39Å; F89-V145 HydrophobicContact CE2-CG2 3.84Å; L103-V145 HydrophobicContact CD1-CG2 3.62Å; V106-V145 HydrophobicContact CG1-CB 4.15Å; V106-V145 HydrophobicContact CG1-CG2 3.73Å; L110-V145 HydrophobicContact CD1-CB 3.91Å; L110-V145 HydrophobicContact CD1-CG1 3.61Å; W141-V145 WeakPolarHBondContact O-CG2 3.42Å; W141-V145 PolarHBondContact O-N 3.47Å; E142-V145 PolarHBondContact O-N 2.88Å; V145-G147 VanDerWaalsContact C-N 3.33Å; V145-G147 PolarHBondContact O-N 3.46Å; V145-K148 PolarHBondContact O-N 2.98Å; V145-L149 HydrophobicContact CG1-CD1 3.82Å; V145-L149 HydrophobicContact CG1-CG 4.29Å; V145-L149 WeakPolarHBondContact O-CB 3.5Å; V145-L149 WeakPolarHBondContact O-CG 3.26Å; V145-L149 PolarHBondContact O-N 3.04Å |
| 146 | L | 97.9 | Very high | 96.4 | Very high | 13 Ų | 13 | 66 Ų | 66 | 7% | 0.068 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -56.8 | -45.4 | 176.3 | -73.4 | 170.3 | 0 | 0 | 0 | 112.1 | L110 E142 K150 W151 M153 | L110-L146 HydrophobicContact CD1-CG 4.38Å; L110-L146 HydrophobicContact CD2-CD1 4.06Å; L110-L146 HydrophobicContact CD2-CD2 3.82Å; L110-L146 HydrophobicContact CD2-CG 3.89Å; E142-L146 HydrophobicContact CG-CD1 4.05Å; E142-L146 WeakPolarHBondContact O-CB 3.45Å; E142-L146 VanDerWaalsContact O-CG 3.29Å; E142-L146 WeakPolarHBondContact O-CG 3.41Å; E142-L146 PolarHBondContact O-N 3.28Å; L146-K150 PolarHBondContact O-N 3.41Å; L146-W151 HydrophobicContact CB-CD2 4.38Å; L146-W151 HydrophobicContact CB-CZ2 4.37Å; L146-W151 HydrophobicContact CD1-CH2 3.9Å; L146-W151 HydrophobicContact CD1-CZ2 4.25Å; L146-W151 HydrophobicContact CD1-CZ3 4.05Å; L146-W151 HydrophobicContact CD2-CD2 4.38Å; L146-W151 HydrophobicContact CD2-CE3 4.07Å; L146-W151 HydrophobicContact CD2-CZ3 4.31Å; L146-W151 PolarHBondContact O-N 3.31Å; L146-M153 HydrophobicContact CD2-CE 3.98Å; L146-M153 HydrophobicContact CD2-CG 3.72Å; L146-M153 HydrophobicContact CD2-SD 3.82Å |
| 147 | G | 97.6 | Very high | 96.2 | Very high | 45 Ų | 45 | 57.3 Ų | 57.3 | 46% | 0.464 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L143 V144 V145 K150 | L143-G147 PolarHBondContact O-N 3.25Å; V144-G147 PolarHBondContact O-N 3.22Å; V145-G147 VanDerWaalsContact C-N 3.33Å; V145-G147 PolarHBondContact O-N 3.46Å; G147-K150 PolarHBondContact O-N 3.01Å |
| 148 | K | 95.9 | Very high | 96.2 | Very high | 100 Ų | 100 | 54.3 Ų | 54.3 | 44% | 0.435 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -73.8 | -34.7 | -179.8 | -67.9 | -67 | 175.7 | 174.5 | 0 | 113 | F89 V92 M93 V144 V145 K150 | F89-K148 HydrophobicContact CD2-CB 4.03Å; F89-K148 HydrophobicContact CE2-CB 3.93Å; F89-K148 HydrophobicContact CE2-CG 3.91Å; V92-K148 HydrophobicContact CG2-CB 4.4Å; M93-K148 HydrophobicContact CG-CB 4.43Å; M93-K148 HydrophobicContact CG-CD 3.63Å; M93-K148 HydrophobicContact CG-CG 3.79Å; M93-K148 HydrophobicContact SD-CD 3.62Å; M93-K148 WeakPolarHBondContact SD-CE 3.48Å; M93-K148 HydrophobicContact SD-CG 4.34Å; M93-K148 PolarHBondContact SD-NZ 2.84Å; V144-K148 HydrophobicContact CG1-CG 4.39Å; V144-K148 WeakPolarHBondContact O-CB 3.22Å; V144-K148 VanDerWaalsContact O-CG 3.23Å; V144-K148 WeakPolarHBondContact O-CG 3.37Å; V144-K148 PolarHBondContact O-N 2.92Å; V145-K148 PolarHBondContact O-N 2.98Å; K148-K150 PolarHBondContact O-N 3.49Å |
| 149 | L | 95.4 | Very high | 96 | Very high | 9 Ų | 9 | 54.9 Ų | 54.9 | 5% | 0.047 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.4 | 2.7 | 173.4 | -60.7 | -175.9 | 0 | 0 | 0 | 113 | Y85 R88 V145 W151 N152 M153 | Y85-L149 HydrophobicContact CD1-CD1 4.07Å; Y85-L149 HydrophobicContact CG-CD1 4.22Å; R88-L149 HydrophobicContact CB-CD2 3.67Å; V145-L149 HydrophobicContact CG1-CD1 3.82Å; V145-L149 HydrophobicContact CG1-CG 4.29Å; V145-L149 WeakPolarHBondContact O-CB 3.5Å; V145-L149 WeakPolarHBondContact O-CG 3.26Å; V145-L149 PolarHBondContact O-N 3.04Å; L149-W151 PolarHBondContact O-N 2.65Å; L149-N152 WeakPolarHBondContact O-CB 3.41Å; L149-N152 PolarHBondContact O-N 3.46Å; L149-M153 HydrophobicContact CB-SD 4.04Å; L149-M153 HydrophobicContact CD1-CE 4.24Å; L149-M153 HydrophobicContact CD1-SD 3.87Å |
| 150 | K | 95.8 | Very high | 95.8 | Very high | 178 Ų | 178 | 53 Ų | 53 | 77% | 0.774 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 37.4 | -179.5 | -56.6 | 179 | 179.9 | 177 | 0 | 112.4 | L146 G147 K148 N152 | L146-K150 PolarHBondContact O-N 3.41Å; G147-K150 PolarHBondContact O-N 3.01Å; K148-K150 PolarHBondContact O-N 3.49Å; K150-N152 PolarHBondContact O-N 3.34Å |
| 151 | W | 96.1 | Very high | 95.6 | Very high | 181 Ų | 181 | 48.6 Ų | 48.6 | 69% | 0.686 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.5 | 12.1 | -176.1 | -62.9 | 77.7 | 0 | 0 | 0 | 115 | L146 L149 M153 | L146-W151 HydrophobicContact CB-CD2 4.38Å; L146-W151 HydrophobicContact CB-CZ2 4.37Å; L146-W151 HydrophobicContact CD1-CH2 3.9Å; L146-W151 HydrophobicContact CD1-CZ2 4.25Å; L146-W151 HydrophobicContact CD1-CZ3 4.05Å; L146-W151 HydrophobicContact CD2-CD2 4.38Å; L146-W151 HydrophobicContact CD2-CE3 4.07Å; L146-W151 HydrophobicContact CD2-CZ3 4.31Å; L146-W151 PolarHBondContact O-N 3.31Å; L149-W151 PolarHBondContact O-N 2.65Å; W151-M153 PolarHBondContact O-N 3.23Å |
| 152 | N | 94.1 | Very high | 95.4 | Very high | 66 Ų | 66 | 46.6 Ų | 46.6 | 35% | 0.353 | 25% | 0.245 | S | C | . | . | trans | -80.8 | 72.4 | 176.9 | -171.6 | 22.9 | 0 | 0 | 0 | 110.2 | F39 R88 L149 K150 | F39-N152 WeakPolarHBondContact CE1-ND2 3.47Å; F39-N152 VanDerWaalsContact CE1-OD1 3.26Å; F39-N152 WeakPolarHBondContact CE1-OD1 3.46Å; R88-N152 PolarHBondContact NH1-O 3.09Å; R88-N152 PolarHBondContact NH2-O 2.82Å; L149-N152 WeakPolarHBondContact O-CB 3.41Å; L149-N152 PolarHBondContact O-N 3.46Å; K150-N152 PolarHBondContact O-N 3.34Å | ||
| 153 | M | 94.1 | Very high | 95 | Very high | 20 Ų | 20 | 50.6 Ų | 50.6 | 10% | 0.099 | 26% | 0.264 | C | S | . | . | trans | -96.2 | -28.8 | -171.1 | -56.9 | -52.5 | -75.1 | 0 | 0 | 112.9 | Y85 L110 L114 L146 L149 W151 S155 | Y85-M153 HydrophobicContact CD1-CE 4.07Å; Y85-M153 HydrophobicContact CD2-CE 3.72Å; Y85-M153 HydrophobicContact CE1-CB 4.38Å; Y85-M153 HydrophobicContact CE1-CE 3.82Å; Y85-M153 WeakPolarHBondContact CE1-O 3.29Å; Y85-M153 HydrophobicContact CE1-SD 4.34Å; Y85-M153 HydrophobicContact CE2-CE 3.43Å; Y85-M153 VanDerWaalsContact CE2-CE 3.43Å; Y85-M153 HydrophobicContact CG-CE 4.02Å; Y85-M153 VanDerWaalsContact CZ-CE 3.48Å; Y85-M153 VanDerWaalsContact CZ-O 3.29Å; Y85-M153 PolarHBondContact OH-O 2.93Å; L110-M153 HydrophobicContact CB-CE 3.92Å; L110-M153 HydrophobicContact CD1-CE 3.78Å; L110-M153 HydrophobicContact CD2-CE 4.32Å; L110-M153 HydrophobicContact CG-CE 4.23Å; L114-M153 HydrophobicContact CD2-CB 4.44Å; L146-M153 HydrophobicContact CD2-CE 3.98Å; L146-M153 HydrophobicContact CD2-CG 3.72Å; L146-M153 HydrophobicContact CD2-SD 3.82Å; L149-M153 HydrophobicContact CB-SD 4.04Å; L149-M153 HydrophobicContact CD1-CE 4.24Å; L149-M153 HydrophobicContact CD1-SD 3.87Å; W151-M153 PolarHBondContact O-N 3.23Å; M153-S155 PolarHBondContact O-N 3.08Å; M153-S155 PolarHBondContact O-OG 3.16Å | ||
| 154 | A | 92.6 | Very high | 94.7 | Very high | 75 Ų | 75 | 45.5 Ų | 45.5 | 62% | 0.62 | 24% | 0.237 | S | C | * | . | trans | -76.3 | 69.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | F39 L114 | F39-A154 WeakPolarHBondContact CZ-O 3.37Å; L114-A154 HydrophobicContact CD2-CB 4.48Å | ||
| 155 | S | 92.6 | Very high | 94.4 | Very high | 6 Ų | 6 | 42.6 Ų | 42.6 | 4% | 0.042 | 22% | 0.219 | C | C | . | . | trans | -83.7 | 143.2 | -177.1 | -47.8 | 0 | 0 | 0 | 0 | 110.3 | F39 N84 R88 M153 I157 | F39-S155 VanDerWaalsContact CD1-CB 3.43Å; F39-S155 VanDerWaalsContact CD1-OG 3.27Å; F39-S155 WeakPolarHBondContact CD1-OG 3.45Å; N84-S155 WeakPolarHBondContact OD1-CB 3.45Å; N84-S155 PolarHBondContact OD1-OG 2.98Å; N84-S155 VanDerWaalsContact OD1-OG 3.13Å; R88-S155 PolarHBondContact NH1-OG 2.7Å; M153-S155 PolarHBondContact O-N 3.08Å; M153-S155 PolarHBondContact O-OG 3.16Å; S155-I157 PolarHBondContact O-N 2.85Å | ||
| 156 | V | 94.2 | Very high | 94 | Very high | 5 Ų | 5 | 43.7 Ų | 43.7 | 3% | 0.03 | 23% | 0.225 | C | C | . | . | trans | -70.1 | 127.6 | 171.1 | 179.7 | 0 | 0 | 0 | 0 | 109 | L32 I35 E36 F39 F161 P201 | L32-V156 HydrophobicContact CD2-CG1 4.18Å; L32-V156 HydrophobicContact CD2-CG2 3.84Å; I35-V156 HydrophobicContact CD1-CG2 3.44Å; I35-V156 VanDerWaalsContact CD1-CG2 3.44Å; I35-V156 HydrophobicContact CG1-CG2 3.45Å; I35-V156 VanDerWaalsContact CG1-CG2 3.45Å; E36-V156 HydrophobicContact CB-CB 4.42Å; E36-V156 HydrophobicContact CB-CG1 4.33Å; F39-V156 HydrophobicContact CD2-CB 4.38Å; F39-V156 HydrophobicContact CD2-CG2 4.35Å; F39-V156 HydrophobicContact CE2-CG2 4.17Å; V156-F161 HydrophobicContact CG1-CD2 4.26Å; V156-F161 HydrophobicContact CG1-CE2 3.35Å; V156-F161 HydrophobicContact CG1-CZ 3.78Å; V156-P201 WeakPolarHBondContact O-CG 3.31Å | ||
| 157 | I | 94.9 | Very high | 93.4 | Very high | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.01 | 24% | 0.235 | C | C | . | . | trans | -115.3 | 160.5 | 179.1 | 57.4 | 168.3 | 0 | 0 | 0 | 110.8 | D77 P80 L81 S155 N159 D160 | D77-I157 HydrophobicContact CB-CD1 3.65Å; P80-I157 HydrophobicContact CB-CB 4.41Å; L81-I157 HydrophobicContact CB-CG2 4.01Å; L81-I157 HydrophobicContact CD1-CG2 3.94Å; S155-I157 PolarHBondContact O-N 2.85Å; I157-N159 HydrophobicContact CD1-CB 3.91Å; I157-N159 HydrophobicContact CG1-CB 4.22Å; I157-N159 PolarHBondContact O-N 3.13Å; I157-N159 VanDerWaalsContact O-N 3.13Å; I157-D160 VanDerWaalsContact CG1-OD2 3.25Å; I157-D160 WeakPolarHBondContact CG1-OD2 3.33Å; I157-D160 PolarHBondContact N-OD2 2.79Å; I157-D160 WeakPolarHBondContact O-CB 3.46Å; I157-D160 PolarHBondContact O-N 3.42Å | ||
| 158 | P | 94.9 | Very high | 93 | Very high | 17 Ų | 17 | 47.4 Ų | 47.4 | 11% | 0.11 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -57.5 | -32 | -179.1 | -25.1 | 34.2 | 0 | 0 | 0 | 113.1 | D160 F161 I187 P201 I204 A205 | P158-D160 VanDerWaalsContact C-N 3.27Å; P158-D160 PolarHBondContact O-N 3.41Å; P158-F161 PolarHBondContact O-N 3.08Å; P158-F161 VanDerWaalsContact O-N 3.16Å; P158-I187 HydrophobicContact CB-CD1 3.83Å; P158-I187 HydrophobicContact CB-CG1 3.89Å; P158-I187 HydrophobicContact CB-CG2 3.79Å; P158-I187 HydrophobicContact CG-CG2 3.99Å; P158-P201 HydrophobicContact CG-CB 4.07Å; P158-I204 HydrophobicContact CB-CB 4.3Å; P158-I204 HydrophobicContact CB-CG2 4.02Å; P158-I204 HydrophobicContact CG-CB 4.05Å; P158-I204 HydrophobicContact CG-CG2 3.84Å; P158-A205 HydrophobicContact CB-CB 4.11Å; P158-A205 VanDerWaalsContact O-CB 3.3Å; P158-A205 WeakPolarHBondContact O-CB 3.43Å |
| 159 | N | 94.9 | Very high | 92.5 | Very high | 12 Ų | 12 | 43.1 Ų | 43.1 | 6% | 0.064 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.9 | -34.3 | 178.9 | -65.1 | 7.3 | 0 | 0 | 0 | 112.9 | Q76 D77 I157 F161 I162 L184 | Q76-N159 VanDerWaalsContact C-ND2 3.34Å; Q76-N159 PolarHBondContact O-ND2 3.22Å; D77-N159 WeakPolarHBondContact CA-ND2 3.2Å; D77-N159 WeakPolarHBondContact OD1-CB 3.18Å; D77-N159 PolarHBondContact OD1-ND2 2.93Å; I157-N159 HydrophobicContact CD1-CB 3.91Å; I157-N159 HydrophobicContact CG1-CB 4.22Å; I157-N159 PolarHBondContact O-N 3.13Å; I157-N159 VanDerWaalsContact O-N 3.13Å; N159-F161 PolarHBondContact O-N 2.89Å; N159-F161 VanDerWaalsContact O-N 3.12Å; N159-I162 HydrophobicContact CB-CD1 4.35Å; N159-I162 PolarHBondContact O-N 3.32Å; N159-I162 VanDerWaalsContact O-N 3.08Å; N159-L184 HydrophobicContact CB-CD2 4.47Å |
| 160 | D | 93.6 | Very high | 92 | Very high | 44 Ų | 44 | 45.2 Ų | 45.2 | 24% | 0.235 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.6 | -22.7 | -179.3 | -58.2 | -39.1 | 0 | 0 | 0 | 111.6 | K115 I157 P158 | K115-D160 IonicContact NZ-OD1 3.39Å; K115-D160 PolarHBondContact NZ-OD1 3.17Å; I157-D160 VanDerWaalsContact CG1-OD2 3.25Å; I157-D160 WeakPolarHBondContact CG1-OD2 3.33Å; I157-D160 PolarHBondContact N-OD2 2.79Å; I157-D160 WeakPolarHBondContact O-CB 3.46Å; I157-D160 PolarHBondContact O-N 3.42Å; P158-D160 VanDerWaalsContact C-N 3.27Å; P158-D160 PolarHBondContact O-N 3.41Å |
| 161 | F | 94.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -88.2 | -19.5 | 178.3 | -67.7 | -81.1 | 0 | 0 | 0 | 114.1 | L29 L32 L33 E36 V156 P158 N159 E163 H164 I165 P201 A205 | L29-F161 HydrophobicContact CD1-CD1 3.58Å; L29-F161 HydrophobicContact CD1-CE1 3.76Å; L32-F161 HydrophobicContact CB-CE1 3.72Å; L32-F161 HydrophobicContact CB-CZ 3.83Å; L33-F161 HydrophobicContact CD2-CD1 4.45Å; L33-F161 HydrophobicContact CD2-CE1 3.61Å; L33-F161 HydrophobicContact CD2-CZ 4.13Å; L33-F161 HydrophobicContact CG-CE1 3.99Å; E36-F161 HydrophobicContact CB-CZ 4.49Å; V156-F161 HydrophobicContact CG1-CD2 4.26Å; V156-F161 HydrophobicContact CG1-CE2 3.35Å; V156-F161 HydrophobicContact CG1-CZ 3.78Å; P158-F161 PolarHBondContact O-N 3.08Å; P158-F161 VanDerWaalsContact O-N 3.16Å; N159-F161 PolarHBondContact O-N 2.89Å; N159-F161 VanDerWaalsContact O-N 3.12Å; F161-E163 PolarHBondContact O-N 2.87Å; F161-H164 CarbonylContact O-C 3.58Å; F161-H164 WeakPolarHBondContact O-CA 3.42Å; F161-H164 WeakPolarHBondContact O-CB 3.38Å; F161-H164 PolarHBondContact O-N 3.4Å; F161-I165 HydrophobicContact CB-CD1 3.81Å; F161-I165 HydrophobicContact CB-CG1 4.38Å; F161-I165 WeakPolarHBondContact O-CD1 3.46Å; F161-I165 VanDerWaalsContact O-CG1 3.22Å; F161-I165 WeakPolarHBondContact O-CG1 3.34Å; F161-I165 PolarHBondContact O-N 3.28Å; F161-P201 HydrophobicContact CD2-CB 4.4Å; F161-P201 HydrophobicContact CE2-CB 3.96Å; F161-A205 HydrophobicContact CB-CB 3.77Å |
| 162 | I | 93.2 | Very high | 90.8 | Very high | 6 Ų | 6 | 31.6 Ų | 31.6 | 3% | 0.031 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.1 | -54.4 | -170 | -61.8 | 174.3 | 0 | 0 | 0 | 111 | N159 H164 I165 M166 T183 L184 I187 | N159-I162 HydrophobicContact CB-CD1 4.35Å; N159-I162 PolarHBondContact O-N 3.32Å; N159-I162 VanDerWaalsContact O-N 3.08Å; I162-H164 PolarHBondContact O-N 2.84Å; I162-I165 PolarHBondContact O-N 2.88Å; I162-M166 WeakPolarHBondContact O-CB 3.46Å; I162-M166 PolarHBondContact O-N 3.1Å; I162-T183 HydrophobicContact CD1-CG2 3.97Å; I162-T183 HydrophobicContact CG1-CG2 3.98Å; I162-L184 HydrophobicContact CD1-CD2 3.5Å; I162-L184 HydrophobicContact CD1-CG 3.79Å; I162-I187 HydrophobicContact CD1-CD1 3.55Å; I162-I187 HydrophobicContact CG1-CD1 3.96Å |
| 163 | E | 89.8 | Confident | 90.3 | Very high | 107 Ų | 107 | 36.8 Ų | 36.8 | 50% | 0.5 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -62.1 | -31.3 | 179 | -64.6 | -169 | 170.6 | 0 | 0 | 111.2 | L23 F161 R167 | L23-E163 HydrophobicContact CD2-CB 3.94Å; L23-E163 WeakPolarHBondContact CD2-OE2 3.44Å; F161-E163 PolarHBondContact O-N 2.87Å; E163-R167 VanDerWaalsContact O-CD 3.31Å; E163-R167 WeakPolarHBondContact O-CD 3.38Å; E163-R167 WeakPolarHBondContact O-CG 3.32Å; E163-R167 PolarHBondContact O-N 2.94Å; E163-R167 PolarHBondContact O-NE 3.11Å |
| 164 | H | 90.9 | Very high | 89.9 | Confident | 8 Ų | 8 | 43.3 Ų | 43.3 | 4% | 0.037 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -68.1 | -40.1 | 177.7 | -72.1 | -3.5 | 0 | 0 | 0 | 114.5 | I22 V28 L29 L32 F161 I162 R167 R168 | I22-H164 PolarHBondContact O-CE1 3.39Å; V28-H164 WeakPolarHBondContact CG1-NE2 3.37Å; L29-H164 HydrophobicContact CD1-CB 4.17Å; L32-H164 VanDerWaalsContact CD1-CD2 3.45Å; L32-H164 WeakPolarHBondContact CD1-CD2 3.23Å; L32-H164 WeakPolarHBondContact CD1-NE2 3.3Å; F161-H164 CarbonylContact O-C 3.58Å; F161-H164 WeakPolarHBondContact O-CA 3.42Å; F161-H164 WeakPolarHBondContact O-CB 3.38Å; F161-H164 PolarHBondContact O-N 3.4Å; I162-H164 PolarHBondContact O-N 2.84Å; H164-R167 VanDerWaalsContact CA-NE 3.28Å; H164-R167 PolarHBondContact ND1-NH2 2.82Å; H164-R167 VanDerWaalsContact O-CG 3.28Å; H164-R167 WeakPolarHBondContact O-CG 3.11Å; H164-R167 PolarHBondContact O-NE 3.06Å; H164-R168 PolarHBondContact O-NH1 2.71Å |
| 165 | I | 91.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -84.5 | -42.3 | -178.8 | -50.6 | 154.6 | 0 | 0 | 0 | 109.7 | F161 I162 R167 R168 L169 A205 T206 M209 L234 I237 T238 | F161-I165 HydrophobicContact CB-CD1 3.81Å; F161-I165 HydrophobicContact CB-CG1 4.38Å; F161-I165 WeakPolarHBondContact O-CD1 3.46Å; F161-I165 VanDerWaalsContact O-CG1 3.22Å; F161-I165 WeakPolarHBondContact O-CG1 3.34Å; F161-I165 PolarHBondContact O-N 3.28Å; I162-I165 PolarHBondContact O-N 2.88Å; I165-R167 VanDerWaalsContact C-N 3.28Å; I165-R167 PolarHBondContact O-N 2.99Å; I165-R168 PolarHBondContact O-N 3.23Å; I165-L169 PolarHBondContact O-N 3.21Å; I165-A205 HydrophobicContact CD1-CB 4.09Å; I165-T206 HydrophobicContact CD1-CG2 3.56Å; I165-T206 HydrophobicContact CG1-CG2 4.37Å; I165-M209 HydrophobicContact CB-CE 3.44Å; I165-M209 VanDerWaalsContact CB-CE 3.44Å; I165-M209 HydrophobicContact CD1-CE 4.25Å; I165-M209 HydrophobicContact CG1-CE 4.46Å; I165-M209 HydrophobicContact CG2-CE 3.15Å; I165-L234 HydrophobicContact CG2-CD2 3.38Å; I165-I237 HydrophobicContact CG1-CG2 4.28Å; I165-I237 HydrophobicContact CG2-CD1 3.93Å; I165-I237 HydrophobicContact CG2-CG2 4.16Å; I165-T238 HydrophobicContact CD1-CG2 4.42Å |
| 166 | M | 89.9 | Confident | 89.4 | Confident | 23 Ų | 23 | 45.5 Ų | 45.5 | 11% | 0.113 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.3 | -37.6 | -176.7 | -175.3 | 160.6 | 62.5 | 0 | 0 | 113.1 | I162 R168 L169 L171 Q176 C180 M209 | I162-M166 WeakPolarHBondContact O-CB 3.46Å; I162-M166 PolarHBondContact O-N 3.1Å; M166-R168 VanDerWaalsContact C-N 3.28Å; M166-R168 PolarHBondContact O-N 2.91Å; M166-L169 PolarHBondContact O-N 3.27Å; M166-L171 HydrophobicContact CG-CD1 4.33Å; M166-Q176 HydrophobicContact CE-CB 4.44Å; M166-Q176 HydrophobicContact CG-CB 4.47Å; M166-Q176 HydrophobicContact CG-CG 4.21Å; M166-Q176 HydrophobicContact SD-CB 3.77Å; M166-Q176 HydrophobicContact SD-CG 4.15Å; M166-C180 HydrophobicContact CE-CB 4.1Å; M166-C180 HydrophobicContact SD-CB 4.16Å; M166-M209 HydrophobicContact CB-SD 4.39Å |
| 167 | R | 86.7 | Confident | 89.1 | Confident | 73 Ų | 73 | 48.9 Ų | 48.9 | 28% | 0.275 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | -22.1 | 176.6 | 62.4 | -172.1 | 164 | 82.7 | -1.4 | 114.6 | L23 E163 H164 I165 | L23-R167 WeakPolarHBondContact O-CD 3.22Å; L23-R167 PolarHBondContact O-NE 3.24Å; L23-R167 PolarHBondContact O-NH1 3.29Å; L23-R167 PolarHBondContact O-NH2 2.81Å; E163-R167 VanDerWaalsContact O-CD 3.31Å; E163-R167 WeakPolarHBondContact O-CD 3.38Å; E163-R167 WeakPolarHBondContact O-CG 3.32Å; E163-R167 PolarHBondContact O-N 2.94Å; E163-R167 PolarHBondContact O-NE 3.11Å; H164-R167 VanDerWaalsContact CA-NE 3.28Å; H164-R167 PolarHBondContact ND1-NH2 2.82Å; H164-R167 VanDerWaalsContact O-CG 3.28Å; H164-R167 WeakPolarHBondContact O-CG 3.11Å; H164-R167 PolarHBondContact O-NE 3.06Å; I165-R167 VanDerWaalsContact C-N 3.28Å; I165-R167 PolarHBondContact O-N 2.99Å |
| 168 | R | 88.2 | Confident | 88.9 | Confident | 64 Ų | 64 | 53.8 Ų | 53.8 | 24% | 0.242 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.2 | -8 | 177.4 | -63.8 | -174.6 | -179.8 | 96.2 | -11.2 | 112.5 | D26 H164 I165 M166 I237 | D26-R168 IonicContact OD1-CZ 3.59Å; D26-R168 IonicContact OD1-NE 3.69Å; D26-R168 IonicContact OD1-NH2 2.67Å; D26-R168 PolarHBondContact OD1-NH2 2.88Å; H164-R168 PolarHBondContact O-NH1 2.71Å; I165-R168 PolarHBondContact O-N 3.23Å; M166-R168 VanDerWaalsContact C-N 3.28Å; M166-R168 PolarHBondContact O-N 2.91Å; R168-I237 HydrophobicContact CB-CD1 3.7Å; R168-I237 HydrophobicContact CB-CG1 4.2Å |
| 169 | L | 85.8 | Confident | 88.7 | Confident | 10 Ų | 10 | 53 Ų | 53 | 5% | 0.052 | 27% | 0.27 | C | S | . | . | S | Bend | trans | -87.9 | 143.6 | 175.7 | -66.7 | -179.2 | 0 | 0 | 0 | 111.1 | I165 M166 L171 M209 I213 L230 L233 L234 I237 | I165-L169 PolarHBondContact O-N 3.21Å; M166-L169 PolarHBondContact O-N 3.27Å; L169-L171 HydrophobicContact CB-CD1 3.94Å; L169-L171 HydrophobicContact CB-CG 3.91Å; L169-L171 HydrophobicContact CD1-CD1 3.81Å; L169-L171 HydrophobicContact CD1-CG 4.45Å; L169-L171 PolarHBondContact O-N 3.27Å; L169-M209 HydrophobicContact CD1-CE 3.47Å; L169-M209 VanDerWaalsContact CD1-CE 3.47Å; L169-M209 HydrophobicContact CD1-CG 4.41Å; L169-M209 HydrophobicContact CD1-SD 3.75Å; L169-M209 HydrophobicContact CG-CE 4.41Å; L169-I213 HydrophobicContact CD1-CD1 3.74Å; L169-L230 HydrophobicContact CD1-CD1 4.43Å; L169-L230 HydrophobicContact CD2-CD1 3.89Å; L169-L233 HydrophobicContact CD2-CD2 3.56Å; L169-L233 HydrophobicContact CD2-CG 4.08Å; L169-L234 HydrophobicContact CD1-CD2 4.23Å; L169-L234 HydrophobicContact CD2-CD2 3.96Å; L169-L234 HydrophobicContact CG-CD2 4.49Å; L169-I237 HydrophobicContact CD2-CD1 4.3Å |
| 170 | P | 83.7 | Confident | 88.6 | Confident | 52 Ų | 52 | 53.8 Ų | 53.8 | 34% | 0.338 | 28% | 0.276 | S | S | . | . | trans | -76.9 | 55.2 | 175 | 34.1 | -36.1 | 0 | 0 | 0 | 111.3 | R224 L225 | P170-R224 HydrophobicContact CG-CB 4.47Å; P170-L225 HydrophobicContact CG-CD2 4.11Å | ||
| 171 | L | 82.9 | Confident | 88.5 | Confident | 12 Ų | 12 | 58.5 Ų | 58.5 | 6% | 0.063 | 30% | 0.295 | C | S | . | . | trans | -93.6 | 132.5 | -178.8 | -72.5 | 170.3 | 0 | 0 | 0 | 111.7 | M166 L169 K173 Q176 V179 I213 L218 L225 | M166-L171 HydrophobicContact CG-CD1 4.33Å; L169-L171 HydrophobicContact CB-CD1 3.94Å; L169-L171 HydrophobicContact CB-CG 3.91Å; L169-L171 HydrophobicContact CD1-CD1 3.81Å; L169-L171 HydrophobicContact CD1-CG 4.45Å; L169-L171 PolarHBondContact O-N 3.27Å; L171-K173 PolarHBondContact O-N 2.94Å; L171-Q176 HydrophobicContact CB-CG 4.15Å; L171-Q176 PolarHBondContact O-NE2 3.35Å; L171-V179 HydrophobicContact CD1-CG1 4.26Å; L171-V179 HydrophobicContact CD1-CG2 4.49Å; L171-I213 HydrophobicContact CD1-CD1 4.11Å; L171-I213 HydrophobicContact CD2-CD1 4.25Å; L171-I213 HydrophobicContact CD2-CG1 4.38Å; L171-L218 HydrophobicContact CD2-CD1 4.45Å; L171-L225 HydrophobicContact CD2-CD1 3.82Å; L171-L225 HydrophobicContact CD2-CD2 4.19Å | ||
| 172 | P | 83.8 | Confident | 88.4 | Confident | 62 Ų | 62 | 61.8 Ų | 61.8 | 40% | 0.403 | 31% | 0.31 | S | S | . | . | trans | -56.8 | 135.8 | 171.1 | -23.8 | 33.8 | 0 | 0 | 0 | 111.4 | D174 K175 Q176 | P172-D174 PolarHBondContact O-N 3.49Å; P172-D174 VanDerWaalsContact O-N 3.15Å; P172-K175 HydrophobicContact CB-CD 4.46Å; P172-K175 HydrophobicContact CB-CG 4.42Å; P172-K175 HydrophobicContact CG-CD 4.24Å; P172-K175 PolarHBondContact O-N 3.02Å; P172-Q176 PolarHBondContact O-N 3.4Å | ||
| 173 | K | 83.9 | Confident | 88.5 | Confident | 175 Ų | 175 | 61.5 Ų | 61.5 | 76% | 0.761 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -53.1 | -39.5 | -177.6 | -69.6 | -173.4 | 177.5 | -176.7 | 0 | 112.6 | L171 K175 Q176 | L171-K173 PolarHBondContact O-N 2.94Å; K173-K175 PolarHBondContact O-N 2.59Å; K173-Q176 WeakPolarHBondContact O-CB 3.13Å; K173-Q176 PolarHBondContact O-N 2.83Å |
| 174 | D | 85.8 | Confident | 88.7 | Confident | 156 Ų | 156 | 57.4 Ų | 57.4 | 83% | 0.834 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -65.2 | -22.7 | -178.6 | -48.9 | -29.1 | 0 | 0 | 0 | 112.9 | P172 | P172-D174 PolarHBondContact O-N 3.49Å; P172-D174 VanDerWaalsContact O-N 3.15Å |
| 175 | K | 86.4 | Confident | 88.9 | Confident | 71 Ų | 71 | 61.2 Ų | 61.2 | 31% | 0.309 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -96.7 | -16.5 | 180 | -64.6 | -176.6 | 170.7 | -175.7 | 0 | 113.1 | P172 K173 A177 M178 V179 L218 | P172-K175 HydrophobicContact CB-CD 4.46Å; P172-K175 HydrophobicContact CB-CG 4.42Å; P172-K175 HydrophobicContact CG-CD 4.24Å; P172-K175 PolarHBondContact O-N 3.02Å; K173-K175 PolarHBondContact O-N 2.59Å; K175-A177 PolarHBondContact O-N 2.97Å; K175-M178 PolarHBondContact O-N 3.29Å; K175-V179 WeakPolarHBondContact O-CG2 3.24Å; K175-V179 PolarHBondContact O-N 3.41Å; K175-L218 HydrophobicContact CD-CD1 4.16Å; K175-L218 HydrophobicContact CD-CD2 3.47Å; K175-L218 VanDerWaalsContact CD-CD2 3.47Å; K175-L218 HydrophobicContact CD-CG 4.46Å |
| 176 | Q | 88 | Confident | 89 | Confident | 57 Ų | 57 | 62.2 Ų | 62.2 | 27% | 0.266 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.8 | -44.5 | -176.4 | -71.5 | 178.7 | 13.5 | 0 | 0 | 112.4 | M166 L171 P172 K173 M178 V179 C180 | M166-Q176 HydrophobicContact CE-CB 4.44Å; M166-Q176 HydrophobicContact CG-CB 4.47Å; M166-Q176 HydrophobicContact CG-CG 4.21Å; M166-Q176 HydrophobicContact SD-CB 3.77Å; M166-Q176 HydrophobicContact SD-CG 4.15Å; L171-Q176 HydrophobicContact CB-CG 4.15Å; L171-Q176 PolarHBondContact O-NE2 3.35Å; P172-Q176 PolarHBondContact O-N 3.4Å; K173-Q176 WeakPolarHBondContact O-CB 3.13Å; K173-Q176 PolarHBondContact O-N 2.83Å; Q176-M178 VanDerWaalsContact C-N 3.31Å; Q176-M178 PolarHBondContact O-N 3Å; Q176-V179 PolarHBondContact O-N 3.49Å; Q176-C180 VanDerWaalsContact O-CB 3.24Å; Q176-C180 WeakPolarHBondContact O-CB 3.49Å; Q176-C180 PolarHBondContact O-N 3.17Å |
| 177 | A | 89.4 | Confident | 89.3 | Confident | 76 Ų | 76 | 61.2 Ų | 61.2 | 63% | 0.628 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -61.8 | -39.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K175 K181 | K175-A177 PolarHBondContact O-N 2.97Å; A177-K181 PolarHBondContact O-N 3.19Å |
| 178 | M | 90.2 | Very high | 89.6 | Confident | 104 Ų | 104 | 58.4 Ų | 58.4 | 51% | 0.512 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -69.2 | -46.2 | 178.1 | -174 | -177.5 | -66 | 0 | 0 | 111.6 | K175 Q176 C180 K181 H182 L216 | K175-M178 PolarHBondContact O-N 3.29Å; Q176-M178 VanDerWaalsContact C-N 3.31Å; Q176-M178 PolarHBondContact O-N 3Å; M178-C180 VanDerWaalsContact C-N 3.35Å; M178-K181 PolarHBondContact O-N 2.7Å; M178-H182 PolarHBondContact O-N 2.99Å; M178-H182 VanDerWaalsContact O-N 3.08Å; M178-H182 PolarHBondContact O-ND1 3.09Å; M178-L216 HydrophobicContact CG-CD1 3.99Å; M178-L216 HydrophobicContact CG-CD2 4.35Å; M178-L216 HydrophobicContact SD-CD1 4.14Å; M178-L216 HydrophobicContact SD-CD2 3.84Å |
| 179 | V | 91.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.5 | -47.8 | 175.9 | 172.2 | 0 | 0 | 0 | 0 | 109.9 | L171 K175 Q176 K181 H182 T183 M209 I213 L216 L218 | L171-V179 HydrophobicContact CD1-CG1 4.26Å; L171-V179 HydrophobicContact CD1-CG2 4.49Å; K175-V179 WeakPolarHBondContact O-CG2 3.24Å; K175-V179 PolarHBondContact O-N 3.41Å; Q176-V179 PolarHBondContact O-N 3.49Å; V179-K181 VanDerWaalsContact C-N 3.34Å; V179-K181 PolarHBondContact O-N 2.88Å; V179-H182 PolarHBondContact O-N 3.36Å; V179-T183 WeakPolarHBondContact O-CB 3.33Å; V179-T183 PolarHBondContact O-N 2.92Å; V179-T183 PolarHBondContact O-OG1 3.2Å; V179-M209 HydrophobicContact CG1-CG 3.96Å; V179-M209 HydrophobicContact CG1-SD 4.45Å; V179-I213 HydrophobicContact CG1-CD1 4.4Å; V179-I213 HydrophobicContact CG1-CG1 3.9Å; V179-I213 HydrophobicContact CG2-CG1 4.26Å; V179-L216 HydrophobicContact CG2-CD1 4.03Å; V179-L218 HydrophobicContact CG2-CD1 3.73Å |
| 180 | C | 92.1 | Very high | 90.2 | Very high | 30 Ų | 30 | 56.4 Ų | 56.4 | 20% | 0.203 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -53.9 | -49.9 | 176.9 | -174.1 | 0 | 0 | 0 | 0 | 111.5 | M166 Q176 M178 H182 T183 L184 | M166-C180 HydrophobicContact CE-CB 4.1Å; M166-C180 HydrophobicContact SD-CB 4.16Å; Q176-C180 VanDerWaalsContact O-CB 3.24Å; Q176-C180 WeakPolarHBondContact O-CB 3.49Å; Q176-C180 PolarHBondContact O-N 3.17Å; M178-C180 VanDerWaalsContact C-N 3.35Å; C180-H182 PolarHBondContact O-N 2.95Å; C180-T183 WeakPolarHBondContact O-CB 3.44Å; C180-T183 PolarHBondContact O-N 3.45Å; C180-L184 WeakPolarHBondContact O-CD1 3.21Å; C180-L184 VanDerWaalsContact O-CG 3.31Å; C180-L184 WeakPolarHBondContact O-CG 3.2Å; C180-L184 PolarHBondContact O-N 2.89Å |
| 181 | K | 92.1 | Very high | 90.6 | Very high | 143 Ų | 143 | 54.7 Ų | 54.7 | 62% | 0.622 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -57.6 | -45.9 | 177.8 | -173.3 | -179.7 | 178.2 | -179.9 | 0 | 112.5 | A177 M178 V179 L184 T185 | A177-K181 PolarHBondContact O-N 3.19Å; M178-K181 PolarHBondContact O-N 2.7Å; V179-K181 VanDerWaalsContact C-N 3.34Å; V179-K181 PolarHBondContact O-N 2.88Å; K181-L184 PolarHBondContact O-N 3.08Å; K181-T185 PolarHBondContact O-N 3.35Å; K181-T185 VanDerWaalsContact O-N 3.13Å; K181-T185 PolarHBondContact O-OG1 2.78Å |
| 182 | H | 92.5 | Very high | 91 | Very high | 69 Ų | 69 | 55.3 Ų | 55.3 | 32% | 0.319 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -68.1 | -40.5 | 179.3 | -72.5 | 76.6 | 0 | 0 | 0 | 111.8 | M178 V179 C180 L184 T185 F186 A212 | M178-H182 PolarHBondContact O-N 2.99Å; M178-H182 VanDerWaalsContact O-N 3.08Å; M178-H182 PolarHBondContact O-ND1 3.09Å; V179-H182 PolarHBondContact O-N 3.36Å; C180-H182 PolarHBondContact O-N 2.95Å; H182-L184 VanDerWaalsContact C-N 3.31Å; H182-L184 PolarHBondContact O-N 3.36Å; H182-T185 WeakPolarHBondContact O-CB 3.39Å; H182-T185 PolarHBondContact O-N 3.19Å; H182-F186 HydrophobicContact CB-CE2 4.31Å; H182-F186 WeakPolarHBondContact O-CD2 3.16Å; H182-F186 PolarHBondContact O-N 2.91Å; H182-A212 HydrophobicContact CB-CB 3.72Å |
| 183 | T | 94.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -56.9 | -45.3 | 174.6 | -59.6 | 0 | 0 | 0 | 0 | 111.1 | I162 V179 C180 F186 I187 M209 | I162-T183 HydrophobicContact CD1-CG2 3.97Å; I162-T183 HydrophobicContact CG1-CG2 3.98Å; V179-T183 WeakPolarHBondContact O-CB 3.33Å; V179-T183 PolarHBondContact O-N 2.92Å; V179-T183 PolarHBondContact O-OG1 3.2Å; C180-T183 WeakPolarHBondContact O-CB 3.44Å; C180-T183 PolarHBondContact O-N 3.45Å; T183-F186 PolarHBondContact O-N 2.68Å; T183-I187 HydrophobicContact CG2-CD1 3.89Å; T183-I187 WeakPolarHBondContact O-CG1 3.28Å; T183-I187 PolarHBondContact O-N 3.21Å; T183-M209 HydrophobicContact CG2-CB 3.91Å; T183-M209 WeakPolarHBondContact OG1-CA 3.25Å |
| 184 | L | 94.5 | Very high | 91.3 | Very high | 20 Ų | 20 | 45.9 Ų | 45.9 | 11% | 0.105 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.5 | -42.6 | 177.5 | -71.3 | 156 | 0 | 0 | 0 | 112 | Q76 N159 I162 C180 K181 H182 F186 I187 A188 | Q76-L184 HydrophobicContact CB-CD2 4.27Å; N159-L184 HydrophobicContact CB-CD2 4.47Å; I162-L184 HydrophobicContact CD1-CD2 3.5Å; I162-L184 HydrophobicContact CD1-CG 3.79Å; C180-L184 WeakPolarHBondContact O-CD1 3.21Å; C180-L184 VanDerWaalsContact O-CG 3.31Å; C180-L184 WeakPolarHBondContact O-CG 3.2Å; C180-L184 PolarHBondContact O-N 2.89Å; K181-L184 PolarHBondContact O-N 3.08Å; H182-L184 VanDerWaalsContact C-N 3.31Å; H182-L184 PolarHBondContact O-N 3.36Å; L184-F186 VanDerWaalsContact C-N 3.34Å; L184-F186 PolarHBondContact O-N 2.81Å; L184-I187 PolarHBondContact O-N 2.97Å; L184-A188 WeakPolarHBondContact O-CB 3.29Å; L184-A188 PolarHBondContact O-N 2.9Å |
| 185 | T | 93.3 | Very high | 91.3 | Very high | 88 Ų | 88 | 46.7 Ų | 46.7 | 54% | 0.54 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.6 | -42.3 | 173.6 | -57.7 | 0 | 0 | 0 | 0 | 111.9 | K181 H182 A188 L189 | K181-T185 PolarHBondContact O-N 3.35Å; K181-T185 VanDerWaalsContact O-N 3.13Å; K181-T185 PolarHBondContact O-OG1 2.78Å; H182-T185 WeakPolarHBondContact O-CB 3.39Å; H182-T185 PolarHBondContact O-N 3.19Å; T185-A188 PolarHBondContact O-N 3.39Å; T185-L189 WeakPolarHBondContact O-CB 3.31Å; T185-L189 PolarHBondContact O-N 3.39Å |
| 186 | F | 94 | Very high | 91.1 | Very high | 22 Ų | 22 | 43.6 Ų | 43.6 | 10% | 0.096 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -66.5 | -39.6 | 175.9 | -71.7 | -51.7 | 0 | 0 | 0 | 112.5 | H182 T183 L184 A188 L189 C190 S208 A211 A212 I252 L256 | H182-F186 HydrophobicContact CB-CE2 4.31Å; H182-F186 WeakPolarHBondContact O-CD2 3.16Å; H182-F186 PolarHBondContact O-N 2.91Å; T183-F186 PolarHBondContact O-N 2.68Å; L184-F186 VanDerWaalsContact C-N 3.34Å; L184-F186 PolarHBondContact O-N 2.81Å; F186-A188 VanDerWaalsContact C-N 3.33Å; F186-A188 PolarHBondContact O-N 3.08Å; F186-L189 HydrophobicContact CD1-CD2 4.42Å; F186-L189 WeakPolarHBondContact O-CB 3.42Å; F186-L189 PolarHBondContact O-N 3.44Å; F186-C190 WeakPolarHBondContact O-CB 3.24Å; F186-C190 PolarHBondContact O-N 2.89Å; F186-C190 PolarHBondContact O-SG 2.98Å; F186-S208 WeakPolarHBondContact CD2-O 3.44Å; F186-A211 HydrophobicContact CD2-CB 4.36Å; F186-A211 HydrophobicContact CE2-CB 4.3Å; F186-A212 HydrophobicContact CD2-CB 3.99Å; F186-A212 HydrophobicContact CE2-CB 3.87Å; F186-I252 HydrophobicContact CB-CG2 4.27Å; F186-I252 HydrophobicContact CD1-CG2 4.02Å; F186-I252 HydrophobicContact CG-CG2 4.29Å; F186-L256 HydrophobicContact CE1-CB 4.44Å; F186-L256 HydrophobicContact CE1-CD1 3.94Å; F186-L256 HydrophobicContact CE1-CD2 3.68Å; F186-L256 HydrophobicContact CE1-CG 4.21Å; F186-L256 HydrophobicContact CZ-CD2 4.13Å |
| 187 | I | 95.4 | Very high | 90.9 | Very high | 2 Ų | 2 | 41.7 Ų | 41.7 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.4 | -45.6 | 174.9 | -72.1 | 162.2 | 0 | 0 | 0 | 110.6 | P80 P158 I162 T183 L184 L189 C190 A191 I204 | P80-I187 HydrophobicContact CB-CG2 4.4Å; P80-I187 HydrophobicContact CG-CG2 3.97Å; P158-I187 HydrophobicContact CB-CD1 3.83Å; P158-I187 HydrophobicContact CB-CG1 3.89Å; P158-I187 HydrophobicContact CB-CG2 3.79Å; P158-I187 HydrophobicContact CG-CG2 3.99Å; I162-I187 HydrophobicContact CD1-CD1 3.55Å; I162-I187 HydrophobicContact CG1-CD1 3.96Å; T183-I187 HydrophobicContact CG2-CD1 3.89Å; T183-I187 WeakPolarHBondContact O-CG1 3.28Å; T183-I187 PolarHBondContact O-N 3.21Å; L184-I187 PolarHBondContact O-N 2.97Å; I187-L189 VanDerWaalsContact C-N 3.33Å; I187-L189 PolarHBondContact O-N 3.44Å; I187-C190 WeakPolarHBondContact O-CB 3.47Å; I187-C190 PolarHBondContact O-N 3.47Å; I187-A191 WeakPolarHBondContact O-CB 3.47Å; I187-A191 PolarHBondContact O-N 2.9Å; I187-I204 HydrophobicContact CG1-CG2 4.25Å |
| 188 | A | 93.9 | Very high | 90.7 | Very high | 13 Ų | 13 | 41.8 Ų | 41.8 | 11% | 0.107 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.4 | -44.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | F79 L184 T185 F186 C190 A191 T192 | F79-A188 HydrophobicContact CD1-CB 4.16Å; F79-A188 HydrophobicContact CE1-CB 4.2Å; F79-A188 WeakPolarHBondContact CE1-O 3.46Å; L184-A188 WeakPolarHBondContact O-CB 3.29Å; L184-A188 PolarHBondContact O-N 2.9Å; T185-A188 PolarHBondContact O-N 3.39Å; F186-A188 VanDerWaalsContact C-N 3.33Å; F186-A188 PolarHBondContact O-N 3.08Å; A188-C190 PolarHBondContact O-N 3.23Å; A188-A191 WeakPolarHBondContact O-CB 3.44Å; A188-A191 PolarHBondContact O-N 3.25Å; A188-T192 PolarHBondContact O-N 2.94Å |
| 189 | L | 92.8 | Very high | 90.6 | Very high | 29 Ų | 29 | 38.5 Ų | 38.5 | 15% | 0.152 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.7 | -46.3 | 173.9 | -178.4 | 67.1 | 0 | 0 | 0 | 112.1 | T185 F186 I187 A191 T192 V255 L256 S259 | T185-L189 WeakPolarHBondContact O-CB 3.31Å; T185-L189 PolarHBondContact O-N 3.39Å; F186-L189 HydrophobicContact CD1-CD2 4.42Å; F186-L189 WeakPolarHBondContact O-CB 3.42Å; F186-L189 PolarHBondContact O-N 3.44Å; I187-L189 VanDerWaalsContact C-N 3.33Å; I187-L189 PolarHBondContact O-N 3.44Å; L189-A191 VanDerWaalsContact C-N 3.26Å; L189-A191 PolarHBondContact O-N 2.94Å; L189-T192 PolarHBondContact O-N 3.29Å; L189-T192 VanDerWaalsContact O-N 3.08Å; L189-T192 PolarHBondContact O-OG1 3.35Å; L189-V255 HydrophobicContact CD1-CG1 3.9Å; L189-V255 HydrophobicContact CD2-CG1 4.01Å; L189-V255 HydrophobicContact CG-CG1 3.7Å; L189-L256 HydrophobicContact CD2-CB 3.92Å; L189-L256 HydrophobicContact CD2-CD1 4.05Å; L189-S259 WeakPolarHBondContact CD1-OG 3.45Å |
| 190 | C | 93.3 | Very high | 90.7 | Very high | 4 Ų | 4 | 39.7 Ų | 39.7 | 3% | 0.027 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.2 | -41.2 | 176.9 | -65.9 | 0 | 0 | 0 | 0 | 111.6 | F186 I187 A188 T192 D193 L196 I204 I252 | F186-C190 WeakPolarHBondContact O-CB 3.24Å; F186-C190 PolarHBondContact O-N 2.89Å; F186-C190 PolarHBondContact O-SG 2.98Å; I187-C190 WeakPolarHBondContact O-CB 3.47Å; I187-C190 PolarHBondContact O-N 3.47Å; A188-C190 PolarHBondContact O-N 3.23Å; C190-T192 PolarHBondContact O-N 3.34Å; C190-D193 PolarHBondContact O-N 2.93Å; C190-D193 VanDerWaalsContact O-N 3.09Å; C190-L196 HydrophobicContact CB-CB 4.4Å; C190-L196 HydrophobicContact CB-CD1 3.79Å; C190-I204 HydrophobicContact CB-CD1 4.35Å; C190-I204 HydrophobicContact CB-CG2 3.88Å; C190-I252 WeakPolarHBondContact SG-CG1 3.4Å |
| 191 | A | 93.1 | Very high | 90.8 | Very high | 15 Ų | 15 | 38.7 Ų | 38.7 | 12% | 0.124 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -65.8 | -18.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | R58 F79 I83 I187 A188 L189 | R58-A191 VanDerWaalsContact CZ-O 3.25Å; R58-A191 PolarHBondContact NH1-O 3.3Å; R58-A191 PolarHBondContact NH2-O 2.98Å; F79-A191 HydrophobicContact CD1-CB 4.43Å; F79-A191 HydrophobicContact CE1-CB 3.73Å; F79-A191 HydrophobicContact CZ-CB 4.24Å; I83-A191 HydrophobicContact CB-CB 4.33Å; I83-A191 HydrophobicContact CG1-CB 4.11Å; I83-A191 HydrophobicContact CG2-CB 4.16Å; I187-A191 WeakPolarHBondContact O-CB 3.47Å; I187-A191 PolarHBondContact O-N 2.9Å; A188-A191 WeakPolarHBondContact O-CB 3.44Å; A188-A191 PolarHBondContact O-N 3.25Å; L189-A191 VanDerWaalsContact C-N 3.26Å; L189-A191 PolarHBondContact O-N 2.94Å |
| 192 | T | 91.2 | Very high | 90.9 | Very high | 25 Ų | 25 | 31.9 Ų | 31.9 | 15% | 0.153 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -81.5 | -24.8 | 172.9 | 70.9 | 0 | 0 | 0 | 0 | 113.9 | R58 A62 F79 A188 L189 C190 | R58-T192 PolarHBondContact NH1-O 3.26Å; A62-T192 HydrophobicContact CB-CG2 4.5Å; F79-T192 HydrophobicContact CZ-CG2 4.14Å; A188-T192 PolarHBondContact O-N 2.94Å; L189-T192 PolarHBondContact O-N 3.29Å; L189-T192 VanDerWaalsContact O-N 3.08Å; L189-T192 PolarHBondContact O-OG1 3.35Å; C190-T192 PolarHBondContact O-N 3.34Å |
| 193 | D | 89.6 | Confident | 91 | Very high | 12 Ų | 12 | 29.8 Ų | 29.8 | 6% | 0.064 | 16% | 0.156 | C | C | . | . | trans | -90 | 127.4 | -177.2 | -166.7 | -74 | 0 | 0 | 0 | 111.7 | C190 R195 L196 V255 | C190-D193 PolarHBondContact O-N 2.93Å; C190-D193 VanDerWaalsContact O-N 3.09Å; D193-R195 VanDerWaalsContact C-N 3.28Å; D193-R195 PolarHBondContact O-N 3.12Å; D193-R195 WeakPolarHBondContact OD1-CA 3.44Å; D193-R195 WeakPolarHBondContact OD1-CB 3.43Å; D193-R195 WeakPolarHBondContact OD1-CG 3.3Å; D193-R195 PolarHBondContact OD1-N 2.87Å; D193-L196 HydrophobicContact CB-CD1 4.22Å; D193-L196 PolarHBondContact O-N 2.96Å; D193-V255 HydrophobicContact CB-CG1 4.32Å; D193-V255 HydrophobicContact CB-CG2 4.19Å | ||
| 194 | D | 83.8 | Confident | 91 | Very high | 28 Ų | 28 | 30.2 Ų | 30.2 | 15% | 0.15 | 16% | 0.158 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -24.9 | -177.2 | 56.2 | -75.6 | 0 | 0 | 0 | 113.7 | F46 P55 R59 A197 | F46-D194 HydrophobicContact CE2-CB 4.01Å; F46-D194 HydrophobicContact CZ-CB 4.48Å; P55-D194 HydrophobicContact CB-CB 4.28Å; R59-D194 IonicContact CZ-OD1 3.91Å; R59-D194 IonicContact NH2-OD1 2.94Å; R59-D194 PolarHBondContact NH2-OD1 3.35Å; D194-A197 WeakPolarHBondContact O-CB 3.48Å |
| 195 | R | 84.8 | Confident | 91 | Very high | 173 Ų | 173 | 29.3 Ų | 29.3 | 65% | 0.653 | 15% | 0.153 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -26.3 | -178.1 | -54.6 | 169.1 | 177.1 | 177.9 | -1.5 | 111.8 | D193 | D193-R195 VanDerWaalsContact C-N 3.28Å; D193-R195 PolarHBondContact O-N 3.12Å; D193-R195 WeakPolarHBondContact OD1-CA 3.44Å; D193-R195 WeakPolarHBondContact OD1-CB 3.43Å; D193-R195 WeakPolarHBondContact OD1-CG 3.3Å; D193-R195 PolarHBondContact OD1-N 2.87Å |
| 196 | L | 83.8 | Confident | 91 | Very high | 5 Ų | 5 | 25.1 Ų | 25.1 | 3% | 0.026 | 13% | 0.128 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | -14.1 | 178 | -70.1 | 171.7 | 0 | 0 | 0 | 112.3 | C190 D193 M198 N199 I204 Q251 I252 V255 | C190-L196 HydrophobicContact CB-CB 4.4Å; C190-L196 HydrophobicContact CB-CD1 3.79Å; D193-L196 HydrophobicContact CB-CD1 4.22Å; D193-L196 PolarHBondContact O-N 2.96Å; L196-M198 PolarHBondContact O-N 3.19Å; L196-M198 VanDerWaalsContact O-N 3.15Å; L196-N199 VanDerWaalsContact CD2-ND2 3.29Å; L196-N199 WeakPolarHBondContact CD2-ND2 3.37Å; L196-N199 PolarHBondContact O-N 3.3Å; L196-N199 VanDerWaalsContact O-N 3.1Å; L196-I204 HydrophobicContact CB-CD1 4.06Å; L196-I204 HydrophobicContact CD2-CD1 3.97Å; L196-Q251 HydrophobicContact CD2-CB 4.25Å; L196-Q251 HydrophobicContact CD2-CG 3.77Å; L196-Q251 HydrophobicContact CG-CG 4.22Å; L196-I252 HydrophobicContact CD1-CG1 4.23Å; L196-V255 HydrophobicContact CD1-CG2 4.19Å |
| 197 | A | 82.9 | Confident | 91 | Very high | 18 Ų | 18 | 24.1 Ų | 24.1 | 15% | 0.149 | 12% | 0.123 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -19.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | D194 | D194-A197 WeakPolarHBondContact O-CB 3.48Š|
| 198 | M | 85.4 | Confident | 90.9 | Very high | 77 Ų | 77 | 24 Ų | 24 | 38% | 0.379 | 12% | 0.123 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92 | -8.5 | 178.5 | -66.3 | -62.3 | -52.5 | 0 | 0 | 113.6 | P41 L196 | P41-M198 HydrophobicContact CB-SD 4Å; P41-M198 HydrophobicContact CG-SD 4.3Å; P41-M198 WeakPolarHBondContact O-CE 3.44Å; L196-M198 PolarHBondContact O-N 3.19Å; L196-M198 VanDerWaalsContact O-N 3.15Å |
| 199 | N | 89.3 | Confident | 90.9 | Very high | 36 Ų | 36 | 23.4 Ų | 23.4 | 19% | 0.193 | 12% | 0.117 | C | C | . | . | S | Bend | trans | -80.6 | 141 | 179.2 | -69.2 | -30.2 | 0 | 0 | 0 | 110.4 | L40 L196 M203 I204 | L40-N199 WeakPolarHBondContact CD2-O 3.46Å; L196-N199 VanDerWaalsContact CD2-ND2 3.29Å; L196-N199 WeakPolarHBondContact CD2-ND2 3.37Å; L196-N199 PolarHBondContact O-N 3.3Å; L196-N199 VanDerWaalsContact O-N 3.1Å; N199-M203 HydrophobicContact CB-SD 4.27Å; N199-I204 HydrophobicContact CB-CD1 3.73Å; N199-I204 HydrophobicContact CB-CG1 3.97Å |
| 200 | P | 92.3 | Very high | 90.8 | Very high | 24 Ų | 24 | 22 Ų | 22 | 16% | 0.156 | 11% | 0.11 | C | C | . | . | trans | -51.4 | 140.7 | 171.6 | -26.5 | 32.9 | 0 | 0 | 0 | 112.6 | E36 L40 S202 M203 I204 | E36-P200 HydrophobicContact CG-CB 4.45Å; E36-P200 WeakPolarHBondContact OE2-CB 3.49Å; L40-P200 HydrophobicContact CD1-CB 4.48Å; L40-P200 HydrophobicContact CD1-CG 4.14Å; P200-S202 PolarHBondContact O-N 3.35Å; P200-M203 HydrophobicContact CB-CB 4.3Å; P200-M203 HydrophobicContact CG-CE 4.04Å; P200-M203 WeakPolarHBondContact O-CB 3.45Å; P200-M203 PolarHBondContact O-N 3.41Å; P200-I204 PolarHBondContact O-N 2.77Å | ||
| 201 | P | 94.1 | Very high | 90.6 | Very high | 9 Ų | 9 | 22 Ų | 22 | 6% | 0.058 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -52.3 | -36.9 | 175.9 | -28.6 | 34.4 | 0 | 0 | 0 | 114.4 | E36 V156 P158 F161 I204 A205 | E36-P201 HydrophobicContact CB-CG 4.39Å; E36-P201 WeakPolarHBondContact OE2-CD 3.3Å; V156-P201 WeakPolarHBondContact O-CG 3.31Å; P158-P201 HydrophobicContact CG-CB 4.07Å; F161-P201 HydrophobicContact CD2-CB 4.4Å; F161-P201 HydrophobicContact CE2-CB 3.96Å; P201-I204 PolarHBondContact O-N 3.23Å; P201-A205 WeakPolarHBondContact O-CB 3.39Å; P201-A205 PolarHBondContact O-N 3.35Å |
| 202 | S | 94.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.7 | -40.6 | 175.7 | 65.2 | 0 | 0 | 0 | 0 | 112.7 | E36 P200 A205 T206 | E36-S202 VanDerWaalsContact OE1-CB 3.29Å; E36-S202 WeakPolarHBondContact OE1-CB 3.39Å; E36-S202 PolarHBondContact OE1-OG 3.22Å; E36-S202 WeakPolarHBondContact OE2-CB 3.44Å; E36-S202 PolarHBondContact OE2-N 3Å; E36-S202 PolarHBondContact OE2-OG 3.34Å; P200-S202 PolarHBondContact O-N 3.35Å; S202-A205 PolarHBondContact O-N 2.94Å; S202-T206 WeakPolarHBondContact O-CB 3.29Å; S202-T206 WeakPolarHBondContact O-CG2 3.26Å; S202-T206 PolarHBondContact O-N 3Å; S202-T206 PolarHBondContact O-OG1 2.91Å |
| 203 | M | 93.5 | Very high | 90.4 | Very high | 25 Ų | 25 | 20.1 Ų | 20.1 | 12% | 0.123 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -67.8 | -41.5 | 176.8 | -166.3 | -174.7 | -56.6 | 0 | 0 | 111.7 | N199 P200 T206 G207 C244 C248 | N199-M203 HydrophobicContact CB-SD 4.27Å; P200-M203 HydrophobicContact CB-CB 4.3Å; P200-M203 HydrophobicContact CG-CE 4.04Å; P200-M203 WeakPolarHBondContact O-CB 3.45Å; P200-M203 PolarHBondContact O-N 3.41Å; M203-T206 WeakPolarHBondContact CA-OG1 3.48Å; M203-T206 PolarHBondContact O-OG1 3.43Å; M203-T206 VanDerWaalsContact O-OG1 3.06Å; M203-G207 PolarHBondContact O-N 2.95Å; M203-C244 HydrophobicContact CE-CB 4.43Å; M203-C248 HydrophobicContact CG-CB 4Å; M203-C248 HydrophobicContact SD-CB 4.14Å |
| 204 | I | 94.6 | Very high | 90.2 | Very high | 10 Ų | 10 | 20.5 Ų | 20.5 | 5% | 0.051 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63.6 | -42.6 | 174 | -64.7 | -60.8 | 0 | 0 | 0 | 110.8 | P158 I187 C190 L196 N199 P200 P201 S208 | P158-I204 HydrophobicContact CB-CB 4.3Å; P158-I204 HydrophobicContact CB-CG2 4.02Å; P158-I204 HydrophobicContact CG-CB 4.05Å; P158-I204 HydrophobicContact CG-CG2 3.84Å; I187-I204 HydrophobicContact CG1-CG2 4.25Å; C190-I204 HydrophobicContact CB-CD1 4.35Å; C190-I204 HydrophobicContact CB-CG2 3.88Å; L196-I204 HydrophobicContact CB-CD1 4.06Å; L196-I204 HydrophobicContact CD2-CD1 3.97Å; N199-I204 HydrophobicContact CB-CD1 3.73Å; N199-I204 HydrophobicContact CB-CG1 3.97Å; P200-I204 PolarHBondContact O-N 2.77Å; P201-I204 PolarHBondContact O-N 3.23Å; I204-S208 WeakPolarHBondContact O-CB 3.45Å; I204-S208 PolarHBondContact O-N 3.44Å; I204-S208 PolarHBondContact O-OG 3.39Å |
| 205 | A | 95 | Very high | 90.1 | Very high | 1 Ų | 1 | 22.1 Ų | 22.1 | 1% | 0.008 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -64.1 | -49.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | P158 F161 I165 P201 S202 M209 | P158-A205 HydrophobicContact CB-CB 4.11Å; P158-A205 VanDerWaalsContact O-CB 3.3Å; P158-A205 WeakPolarHBondContact O-CB 3.43Å; F161-A205 HydrophobicContact CB-CB 3.77Å; I165-A205 HydrophobicContact CD1-CB 4.09Å; P201-A205 WeakPolarHBondContact O-CB 3.39Å; P201-A205 PolarHBondContact O-N 3.35Å; S202-A205 PolarHBondContact O-N 2.94Å; A205-M209 WeakPolarHBondContact O-CB 3.49Å; A205-M209 PolarHBondContact O-N 2.89Å |
| 206 | T | 93.8 | Very high | 90 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -64.6 | -46.1 | 177.5 | 47.3 | 0 | 0 | 0 | 0 | 112.4 | I165 S202 M203 S208 M209 A210 L234 T238 L245 | I165-T206 HydrophobicContact CD1-CG2 3.56Å; I165-T206 HydrophobicContact CG1-CG2 4.37Å; S202-T206 WeakPolarHBondContact O-CB 3.29Å; S202-T206 WeakPolarHBondContact O-CG2 3.26Å; S202-T206 PolarHBondContact O-N 3Å; S202-T206 PolarHBondContact O-OG1 2.91Å; M203-T206 WeakPolarHBondContact CA-OG1 3.48Å; M203-T206 PolarHBondContact O-OG1 3.43Å; M203-T206 VanDerWaalsContact O-OG1 3.06Å; T206-S208 PolarHBondContact O-N 2.97Å; T206-M209 PolarHBondContact O-N 3.35Å; T206-A210 WeakPolarHBondContact O-CB 3.43Å; T206-A210 PolarHBondContact O-N 2.85Å; T206-L234 HydrophobicContact CG2-CB 4.27Å; T206-L234 HydrophobicContact CG2-CD2 4.29Å; T206-T238 HydrophobicContact CG2-CG2 3.38Å; T206-L245 WeakPolarHBondContact OG1-CD1 3.38Å |
| 207 | G | 93.1 | Very high | 89.4 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.1 | -42.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | M203 A210 A211 | M203-G207 PolarHBondContact O-N 2.95Å; G207-A210 PolarHBondContact O-N 2.85Å; G207-A211 WeakPolarHBondContact O-CB 3.4Å; G207-A211 PolarHBondContact O-N 3.11Å |
| 208 | S | 94.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.3 | -41.4 | 176 | -66 | 0 | 0 | 0 | 0 | 112 | F186 I204 T206 A212 | F186-S208 WeakPolarHBondContact CD2-O 3.44Å; I204-S208 WeakPolarHBondContact O-CB 3.45Å; I204-S208 PolarHBondContact O-N 3.44Å; I204-S208 PolarHBondContact O-OG 3.39Å; T206-S208 PolarHBondContact O-N 2.97Å; S208-A212 WeakPolarHBondContact O-CB 3.36Å; S208-A212 PolarHBondContact O-N 3.49Å |
| 209 | M | 92.7 | Very high | 87.2 | Confident | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -73.5 | -36 | 178.3 | -170 | 167.4 | 55.7 | 0 | 0 | 112.6 | I165 M166 L169 V179 T183 A205 T206 A212 I213 L234 | I165-M209 HydrophobicContact CB-CE 3.44Å; I165-M209 VanDerWaalsContact CB-CE 3.44Å; I165-M209 HydrophobicContact CD1-CE 4.25Å; I165-M209 HydrophobicContact CG1-CE 4.46Å; I165-M209 HydrophobicContact CG2-CE 3.15Å; M166-M209 HydrophobicContact CB-SD 4.39Å; L169-M209 HydrophobicContact CD1-CE 3.47Å; L169-M209 VanDerWaalsContact CD1-CE 3.47Å; L169-M209 HydrophobicContact CD1-CG 4.41Å; L169-M209 HydrophobicContact CD1-SD 3.75Å; L169-M209 HydrophobicContact CG-CE 4.41Å; V179-M209 HydrophobicContact CG1-CG 3.96Å; V179-M209 HydrophobicContact CG1-SD 4.45Å; T183-M209 HydrophobicContact CG2-CB 3.91Å; T183-M209 WeakPolarHBondContact OG1-CA 3.25Å; A205-M209 WeakPolarHBondContact O-CB 3.49Å; A205-M209 PolarHBondContact O-N 2.89Å; T206-M209 PolarHBondContact O-N 3.35Å; M209-A212 PolarHBondContact O-N 2.75Å; M209-I213 HydrophobicContact CG-CD1 3.93Å; M209-I213 HydrophobicContact CG-CG1 4.46Å; M209-I213 VanDerWaalsContact O-CG1 3.27Å; M209-I213 WeakPolarHBondContact O-CG1 3.31Å; M209-I213 PolarHBondContact O-N 3.32Å; M209-L234 HydrophobicContact CE-CD2 3.61Å |
| 210 | A | 91.1 | Very high | 85.7 | Confident | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.6 | -49.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | T206 G207 A212 I213 C214 L234 Q249 | T206-A210 WeakPolarHBondContact O-CB 3.43Å; T206-A210 PolarHBondContact O-N 2.85Å; G207-A210 PolarHBondContact O-N 2.85Å; A210-A212 VanDerWaalsContact C-N 3.3Å; A210-A212 PolarHBondContact O-N 3.29Å; A210-I213 PolarHBondContact O-N 2.85Å; A210-C214 WeakPolarHBondContact O-CB 3.37Å; A210-C214 PolarHBondContact O-N 2.9Å; A210-C214 PolarHBondContact O-SG 3.4Å; A210-L234 HydrophobicContact CB-CD1 3.68Å; A210-Q249 HydrophobicContact CB-CG 4.37Å |
| 211 | A | 90.6 | Very high | 84 | Confident | 4 Ų | 4 | 28.4 Ų | 28.4 | 3% | 0.033 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -59.4 | -39.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F186 G207 G215 Q249 I252 E253 | F186-A211 HydrophobicContact CD2-CB 4.36Å; F186-A211 HydrophobicContact CE2-CB 4.3Å; G207-A211 WeakPolarHBondContact O-CB 3.4Å; G207-A211 PolarHBondContact O-N 3.11Å; A211-G215 PolarHBondContact O-N 3.38Å; A211-Q249 HydrophobicContact CB-CG 4.42Å; A211-I252 HydrophobicContact CB-CG2 4.36Å; A211-E253 HydrophobicContact CB-CG 4.4Å |
| 212 | A | 91.3 | Very high | 82.5 | Confident | 1 Ų | 1 | 30.8 Ų | 30.8 | 1% | 0.008 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.1 | -45.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | H182 F186 S208 M209 A210 G215 L216 | H182-A212 HydrophobicContact CB-CB 3.72Å; F186-A212 HydrophobicContact CD2-CB 3.99Å; F186-A212 HydrophobicContact CE2-CB 3.87Å; S208-A212 WeakPolarHBondContact O-CB 3.36Å; S208-A212 PolarHBondContact O-N 3.49Å; M209-A212 PolarHBondContact O-N 2.75Å; A210-A212 VanDerWaalsContact C-N 3.3Å; A210-A212 PolarHBondContact O-N 3.29Å; A212-G215 PolarHBondContact O-N 3.32Å; A212-L216 WeakPolarHBondContact O-CB 3.4Å; A212-L216 VanDerWaalsContact O-CG 3.23Å; A212-L216 WeakPolarHBondContact O-CG 3.36Å; A212-L216 PolarHBondContact O-N 2.97Å |
| 213 | I | 88 | Confident | 80.9 | Confident | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -67.5 | -41.8 | -178.8 | -66.6 | 166 | 0 | 0 | 0 | 110.6 | L169 L171 V179 M209 A210 L218 L230 | L169-I213 HydrophobicContact CD1-CD1 3.74Å; L171-I213 HydrophobicContact CD1-CD1 4.11Å; L171-I213 HydrophobicContact CD2-CD1 4.25Å; L171-I213 HydrophobicContact CD2-CG1 4.38Å; V179-I213 HydrophobicContact CG1-CD1 4.4Å; V179-I213 HydrophobicContact CG1-CG1 3.9Å; V179-I213 HydrophobicContact CG2-CG1 4.26Å; M209-I213 HydrophobicContact CG-CD1 3.93Å; M209-I213 HydrophobicContact CG-CG1 4.46Å; M209-I213 VanDerWaalsContact O-CG1 3.27Å; M209-I213 WeakPolarHBondContact O-CG1 3.31Å; M209-I213 PolarHBondContact O-N 3.32Å; A210-I213 PolarHBondContact O-N 2.85Å; I213-L218 HydrophobicContact CG2-CB 3.93Å; I213-L218 PolarHBondContact O-N 3.38Å; I213-L230 HydrophobicContact CB-CD2 3.79Å; I213-L230 HydrophobicContact CD1-CD1 3.99Å; I213-L230 HydrophobicContact CD1-CD2 3.97Å; I213-L230 HydrophobicContact CG1-CD2 4.49Å; I213-L230 HydrophobicContact CG2-CD2 3.66Å |
| 214 | C | 85.2 | Confident | 79.4 | Confident | 19 Ų | 19 | 46.2 Ų | 46.2 | 13% | 0.128 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.3 | -46 | 174.8 | -70.4 | 0 | 0 | 0 | 0 | 112.1 | A210 L216 Q217 | A210-C214 WeakPolarHBondContact O-CB 3.37Å; A210-C214 PolarHBondContact O-N 2.9Å; A210-C214 PolarHBondContact O-SG 3.4Å; C214-L216 VanDerWaalsContact C-N 3.26Å; C214-L216 PolarHBondContact O-N 2.96Å; C214-Q217 PolarHBondContact O-N 3.44Å |
| 215 | G | 82.4 | Confident | 78.1 | Confident | 63 Ų | 63 | 45.9 Ų | 45.9 | 65% | 0.649 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -63.1 | -30.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | A211 A212 Q217 | A211-G215 PolarHBondContact O-N 3.38Å; A212-G215 PolarHBondContact O-N 3.32Å; G215-Q217 PolarHBondContact O-N 3.25Å |
| 216 | L | 81.1 | Confident | 77.2 | Confident | 47 Ų | 47 | 48 Ų | 48 | 25% | 0.246 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | 5.2 | 175 | -69.1 | 172.9 | 0 | 0 | 0 | 113.8 | M178 V179 A212 C214 L218 | M178-L216 HydrophobicContact CG-CD1 3.99Å; M178-L216 HydrophobicContact CG-CD2 4.35Å; M178-L216 HydrophobicContact SD-CD1 4.14Å; M178-L216 HydrophobicContact SD-CD2 3.84Å; V179-L216 HydrophobicContact CG2-CD1 4.03Å; A212-L216 WeakPolarHBondContact O-CB 3.4Å; A212-L216 VanDerWaalsContact O-CG 3.23Å; A212-L216 WeakPolarHBondContact O-CG 3.36Å; A212-L216 PolarHBondContact O-N 2.97Å; C214-L216 VanDerWaalsContact C-N 3.26Å; C214-L216 PolarHBondContact O-N 2.96Å; L216-L218 HydrophobicContact CB-CD1 4.14Å; L216-L218 HydrophobicContact CB-CD2 4.47Å; L216-L218 HydrophobicContact CB-CG 3.79Å; L216-L218 HydrophobicContact CD1-CD1 4.38Å; L216-L218 PolarHBondContact O-N 2.91Å; L216-L218 VanDerWaalsContact O-N 3.13Å |
| 217 | Q | 72.9 | Confident | 76.3 | Confident | 131 Ų | 131 | 53 Ų | 53 | 61% | 0.612 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.8 | 28.3 | -179.5 | -62.5 | -179 | -18.7 | 0 | 0 | 113.6 | C214 G215 D219 H220 | C214-Q217 PolarHBondContact O-N 3.44Å; G215-Q217 PolarHBondContact O-N 3.25Å; Q217-D219 VanDerWaalsContact CA-OD1 3.26Å; Q217-D219 WeakPolarHBondContact CA-OD1 3.29Å; Q217-D219 PolarHBondContact O-N 3.25Å; Q217-H220 PolarHBondContact O-N 3.03Å |
| 218 | L | 62.6 | Low | 75.6 | Confident | 12 Ų | 12 | 56.9 Ų | 56.9 | 6% | 0.063 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -19.2 | 177.9 | -60.1 | -175.1 | 0 | 0 | 0 | 112 | L171 K175 V179 I213 L216 H220 S221 | L171-L218 HydrophobicContact CD2-CD1 4.45Å; K175-L218 HydrophobicContact CD-CD1 4.16Å; K175-L218 HydrophobicContact CD-CD2 3.47Å; K175-L218 VanDerWaalsContact CD-CD2 3.47Å; K175-L218 HydrophobicContact CD-CG 4.46Å; V179-L218 HydrophobicContact CG2-CD1 3.73Å; I213-L218 HydrophobicContact CG2-CB 3.93Å; I213-L218 PolarHBondContact O-N 3.38Å; L216-L218 HydrophobicContact CB-CD1 4.14Å; L216-L218 HydrophobicContact CB-CD2 4.47Å; L216-L218 HydrophobicContact CB-CG 3.79Å; L216-L218 HydrophobicContact CD1-CD1 4.38Å; L216-L218 PolarHBondContact O-N 2.91Å; L216-L218 VanDerWaalsContact O-N 3.13Å; L218-H220 VanDerWaalsContact C-N 3.33Å; L218-S221 PolarHBondContact O-N 3.44Å |
| 219 | D | 58.1 | Low | 74.9 | Confident | 34 Ų | 34 | 60.8 Ų | 60.8 | 18% | 0.182 | 32% | 0.316 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -29.8 | 172.7 | 63.2 | -23.1 | 0 | 0 | 0 | 113.6 | Q217 L225 | Q217-D219 VanDerWaalsContact CA-OD1 3.26Å; Q217-D219 WeakPolarHBondContact CA-OD1 3.29Å; Q217-D219 PolarHBondContact O-N 3.25Å; D219-L225 WeakPolarHBondContact CA-O 3.48Å; D219-L225 WeakPolarHBondContact CB-O 3.38Å |
| 220 | H | 57.6 | Low | 74.6 | Confident | 152 Ų | 152 | 60.8 Ų | 60.8 | 70% | 0.704 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.3 | -21.9 | 176.5 | -68.7 | -55.8 | 0 | 0 | 0 | 113.6 | Q217 L218 | Q217-H220 PolarHBondContact O-N 3.03Å; L218-H220 VanDerWaalsContact C-N 3.33Å |
| 221 | S | 57.9 | Low | 74.3 | Confident | 88 Ų | 88 | 60.9 Ų | 60.9 | 62% | 0.615 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -29.2 | -175.7 | -54.9 | 0 | 0 | 0 | 0 | 113 | L218 | L218-S221 PolarHBondContact O-N 3.44Š|
| 222 | D | 62 | Low | 74.2 | Confident | 59 Ų | 59 | 63.5 Ų | 63.5 | 32% | 0.316 | 33% | 0.33 | S | S | . | . | trans | -141.3 | 118.4 | -175.7 | -163 | -25.7 | 0 | 0 | 0 | 110.3 | R224 L225 | D222-R224 PolarHBondContact O-N 3.37Å; D222-R224 WeakPolarHBondContact OD1-CB 3.4Å; D222-R224 PolarHBondContact OD1-N 3.39Å; D222-L225 HydrophobicContact CB-CD1 4.29Å; D222-L225 PolarHBondContact O-N 2.81Å | ||
| 223 | Q | 61.7 | Low | 74 | Confident | 170 Ų | 170 | 66 Ų | 66 | 79% | 0.794 | 34% | 0.343 | S | S | * | . | G | 310 helix | trans | -61.6 | -19.1 | -177.4 | -161 | 162.1 | 13.5 | 0 | 0 | 112.8 | L225 S226 N229 | Q223-L225 VanDerWaalsContact C-N 3.3Å; Q223-S226 WeakPolarHBondContact O-CB 3.37Å; Q223-S226 PolarHBondContact O-N 3.03Å; Q223-N229 PolarHBondContact O-ND2 2.92Å; Q223-N229 VanDerWaalsContact O-ND2 3.15Å |
| 224 | R | 62 | Low | 74 | Confident | 179 Ų | 179 | 66 Ų | 66 | 68% | 0.675 | 34% | 0.343 | S | S | * | . | G | 310 helix | trans | -72.7 | -21.6 | 173.5 | -63.3 | 176.1 | 178.8 | 178.2 | 0.9 | 113.5 | P170 D222 | P170-R224 HydrophobicContact CG-CB 4.47Å; D222-R224 PolarHBondContact O-N 3.37Å; D222-R224 WeakPolarHBondContact OD1-CB 3.4Å; D222-R224 PolarHBondContact OD1-N 3.39Å |
| 225 | L | 67.3 | Low | 74.3 | Confident | 4 Ų | 4 | 65.3 Ų | 65.3 | 2% | 0.021 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -102.9 | 12 | 175.9 | -64 | 171 | 0 | 0 | 0 | 111.9 | P170 L171 D219 D222 Q223 R227 L230 | P170-L225 HydrophobicContact CG-CD2 4.11Å; L171-L225 HydrophobicContact CD2-CD1 3.82Å; L171-L225 HydrophobicContact CD2-CD2 4.19Å; D219-L225 WeakPolarHBondContact CA-O 3.48Å; D219-L225 WeakPolarHBondContact CB-O 3.38Å; D222-L225 HydrophobicContact CB-CD1 4.29Å; D222-L225 PolarHBondContact O-N 2.81Å; Q223-L225 VanDerWaalsContact C-N 3.3Å; L225-R227 PolarHBondContact O-N 3.16Å; L225-L230 HydrophobicContact CD2-CD1 4.21Å |
| 226 | S | 74.6 | Confident | 74.6 | Confident | 45 Ų | 45 | 70.1 Ų | 70.1 | 32% | 0.315 | 34% | 0.342 | S | S | . | . | trans | -51.3 | 138.3 | 169.9 | -177.5 | 0 | 0 | 0 | 0 | 109.5 | Q223 D228 N229 L230 | Q223-S226 WeakPolarHBondContact O-CB 3.37Å; Q223-S226 PolarHBondContact O-N 3.03Å; S226-D228 PolarHBondContact O-N 3.49Å; S226-D228 VanDerWaalsContact O-N 3.08Å; S226-N229 WeakPolarHBondContact O-CB 3.41Å; S226-N229 PolarHBondContact O-N 3.38Å; S226-L230 PolarHBondContact O-N 3.28Å | ||
| 227 | R | 74.9 | Confident | 74.9 | Confident | 104 Ų | 104 | 69 Ų | 69 | 39% | 0.392 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -45.7 | -46.9 | -170.9 | -168.2 | 171.6 | 71.7 | 108.7 | 7.5 | 113.2 | L225 L230 T231 | L225-R227 PolarHBondContact O-N 3.16Å; R227-L230 PolarHBondContact O-N 3Å; R227-T231 PolarHBondContact O-N 3.25Å; R227-T231 PolarHBondContact O-OG1 3.18Å |
| 228 | D | 78.3 | Confident | 75.6 | Confident | 82 Ų | 82 | 63 Ų | 63 | 44% | 0.439 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -68 | -43.9 | -178.8 | -60.7 | -32.8 | 0 | 0 | 0 | 112.3 | S226 L230 T231 D232 | S226-D228 PolarHBondContact O-N 3.49Å; S226-D228 VanDerWaalsContact O-N 3.08Å; D228-L230 VanDerWaalsContact C-N 3.3Å; D228-L230 PolarHBondContact O-N 3.37Å; D228-T231 PolarHBondContact O-N 2.97Å; D228-D232 PolarHBondContact O-N 3.42Å |
| 229 | N | 81.7 | Confident | 76.8 | Confident | 82 Ų | 82 | 69.3 Ų | 69.3 | 44% | 0.439 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -64.1 | -36.5 | 176.6 | -69.7 | -21 | 0 | 0 | 0 | 112.1 | Q223 S226 L233 | Q223-N229 PolarHBondContact O-ND2 2.92Å; Q223-N229 VanDerWaalsContact O-ND2 3.15Å; S226-N229 WeakPolarHBondContact O-CB 3.41Å; S226-N229 PolarHBondContact O-N 3.38Å; N229-L233 VanDerWaalsContact O-CB 3.32Å; N229-L233 WeakPolarHBondContact O-CB 3.26Å; N229-L233 PolarHBondContact O-N 3.16Å |
| 230 | L | 84.9 | Confident | 78.2 | Confident | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.005 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -68.2 | -47.9 | 178.2 | 178.7 | 64 | 0 | 0 | 0 | 110.9 | L169 I213 L225 S226 R227 D228 D232 L233 L234 | L169-L230 HydrophobicContact CD1-CD1 4.43Å; L169-L230 HydrophobicContact CD2-CD1 3.89Å; I213-L230 HydrophobicContact CB-CD2 3.79Å; I213-L230 HydrophobicContact CD1-CD1 3.99Å; I213-L230 HydrophobicContact CD1-CD2 3.97Å; I213-L230 HydrophobicContact CG1-CD2 4.49Å; I213-L230 HydrophobicContact CG2-CD2 3.66Å; L225-L230 HydrophobicContact CD2-CD1 4.21Å; S226-L230 PolarHBondContact O-N 3.28Å; R227-L230 PolarHBondContact O-N 3Å; D228-L230 VanDerWaalsContact C-N 3.3Å; D228-L230 PolarHBondContact O-N 3.37Å; L230-D232 VanDerWaalsContact C-N 3.29Å; L230-D232 PolarHBondContact O-N 3.02Å; L230-L233 PolarHBondContact O-N 3.09Å; L230-L234 HydrophobicContact CD1-CD1 4.03Å; L230-L234 HydrophobicContact CD1-CG 4.11Å; L230-L234 HydrophobicContact CG-CD1 3.88Å; L230-L234 HydrophobicContact CG-CG 4.37Å; L230-L234 WeakPolarHBondContact O-CB 3.49Å; L230-L234 VanDerWaalsContact O-CG 3.22Å; L230-L234 WeakPolarHBondContact O-CG 3.48Å; L230-L234 PolarHBondContact O-N 3.46Å |
| 231 | T | 85.8 | Confident | 79.7 | Confident | 2 Ų | 2 | 68.6 Ų | 68.6 | 1% | 0.012 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.4 | -42.9 | 176.3 | -50 | 0 | 0 | 0 | 0 | 110.7 | R227 D228 L233 L234 A235 V242 L245 R246 | R227-T231 PolarHBondContact O-N 3.25Å; R227-T231 PolarHBondContact O-OG1 3.18Å; D228-T231 PolarHBondContact O-N 2.97Å; T231-L233 PolarHBondContact O-N 3.11Å; T231-L234 PolarHBondContact O-N 3.43Å; T231-A235 WeakPolarHBondContact O-CB 3.16Å; T231-A235 PolarHBondContact O-N 3.01Å; T231-V242 HydrophobicContact CG2-CG1 3.86Å; T231-L245 HydrophobicContact CG2-CB 4.19Å; T231-L245 HydrophobicContact CG2-CD2 3.72Å; T231-L245 HydrophobicContact CG2-CG 3.91Å; T231-L245 WeakPolarHBondContact O-CD2 2.81Å; T231-R246 HydrophobicContact CG2-CB 4.48Å |
| 232 | D | 87.1 | Confident | 81.3 | Confident | 59 Ų | 59 | 66.4 Ų | 66.4 | 32% | 0.316 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 176.6 | -75.1 | -15.2 | 0 | 0 | 0 | 112.8 | D228 L230 K236 V242 | D228-D232 PolarHBondContact O-N 3.42Å; L230-D232 VanDerWaalsContact C-N 3.29Å; L230-D232 PolarHBondContact O-N 3.02Å; D232-K236 WeakPolarHBondContact O-CD 3.46Å; D232-K236 VanDerWaalsContact O-CG 3.22Å; D232-K236 WeakPolarHBondContact O-CG 3.38Å; D232-K236 PolarHBondContact O-N 3.26Å; D232-K236 VanDerWaalsContact O-N 3.09Å; D232-V242 WeakPolarHBondContact OD1-CG1 3.46Å |
| 233 | L | 87.6 | Confident | 82.5 | Confident | 53 Ų | 53 | 68.9 Ų | 68.9 | 28% | 0.277 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -67.7 | -45.1 | 178.2 | -179.5 | 60.8 | 0 | 0 | 0 | 111.4 | L169 N229 L230 T231 K236 I237 | L169-L233 HydrophobicContact CD2-CD2 3.56Å; L169-L233 HydrophobicContact CD2-CG 4.08Å; N229-L233 VanDerWaalsContact O-CB 3.32Å; N229-L233 WeakPolarHBondContact O-CB 3.26Å; N229-L233 PolarHBondContact O-N 3.16Å; L230-L233 PolarHBondContact O-N 3.09Å; T231-L233 PolarHBondContact O-N 3.11Å; L233-K236 PolarHBondContact O-N 3Å; L233-I237 HydrophobicContact CD1-CD1 4.36Å; L233-I237 HydrophobicContact CG-CD1 4.09Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.38Å; L233-I237 PolarHBondContact O-N 3.31Å |
| 234 | L | 89.1 | Confident | 83.8 | Confident | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 177.3 | -69.7 | 172.4 | 0 | 0 | 0 | 111.2 | I165 L169 T206 M209 A210 L230 T231 K236 I237 T238 L245 | I165-L234 HydrophobicContact CG2-CD2 3.38Å; L169-L234 HydrophobicContact CD1-CD2 4.23Å; L169-L234 HydrophobicContact CD2-CD2 3.96Å; L169-L234 HydrophobicContact CG-CD2 4.49Å; T206-L234 HydrophobicContact CG2-CB 4.27Å; T206-L234 HydrophobicContact CG2-CD2 4.29Å; M209-L234 HydrophobicContact CE-CD2 3.61Å; A210-L234 HydrophobicContact CB-CD1 3.68Å; L230-L234 HydrophobicContact CD1-CD1 4.03Å; L230-L234 HydrophobicContact CD1-CG 4.11Å; L230-L234 HydrophobicContact CG-CD1 3.88Å; L230-L234 HydrophobicContact CG-CG 4.37Å; L230-L234 WeakPolarHBondContact O-CB 3.49Å; L230-L234 VanDerWaalsContact O-CG 3.22Å; L230-L234 WeakPolarHBondContact O-CG 3.48Å; L230-L234 PolarHBondContact O-N 3.46Å; T231-L234 PolarHBondContact O-N 3.43Å; L234-K236 VanDerWaalsContact C-N 3.28Å; L234-K236 PolarHBondContact O-N 3.38Å; L234-I237 PolarHBondContact O-N 3.04Å; L234-T238 PolarHBondContact O-N 3.43Å; L234-T238 VanDerWaalsContact O-N 3.08Å; L234-T238 PolarHBondContact O-OG1 3.41Å; L234-L245 HydrophobicContact CB-CD2 3.59Å; L234-L245 HydrophobicContact CD1-CD2 4.48Å |
| 235 | A | 90.5 | Very high | 85.2 | Confident | 5 Ų | 5 | 54.8 Ų | 54.8 | 4% | 0.041 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -56.5 | -40.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | T231 N239 T240 V242 L245 | T231-A235 WeakPolarHBondContact O-CB 3.16Å; T231-A235 PolarHBondContact O-N 3.01Å; A235-N239 VanDerWaalsContact O-CA 3.3Å; A235-N239 WeakPolarHBondContact O-CA 3.35Å; A235-N239 PolarHBondContact O-N 3.05Å; A235-T240 VanDerWaalsContact CB-O 3.29Å; A235-T240 WeakPolarHBondContact CB-O 3.46Å; A235-T240 PolarHBondContact O-N 3.48Å; A235-V242 HydrophobicContact CB-CB 4.46Å; A235-V242 HydrophobicContact CB-CG2 3.65Å; A235-L245 HydrophobicContact CB-CD2 4.28Å |
| 236 | K | 89.7 | Confident | 86.2 | Confident | 164 Ų | 164 | 57.6 Ų | 57.6 | 71% | 0.713 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -66.9 | -36.6 | 174.7 | -73.5 | 166.9 | -171.8 | 169.1 | 0 | 113 | D232 L233 L234 | D232-K236 WeakPolarHBondContact O-CD 3.46Å; D232-K236 VanDerWaalsContact O-CG 3.22Å; D232-K236 WeakPolarHBondContact O-CG 3.38Å; D232-K236 PolarHBondContact O-N 3.26Å; D232-K236 VanDerWaalsContact O-N 3.09Å; L233-K236 PolarHBondContact O-N 3Å; L234-K236 VanDerWaalsContact C-N 3.28Å; L234-K236 PolarHBondContact O-N 3.38Å |
| 237 | I | 87.8 | Confident | 86.9 | Confident | 23 Ų | 23 | 57.9 Ų | 57.9 | 12% | 0.118 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.8 | -43.4 | -179 | -68.7 | 161.5 | 0 | 0 | 0 | 111.1 | L29 I165 R168 L169 L233 L234 | L29-I237 HydrophobicContact CD2-CG2 3.95Å; I165-I237 HydrophobicContact CG1-CG2 4.28Å; I165-I237 HydrophobicContact CG2-CD1 3.93Å; I165-I237 HydrophobicContact CG2-CG2 4.16Å; R168-I237 HydrophobicContact CB-CD1 3.7Å; R168-I237 HydrophobicContact CB-CG1 4.2Å; L169-I237 HydrophobicContact CD2-CD1 4.3Å; L233-I237 HydrophobicContact CD1-CD1 4.36Å; L233-I237 HydrophobicContact CG-CD1 4.09Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.38Å; L233-I237 PolarHBondContact O-N 3.31Å; L234-I237 PolarHBondContact O-N 3.04Å |
| 238 | T | 87.5 | Confident | 87.7 | Confident | 6 Ų | 6 | 53.1 Ų | 53.1 | 4% | 0.037 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -93.6 | -0.8 | -178.1 | 47.8 | 0 | 0 | 0 | 0 | 113.9 | L33 I165 T206 L234 T240 | L33-T238 HydrophobicContact CD2-CG2 4.33Å; I165-T238 HydrophobicContact CD1-CG2 4.42Å; T206-T238 HydrophobicContact CG2-CG2 3.38Å; L234-T238 PolarHBondContact O-N 3.43Å; L234-T238 VanDerWaalsContact O-N 3.08Å; L234-T238 PolarHBondContact O-OG1 3.41Å; T238-T240 PolarHBondContact O-N 3.14Å; T238-T240 PolarHBondContact OG1-OG1 3.13Å |
| 239 | N | 87.6 | Confident | 88.2 | Confident | 144 Ų | 144 | 49.3 Ų | 49.3 | 77% | 0.77 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.7 | 41.9 | -173.9 | -168.4 | 51.4 | 0 | 0 | 0 | 112.5 | A235 | A235-N239 VanDerWaalsContact O-CA 3.3Å; A235-N239 WeakPolarHBondContact O-CA 3.35Å; A235-N239 PolarHBondContact O-N 3.05Å |
| 240 | T | 87.8 | Confident | 88.6 | Confident | 28 Ų | 28 | 48.7 Ų | 48.7 | 17% | 0.172 | 26% | 0.255 | C | S | . | . | trans | -107.4 | 151.2 | 179.4 | 51.9 | 0 | 0 | 0 | 0 | 110.8 | A235 T238 | A235-T240 VanDerWaalsContact CB-O 3.29Å; A235-T240 WeakPolarHBondContact CB-O 3.46Å; A235-T240 PolarHBondContact O-N 3.48Å; T238-T240 PolarHBondContact O-N 3.14Å; T238-T240 PolarHBondContact OG1-OG1 3.13Å | ||
| 241 | E | 89 | Confident | 88.9 | Confident | 143 Ų | 143 | 50.8 Ų | 50.8 | 67% | 0.668 | 27% | 0.265 | S | S | * | . | trans | -66.2 | 135.4 | 174.8 | -63.7 | -176.4 | 179.5 | 0 | 0 | 111.4 | D243 C244 L245 | E241-D243 VanDerWaalsContact C-N 3.27Å; E241-D243 PolarHBondContact O-N 3.49Å; E241-C244 HydrophobicContact CB-CB 4.27Å; E241-C244 PolarHBondContact O-N 3.05Å; E241-L245 PolarHBondContact O-N 3.49Å | ||
| 242 | V | 89.7 | Confident | 89.1 | Confident | 41 Ų | 41 | 50.7 Ų | 50.7 | 25% | 0.248 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.4 | -39.6 | -177.2 | 178.9 | 0 | 0 | 0 | 0 | 111.4 | T231 D232 A235 L245 R246 | T231-V242 HydrophobicContact CG2-CG1 3.86Å; D232-V242 WeakPolarHBondContact OD1-CG1 3.46Å; A235-V242 HydrophobicContact CB-CB 4.46Å; A235-V242 HydrophobicContact CB-CG2 3.65Å; V242-L245 PolarHBondContact O-N 3.49Å; V242-R246 WeakPolarHBondContact O-CB 3.22Å; V242-R246 PolarHBondContact O-N 2.94Å |
| 243 | D | 89.1 | Confident | 89.2 | Confident | 112 Ų | 112 | 51.5 Ų | 51.5 | 60% | 0.599 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -69.9 | -38.3 | -178.5 | -65.4 | -33.3 | 0 | 0 | 0 | 112.1 | E241 R246 A247 | E241-D243 VanDerWaalsContact C-N 3.27Å; E241-D243 PolarHBondContact O-N 3.49Å; D243-R246 PolarHBondContact O-N 3.31Å; D243-R246 IonicContact OD1-NH1 2.65Å; D243-R246 PolarHBondContact OD1-NH1 3Å; D243-A247 WeakPolarHBondContact O-CB 3.48Å; D243-A247 PolarHBondContact O-N 2.94Å |
| 244 | C | 89.1 | Confident | 89.3 | Confident | 53 Ų | 53 | 56.2 Ų | 56.2 | 36% | 0.358 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 172.3 | -65.8 | 0 | 0 | 0 | 0 | 111.4 | M203 E241 A247 C248 | M203-C244 HydrophobicContact CE-CB 4.43Å; E241-C244 HydrophobicContact CB-CB 4.27Å; E241-C244 PolarHBondContact O-N 3.05Å; C244-A247 PolarHBondContact O-N 2.97Å; C244-C248 WeakPolarHBondContact O-CB 3.47Å; C244-C248 PolarHBondContact O-N 3.07Å |
| 245 | L | 89.5 | Confident | 89.3 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.4 | -43.8 | 177.5 | -179.8 | 58.9 | 0 | 0 | 0 | 111.6 | T206 T231 L234 A235 E241 V242 C248 Q249 | T206-L245 WeakPolarHBondContact OG1-CD1 3.38Å; T231-L245 HydrophobicContact CG2-CB 4.19Å; T231-L245 HydrophobicContact CG2-CD2 3.72Å; T231-L245 HydrophobicContact CG2-CG 3.91Å; T231-L245 WeakPolarHBondContact O-CD2 2.81Å; L234-L245 HydrophobicContact CB-CD2 3.59Å; L234-L245 HydrophobicContact CD1-CD2 4.48Å; A235-L245 HydrophobicContact CB-CD2 4.28Å; E241-L245 PolarHBondContact O-N 3.49Å; V242-L245 PolarHBondContact O-N 3.49Å; L245-C248 WeakPolarHBondContact O-CB 3.38Å; L245-C248 PolarHBondContact O-N 2.95Å; L245-Q249 PolarHBondContact O-N 3.32Å |
| 246 | R | 89.4 | Confident | 89.2 | Confident | 63 Ų | 63 | 59.3 Ų | 59.3 | 24% | 0.238 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.6 | -43.9 | 177 | -168.4 | -179.4 | -63 | 112 | 0 | 111.4 | T231 V242 D243 C248 Q249 E250 | T231-R246 HydrophobicContact CG2-CB 4.48Å; V242-R246 WeakPolarHBondContact O-CB 3.22Å; V242-R246 PolarHBondContact O-N 2.94Å; D243-R246 PolarHBondContact O-N 3.31Å; D243-R246 IonicContact OD1-NH1 2.65Å; D243-R246 PolarHBondContact OD1-NH1 3Å; R246-C248 VanDerWaalsContact C-N 3.33Å; R246-C248 PolarHBondContact O-N 3.26Å; R246-Q249 PolarHBondContact O-N 3.03Å; R246-E250 WeakPolarHBondContact O-CG 3.36Å; R246-E250 PolarHBondContact O-N 3.32Å |
| 247 | A | 89.5 | Confident | 89.1 | Confident | 51 Ų | 51 | 53.8 Ų | 53.8 | 42% | 0.421 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.4 | -41.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | D243 C244 E250 Q251 | D243-A247 WeakPolarHBondContact O-CB 3.48Å; D243-A247 PolarHBondContact O-N 2.94Å; C244-A247 PolarHBondContact O-N 2.97Å; A247-E250 PolarHBondContact O-N 3.34Å; A247-Q251 WeakPolarHBondContact O-CB 3.31Å; A247-Q251 PolarHBondContact O-N 3.18Å |
| 248 | C | 90.3 | Very high | 89 | Confident | 3 Ų | 3 | 54.7 Ų | 54.7 | 2% | 0.02 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62 | -47.4 | 174.8 | -173.6 | 0 | 0 | 0 | 0 | 111.1 | M203 C244 L245 R246 E250 Q251 I252 | M203-C248 HydrophobicContact CG-CB 4Å; M203-C248 HydrophobicContact SD-CB 4.14Å; C244-C248 WeakPolarHBondContact O-CB 3.47Å; C244-C248 PolarHBondContact O-N 3.07Å; L245-C248 WeakPolarHBondContact O-CB 3.38Å; L245-C248 PolarHBondContact O-N 2.95Å; R246-C248 VanDerWaalsContact C-N 3.33Å; R246-C248 PolarHBondContact O-N 3.26Å; C248-E250 PolarHBondContact O-N 3.48Å; C248-Q251 WeakPolarHBondContact O-CB 3.48Å; C248-Q251 PolarHBondContact O-N 2.86Å; C248-Q251 VanDerWaalsContact O-N 3.17Å; C248-I252 VanDerWaalsContact O-CG1 3.26Å; C248-I252 WeakPolarHBondContact O-CG1 3.42Å; C248-I252 PolarHBondContact O-N 3.17Å |
| 249 | Q | 90.6 | Very high | 88.8 | Confident | 2 Ų | 2 | 56.3 Ų | 56.3 | 1% | 0.009 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -56.9 | -50.3 | 177 | 179.3 | -177.5 | -13.1 | 0 | 0 | 111.6 | A210 A211 L245 R246 Q251 I252 E253 | A210-Q249 HydrophobicContact CB-CG 4.37Å; A211-Q249 HydrophobicContact CB-CG 4.42Å; L245-Q249 PolarHBondContact O-N 3.32Å; R246-Q249 PolarHBondContact O-N 3.03Å; Q249-Q251 PolarHBondContact O-N 2.9Å; Q249-I252 WeakPolarHBondContact O-CB 3.39Å; Q249-I252 PolarHBondContact O-N 3.37Å; Q249-I252 VanDerWaalsContact O-N 3.14Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.44Å; Q249-E253 PolarHBondContact NE2-OE1 3.13Å; Q249-E253 WeakPolarHBondContact O-CG 3.22Å; Q249-E253 PolarHBondContact O-N 3.17Å |
| 250 | E | 90 | Very high | 88.6 | Confident | 69 Ų | 69 | 54.3 Ų | 54.3 | 32% | 0.322 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.5 | -36.3 | 178.1 | -72 | 178.8 | -170.1 | 0 | 0 | 112.3 | R246 A247 C248 E253 R254 | R246-E250 WeakPolarHBondContact O-CG 3.36Å; R246-E250 PolarHBondContact O-N 3.32Å; A247-E250 PolarHBondContact O-N 3.34Å; C248-E250 PolarHBondContact O-N 3.48Å; E250-E253 PolarHBondContact O-N 3.23Å; E250-R254 VanDerWaalsContact O-CG 3.24Å; E250-R254 WeakPolarHBondContact O-CG 3.44Å; E250-R254 PolarHBondContact O-N 3.08Å; E250-R254 IonicContact OE2-CZ 2.84Å; E250-R254 IonicContact OE2-NH2 2.94Å; E250-R254 PolarHBondContact OE2-NH2 3.48Å |
| 251 | Q | 90.6 | Very high | 88.3 | Confident | 46 Ų | 46 | 59 Ų | 59 | 22% | 0.215 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 176.4 | -172.4 | 173.7 | -3.7 | 0 | 0 | 111.3 | L196 A247 C248 Q249 R254 V255 | L196-Q251 HydrophobicContact CD2-CB 4.25Å; L196-Q251 HydrophobicContact CD2-CG 3.77Å; L196-Q251 HydrophobicContact CG-CG 4.22Å; A247-Q251 WeakPolarHBondContact O-CB 3.31Å; A247-Q251 PolarHBondContact O-N 3.18Å; C248-Q251 WeakPolarHBondContact O-CB 3.48Å; C248-Q251 PolarHBondContact O-N 2.86Å; C248-Q251 VanDerWaalsContact O-N 3.17Å; Q249-Q251 PolarHBondContact O-N 2.9Å; Q251-R254 PolarHBondContact O-N 3.38Å; Q251-V255 VanDerWaalsContact O-CG2 3.31Å; Q251-V255 WeakPolarHBondContact O-CG2 3.49Å; Q251-V255 PolarHBondContact O-N 3.26Å |
| 252 | I | 90.5 | Very high | 87.6 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 176.6 | -64 | 172.4 | 0 | 0 | 0 | 110.6 | F186 C190 L196 A211 C248 Q249 R254 V255 L256 | F186-I252 HydrophobicContact CB-CG2 4.27Å; F186-I252 HydrophobicContact CD1-CG2 4.02Å; F186-I252 HydrophobicContact CG-CG2 4.29Å; C190-I252 WeakPolarHBondContact SG-CG1 3.4Å; L196-I252 HydrophobicContact CD1-CG1 4.23Å; A211-I252 HydrophobicContact CB-CG2 4.36Å; C248-I252 VanDerWaalsContact O-CG1 3.26Å; C248-I252 WeakPolarHBondContact O-CG1 3.42Å; C248-I252 PolarHBondContact O-N 3.17Å; Q249-I252 WeakPolarHBondContact O-CB 3.39Å; Q249-I252 PolarHBondContact O-N 3.37Å; Q249-I252 VanDerWaalsContact O-N 3.14Å; I252-R254 VanDerWaalsContact C-N 3.32Å; I252-R254 PolarHBondContact O-N 2.65Å; I252-V255 PolarHBondContact O-N 3.44Å; I252-L256 PolarHBondContact O-N 3.02Å |
| 253 | E | 89.2 | Confident | 86.5 | Confident | 76 Ų | 76 | 57.3 Ų | 57.3 | 36% | 0.355 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62 | -38.3 | 177.2 | -70 | 171.8 | -173.9 | 0 | 0 | 112.1 | A211 Q249 E250 L256 A257 | A211-E253 HydrophobicContact CB-CG 4.4Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.44Å; Q249-E253 PolarHBondContact NE2-OE1 3.13Å; Q249-E253 WeakPolarHBondContact O-CG 3.22Å; Q249-E253 PolarHBondContact O-N 3.17Å; E250-E253 PolarHBondContact O-N 3.23Å; E253-L256 PolarHBondContact O-N 3.44Å; E253-A257 PolarHBondContact O-N 2.96Å |
| 254 | R | 89.6 | Confident | 85 | Confident | 152 Ų | 152 | 59.6 Ų | 59.6 | 57% | 0.574 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -65.1 | -43.2 | 173.3 | -72 | 171.1 | -164.5 | 135.5 | 10.3 | 112.1 | E250 Q251 I252 L256 A257 S258 | E250-R254 VanDerWaalsContact O-CG 3.24Å; E250-R254 WeakPolarHBondContact O-CG 3.44Å; E250-R254 PolarHBondContact O-N 3.08Å; E250-R254 IonicContact OE2-CZ 2.84Å; E250-R254 IonicContact OE2-NH2 2.94Å; E250-R254 PolarHBondContact OE2-NH2 3.48Å; Q251-R254 PolarHBondContact O-N 3.38Å; I252-R254 VanDerWaalsContact C-N 3.32Å; I252-R254 PolarHBondContact O-N 2.65Å; R254-L256 VanDerWaalsContact C-N 3.31Å; R254-A257 PolarHBondContact O-N 3.12Å; R254-S258 PolarHBondContact O-N 3.08Å |
| 255 | V | 88.7 | Confident | 83.2 | Confident | 10 Ų | 10 | 64.6 Ų | 64.6 | 6% | 0.061 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 177.3 | 175.2 | 0 | 0 | 0 | 0 | 110 | L189 D193 L196 Q251 I252 S258 S259 | L189-V255 HydrophobicContact CD1-CG1 3.9Å; L189-V255 HydrophobicContact CD2-CG1 4.01Å; L189-V255 HydrophobicContact CG-CG1 3.7Å; D193-V255 HydrophobicContact CB-CG1 4.32Å; D193-V255 HydrophobicContact CB-CG2 4.19Å; L196-V255 HydrophobicContact CD1-CG2 4.19Å; Q251-V255 VanDerWaalsContact O-CG2 3.31Å; Q251-V255 WeakPolarHBondContact O-CG2 3.49Å; Q251-V255 PolarHBondContact O-N 3.26Å; I252-V255 PolarHBondContact O-N 3.44Å; V255-S258 PolarHBondContact O-N 3.41Å; V255-S258 PolarHBondContact O-OG 3.18Å; V255-S259 WeakPolarHBondContact O-CB 3.16Å; V255-S259 PolarHBondContact O-N 3.1Å; V255-S259 PolarHBondContact O-OG 2.53Å |
| 256 | L | 87.7 | Confident | 81.1 | Confident | 59 Ų | 59 | 74 Ų | 74 | 31% | 0.309 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.1 | -51.2 | 174.5 | 179.5 | 68.5 | 0 | 0 | 0 | 111.5 | F186 L189 I252 E253 R254 S258 S259 L260 | F186-L256 HydrophobicContact CE1-CB 4.44Å; F186-L256 HydrophobicContact CE1-CD1 3.94Å; F186-L256 HydrophobicContact CE1-CD2 3.68Å; F186-L256 HydrophobicContact CE1-CG 4.21Å; F186-L256 HydrophobicContact CZ-CD2 4.13Å; L189-L256 HydrophobicContact CD2-CB 3.92Å; L189-L256 HydrophobicContact CD2-CD1 4.05Å; I252-L256 PolarHBondContact O-N 3.02Å; E253-L256 PolarHBondContact O-N 3.44Å; R254-L256 VanDerWaalsContact C-N 3.31Å; L256-S258 VanDerWaalsContact C-N 3.28Å; L256-S258 PolarHBondContact O-N 3.33Å; L256-S259 PolarHBondContact O-N 3.45Å; L256-S259 VanDerWaalsContact O-N 3.11Å; L256-L260 HydrophobicContact CD1-CD1 4.38Å; L256-L260 HydrophobicContact CD1-CG 4.4Å; L256-L260 HydrophobicContact CG-CD1 4.1Å; L256-L260 WeakPolarHBondContact O-CG 3.41Å; L256-L260 PolarHBondContact O-N 3.04Å |
| 257 | A | 87.3 | Confident | 78.4 | Confident | 48 Ų | 48 | 72.8 Ų | 72.8 | 40% | 0.397 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -57.5 | -42.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E253 R254 S259 Q261 | E253-A257 PolarHBondContact O-N 2.96Å; R254-A257 PolarHBondContact O-N 3.12Å; A257-S259 VanDerWaalsContact C-N 3.35Å; A257-S259 PolarHBondContact O-N 3.17Å; A257-Q261 WeakPolarHBondContact O-CG 3.28Å; A257-Q261 PolarHBondContact O-N 3.43Å |
| 258 | S | 86.2 | Confident | 75.9 | Confident | 42 Ų | 42 | 76.4 Ų | 76.4 | 29% | 0.294 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -66.5 | -35.1 | 177.7 | 73.5 | 0 | 0 | 0 | 0 | 113.2 | R254 V255 L256 Q261 Q262 | R254-S258 PolarHBondContact O-N 3.08Å; V255-S258 PolarHBondContact O-N 3.41Å; V255-S258 PolarHBondContact O-OG 3.18Å; L256-S258 VanDerWaalsContact C-N 3.28Å; L256-S258 PolarHBondContact O-N 3.33Å; S258-Q261 PolarHBondContact O-N 3.14Å; S258-Q262 WeakPolarHBondContact O-CG 3.43Å; S258-Q262 PolarHBondContact O-N 3.11Å; S258-Q262 VanDerWaalsContact O-N 3.17Å |
| 259 | S | 84.3 | Confident | 73.2 | Confident | 40 Ų | 40 | 83.8 Ų | 83.8 | 28% | 0.28 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -73.8 | -37.5 | -179.5 | -57.1 | 0 | 0 | 0 | 0 | 111.7 | L189 V255 L256 A257 Q261 Q262 G263 | L189-S259 WeakPolarHBondContact CD1-OG 3.45Å; V255-S259 WeakPolarHBondContact O-CB 3.16Å; V255-S259 PolarHBondContact O-N 3.1Å; V255-S259 PolarHBondContact O-OG 2.53Å; L256-S259 PolarHBondContact O-N 3.45Å; L256-S259 VanDerWaalsContact O-N 3.11Å; A257-S259 VanDerWaalsContact C-N 3.35Å; A257-S259 PolarHBondContact O-N 3.17Å; S259-Q261 VanDerWaalsContact C-N 3.34Å; S259-Q261 PolarHBondContact O-N 3Å; S259-Q262 PolarHBondContact O-N 3.3Å; S259-G263 PolarHBondContact O-N 3.39Å |
| 260 | L | 82.8 | Confident | 70.6 | Confident | 103 Ų | 103 | 89.2 Ų | 89.2 | 54% | 0.539 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.2 | -39.1 | 173.5 | -68.6 | 172.2 | 0 | 0 | 0 | 112.1 | L256 G263 Q264 | L256-L260 HydrophobicContact CD1-CD1 4.38Å; L256-L260 HydrophobicContact CD1-CG 4.4Å; L256-L260 HydrophobicContact CG-CD1 4.1Å; L256-L260 WeakPolarHBondContact O-CG 3.41Å; L256-L260 PolarHBondContact O-N 3.04Å; L260-G263 PolarHBondContact O-N 3.2Å; L260-Q264 WeakPolarHBondContact O-CG 3.2Å; L260-Q264 PolarHBondContact O-N 3.34Å; L260-Q264 VanDerWaalsContact O-N 3.13Å |
| 261 | Q | 81.4 | Confident | 68.1 | Low | 127 Ų | 127 | 89.6 Ų | 89.6 | 59% | 0.593 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.4 | -39.3 | 176.1 | -72 | 177 | -3.4 | 0 | 0 | 112.4 | A257 S258 S259 Q264 Q265 | A257-Q261 WeakPolarHBondContact O-CG 3.28Å; A257-Q261 PolarHBondContact O-N 3.43Å; S258-Q261 PolarHBondContact O-N 3.14Å; S259-Q261 VanDerWaalsContact C-N 3.34Å; S259-Q261 PolarHBondContact O-N 3Å; Q261-Q264 PolarHBondContact O-N 3.45Å; Q261-Q265 PolarHBondContact O-N 3.46Å |
| 262 | Q | 75.2 | Confident | 65.7 | Low | 98 Ų | 98 | 93.9 Ų | 93.9 | 46% | 0.458 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.2 | -43.1 | 175.2 | -71.7 | 171.6 | 30 | 0 | 0 | 111.3 | S258 S259 Q264 Q265 Y266 | S258-Q262 WeakPolarHBondContact O-CG 3.43Å; S258-Q262 PolarHBondContact O-N 3.11Å; S258-Q262 VanDerWaalsContact O-N 3.17Å; S259-Q262 PolarHBondContact O-N 3.3Å; Q262-Q264 VanDerWaalsContact C-N 3.27Å; Q262-Q264 PolarHBondContact O-N 3.04Å; Q262-Q265 PolarHBondContact O-N 3.29Å; Q262-Q265 VanDerWaalsContact O-N 3.11Å; Q262-Y266 WeakPolarHBondContact O-CD2 3.39Å; Q262-Y266 PolarHBondContact O-N 3.03Å |
| 263 | G | 65.4 | Low | 62.9 | Low | 50 Ų | 50 | 105.8 Ų | 105.8 | 52% | 0.515 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.4 | -33.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | S259 L260 Y266 | S259-G263 PolarHBondContact O-N 3.39Å; L260-G263 PolarHBondContact O-N 3.2Å; G263-Y266 PolarHBondContact O-N 3.01Å |
| 264 | Q | 58.3 | Low | 60.1 | Low | 160 Ų | 160 | 105.6 Ų | 105.6 | 75% | 0.748 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.2 | -26.2 | 176.1 | -73.6 | 176.1 | -7.9 | 0 | 0 | 113.6 | L260 Q261 Q262 Y266 | L260-Q264 WeakPolarHBondContact O-CG 3.2Å; L260-Q264 PolarHBondContact O-N 3.34Å; L260-Q264 VanDerWaalsContact O-N 3.13Å; Q261-Q264 PolarHBondContact O-N 3.45Å; Q262-Q264 VanDerWaalsContact C-N 3.27Å; Q262-Q264 PolarHBondContact O-N 3.04Å; Q264-Y266 VanDerWaalsContact C-N 3.31Å |
| 265 | Q | 50.4 | Low | 57.3 | Low | 158 Ų | 158 | 102.1 Ų | 102.1 | 74% | 0.738 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -76.2 | -18.1 | 175.7 | -74.7 | 178.6 | -1.4 | 0 | 0 | 113.4 | Q261 Q262 | Q261-Q265 PolarHBondContact O-N 3.46Å; Q262-Q265 PolarHBondContact O-N 3.29Å; Q262-Q265 VanDerWaalsContact O-N 3.11Å |
| 266 | Y | 46.3 | Very low | 54.5 | Low | 198 Ų | 198 | 107.4 Ų | 107.4 | 78% | 0.776 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.6 | 16.4 | 179.2 | -72.4 | -82.6 | 0 | 0 | 0 | 114 | Q262 G263 Q264 | Q262-Y266 WeakPolarHBondContact O-CD2 3.39Å; Q262-Y266 PolarHBondContact O-N 3.03Å; G263-Y266 PolarHBondContact O-N 3.01Å; Q264-Y266 VanDerWaalsContact C-N 3.31Å |
| 267 | G | 31.3 | Very low | 51.8 | Low | 36 Ų | 36 | 114.1 Ų | 114.1 | 37% | 0.371 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -70.3 | 168.8 | 168.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | D269 | G267-D269 VanDerWaalsContact C-N 3.31Å; G267-D269 PolarHBondContact O-N 2.79Å |
| 268 | P | 37.6 | Very low | 49 | Very low | 127 Ų | 127 | 116.8 Ų | 116.8 | 83% | 0.825 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -77.4 | 42.2 | -140.6 | 34.8 | -39.6 | 0 | 0 | 0 | 117.3 | ||
| 269 | D | 33.5 | Very low | 46.2 | Very low | 159 Ų | 159 | 126.8 Ų | 126.8 | 85% | 0.85 | 71% | 0.707 | S | S | * | * | trans | -106.8 | 13.5 | 179.3 | -87.7 | -17.5 | 0 | 0 | 0 | 114.2 | G267 | G267-D269 VanDerWaalsContact C-N 3.31Å; G267-D269 PolarHBondContact O-N 2.79Å | ||
| 270 | S | 35.7 | Very low | 43.7 | Very low | 115 Ų | 115 | 134 Ų | 134 | 80% | 0.804 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -100.9 | 3.9 | 174.9 | 47.1 | 0 | 0 | 0 | 0 | 114.4 | ||
| 271 | A | 37.5 | Very low | 41.1 | Very low | 77 Ų | 77 | 138 Ų | 138 | 64% | 0.636 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -101.1 | 128.5 | 157.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||
| 272 | V | 40.5 | Very low | 38.6 | Very low | 136 Ų | 136 | 141 Ų | 141 | 82% | 0.824 | 77% | 0.767 | S | S | * | * | trans | 89 | 67.5 | -174.9 | -160.9 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 273 | R | 31.7 | Very low | 36.5 | Very low | 250 Ų | 250 | 144 Ų | 144 | 94% | 0.943 | 79% | 0.786 | S | S | * | * | trans | -129.7 | 58 | 136.6 | -99.2 | -175.6 | 177.8 | -174.4 | 1.1 | 110.1 | G275 | R273-G275 PolarHBondContact O-N 3.18Š| ||
| 274 | G | 31.1 | Very low | 34.9 | Very low | 72 Ų | 72 | 150.7 Ų | 150.7 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | trans | -65.9 | 114.9 | 154.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | S276 | G274-S276 PolarHBondContact O-N 3.34Š| ||
| 275 | G | 30.1 | Very low | 33.7 | Very low | 79 Ų | 79 | 148.7 Ų | 148.7 | 81% | 0.814 | 81% | 0.807 | S | S | * | * | trans | -58 | 116.3 | -173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | R273 K277 | R273-G275 PolarHBondContact O-N 3.18Å; G275-K277 PolarHBondContact O-N 3.5Å | ||
| 276 | S | 29.4 | Very low | 32.9 | Very low | 121 Ų | 121 | 146.4 Ų | 146.4 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | -88.7 | 97.2 | 158.7 | -153.5 | 0 | 0 | 0 | 0 | 107.4 | G274 | G274-S276 PolarHBondContact O-N 3.34Š| ||
| 277 | K | 31.8 | Very low | 32.3 | Very low | 200 Ų | 200 | 143.7 Ų | 143.7 | 87% | 0.87 | 81% | 0.813 | S | S | * | * | trans | -124.5 | 98.4 | 159.2 | -82.9 | -166.8 | 176.1 | -175.1 | 0 | 108.2 | G275 | G275-K277 PolarHBondContact O-N 3.5Š| ||
| 278 | S | 28 | Very low | 32.6 | Very low | 105 Ų | 105 | 147.5 Ų | 147.5 | 73% | 0.734 | 83% | 0.832 | S | S | * | * | trans | 22 | 111.7 | 133.6 | -32.5 | 0 | 0 | 0 | 0 | 116.6 | E280 | S278-E280 PolarHBondContact O-N 3.27Š| ||
| 279 | R | 28.1 | Very low | 32.6 | Very low | 251 Ų | 251 | 148 Ų | 148 | 95% | 0.947 | 83% | 0.832 | S | S | * | * | trans | -47.9 | 115 | 153.7 | -106.9 | 169 | 165.4 | 172.2 | -4.4 | 110.2 | ||||
| 280 | E | 31.3 | Very low | 32.6 | Very low | 192 Ų | 192 | 147.6 Ų | 147.6 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | trans | -126.1 | 127.8 | 152.4 | -82.2 | -175.8 | 161.9 | 0 | 0 | 108.6 | S278 | S278-E280 PolarHBondContact O-N 3.27Š| ||
| 281 | Q | 28.1 | Very low | 32.9 | Very low | 188 Ų | 188 | 148.1 Ų | 148.1 | 88% | 0.879 | 83% | 0.828 | S | S | * | * | trans | -77 | 130 | 178.3 | -71.9 | 163.8 | -22.7 | 0 | 0 | 109.6 | ||||
| 282 | Q | 29.8 | Very low | 32.8 | Very low | 188 Ų | 188 | 154.5 Ų | 154.5 | 88% | 0.879 | 84% | 0.836 | S | S | * | * | trans | 178.9 | 103.7 | 141.6 | -102.6 | 166.2 | 8.9 | 0 | 0 | 107.9 | ||||
| 283 | D | 30.7 | Very low | 32.7 | Very low | 162 Ų | 162 | 154.7 Ų | 154.7 | 87% | 0.866 | 83% | 0.832 | S | S | * | * | -165.5 | 139.1 | 108.3 | -120 | -20.4 | 0 | 0 | 0 | 112 | |||||
| 284 | Q | 32.1 | Very low | 32.9 | Very low | 190 Ų | 190 | 149.4 Ų | 149.4 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | trans | -78.8 | 127.7 | -172.5 | -70.8 | 167.6 | -10.2 | 0 | 0 | 110.7 | ||||
| 285 | S | 33.5 | Very low | 33.1 | Very low | 118 Ų | 118 | 153.4 Ų | 153.4 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | trans | -111.8 | 110.5 | 153.4 | 59.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 286 | S | 33.7 | Very low | 33.6 | Very low | 111 Ų | 111 | 161.5 Ų | 161.5 | 78% | 0.776 | 86% | 0.855 | S | S | * | * | trans | -61.8 | 128.3 | 179.1 | 43.5 | 0 | 0 | 0 | 0 | 114 | ||||
| 287 | T | 32.8 | Very low | 33.8 | Very low | 140 Ų | 140 | 163.5 Ų | 163.5 | 86% | 0.859 | 86% | 0.856 | S | S | * | * | -164.9 | 134.5 | 128.6 | 35.3 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 288 | P | 37.2 | Very low | 33.9 | Very low | 117 Ų | 117 | 161.6 Ų | 161.6 | 76% | 0.76 | 86% | 0.855 | S | S | * | * | trans | -102 | 132.7 | -175 | 35.8 | -26.6 | 0 | 0 | 0 | 111.6 | ||||
| 289 | T | 37.8 | Very low | 34.2 | Very low | 136 Ų | 136 | 164.7 Ų | 164.7 | 83% | 0.834 | 86% | 0.862 | S | S | * | * | trans | -159.4 | 105.9 | 142.3 | -20.8 | 0 | 0 | 0 | 0 | 110.8 | V291 | T289-V291 HydrophobicContact CG2-CG2 4.23Š| ||
| 290 | D | 33.6 | Very low | 34.5 | Very low | 152 Ų | 152 | 159.6 Ų | 159.6 | 81% | 0.813 | 86% | 0.857 | S | S | * | * | trans | -73.4 | 118.7 | 159.9 | -119.3 | -25.8 | 0 | 0 | 0 | 107.9 | ||||
| 291 | V | 41.5 | Very low | 34.7 | Very low | 126 Ų | 126 | 157.6 Ų | 157.6 | 76% | 0.764 | 85% | 0.854 | S | S | * | * | trans | -137.9 | 101.1 | 156.3 | -173.6 | 0 | 0 | 0 | 0 | 107.1 | T289 | T289-V291 HydrophobicContact CG2-CG2 4.23Š| ||
| 292 | R | 35.8 | Very low | 35.2 | Very low | 210 Ų | 210 | 155.6 Ų | 155.6 | 79% | 0.792 | 85% | 0.852 | S | S | * | * | trans | -85.8 | 141.7 | 161.3 | -76.4 | -169.1 | 176.6 | -171.9 | -1.1 | 109.5 | ||||
| 293 | D | 37.7 | Very low | 35.6 | Very low | 140 Ų | 140 | 153.3 Ų | 153.3 | 75% | 0.749 | 85% | 0.851 | S | S | * | * | trans | 70.6 | 125.3 | 157.6 | -52.6 | -31.9 | 0 | 0 | 0 | 117.3 | ||||
| 294 | V | 37.8 | Very low | 36 | Very low | 140 Ų | 140 | 152.6 Ų | 152.6 | 85% | 0.848 | 85% | 0.849 | S | S | * | * | -169.4 | 132.1 | 95.9 | 174 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 295 | N | 35.3 | Very low | 36.3 | Very low | 156 Ų | 156 | 149.5 Ų | 149.5 | 83% | 0.834 | 85% | 0.846 | S | S | * | * | trans | -61 | 139.4 | 169 | -74.7 | -65.1 | 0 | 0 | 0 | 112.5 | ||||
| 296 | L | 38.7 | Very low | 36.5 | Very low | 248 Ų | 248 | 152.4 Ų | 152.4 | 100% | 1.298 | 85% | 0.848 | S | S | * | * | trans | -142.7 | 0 | 139.6 | -100.4 | 162.2 | 0 | 0 | 0 | 108.5 |
Retrieved 296 of 296 residues in 150.7 ms
(Link to these results)