| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 44.9 | Very low | 63.5 | Low | 233 Ų | 233 | 171.6 Ų | 171.6 | 100% | 1.148 | 82% | 0.822 | S | S | * | * | 0 | 139 | 0 | -78.5 | 176.1 | 179.5 | 0 | 0 | 108.4 | |||||
| 2 | D | 51.8 | Low | 64.3 | Low | 142 Ų | 142 | 171.4 Ų | 171.4 | 76% | 0.759 | 83% | 0.828 | S | S | * | * | trans | 68.8 | 74.5 | 164.3 | -53.1 | -41.7 | 0 | 0 | 0 | 120.7 | ||||
| 3 | I | 55 | Low | 65 | Low | 160 Ų | 160 | 169.5 Ų | 169.5 | 82% | 0.821 | 82% | 0.823 | S | S | * | * | trans | -95.8 | 74.7 | 153.6 | -59.3 | 159.4 | 0 | 0 | 0 | 107.6 | R5 | I3-R5 VanDerWaalsContact C-N 3.27Å; I3-R5 HydrophobicContact CG2-CG 4.36Å; I3-R5 PolarHBondContact O-N 3.1Å | ||
| 4 | S | 61.7 | Low | 65.1 | Low | 100 Ų | 100 | 169.1 Ų | 169.1 | 70% | 0.699 | 83% | 0.827 | S | S | * | * | trans | -85.4 | 69.9 | 166.8 | -82.1 | 0 | 0 | 0 | 0 | 109.5 | K6 | S4-K6 PolarHBondContact O-N 2.75Å; S4-K6 VanDerWaalsContact O-N 3.15Å | ||
| 5 | R | 66.6 | Low | 65.6 | Low | 224 Ų | 224 | 165.8 Ų | 165.8 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | trans | -74 | 100.6 | 163.7 | -87.2 | -173.7 | -170.9 | -137.2 | 1.2 | 107.7 | I3 F7 | I3-R5 VanDerWaalsContact C-N 3.27Å; I3-R5 HydrophobicContact CG2-CG 4.36Å; I3-R5 PolarHBondContact O-N 3.1Å; R5-F7 PolarHBondContact O-N 2.71Å | ||
| 6 | K | 69.7 | Low | 66.1 | Low | 161 Ų | 161 | 165 Ų | 165 | 70% | 0.7 | 82% | 0.819 | S | S | * | * | trans | -61.1 | 108.7 | 172.7 | -63.7 | -178.2 | -179.4 | -176.6 | 0 | 108.4 | S4 Y8 | S4-K6 PolarHBondContact O-N 2.75Å; S4-K6 VanDerWaalsContact O-N 3.15Å; K6-Y8 HydrophobicContact CB-CE2 4.01Å; K6-Y8 WeakPolarHBondContact O-CD2 3.4Å; K6-Y8 PolarHBondContact O-N 3.44Å | ||
| 7 | F | 63.6 | Low | 66.4 | Low | 204 Ų | 204 | 167.5 Ų | 167.5 | 90% | 0.895 | 83% | 0.825 | S | S | * | * | trans | -76.3 | 112.1 | 172.8 | -130.1 | -93.7 | 0 | 0 | 0 | 107.5 | R5 | R5-F7 PolarHBondContact O-N 2.71Š| ||
| 8 | Y | 70.7 | Confident | 66.7 | Low | 180 Ų | 180 | 166.7 Ų | 166.7 | 71% | 0.706 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 129.8 | 171.8 | -66.2 | -84.2 | 0 | 0 | 0 | 108.4 | K6 T10 | K6-Y8 HydrophobicContact CB-CE2 4.01Å; K6-Y8 WeakPolarHBondContact O-CD2 3.4Å; K6-Y8 PolarHBondContact O-N 3.44Å; Y8-T10 PolarHBondContact O-N 3.04Å |
| 9 | P | 70.3 | Confident | 66.8 | Low | 120 Ų | 120 | 167.7 Ų | 167.7 | 78% | 0.779 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -60 | 134.5 | 173.4 | -14.3 | 25.7 | 0 | 0 | 0 | 109.6 | ||
| 10 | T | 72.4 | Confident | 67.1 | Low | 132 Ų | 132 | 166.5 Ų | 166.5 | 81% | 0.81 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -61 | 138.9 | 172.9 | 39.6 | 0 | 0 | 0 | 0 | 110.2 | Y8 N12 | Y8-T10 PolarHBondContact O-N 3.04Å; T10-N12 PolarHBondContact O-N 3.36Å |
| 11 | R | 71.6 | Confident | 67.4 | Low | 232 Ų | 232 | 163.2 Ų | 163.2 | 88% | 0.875 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -58 | 134.5 | 179.2 | -71.2 | -178 | 175.1 | 174.7 | -1.8 | 110.1 | I13 | R11-I13 WeakPolarHBondContact O-CG1 3.43Å; R11-I13 PolarHBondContact O-N 3.43Å |
| 12 | N | 73.9 | Confident | 68.6 | Low | 169 Ų | 169 | 157.4 Ų | 157.4 | 90% | 0.904 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 118.2 | 173 | -70.2 | -34.4 | 0 | 0 | 0 | 109.1 | T10 | T10-N12 PolarHBondContact O-N 3.36Š|
| 13 | I | 72.8 | Confident | 69.2 | Low | 147 Ų | 147 | 156.5 Ų | 156.5 | 75% | 0.754 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 116.6 | 176.5 | -38.6 | 172.7 | 0 | 0 | 0 | 105.8 | R11 V15 | R11-I13 WeakPolarHBondContact O-CG1 3.43Å; R11-I13 PolarHBondContact O-N 3.43Å; I13-V15 PolarHBondContact O-N 3.47Å |
| 14 | N | 65.9 | Low | 69.7 | Low | 164 Ų | 164 | 158.1 Ų | 158.1 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | -72.9 | 109.3 | 170 | -103.1 | -27.8 | 0 | 0 | 0 | 107.6 | ||||
| 15 | V | 72.5 | Confident | 69.9 | Low | 119 Ų | 119 | 160 Ų | 160 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | trans | -87.4 | 124.8 | 168.6 | -84.6 | 0 | 0 | 0 | 0 | 107.9 | I13 F17 | I13-V15 PolarHBondContact O-N 3.47Å; V15-F17 PolarHBondContact O-N 3.37Å | ||
| 16 | D | 75 | Confident | 70 | Confident | 153 Ų | 153 | 156 Ų | 156 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -57.7 | 136.2 | 174.5 | -70 | -38.2 | 0 | 0 | 0 | 109.8 | I18 | D16-I18 PolarHBondContact O-N 3.21Š| ||
| 17 | F | 70.5 | Confident | 69.8 | Low | 208 Ų | 208 | 155.6 Ų | 155.6 | 91% | 0.912 | 77% | 0.77 | S | S | * | * | trans | -64.3 | 108.4 | 177.3 | -82.5 | -89.5 | 0 | 0 | 0 | 109.4 | V15 Q19 | V15-F17 PolarHBondContact O-N 3.37Å; F17-Q19 PolarHBondContact O-N 3Å; F17-Q19 VanDerWaalsContact O-N 3.09Å | ||
| 18 | I | 72.5 | Confident | 69.9 | Low | 153 Ų | 153 | 154.2 Ų | 154.2 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | trans | -68.3 | 108.2 | 170.9 | -58.3 | 173.6 | 0 | 0 | 0 | 107.2 | D16 I20 | D16-I18 PolarHBondContact O-N 3.21Å; I18-I20 PolarHBondContact O-N 3.35Å; I18-I20 VanDerWaalsContact O-N 3.15Å | ||
| 19 | Q | 68.1 | Low | 70 | Confident | 186 Ų | 186 | 153.1 Ų | 153.1 | 87% | 0.869 | 77% | 0.765 | S | S | * | * | trans | -77.1 | 101.4 | 177.5 | -160.5 | 161.7 | 21.5 | 0 | 0 | 109 | F17 P21 | F17-Q19 PolarHBondContact O-N 3Å; F17-Q19 VanDerWaalsContact O-N 3.09Å; Q19-P21 WeakPolarHBondContact O-CD 3.23Å | ||
| 20 | I | 72.8 | Confident | 70.1 | Confident | 143 Ų | 143 | 155.7 Ų | 155.7 | 73% | 0.733 | 76% | 0.761 | S | S | * | * | trans | -77.1 | 121.6 | 174.2 | -56.2 | 175.5 | 0 | 0 | 0 | 107.5 | I18 | I18-I20 PolarHBondContact O-N 3.35Å; I18-I20 VanDerWaalsContact O-N 3.15Å | ||
| 21 | P | 74.3 | Confident | 70.4 | Confident | 97 Ų | 97 | 153.3 Ų | 153.3 | 63% | 0.63 | 75% | 0.749 | S | S | * | * | trans | -61.6 | 137 | 177 | -19 | 30.4 | 0 | 0 | 0 | 111.1 | Q19 L23 | Q19-P21 WeakPolarHBondContact O-CD 3.23Å; P21-L23 PolarHBondContact O-N 2.98Å | ||
| 22 | D | 69.6 | Low | 70.8 | Confident | 111 Ų | 111 | 148 Ų | 148 | 59% | 0.594 | 73% | 0.733 | S | S | * | * | trans | -70.3 | 99.8 | 175 | -166.8 | 7.1 | 0 | 0 | 0 | 109.1 | R24 | D22-R24 PolarHBondContact O-N 3.29Å; D22-R24 IonicContact OD2-CZ 3.21Å; D22-R24 IonicContact OD2-NE 2.77Å; D22-R24 PolarHBondContact OD2-NE 3.3Å; D22-R24 IonicContact OD2-NH2 3.04Å; D22-R24 PolarHBondContact OD2-NH2 2.74Å | ||
| 23 | L | 64.3 | Low | 71.2 | Confident | 124 Ų | 124 | 146.6 Ų | 146.6 | 65% | 0.649 | 72% | 0.721 | S | S | * | * | trans | -76.3 | 75.8 | 178.6 | -67.4 | 172.7 | 0 | 0 | 0 | 109.9 | P21 F25 | P21-L23 PolarHBondContact O-N 2.98Å; L23-F25 HydrophobicContact CB-CD2 4.33Å; L23-F25 HydrophobicContact CB-CE2 3.64Å; L23-F25 HydrophobicContact CB-CZ 3.87Å; L23-F25 HydrophobicContact CD1-CE2 4.36Å; L23-F25 HydrophobicContact CD1-CZ 4.12Å; L23-F25 HydrophobicContact CD2-CZ 4.4Å; L23-F25 HydrophobicContact CG-CZ 4.37Å; L23-F25 WeakPolarHBondContact O-CD2 3.29Å; L23-F25 PolarHBondContact O-N 3.44Å; L23-F25 VanDerWaalsContact O-N 3.13Å | ||
| 24 | R | 66.1 | Low | 71.5 | Confident | 193 Ų | 193 | 143.1 Ų | 143.1 | 73% | 0.728 | 71% | 0.714 | S | S | * | * | trans | -79 | 92.2 | 170.9 | -63.5 | -167.6 | -172.3 | 165 | 6.8 | 109.9 | D22 T26 | D22-R24 PolarHBondContact O-N 3.29Å; D22-R24 IonicContact OD2-CZ 3.21Å; D22-R24 IonicContact OD2-NE 2.77Å; D22-R24 PolarHBondContact OD2-NE 3.3Å; D22-R24 IonicContact OD2-NH2 3.04Å; D22-R24 PolarHBondContact OD2-NH2 2.74Å; R24-T26 PolarHBondContact O-N 2.98Å | ||
| 25 | F | 65.5 | Low | 72.4 | Confident | 141 Ų | 141 | 140.9 Ų | 140.9 | 62% | 0.618 | 70% | 0.699 | S | S | * | * | trans | -73.1 | 102.9 | 169.4 | -57.3 | -77.3 | 0 | 0 | 0 | 109.1 | L23 F28 | L23-F25 HydrophobicContact CB-CD2 4.33Å; L23-F25 HydrophobicContact CB-CE2 3.64Å; L23-F25 HydrophobicContact CB-CZ 3.87Å; L23-F25 HydrophobicContact CD1-CE2 4.36Å; L23-F25 HydrophobicContact CD1-CZ 4.12Å; L23-F25 HydrophobicContact CD2-CZ 4.4Å; L23-F25 HydrophobicContact CG-CZ 4.37Å; L23-F25 WeakPolarHBondContact O-CD2 3.29Å; L23-F25 PolarHBondContact O-N 3.44Å; L23-F25 VanDerWaalsContact O-N 3.13Å; F25-F28 HydrophobicContact CB-CE1 4.4Å; F25-F28 HydrophobicContact CB-CE2 4Å; F25-F28 HydrophobicContact CB-CZ 3.7Å; F25-F28 HydrophobicContact CG-CZ 4.24Å | ||
| 26 | T | 67.2 | Low | 73.1 | Confident | 139 Ų | 139 | 138.8 Ų | 138.8 | 85% | 0.853 | 69% | 0.686 | S | S | * | * | trans | -90.4 | -10.3 | -176.3 | 49.7 | 0 | 0 | 0 | 0 | 114 | R24 | R24-T26 PolarHBondContact O-N 2.98Š| ||
| 27 | K | 66.6 | Low | 73.6 | Confident | 153 Ų | 153 | 139 Ų | 139 | 67% | 0.665 | 68% | 0.675 | S | S | * | * | trans | -151.7 | 118.5 | 179.5 | -161.3 | -176.2 | -177.2 | -145 | 0 | 110.6 | E29 | K27-E29 IonicContact NZ-OE2 2.85Å; K27-E29 PolarHBondContact NZ-OE2 3.02Å | ||
| 28 | F | 65.1 | Low | 74.2 | Confident | 174 Ų | 174 | 131.6 Ų | 131.6 | 76% | 0.763 | 65% | 0.653 | S | S | * | * | trans | -97.7 | 117.9 | 163.8 | -66 | -84.9 | 0 | 0 | 0 | 107.1 | F25 | F25-F28 HydrophobicContact CB-CE1 4.4Å; F25-F28 HydrophobicContact CB-CE2 4Å; F25-F28 HydrophobicContact CB-CZ 3.7Å; F25-F28 HydrophobicContact CG-CZ 4.24Å | ||
| 29 | E | 73.2 | Confident | 74.6 | Confident | 157 Ų | 157 | 132.4 Ų | 132.4 | 73% | 0.734 | 65% | 0.646 | S | S | * | * | trans | -105.5 | 107.1 | 170.8 | -163.8 | 156 | 172.2 | 0 | 0 | 106.7 | K27 S31 | K27-E29 IonicContact NZ-OE2 2.85Å; K27-E29 PolarHBondContact NZ-OE2 3.02Å; E29-S31 PolarHBondContact O-N 3.26Å | ||
| 30 | Y | 71.6 | Confident | 75.4 | Confident | 175 Ų | 175 | 128.3 Ų | 128.3 | 69% | 0.686 | 63% | 0.627 | S | S | * | * | trans | -77.4 | 116.2 | -179.7 | -166.9 | -95.8 | 0 | 0 | 0 | 108.7 | F32 | Y30-F32 HydrophobicContact CD1-CD1 4.26Å; Y30-F32 HydrophobicContact CD1-CD2 4.41Å; Y30-F32 HydrophobicContact CD1-CE1 4.01Å; Y30-F32 HydrophobicContact CD1-CE2 4.17Å; Y30-F32 HydrophobicContact CD1-CG 4.45Å; Y30-F32 AromaticContact CD1-CZ 3.97Å; Y30-F32 HydrophobicContact CD1-CZ 3.97Å; Y30-F32 HydrophobicContact CE1-CD1 4.29Å; Y30-F32 HydrophobicContact CE1-CE1 4.16Å | ||
| 31 | S | 78.8 | Confident | 75.8 | Confident | 81 Ų | 81 | 127.1 Ų | 127.1 | 57% | 0.566 | 62% | 0.618 | S | S | * | * | trans | -83.2 | 116.9 | 177 | 65.2 | 0 | 0 | 0 | 0 | 110.2 | E29 E33 | E29-S31 PolarHBondContact O-N 3.26Å; S31-E33 PolarHBondContact O-N 3.31Å | ||
| 32 | F | 80.6 | Confident | 76.1 | Confident | 121 Ų | 121 | 127.9 Ų | 127.9 | 53% | 0.531 | 61% | 0.612 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.4 | 1.6 | 175.3 | -70.4 | -84.2 | 0 | 0 | 0 | 113.8 | Y30 A34 E35 T36 | Y30-F32 HydrophobicContact CD1-CD1 4.26Å; Y30-F32 HydrophobicContact CD1-CD2 4.41Å; Y30-F32 HydrophobicContact CD1-CE1 4.01Å; Y30-F32 HydrophobicContact CD1-CE2 4.17Å; Y30-F32 HydrophobicContact CD1-CG 4.45Å; Y30-F32 AromaticContact CD1-CZ 3.97Å; Y30-F32 HydrophobicContact CD1-CZ 3.97Å; Y30-F32 HydrophobicContact CE1-CD1 4.29Å; Y30-F32 HydrophobicContact CE1-CE1 4.16Å; F32-A34 VanDerWaalsContact C-N 3.27Å; F32-A34 PolarHBondContact O-N 2.87Å; F32-E35 VanDerWaalsContact CD1-OE2 3.27Å; F32-E35 WeakPolarHBondContact CD1-OE2 3.09Å; F32-E35 WeakPolarHBondContact O-CB 3.39Å; F32-E35 PolarHBondContact O-N 3.32Å; F32-T36 PolarHBondContact O-N 3.04Å; F32-T36 PolarHBondContact O-OG1 2.87Å; F32-T36 VanDerWaalsContact O-OG1 3.05Å |
| 33 | E | 83.5 | Confident | 76.6 | Confident | 140 Ų | 140 | 126.5 Ų | 126.5 | 65% | 0.654 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -56.5 | -38.3 | -174.8 | -65.5 | -174.9 | 174.3 | 0 | 0 | 113.8 | S31 R37 | S31-E33 PolarHBondContact O-N 3.31Å; E33-R37 WeakPolarHBondContact O-CB 3.34Å; E33-R37 PolarHBondContact O-N 2.88Å; E33-R37 VanDerWaalsContact O-N 3.09Å |
| 34 | A | 78.1 | Confident | 77.3 | Confident | 74 Ų | 74 | 127.6 Ų | 127.6 | 61% | 0.612 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -70.1 | -38.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | F32 A38 | F32-A34 VanDerWaalsContact C-N 3.27Å; F32-A34 PolarHBondContact O-N 2.87Å; A34-A38 WeakPolarHBondContact O-CB 3.5Å; A34-A38 PolarHBondContact O-N 3.11Å |
| 35 | E | 84.3 | Confident | 77.6 | Confident | 117 Ų | 117 | 126 Ų | 126 | 55% | 0.547 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67.9 | -46.1 | 178 | -174.6 | 177.4 | 160.6 | 0 | 0 | 111 | F32 R37 A38 R39 | F32-E35 VanDerWaalsContact CD1-OE2 3.27Å; F32-E35 WeakPolarHBondContact CD1-OE2 3.09Å; F32-E35 WeakPolarHBondContact O-CB 3.39Å; F32-E35 PolarHBondContact O-N 3.32Å; E35-R37 VanDerWaalsContact C-N 3.34Å; E35-R37 PolarHBondContact O-N 2.74Å; E35-A38 PolarHBondContact O-N 3.3Å; E35-R39 PolarHBondContact O-N 2.92Å |
| 36 | T | 87.1 | Confident | 77.7 | Confident | 75 Ų | 75 | 124 Ų | 124 | 46% | 0.46 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -59.7 | -44.4 | 176.4 | -50.1 | 0 | 0 | 0 | 0 | 111.3 | F32 A38 R39 E40 | F32-T36 PolarHBondContact O-N 3.04Å; F32-T36 PolarHBondContact O-OG1 2.87Å; F32-T36 VanDerWaalsContact O-OG1 3.05Å; T36-A38 PolarHBondContact O-N 2.91Å; T36-R39 PolarHBondContact O-N 3.36Å; T36-E40 PolarHBondContact O-N 3.37Å |
| 37 | R | 86.1 | Confident | 77.6 | Confident | 157 Ų | 157 | 124 Ų | 124 | 59% | 0.592 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -63.5 | -40.4 | 178.1 | -170.5 | -176.8 | -58.9 | 166.2 | 5.2 | 112.4 | E33 E35 R39 Q41 | E33-R37 WeakPolarHBondContact O-CB 3.34Å; E33-R37 PolarHBondContact O-N 2.88Å; E33-R37 VanDerWaalsContact O-N 3.09Å; E35-R37 VanDerWaalsContact C-N 3.34Å; E35-R37 PolarHBondContact O-N 2.74Å; R37-R39 VanDerWaalsContact C-N 3.34Å; R37-Q41 WeakPolarHBondContact O-CG 3.32Å; R37-Q41 PolarHBondContact O-N 3.02Å; R37-Q41 VanDerWaalsContact O-N 3.12Å |
| 38 | A | 82.1 | Confident | 76.9 | Confident | 53 Ų | 53 | 121.4 Ų | 121.4 | 44% | 0.438 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.8 | -39.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | A34 E35 T36 Q41 F42 | A34-A38 WeakPolarHBondContact O-CB 3.5Å; A34-A38 PolarHBondContact O-N 3.11Å; E35-A38 PolarHBondContact O-N 3.3Å; T36-A38 PolarHBondContact O-N 2.91Å; A38-Q41 PolarHBondContact O-N 3.29Å; A38-F42 PolarHBondContact O-N 2.96Å |
| 39 | R | 82.1 | Confident | 76.3 | Confident | 169 Ų | 169 | 120.2 Ų | 120.2 | 64% | 0.638 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64 | -46.2 | 176.7 | -156.8 | 73.4 | 170.6 | 176.9 | -1.5 | 111.9 | E35 T36 R37 Q41 F42 D43 | E35-R39 PolarHBondContact O-N 2.92Å; T36-R39 PolarHBondContact O-N 3.36Å; R37-R39 VanDerWaalsContact C-N 3.34Å; R39-Q41 VanDerWaalsContact C-N 3.29Å; R39-Q41 PolarHBondContact O-N 3.11Å; R39-F42 WeakPolarHBondContact O-CB 3.44Å; R39-F42 PolarHBondContact O-N 3.06Å; R39-D43 PolarHBondContact O-N 3.22Å |
| 40 | E | 84.4 | Confident | 75.1 | Confident | 100 Ų | 100 | 118 Ų | 118 | 47% | 0.467 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -61.2 | -36.8 | 175.9 | -74.5 | -177.5 | -167.5 | 0 | 0 | 113.1 | T36 K44 | T36-E40 PolarHBondContact O-N 3.37Å; E40-K44 WeakPolarHBondContact O-CB 3.28Å; E40-K44 VanDerWaalsContact O-CG 3.26Å; E40-K44 WeakPolarHBondContact O-CG 3.3Å; E40-K44 PolarHBondContact O-N 3.42Å; E40-K44 IonicContact OE2-NZ 3.58Å |
| 41 | Q | 81.9 | Confident | 74 | Confident | 118 Ų | 118 | 116.7 Ų | 116.7 | 55% | 0.551 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.6 | -41.3 | 176.4 | -75.6 | -179.8 | -34.3 | 0 | 0 | 111.7 | R37 A38 R39 Q45 | R37-Q41 WeakPolarHBondContact O-CG 3.32Å; R37-Q41 PolarHBondContact O-N 3.02Å; R37-Q41 VanDerWaalsContact O-N 3.12Å; A38-Q41 PolarHBondContact O-N 3.29Å; R39-Q41 VanDerWaalsContact C-N 3.29Å; R39-Q41 PolarHBondContact O-N 3.11Å; Q41-Q45 WeakPolarHBondContact O-CG 3.25Å; Q41-Q45 PolarHBondContact O-N 2.92Å |
| 42 | F | 79.3 | Confident | 72 | Confident | 113 Ų | 113 | 120 Ų | 120 | 50% | 0.496 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -63 | -45 | 175.9 | -178.4 | -95.7 | 0 | 0 | 0 | 111.9 | A38 R39 Q45 N46 | A38-F42 PolarHBondContact O-N 2.96Å; R39-F42 WeakPolarHBondContact O-CB 3.44Å; R39-F42 PolarHBondContact O-N 3.06Å; F42-Q45 PolarHBondContact O-N 3.46Å; F42-N46 WeakPolarHBondContact CE1-ND2 3.42Å; F42-N46 WeakPolarHBondContact CZ-ND2 3.5Å; F42-N46 PolarHBondContact O-N 2.89Å; F42-N46 PolarHBondContact O-ND2 3.39Å |
| 43 | D | 80.4 | Confident | 70.2 | Confident | 83 Ų | 83 | 119 Ų | 119 | 44% | 0.444 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -66.5 | -42 | -179.8 | -65.6 | -21.4 | 0 | 0 | 0 | 111.2 | R39 Q45 N46 E47 | R39-D43 PolarHBondContact O-N 3.22Å; D43-Q45 PolarHBondContact O-N 2.87Å; D43-N46 PolarHBondContact O-N 2.91Å; D43-N46 VanDerWaalsContact O-N 3.08Å; D43-E47 PolarHBondContact O-N 3.35Å |
| 44 | K | 79.5 | Confident | 68 | Low | 147 Ų | 147 | 118.9 Ų | 118.9 | 64% | 0.639 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -60.9 | -28.9 | 174.9 | -77.9 | 170.2 | -176.9 | 163.3 | 0 | 113.9 | E40 | E40-K44 WeakPolarHBondContact O-CB 3.28Å; E40-K44 VanDerWaalsContact O-CG 3.26Å; E40-K44 WeakPolarHBondContact O-CG 3.3Å; E40-K44 PolarHBondContact O-N 3.42Å; E40-K44 IonicContact OE2-NZ 3.58Å |
| 45 | Q | 71.9 | Confident | 65.8 | Low | 159 Ų | 159 | 120.6 Ų | 120.6 | 74% | 0.743 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -81.8 | -20.3 | 177.7 | -74.2 | -177.1 | -38.3 | 0 | 0 | 113.1 | Q41 F42 D43 | Q41-Q45 WeakPolarHBondContact O-CG 3.25Å; Q41-Q45 PolarHBondContact O-N 2.92Å; F42-Q45 PolarHBondContact O-N 3.46Å; D43-Q45 PolarHBondContact O-N 2.87Å |
| 46 | N | 67.8 | Low | 63.7 | Low | 99 Ų | 99 | 121.3 Ų | 121.3 | 53% | 0.529 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -99.1 | 2.5 | 178.8 | -72 | -37.6 | 0 | 0 | 0 | 113.4 | F42 D43 P48 | F42-N46 WeakPolarHBondContact CE1-ND2 3.42Å; F42-N46 WeakPolarHBondContact CZ-ND2 3.5Å; F42-N46 PolarHBondContact O-N 2.89Å; F42-N46 PolarHBondContact O-ND2 3.39Å; D43-N46 PolarHBondContact O-N 2.91Å; D43-N46 VanDerWaalsContact O-N 3.08Å; N46-P48 WeakPolarHBondContact O-CD 3.38Å |
| 47 | E | 64.6 | Low | 61.1 | Low | 138 Ų | 138 | 127 Ų | 127 | 65% | 0.645 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -60.2 | 118.2 | 167.3 | -76.9 | -64.9 | 156.7 | 0 | 0 | 108.7 | D43 I49 | D43-E47 PolarHBondContact O-N 3.35Å; E47-I49 PolarHBondContact O-N 3.37Å; E47-I49 VanDerWaalsContact O-N 3.15Å |
| 48 | P | 53.6 | Low | 58.5 | Low | 100 Ų | 100 | 125.1 Ų | 125.1 | 65% | 0.649 | 66% | 0.663 | S | S | * | * | trans | -61.1 | 122.9 | 177.8 | 24.6 | -31.2 | 0 | 0 | 0 | 108.2 | N46 V50 | N46-P48 WeakPolarHBondContact O-CD 3.38Å; P48-V50 PolarHBondContact O-N 3.32Å | ||
| 49 | I | 51.3 | Low | 56.2 | Low | 149 Ų | 149 | 128.6 Ų | 128.6 | 76% | 0.764 | 68% | 0.68 | S | S | * | * | trans | -63.2 | 92.2 | 172 | -59.5 | 168.8 | 0 | 0 | 0 | 107 | E47 L51 | E47-I49 PolarHBondContact O-N 3.37Å; E47-I49 VanDerWaalsContact O-N 3.15Å; I49-L51 VanDerWaalsContact C-N 3.3Å; I49-L51 HydrophobicContact CG2-CD1 4.27Å; I49-L51 HydrophobicContact CG2-CG 4.07Å; I49-L51 PolarHBondContact O-N 3.24Å | ||
| 50 | V | 49.1 | Very low | 53.7 | Low | 109 Ų | 109 | 127.3 Ų | 127.3 | 66% | 0.661 | 69% | 0.691 | S | S | * | * | trans | -73 | 95.1 | 164.5 | -176.4 | 0 | 0 | 0 | 0 | 105.8 | P48 D52 | P48-V50 PolarHBondContact O-N 3.32Å; V50-D52 HydrophobicContact CG1-CB 4.29Å; V50-D52 PolarHBondContact O-N 3.22Å | ||
| 51 | L | 46.6 | Very low | 51.2 | Low | 149 Ų | 149 | 129 Ų | 129 | 78% | 0.78 | 71% | 0.708 | S | S | * | * | trans | -68.3 | 74.8 | 165.9 | -96.3 | 148.2 | 0 | 0 | 0 | 108.6 | I49 S53 | I49-L51 VanDerWaalsContact C-N 3.3Å; I49-L51 HydrophobicContact CG2-CD1 4.27Å; I49-L51 HydrophobicContact CG2-CG 4.07Å; I49-L51 PolarHBondContact O-N 3.24Å; L51-S53 PolarHBondContact O-N 3.32Å | ||
| 52 | D | 37.4 | Very low | 48.8 | Very low | 149 Ų | 149 | 128 Ų | 128 | 80% | 0.797 | 72% | 0.72 | S | S | * | * | trans | -83.9 | 105.5 | 166.6 | -110.7 | -10.7 | 0 | 0 | 0 | 108.9 | V50 T54 | V50-D52 HydrophobicContact CG1-CB 4.29Å; V50-D52 PolarHBondContact O-N 3.22Å; D52-T54 PolarHBondContact O-N 3.28Å | ||
| 53 | S | 42.3 | Very low | 46.6 | Very low | 100 Ų | 100 | 128.3 Ų | 128.3 | 70% | 0.699 | 74% | 0.736 | S | S | * | * | trans | -69.3 | 118.1 | 172.3 | -66.4 | 0 | 0 | 0 | 0 | 109.5 | L51 | L51-S53 PolarHBondContact O-N 3.32Š| ||
| 54 | T | 37.5 | Very low | 45.2 | Very low | 139 Ų | 139 | 129.9 Ų | 129.9 | 85% | 0.853 | 75% | 0.751 | S | S | * | * | trans | 63 | 106.8 | 155.6 | -39.8 | 0 | 0 | 0 | 0 | 117 | D52 | D52-T54 PolarHBondContact O-N 3.28Š| ||
| 55 | S | 32.7 | Very low | 43.6 | Very low | 110 Ų | 110 | 129 Ų | 129 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | -177 | 125.1 | 117.6 | -165.4 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 56 | T | 39.4 | Very low | 41.5 | Very low | 131 Ų | 131 | 125.2 Ų | 125.2 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | trans | -45.3 | 126.3 | 156.7 | 28 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 57 | K | 34 | Very low | 39.6 | Very low | 196 Ų | 196 | 124.1 Ų | 124.1 | 85% | 0.852 | 78% | 0.776 | S | S | * | * | trans | -175.2 | 120.7 | 134.7 | -108.8 | 172.7 | 178.7 | 178.5 | 0 | 114.6 | ||||
| 58 | T | 30.2 | Very low | 38 | Very low | 116 Ų | 116 | 125.6 Ų | 125.6 | 71% | 0.712 | 79% | 0.788 | S | S | * | * | trans | 15.6 | 125.7 | 140.5 | 53.9 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 59 | T | 33.3 | Very low | 37.3 | Very low | 127 Ų | 127 | 129.4 Ų | 129.4 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | 37.6 | 118.1 | 128.8 | -3.6 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 60 | T | 30.2 | Very low | 36.4 | Very low | 142 Ų | 142 | 130.1 Ų | 130.1 | 87% | 0.871 | 80% | 0.8 | S | S | * | * | -172.1 | 155 | 125.8 | 17.4 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 61 | T | 33.1 | Very low | 35.7 | Very low | 134 Ų | 134 | 130.7 Ų | 130.7 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -68.5 | 163.4 | -174.8 | 44.8 | 0 | 0 | 0 | 0 | 117 | ||||
| 62 | A | 31.5 | Very low | 35 | Very low | 99 Ų | 99 | 127.2 Ų | 127.2 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | 115.5 | 142.6 | 143.9 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 63 | S | 31.7 | Very low | 35 | Very low | 118 Ų | 118 | 129.1 Ų | 129.1 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | -90.7 | -168.9 | -158.1 | -29.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 64 | P | 52.1 | Low | 34.5 | Very low | 117 Ų | 117 | 129.9 Ų | 129.9 | 76% | 0.76 | 81% | 0.813 | S | S | * | * | trans | -93 | -174.8 | -147.4 | 48.9 | -44.5 | 0 | 0 | 0 | 112.8 | ||||
| 65 | P | 45.6 | Very low | 34.3 | Very low | 127 Ų | 127 | 133.4 Ų | 133.4 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | -157.7 | -178.4 | 69.7 | 39.8 | -16.5 | 0 | 0 | 0 | 117.1 | |||||
| 66 | G | 27.8 | Very low | 34.5 | Very low | 80 Ų | 80 | 134.6 Ų | 134.6 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 109.8 | 114.2 | 142.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 67 | G | 27.8 | Very low | 34.5 | Very low | 76 Ų | 76 | 133.9 Ų | 133.9 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | trans | -89 | -177.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 68 | N | 31.1 | Very low | 34.7 | Very low | 169 Ų | 169 | 134 Ų | 134 | 90% | 0.904 | 82% | 0.818 | S | S | * | * | trans | -158.4 | 140.4 | 144.6 | -131.4 | -0.4 | 0 | 0 | 0 | 112 | ||||
| 69 | K | 37.8 | Very low | 34.9 | Very low | 180 Ų | 180 | 133.8 Ų | 133.8 | 78% | 0.783 | 82% | 0.821 | S | S | * | * | trans | -77 | 149.6 | 171.4 | -62.6 | 171.1 | 177.4 | 178.2 | 0 | 108.7 | ||||
| 70 | N | 33.2 | Very low | 35.3 | Very low | 164 Ų | 164 | 139.4 Ų | 139.4 | 88% | 0.877 | 83% | 0.828 | S | S | * | * | -178 | 141.5 | 124 | -86.3 | -10.4 | 0 | 0 | 0 | 112.9 | |||||
| 71 | S | 35.3 | Very low | 35.7 | Very low | 122 Ų | 122 | 141.5 Ų | 141.5 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | trans | -71.2 | 155.8 | 178.6 | 57.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 72 | G | 32 | Very low | 35.9 | Very low | 75 Ų | 75 | 140.3 Ų | 140.3 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | -170.5 | 88 | 159.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 73 | E | 36.1 | Very low | 36.2 | Very low | 189 Ų | 189 | 141.9 Ų | 141.9 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | trans | -55.1 | 150.9 | 153.7 | -74.3 | 175.2 | 114.1 | 0 | 0 | 109.2 | ||||
| 74 | V | 31.5 | Very low | 36.3 | Very low | 116 Ų | 116 | 141.7 Ų | 141.7 | 70% | 0.703 | 82% | 0.822 | S | S | * | * | 164.1 | 122.7 | 127.6 | 155.3 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 75 | R | 33.9 | Very low | 35.4 | Very low | 213 Ų | 213 | 138.5 Ų | 138.5 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | 69.2 | 109.3 | 143.3 | -68.9 | 171.8 | -166.6 | 177 | -2.6 | 121.7 | ||||
| 76 | T | 37 | Very low | 35.2 | Very low | 135 Ų | 135 | 143.2 Ų | 143.2 | 83% | 0.828 | 81% | 0.814 | S | S | * | * | -9.2 | 128 | 128.1 | 52.9 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 77 | S | 39.9 | Very low | 35.8 | Very low | 116 Ų | 116 | 147.3 Ų | 147.3 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | trans | -147.3 | 114.7 | 154.9 | -58.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 78 | E | 37.8 | Very low | 36.8 | Very low | 199 Ų | 199 | 150.5 Ų | 150.5 | 93% | 0.93 | 82% | 0.816 | S | S | * | * | trans | -64 | 140.8 | 162.4 | -65.7 | 175.2 | 118 | 0 | 0 | 109.5 | ||||
| 79 | S | 35 | Very low | 37.8 | Very low | 111 Ų | 111 | 148.9 Ų | 148.9 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | trans | -145.5 | 109.6 | 157 | -168.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 80 | R | 41.4 | Very low | 38.5 | Very low | 246 Ų | 246 | 148.5 Ų | 148.5 | 93% | 0.928 | 82% | 0.817 | S | S | * | * | trans | -82.4 | 119.7 | 164.1 | -79 | 177.5 | 159.3 | -178.9 | -5.1 | 107.8 | ||||
| 81 | Q | 38.4 | Very low | 39.5 | Very low | 185 Ų | 185 | 145.3 Ų | 145.3 | 86% | 0.864 | 81% | 0.808 | S | S | * | * | trans | -146.9 | 109 | 153.6 | -112.6 | 166.7 | 6.8 | 0 | 0 | 110 | ||||
| 82 | S | 37.1 | Very low | 40.3 | Very low | 109 Ų | 109 | 148.3 Ų | 148.3 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | trans | -77.5 | 140 | 162.6 | 45.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 83 | V | 37.2 | Very low | 41.3 | Very low | 133 Ų | 133 | 152.3 Ų | 152.3 | 81% | 0.806 | 81% | 0.812 | S | S | * | * | -176.2 | 123 | 123.3 | 168.8 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 84 | S | 34.3 | Very low | 42 | Very low | 113 Ų | 113 | 149.2 Ų | 149.2 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | 33.2 | 136.4 | 153.8 | 79.3 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 85 | G | 34.2 | Very low | 42.8 | Very low | 50 Ų | 50 | 151.6 Ų | 151.6 | 52% | 0.515 | 81% | 0.814 | S | S | . | * | cis | 178.2 | 165.5 | 11.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 86 | Y | 40.1 | Very low | 44.1 | Very low | 226 Ų | 226 | 147 Ų | 147 | 89% | 0.886 | 81% | 0.809 | S | S | * | * | S | Bend | trans | 67.4 | 105.4 | 174.1 | -30.4 | -75.7 | 0 | 0 | 0 | 113.1 | ||
| 87 | D | 40.1 | Very low | 44.7 | Very low | 166 Ų | 166 | 146.1 Ų | 146.1 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | cis | -145.7 | 139.9 | 44.7 | -83.6 | -57 | 0 | 0 | 0 | 112.2 | ||||
| 88 | D | 49.9 | Very low | 44.7 | Very low | 144 Ų | 144 | 146 Ų | 146 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | -120.3 | 91.2 | -170.7 | -177.1 | 22.8 | 0 | 0 | 0 | 110 | ||||
| 89 | V | 52.1 | Low | 45.1 | Very low | 134 Ų | 134 | 142.5 Ų | 142.5 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -150.8 | 14.6 | 167.1 | -153 | 0 | 0 | 0 | 0 | 115.2 | ||
| 90 | L | 51.9 | Low | 45.4 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 90% | 0.901 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -130.3 | 8 | -176.8 | -74.9 | 174.5 | 0 | 0 | 0 | 117.1 | ||
| 91 | S | 53.9 | Low | 45.4 | Very low | 97 Ų | 97 | 139.5 Ų | 139.5 | 68% | 0.678 | 80% | 0.796 | S | S | * | * | trans | -102 | 10.3 | -168.1 | -52.2 | 0 | 0 | 0 | 0 | 116 | N93 | S91-N93 PolarHBondContact O-N 3.12Š| ||
| 92 | Q | 52.1 | Low | 45.3 | Very low | 186 Ų | 186 | 135.3 Ų | 135.3 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -89.9 | 14.5 | -166.4 | -121.7 | 171.4 | 22.5 | 0 | 0 | 116.9 | ||
| 93 | N | 53.7 | Low | 45.4 | Very low | 159 Ų | 159 | 137.5 Ų | 137.5 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | trans | -140.6 | 55 | 175.7 | -75.5 | -46.4 | 0 | 0 | 0 | 113.4 | S91 | S91-N93 PolarHBondContact O-N 3.12Š| ||
| 94 | V | 51.1 | Low | 45.6 | Very low | 123 Ų | 123 | 137 Ų | 137 | 75% | 0.745 | 79% | 0.79 | S | S | * | * | trans | -97.3 | 103.4 | 161.8 | -175 | 0 | 0 | 0 | 0 | 108.1 | V96 | V94-V96 PolarHBondContact O-N 3.24Š| ||
| 95 | L | 47.1 | Very low | 45.6 | Very low | 166 Ų | 166 | 136.7 Ų | 136.7 | 87% | 0.869 | 79% | 0.788 | S | S | * | * | trans | -64.2 | 112.1 | 173.4 | -131.4 | 79.4 | 0 | 0 | 0 | 108.8 | ||||
| 96 | V | 60.9 | Low | 46 | Very low | 117 Ų | 117 | 142.9 Ų | 142.9 | 71% | 0.709 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 131.7 | 174 | -177.1 | 0 | 0 | 0 | 0 | 108.7 | V94 C98 | V94-V96 PolarHBondContact O-N 3.24Å; V96-C98 PolarHBondContact O-N 3.43Å |
| 97 | P | 49.7 | Very low | 45.7 | Very low | 116 Ų | 116 | 138.1 Ų | 138.1 | 75% | 0.753 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 121.3 | 174 | -19.4 | 31.2 | 0 | 0 | 0 | 111.1 | ||
| 98 | C | 40.3 | Very low | 45.8 | Very low | 114 Ų | 114 | 135.9 Ų | 135.9 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 128.3 | 169 | -66.5 | 0 | 0 | 0 | 0 | 109.9 | V96 V100 | V96-C98 PolarHBondContact O-N 3.43Å; C98-V100 PolarHBondContact O-N 3.18Å |
| 99 | P | 45.9 | Very low | 45.1 | Very low | 126 Ų | 126 | 134.5 Ų | 134.5 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 127.6 | 172.4 | 25.1 | -30 | 0 | 0 | 0 | 110.3 | N101 | P99-N101 PolarHBondContact O-N 2.89Š|
| 100 | V | 41.5 | Very low | 44.6 | Very low | 127 Ų | 127 | 133.2 Ų | 133.2 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -76.8 | 104.5 | 175 | -176.3 | 0 | 0 | 0 | 0 | 108.2 | C98 S102 | C98-V100 PolarHBondContact O-N 3.18Å; V100-S102 WeakPolarHBondContact CG1-OG 3.34Å; V100-S102 PolarHBondContact O-N 3.15Å | ||
| 101 | N | 40.9 | Very low | 43.8 | Very low | 166 Ų | 166 | 131.7 Ų | 131.7 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | trans | -95.8 | 85.6 | 170.4 | -143.8 | 7.2 | 0 | 0 | 0 | 108.5 | P99 | P99-N101 PolarHBondContact O-N 2.89Š| ||
| 102 | S | 36.6 | Very low | 43.1 | Very low | 98 Ų | 98 | 136.6 Ų | 136.6 | 69% | 0.685 | 80% | 0.803 | S | S | * | * | trans | -89.1 | 104.5 | 174.4 | -65.3 | 0 | 0 | 0 | 0 | 109.7 | V100 | V100-S102 WeakPolarHBondContact CG1-OG 3.34Å; V100-S102 PolarHBondContact O-N 3.15Å | ||
| 103 | N | 39.2 | Very low | 42.3 | Very low | 154 Ų | 154 | 133.9 Ų | 133.9 | 82% | 0.824 | 80% | 0.802 | S | S | * | * | trans | -128.7 | 126.4 | 153.1 | -121.9 | 16.6 | 0 | 0 | 0 | 108 | S105 | N103-S105 PolarHBondContact O-N 2.9Š| ||
| 104 | P | 42.1 | Very low | 41.3 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | trans | -78.7 | 114.5 | -178.2 | 30.4 | -30.2 | 0 | 0 | 0 | 109.6 | ||||
| 105 | S | 34.7 | Very low | 40.9 | Very low | 106 Ų | 106 | 132.2 Ų | 132.2 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | trans | -94.2 | 106.5 | 168.6 | -169.5 | 0 | 0 | 0 | 0 | 109.5 | N103 T107 | N103-S105 PolarHBondContact O-N 2.9Å; S105-T107 PolarHBondContact O-N 3.46Å | ||
| 106 | M | 42.3 | Very low | 40.2 | Very low | 181 Ų | 181 | 128.9 Ų | 128.9 | 89% | 0.892 | 79% | 0.792 | S | S | * | * | trans | -71.3 | 113.2 | 165.5 | -73 | -99.8 | 88.9 | 0 | 0 | 108.6 | ||||
| 107 | T | 34 | Very low | 39.5 | Very low | 125 Ų | 125 | 130.7 Ų | 130.7 | 77% | 0.767 | 80% | 0.798 | S | S | * | * | trans | -136.6 | 122.1 | 156 | 52.3 | 0 | 0 | 0 | 0 | 110.3 | S105 | S105-T107 PolarHBondContact O-N 3.46Š| ||
| 108 | S | 41.4 | Very low | 38.9 | Very low | 119 Ų | 119 | 131 Ų | 131 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -75 | 130.5 | 170 | 37.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 109 | S | 35.5 | Very low | 39 | Very low | 116 Ų | 116 | 130.9 Ų | 130.9 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | trans | -171.9 | 133.1 | 139.9 | 44.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 110 | S | 41.1 | Very low | 38.8 | Very low | 106 Ų | 106 | 128.8 Ų | 128.8 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | trans | -64.2 | 139.2 | 172.6 | 62 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 111 | T | 35 | Very low | 38.9 | Very low | 141 Ų | 141 | 129.7 Ų | 129.7 | 87% | 0.865 | 79% | 0.79 | S | S | * | * | trans | -171.8 | 137.8 | 130.5 | 27.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 112 | K | 39.2 | Very low | 39.2 | Very low | 199 Ų | 199 | 127.8 Ų | 127.8 | 87% | 0.865 | 78% | 0.783 | S | S | * | * | trans | -7.6 | 141 | 174.8 | -67.4 | 172.3 | 175.8 | 176.6 | 0 | 119.8 | S114 | K112-S114 PolarHBondContact O-N 2.9Š| ||
| 113 | P | 36.1 | Very low | 39.5 | Very low | 130 Ų | 130 | 130.3 Ų | 130.3 | 84% | 0.844 | 78% | 0.784 | S | S | * | * | trans | -75.9 | 115.4 | 166.6 | 31.1 | -28.8 | 0 | 0 | 0 | 110.5 | ||||
| 114 | S | 32.7 | Very low | 39.8 | Very low | 110 Ų | 110 | 126.6 Ų | 126.6 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | trans | -81.3 | 124.4 | 159.1 | -179.8 | 0 | 0 | 0 | 0 | 107.8 | K112 S116 | K112-S114 PolarHBondContact O-N 2.9Å; S114-S116 PolarHBondContact O-N 3.46Å; S114-S116 VanDerWaalsContact O-N 3.08Å | ||
| 115 | V | 42.9 | Very low | 40.1 | Very low | 137 Ų | 137 | 127.1 Ų | 127.1 | 83% | 0.83 | 77% | 0.765 | S | S | * | * | trans | -75.5 | 97.5 | 177.1 | -167.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 116 | S | 31.9 | Very low | 40.9 | Very low | 95 Ų | 95 | 128 Ų | 128 | 66% | 0.664 | 76% | 0.758 | S | S | * | * | trans | -100 | 115.8 | 169.2 | -158.5 | 0 | 0 | 0 | 0 | 108.5 | S114 T118 | S114-S116 PolarHBondContact O-N 3.46Å; S114-S116 VanDerWaalsContact O-N 3.08Å; S116-T118 PolarHBondContact O-N 3.41Å | ||
| 117 | N | 45.6 | Very low | 41.3 | Very low | 156 Ų | 156 | 126.7 Ų | 126.7 | 83% | 0.834 | 75% | 0.75 | S | S | * | * | trans | -62.4 | 98.9 | 169.6 | -88.5 | -9.7 | 0 | 0 | 0 | 109.1 | ||||
| 118 | T | 37.5 | Very low | 41.7 | Very low | 122 Ų | 122 | 130 Ų | 130 | 75% | 0.748 | 75% | 0.753 | S | S | * | * | trans | -108.9 | 112.9 | 156.4 | 44.5 | 0 | 0 | 0 | 0 | 107.5 | S116 A120 | S116-T118 PolarHBondContact O-N 3.41Å; T118-A120 VanDerWaalsContact C-N 3.27Å; T118-A120 PolarHBondContact O-N 2.93Å | ||
| 119 | S | 43.8 | Very low | 42.2 | Very low | 112 Ų | 112 | 131.1 Ų | 131.1 | 78% | 0.783 | 75% | 0.746 | S | S | * | * | trans | -56.6 | 93.5 | 168.3 | 172.3 | 0 | 0 | 0 | 0 | 108.2 | M121 | S119-M121 VanDerWaalsContact C-N 3.31Å; S119-M121 PolarHBondContact O-N 3.43Å | ||
| 120 | A | 40.2 | Very low | 42.9 | Very low | 82 Ų | 82 | 129 Ų | 129 | 68% | 0.678 | 73% | 0.731 | S | S | * | * | trans | -63.5 | 100.4 | 163.3 | 0 | 0 | 0 | 0 | 0 | 106.2 | T118 V122 | T118-A120 VanDerWaalsContact C-N 3.27Å; T118-A120 PolarHBondContact O-N 2.93Å; A120-V122 PolarHBondContact O-N 2.91Å | ||
| 121 | M | 43.5 | Very low | 43.6 | Very low | 146 Ų | 146 | 130.4 Ų | 130.4 | 72% | 0.719 | 74% | 0.735 | S | S | * | * | trans | -58.5 | 90.6 | 158.9 | -87.6 | -111.3 | -175.6 | 0 | 0 | 106.5 | S119 H123 | S119-M121 VanDerWaalsContact C-N 3.31Å; S119-M121 PolarHBondContact O-N 3.43Å; M121-H123 PolarHBondContact O-N 3.37Å | ||
| 122 | V | 47.1 | Very low | 44.7 | Very low | 125 Ų | 125 | 129.1 Ų | 129.1 | 76% | 0.758 | 72% | 0.723 | S | S | * | * | trans | -67.8 | 90.3 | 160.9 | -176.3 | 0 | 0 | 0 | 0 | 104 | A120 S124 | A120-V122 PolarHBondContact O-N 2.91Å; V122-S124 PolarHBondContact O-N 3.47Å | ||
| 123 | H | 44.7 | Very low | 45.9 | Very low | 151 Ų | 151 | 124.4 Ų | 124.4 | 70% | 0.699 | 71% | 0.707 | S | S | * | * | trans | -61.7 | 91.6 | 162.8 | -75.1 | -70.2 | 0 | 0 | 0 | 106.3 | M121 L125 | M121-H123 PolarHBondContact O-N 3.37Å; H123-L125 PolarHBondContact O-N 3.48Å; H123-L125 VanDerWaalsContact O-N 3.1Å | ||
| 124 | S | 44.6 | Very low | 47.2 | Very low | 76 Ų | 76 | 123 Ų | 123 | 53% | 0.531 | 70% | 0.696 | S | S | . | * | trans | -61.3 | 110.2 | 171 | -175.8 | 0 | 0 | 0 | 0 | 106.5 | V122 H126 E127 | V122-S124 PolarHBondContact O-N 3.47Å; S124-H126 PolarHBondContact O-N 2.95Å; S124-H126 WeakPolarHBondContact OG-CB 3.26Å; S124-E127 PolarHBondContact O-N 2.88Å | ||
| 125 | L | 47.7 | Very low | 48.2 | Very low | 134 Ų | 134 | 125.2 Ų | 125.2 | 70% | 0.702 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -60.1 | 1.3 | 170.9 | -73.3 | 166.5 | 0 | 0 | 0 | 112.9 | H123 E127 F128 E129 | H123-L125 PolarHBondContact O-N 3.48Å; H123-L125 VanDerWaalsContact O-N 3.1Å; L125-E127 PolarHBondContact O-N 3.25Å; L125-F128 PolarHBondContact O-N 2.7Å; L125-E129 PolarHBondContact O-N 2.62Å |
| 126 | H | 51.2 | Low | 49.1 | Very low | 126 Ų | 126 | 122.6 Ų | 122.6 | 58% | 0.583 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -61.1 | -20.3 | 172.2 | -158.4 | 61.2 | 0 | 0 | 0 | 113.7 | S124 S130 | S124-H126 PolarHBondContact O-N 2.95Å; S124-H126 WeakPolarHBondContact OG-CB 3.26Å; H126-S130 PolarHBondContact O-N 3.28Å |
| 127 | E | 51.7 | Low | 50.7 | Low | 153 Ų | 153 | 122.5 Ų | 122.5 | 72% | 0.715 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -71.4 | -36.4 | 176.3 | -163 | 168.9 | -168.9 | 0 | 0 | 112 | S124 L125 S130 | S124-E127 PolarHBondContact O-N 2.88Å; L125-E127 PolarHBondContact O-N 3.25Å; E127-S130 PolarHBondContact O-N 3.36Å; E127-S130 PolarHBondContact O-OG 3.08Å |
| 128 | F | 43.1 | Very low | 51.7 | Low | 193 Ų | 193 | 119.9 Ų | 119.9 | 85% | 0.846 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -16.9 | 176.4 | -83.6 | -86.7 | 0 | 0 | 0 | 113.9 | L125 | L125-F128 PolarHBondContact O-N 2.7Š|
| 129 | E | 50.4 | Low | 52.8 | Low | 143 Ų | 143 | 119.7 Ų | 119.7 | 67% | 0.668 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | -1.5 | 172.6 | -68.2 | -174.7 | 167 | 0 | 0 | 113 | L125 T131 | L125-E129 PolarHBondContact O-N 2.62Å; E129-T131 VanDerWaalsContact C-N 3.33Å; E129-T131 PolarHBondContact O-N 2.9Å |
| 130 | S | 50.8 | Low | 53.6 | Low | 72 Ų | 72 | 119.7 Ų | 119.7 | 50% | 0.503 | 63% | 0.631 | S | S | . | * | trans | -69.8 | 93.9 | 173.5 | 74.6 | 0 | 0 | 0 | 0 | 109.3 | H126 E127 N132 | H126-S130 PolarHBondContact O-N 3.28Å; E127-S130 PolarHBondContact O-N 3.36Å; E127-S130 PolarHBondContact O-OG 3.08Å; S130-N132 PolarHBondContact O-N 3.2Å | ||
| 131 | T | 55.3 | Low | 54.7 | Low | 136 Ų | 136 | 121.3 Ų | 121.3 | 83% | 0.834 | 63% | 0.628 | S | S | * | * | trans | -69.7 | 29.5 | 169.3 | 44 | 0 | 0 | 0 | 0 | 112.4 | E129 | E129-T131 VanDerWaalsContact C-N 3.33Å; E129-T131 PolarHBondContact O-N 2.9Å | ||
| 132 | N | 59 | Low | 55.6 | Low | 113 Ų | 113 | 117 Ų | 117 | 60% | 0.604 | 62% | 0.615 | S | S | * | * | trans | -100.1 | 91.4 | 162.5 | -80.2 | 9.5 | 0 | 0 | 0 | 106 | S130 V134 | S130-N132 PolarHBondContact O-N 3.2Å; N132-V134 PolarHBondContact O-N 3.41Å; N132-V134 VanDerWaalsContact O-N 3.07Å | ||
| 133 | N | 63.2 | Low | 56 | Low | 100 Ų | 100 | 115.6 Ų | 115.6 | 54% | 0.535 | 60% | 0.603 | S | S | . | * | trans | -57.2 | 117.3 | 169.5 | -96.7 | -28.8 | 0 | 0 | 0 | 107.2 | F135 D136 | N133-F135 HydrophobicContact CB-CB 4.44Å; N133-F135 PolarHBondContact O-N 3.07Å; N133-D136 WeakPolarHBondContact O-CB 3.32Å; N133-D136 PolarHBondContact O-N 3.04Å | ||
| 134 | V | 63.9 | Low | 56.8 | Low | 101 Ų | 101 | 113.4 Ų | 113.4 | 61% | 0.612 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -50.8 | -26.1 | 171.9 | 179.2 | 0 | 0 | 0 | 0 | 111 | N132 D137 I138 | N132-V134 PolarHBondContact O-N 3.41Å; N132-V134 VanDerWaalsContact O-N 3.07Å; V134-D137 PolarHBondContact O-N 3.35Å; V134-I138 HydrophobicContact CG1-CD1 3.98Å; V134-I138 VanDerWaalsContact O-CG1 3.26Å; V134-I138 WeakPolarHBondContact O-CG1 3.44Å; V134-I138 PolarHBondContact O-N 3Å; V134-I138 VanDerWaalsContact O-N 3.08Å |
| 135 | F | 54.3 | Low | 57.9 | Low | 157 Ų | 157 | 114.5 Ų | 114.5 | 69% | 0.689 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.8 | -33.4 | 172.6 | -65.4 | -78.2 | 0 | 0 | 0 | 114.7 | N133 Q139 | N133-F135 HydrophobicContact CB-CB 4.44Å; N133-F135 PolarHBondContact O-N 3.07Å; F135-Q139 VanDerWaalsContact O-CB 3.3Å; F135-Q139 WeakPolarHBondContact O-CB 3.4Å; F135-Q139 PolarHBondContact O-N 2.93Å |
| 136 | D | 62.2 | Low | 59 | Low | 82 Ų | 82 | 115.9 Ų | 115.9 | 44% | 0.439 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -71.3 | -40.5 | 176.7 | -73.2 | -16.3 | 0 | 0 | 0 | 110.7 | N133 Q139 I140 | N133-D136 WeakPolarHBondContact O-CB 3.32Å; N133-D136 PolarHBondContact O-N 3.04Å; D136-Q139 PolarHBondContact O-N 3.25Å; D136-I140 WeakPolarHBondContact O-CD1 3.47Å; D136-I140 VanDerWaalsContact O-CG1 3.23Å; D136-I140 WeakPolarHBondContact O-CG1 3.28Å; D136-I140 PolarHBondContact O-N 2.65Å |
| 137 | D | 64.5 | Low | 59.7 | Low | 93 Ų | 93 | 116.6 Ų | 116.6 | 50% | 0.497 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -65.6 | -41.5 | 176.4 | -71.7 | -19.3 | 0 | 0 | 0 | 111.4 | V134 Q139 I140 L141 | V134-D137 PolarHBondContact O-N 3.35Å; D137-Q139 VanDerWaalsContact C-N 3.33Å; D137-Q139 PolarHBondContact O-N 3.42Å; D137-I140 PolarHBondContact O-N 3.48Å; D137-L141 WeakPolarHBondContact O-CB 3.49Å; D137-L141 PolarHBondContact O-N 3.34Å |
| 138 | I | 66.4 | Low | 60.4 | Low | 100 Ų | 100 | 111.6 Ų | 111.6 | 51% | 0.513 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.8 | -39.8 | 174 | -68.8 | 168.5 | 0 | 0 | 0 | 110.8 | V134 L141 A142 | V134-I138 HydrophobicContact CG1-CD1 3.98Å; V134-I138 VanDerWaalsContact O-CG1 3.26Å; V134-I138 WeakPolarHBondContact O-CG1 3.44Å; V134-I138 PolarHBondContact O-N 3Å; V134-I138 VanDerWaalsContact O-N 3.08Å; I138-L141 PolarHBondContact O-N 3.03Å; I138-A142 VanDerWaalsContact O-CB 3.28Å; I138-A142 WeakPolarHBondContact O-CB 3.34Å; I138-A142 PolarHBondContact O-N 3.21Å |
| 139 | Q | 61 | Low | 61.3 | Low | 119 Ų | 119 | 107.6 Ų | 107.6 | 56% | 0.556 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67.9 | -38.9 | 179 | -168.6 | 174.4 | 11.5 | 0 | 0 | 111.8 | F135 D136 D137 L143 | F135-Q139 VanDerWaalsContact O-CB 3.3Å; F135-Q139 WeakPolarHBondContact O-CB 3.4Å; F135-Q139 PolarHBondContact O-N 2.93Å; D136-Q139 PolarHBondContact O-N 3.25Å; D137-Q139 VanDerWaalsContact C-N 3.33Å; D137-Q139 PolarHBondContact O-N 3.42Å; Q139-L143 HydrophobicContact CG-CD1 4.47Å; Q139-L143 WeakPolarHBondContact O-CD1 3.18Å; Q139-L143 WeakPolarHBondContact O-CG 3.28Å; Q139-L143 PolarHBondContact O-N 3.26Å; Q139-L143 VanDerWaalsContact O-N 3.12Å |
| 140 | I | 60.8 | Low | 61.8 | Low | 112 Ų | 112 | 106.4 Ų | 106.4 | 57% | 0.574 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.7 | -42.9 | 175.9 | -67.5 | 163.9 | 0 | 0 | 0 | 110.6 | D136 D137 L143 D144 | D136-I140 WeakPolarHBondContact O-CD1 3.47Å; D136-I140 VanDerWaalsContact O-CG1 3.23Å; D136-I140 WeakPolarHBondContact O-CG1 3.28Å; D136-I140 PolarHBondContact O-N 2.65Å; D137-I140 PolarHBondContact O-N 3.48Å; I140-L143 PolarHBondContact O-N 3.04Å; I140-D144 PolarHBondContact O-N 3.45Å |
| 141 | L | 64.2 | Low | 62.5 | Low | 116 Ų | 116 | 109.2 Ų | 109.2 | 61% | 0.607 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.1 | -43.2 | 176.9 | -167.3 | 67 | 0 | 0 | 0 | 111.8 | D137 I138 L143 D144 D145 | D137-L141 WeakPolarHBondContact O-CB 3.49Å; D137-L141 PolarHBondContact O-N 3.34Å; I138-L141 PolarHBondContact O-N 3.03Å; L141-L143 VanDerWaalsContact C-N 3.25Å; L141-L143 PolarHBondContact O-N 2.89Å; L141-D144 PolarHBondContact O-N 3.3Å; L141-D145 PolarHBondContact O-N 2.97Å |
| 142 | A | 61.8 | Low | 62.6 | Low | 55 Ų | 55 | 109.3 Ų | 109.3 | 46% | 0.455 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.6 | -27.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | I138 R146 | I138-A142 VanDerWaalsContact O-CB 3.28Å; I138-A142 WeakPolarHBondContact O-CB 3.34Å; I138-A142 PolarHBondContact O-N 3.21Å; A142-R146 WeakPolarHBondContact O-CB 3.15Å; A142-R146 PolarHBondContact O-N 3.45Å |
| 143 | L | 55.8 | Low | 62.5 | Low | 95 Ų | 95 | 111.2 Ų | 111.2 | 50% | 0.497 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -74.8 | -31.5 | 176.7 | -74.3 | 168.7 | 0 | 0 | 0 | 112.6 | Q139 I140 L141 K147 | Q139-L143 HydrophobicContact CG-CD1 4.47Å; Q139-L143 WeakPolarHBondContact O-CD1 3.18Å; Q139-L143 WeakPolarHBondContact O-CG 3.28Å; Q139-L143 PolarHBondContact O-N 3.26Å; Q139-L143 VanDerWaalsContact O-N 3.12Å; I140-L143 PolarHBondContact O-N 3.04Å; L141-L143 VanDerWaalsContact C-N 3.25Å; L141-L143 PolarHBondContact O-N 2.89Å; L143-K147 PolarHBondContact O-N 3.4Å |
| 144 | D | 61.1 | Low | 62.2 | Low | 106 Ų | 106 | 115.1 Ų | 115.1 | 57% | 0.567 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -72.5 | -44.6 | 176.5 | -154.4 | 18.9 | 0 | 0 | 0 | 111.1 | I140 L141 R146 K147 A148 | I140-D144 PolarHBondContact O-N 3.45Å; L141-D144 PolarHBondContact O-N 3.3Å; D144-R146 VanDerWaalsContact C-N 3.3Å; D144-R146 PolarHBondContact O-N 2.72Å; D144-K147 WeakPolarHBondContact O-CB 3.21Å; D144-K147 PolarHBondContact O-N 3.5Å; D144-A148 PolarHBondContact O-N 3.11Å |
| 145 | D | 67.4 | Low | 61.6 | Low | 99 Ų | 99 | 117.8 Ų | 117.8 | 53% | 0.529 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -59.4 | -39.9 | 174.6 | -79.6 | -7.9 | 0 | 0 | 0 | 112.2 | L141 K147 A148 L149 | L141-D145 PolarHBondContact O-N 2.97Å; D145-K147 VanDerWaalsContact C-N 3.27Å; D145-K147 PolarHBondContact O-N 2.9Å; D145-A148 PolarHBondContact O-N 3.22Å; D145-L149 WeakPolarHBondContact O-CB 3.27Å; D145-L149 WeakPolarHBondContact O-CG 3.25Å; D145-L149 PolarHBondContact O-N 2.89Å |
| 146 | R | 70.5 | Confident | 61.3 | Low | 163 Ų | 163 | 118.5 Ų | 118.5 | 62% | 0.615 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -64.4 | -33.8 | 176.4 | -161.9 | 178.1 | 83.6 | 166.4 | 3.4 | 112.2 | A142 D144 Q150 | A142-R146 WeakPolarHBondContact O-CB 3.15Å; A142-R146 PolarHBondContact O-N 3.45Å; D144-R146 VanDerWaalsContact C-N 3.3Å; D144-R146 PolarHBondContact O-N 2.72Å; R146-Q150 PolarHBondContact O-N 3.09Å; R146-Q150 VanDerWaalsContact O-N 3.11Å |
| 147 | K | 66.3 | Low | 60.4 | Low | 140 Ų | 140 | 122.4 Ų | 122.4 | 61% | 0.609 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -74.7 | -40.7 | 178.3 | -164.3 | -178.7 | 176.4 | -167.2 | 0 | 111 | L143 D144 D145 Q150 E151 | L143-K147 PolarHBondContact O-N 3.4Å; D144-K147 WeakPolarHBondContact O-CB 3.21Å; D144-K147 PolarHBondContact O-N 3.5Å; D145-K147 VanDerWaalsContact C-N 3.27Å; D145-K147 PolarHBondContact O-N 2.9Å; K147-Q150 PolarHBondContact O-N 3.4Å; K147-E151 PolarHBondContact O-N 2.87Å |
| 148 | A | 66.9 | Low | 59.4 | Low | 48 Ų | 48 | 123.3 Ų | 123.3 | 40% | 0.397 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -61.4 | -41.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112 | D144 D145 E151 Q152 | D144-A148 PolarHBondContact O-N 3.11Å; D145-A148 PolarHBondContact O-N 3.22Å; A148-E151 PolarHBondContact O-N 2.59Å; A148-Q152 WeakPolarHBondContact O-CG 3.42Å; A148-Q152 PolarHBondContact O-N 3.26Å |
| 149 | L | 60.9 | Low | 58.3 | Low | 110 Ų | 110 | 125.9 Ų | 125.9 | 58% | 0.576 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -66.6 | -37.2 | 175.6 | -73.4 | 171.3 | 0 | 0 | 0 | 112.9 | D145 E151 Q152 Q153 | D145-L149 WeakPolarHBondContact O-CB 3.27Å; D145-L149 WeakPolarHBondContact O-CG 3.25Å; D145-L149 PolarHBondContact O-N 2.89Å; L149-E151 VanDerWaalsContact C-N 3.33Å; L149-Q152 PolarHBondContact O-N 2.97Å; L149-Q153 PolarHBondContact O-N 3.4Å |
| 150 | Q | 62.3 | Low | 57.1 | Low | 117 Ų | 117 | 127.6 Ų | 127.6 | 55% | 0.547 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -67.6 | -33.1 | 173.7 | -103.4 | -176.8 | -1.8 | 0 | 0 | 113 | R146 K147 K154 | R146-Q150 PolarHBondContact O-N 3.09Å; R146-Q150 VanDerWaalsContact O-N 3.11Å; K147-Q150 PolarHBondContact O-N 3.4Å; Q150-K154 PolarHBondContact O-N 3.27Å |
| 151 | E | 63.8 | Low | 56.3 | Low | 132 Ų | 132 | 128.4 Ų | 128.4 | 62% | 0.617 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -71.8 | -38.1 | 175.8 | -169.8 | 161.3 | -166.1 | 0 | 0 | 111.4 | K147 A148 L149 K154 | K147-E151 PolarHBondContact O-N 2.87Å; A148-E151 PolarHBondContact O-N 2.59Å; L149-E151 VanDerWaalsContact C-N 3.33Å; E151-K154 PolarHBondContact O-N 2.92Å |
| 152 | Q | 58.5 | Low | 54.8 | Low | 138 Ų | 138 | 130.7 Ų | 130.7 | 65% | 0.645 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -66.8 | -37.4 | 172.2 | -72.7 | -167 | -20.5 | 0 | 0 | 113 | A148 L149 K154 Q155 | A148-Q152 WeakPolarHBondContact O-CG 3.42Å; A148-Q152 PolarHBondContact O-N 3.26Å; L149-Q152 PolarHBondContact O-N 2.97Å; Q152-K154 VanDerWaalsContact C-N 3.29Å; Q152-K154 PolarHBondContact O-N 3.4Å; Q152-Q155 PolarHBondContact O-N 3.05Å |
| 153 | Q | 56.4 | Low | 54 | Low | 152 Ų | 152 | 135.2 Ų | 135.2 | 71% | 0.71 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -64.4 | -30.3 | 175 | -95.5 | -176.2 | -17.4 | 0 | 0 | 113.4 | L149 Q155 | L149-Q153 PolarHBondContact O-N 3.4Å; Q153-Q155 VanDerWaalsContact C-N 3.3Å; Q153-Q155 PolarHBondContact O-N 3.4Å |
| 154 | K | 57 | Low | 52.9 | Low | 182 Ų | 182 | 137.5 Ų | 137.5 | 79% | 0.791 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -75.8 | -14.9 | 176.7 | -80.8 | -178 | 177.4 | 177.9 | 0 | 114.3 | Q150 E151 Q152 | Q150-K154 PolarHBondContact O-N 3.27Å; E151-K154 PolarHBondContact O-N 2.92Å; Q152-K154 VanDerWaalsContact C-N 3.29Å; Q152-K154 PolarHBondContact O-N 3.4Å |
| 155 | Q | 51.5 | Low | 51.9 | Low | 158 Ų | 158 | 138.6 Ų | 138.6 | 74% | 0.738 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -0.9 | 176.6 | -68.4 | -165.5 | -3.2 | 0 | 0 | 113.5 | Q152 Q153 | Q152-Q155 PolarHBondContact O-N 3.05Å; Q153-Q155 VanDerWaalsContact C-N 3.3Å; Q153-Q155 PolarHBondContact O-N 3.4Å |
| 156 | H | 47 | Very low | 50.3 | Low | 171 Ų | 171 | 142.3 Ų | 142.3 | 79% | 0.792 | 71% | 0.71 | S | S | * | * | trans | -129.7 | 49.9 | -177 | -115.3 | -75.7 | 0 | 0 | 0 | 113 | ||||
| 157 | E | 43.8 | Very low | 48.4 | Very low | 164 Ų | 164 | 142.9 Ų | 142.9 | 77% | 0.766 | 72% | 0.721 | S | S | * | * | trans | -99.1 | 125.2 | 162.9 | -86 | -89.2 | 126 | 0 | 0 | 109.2 | I159 | E157-I159 PolarHBondContact O-N 3.28Š| ||
| 158 | P | 43.8 | Very low | 46.9 | Very low | 112 Ų | 112 | 145.8 Ų | 145.8 | 73% | 0.727 | 73% | 0.734 | S | S | * | * | trans | -72.3 | 127.8 | 176.6 | 29 | -30.6 | 0 | 0 | 0 | 110.2 | N160 | P158-N160 PolarHBondContact O-N 3.14Å; P158-N160 VanDerWaalsContact O-N 3.1Å | ||
| 159 | I | 43.9 | Very low | 45.8 | Very low | 154 Ų | 154 | 148.5 Ų | 148.5 | 79% | 0.79 | 75% | 0.748 | S | S | * | * | trans | -59.6 | 110.2 | 174.3 | -61.3 | 167.9 | 0 | 0 | 0 | 108.9 | E157 | E157-I159 PolarHBondContact O-N 3.28Š| ||
| 160 | N | 35.8 | Very low | 44.9 | Very low | 155 Ų | 155 | 152.7 Ų | 152.7 | 83% | 0.829 | 76% | 0.761 | S | S | * | * | trans | -114.8 | 105.9 | 164.4 | -164.3 | 9.5 | 0 | 0 | 0 | 109.3 | P158 | P158-N160 PolarHBondContact O-N 3.14Å; P158-N160 VanDerWaalsContact O-N 3.1Å | ||
| 161 | N | 43.4 | Very low | 43.8 | Very low | 130 Ų | 130 | 155.3 Ų | 155.3 | 70% | 0.695 | 77% | 0.771 | S | S | * | * | trans | -78.6 | 123.7 | 176.8 | -82.2 | -22.7 | 0 | 0 | 0 | 109.9 | ||||
| 162 | N | 33.6 | Very low | 42.7 | Very low | 164 Ų | 164 | 157.6 Ų | 157.6 | 88% | 0.877 | 79% | 0.786 | S | S | * | * | trans | -158.4 | 126.9 | 143.5 | -98.9 | -22.9 | 0 | 0 | 0 | 111.8 | ||||
| 163 | N | 43.3 | Very low | 41.8 | Very low | 150 Ų | 150 | 157.7 Ų | 157.7 | 80% | 0.802 | 79% | 0.787 | S | S | * | * | trans | -84.7 | 133.1 | 177.8 | -68 | -38.5 | 0 | 0 | 0 | 110.7 | ||||
| 164 | N | 34.3 | Very low | 40.9 | Very low | 142 Ų | 142 | 157.1 Ų | 157.1 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | 164.4 | 135.2 | 115 | -90.9 | -14.4 | 0 | 0 | 0 | 113 | |||||
| 165 | T | 39.3 | Very low | 40.1 | Very low | 129 Ų | 129 | 152.6 Ų | 152.6 | 79% | 0.791 | 78% | 0.778 | S | S | * | * | trans | 52 | 124 | 149 | 51.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 166 | E | 33.4 | Very low | 39.6 | Very low | 178 Ų | 178 | 151.3 Ų | 151.3 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | -177.4 | 163.3 | 52.1 | -164.2 | 176.2 | 157.9 | 0 | 0 | 109.3 | |||||
| 167 | M | 31.5 | Very low | 39.3 | Very low | 174 Ų | 174 | 149 Ų | 149 | 86% | 0.857 | 76% | 0.76 | S | S | * | * | trans | 94.1 | 113.2 | 167.5 | -54.1 | -139.9 | -115 | 0 | 0 | 119.3 | ||||
| 168 | K | 34.9 | Very low | 39.3 | Very low | 202 Ų | 202 | 145.5 Ų | 145.5 | 88% | 0.878 | 75% | 0.75 | S | S | * | * | trans | -45.7 | 166.2 | 151.5 | -90.5 | 178.9 | 175.4 | 174.1 | 0 | 111.1 | ||||
| 169 | P | 42.6 | Very low | 39.5 | Very low | 105 Ų | 105 | 142.9 Ų | 142.9 | 68% | 0.682 | 74% | 0.737 | S | S | * | * | cis | -141.4 | 177.6 | 15.2 | 28.9 | -4 | 0 | 0 | 0 | 115.5 | ||||
| 170 | K | 43.2 | Very low | 39.7 | Very low | 197 Ų | 197 | 140.7 Ų | 140.7 | 86% | 0.857 | 72% | 0.722 | S | S | * | * | trans | 48.9 | 97.9 | 147.3 | -71.3 | 171.3 | 178.1 | 179.2 | 0 | 118.3 | ||||
| 171 | K | 38 | Very low | 40.6 | Very low | 172 Ų | 172 | 138 Ų | 138 | 75% | 0.748 | 71% | 0.708 | S | S | * | * | trans | -174.7 | 76.6 | 142.3 | -114.7 | 175.9 | 178.3 | -178.3 | 0 | 112.3 | K174 | K171-K174 HydrophobicContact CG-CB 4.34Š| ||
| 172 | L | 41.8 | Very low | 41.4 | Very low | 180 Ų | 180 | 134.4 Ų | 134.4 | 94% | 0.942 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -120.1 | 1.4 | 159.6 | -105 | 144.9 | 0 | 0 | 0 | 112.8 | ||
| 173 | E | 39.6 | Very low | 42.9 | Very low | 140 Ų | 140 | 130.1 Ų | 130.1 | 65% | 0.654 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -105.5 | 5.8 | -177.9 | -141.5 | -158.7 | 129.6 | 0 | 0 | 114.3 | K177 | E173-K177 IonicContact OE1-NZ 3.62Å; E173-K177 PolarHBondContact OE1-NZ 2.87Å |
| 174 | K | 38 | Very low | 44.3 | Very low | 141 Ų | 141 | 128.8 Ų | 128.8 | 61% | 0.613 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -112 | 1.1 | -171.8 | -142.3 | 179.8 | -176.6 | -179.2 | 0 | 115.4 | K171 T178 | K171-K174 HydrophobicContact CG-CB 4.34Å; K174-T178 PolarHBondContact O-OG1 3.22Å; K174-T178 VanDerWaalsContact O-OG1 3.04Å |
| 175 | A | 40 | Very low | 46.2 | Very low | 86 Ų | 86 | 128.4 Ų | 128.4 | 71% | 0.711 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -90.3 | -25.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 176 | E | 40.7 | Very low | 48 | Very low | 131 Ų | 131 | 128.7 Ų | 128.7 | 61% | 0.612 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -90.2 | -19.1 | -179.7 | -143.8 | -168.1 | 130.9 | 0 | 0 | 113.5 | K180 | E176-K180 WeakPolarHBondContact O-CG 3.31Å; E176-K180 WeakPolarHBondContact OE1-CE 2.85Å; E176-K180 IonicContact OE1-NZ 3.02Å; E176-K180 PolarHBondContact OE1-NZ 3.12Å |
| 177 | K | 41 | Very low | 50.3 | Low | 123 Ų | 123 | 123.7 Ų | 123.7 | 54% | 0.535 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -84 | -24 | 179.2 | -86.4 | 171.6 | 175.2 | 162.2 | 0 | 113.8 | E173 N181 | E173-K177 IonicContact OE1-NZ 3.62Å; E173-K177 PolarHBondContact OE1-NZ 2.87Å; K177-N181 PolarHBondContact O-N 3.28Å |
| 178 | T | 43.3 | Very low | 52.8 | Low | 91 Ų | 91 | 120.6 Ų | 120.6 | 56% | 0.558 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -80 | -34.1 | 178.5 | 16.6 | 0 | 0 | 0 | 0 | 113.1 | K174 S182 | K174-T178 PolarHBondContact O-OG1 3.22Å; K174-T178 VanDerWaalsContact O-OG1 3.04Å; T178-S182 PolarHBondContact O-N 2.61Å |
| 179 | A | 47.1 | Very low | 55.3 | Low | 56 Ų | 56 | 115.9 Ų | 115.9 | 46% | 0.463 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -73.4 | -32.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | N181 S182 D183 | A179-N181 VanDerWaalsContact C-N 3.34Å; A179-S182 PolarHBondContact O-OG 2.98Å; A179-D183 PolarHBondContact O-N 3.04Å |
| 180 | K | 48.9 | Very low | 57.4 | Low | 108 Ų | 108 | 112.7 Ų | 112.7 | 47% | 0.47 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.8 | -34.6 | 174.3 | -72.6 | 177.6 | -173.5 | 169.3 | 0 | 112.2 | E176 Q184 | E176-K180 WeakPolarHBondContact O-CG 3.31Å; E176-K180 WeakPolarHBondContact OE1-CE 2.85Å; E176-K180 IonicContact OE1-NZ 3.02Å; E176-K180 PolarHBondContact OE1-NZ 3.12Å; K180-Q184 VanDerWaalsContact O-CB 3.29Å; K180-Q184 WeakPolarHBondContact O-CB 2.99Å; K180-Q184 VanDerWaalsContact O-CG 3.23Å; K180-Q184 WeakPolarHBondContact O-CG 3.4Å; K180-Q184 PolarHBondContact O-N 3.23Å |
| 181 | N | 54.4 | Low | 59.6 | Low | 98 Ų | 98 | 108.2 Ų | 108.2 | 52% | 0.524 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69.2 | -40.4 | 176.9 | -85.9 | -6.3 | 0 | 0 | 0 | 112.5 | K177 A179 Q185 | K177-N181 PolarHBondContact O-N 3.28Å; A179-N181 VanDerWaalsContact C-N 3.34Å; N181-Q185 WeakPolarHBondContact O-CB 3.47Å; N181-Q185 PolarHBondContact O-N 3.14Å |
| 182 | S | 60.9 | Low | 62.1 | Low | 56 Ų | 56 | 106 Ų | 106 | 39% | 0.392 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.9 | -42.9 | 177.9 | 58.4 | 0 | 0 | 0 | 0 | 112.2 | T178 A179 Q185 Q186 | T178-S182 PolarHBondContact O-N 2.61Å; A179-S182 PolarHBondContact O-OG 2.98Å; S182-Q185 PolarHBondContact O-N 3.27Å; S182-Q186 WeakPolarHBondContact O-CG 3.37Å; S182-Q186 PolarHBondContact O-N 3.32Å |
| 183 | D | 65.1 | Low | 64.4 | Low | 74 Ų | 74 | 103.9 Ų | 103.9 | 40% | 0.396 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.7 | -42.1 | 177.8 | -82.9 | 12.6 | 0 | 0 | 0 | 111.8 | A179 Q185 H187 K213 | A179-D183 PolarHBondContact O-N 3.04Å; D183-Q185 VanDerWaalsContact C-N 3.35Å; D183-H187 VanDerWaalsContact O-CB 3.28Å; D183-H187 WeakPolarHBondContact O-CB 3.34Å; D183-H187 PolarHBondContact O-N 3.14Å; D183-K213 IonicContact OD2-NZ 2.75Å; D183-K213 PolarHBondContact OD2-NZ 3.47Å |
| 184 | Q | 71.6 | Confident | 66.8 | Low | 122 Ų | 122 | 97.2 Ų | 97.2 | 57% | 0.57 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -66.1 | -39.3 | 175.5 | -77.4 | 174.4 | -8.3 | 0 | 0 | 111.6 | K180 H187 E188 | K180-Q184 VanDerWaalsContact O-CB 3.29Å; K180-Q184 WeakPolarHBondContact O-CB 2.99Å; K180-Q184 VanDerWaalsContact O-CG 3.23Å; K180-Q184 WeakPolarHBondContact O-CG 3.4Å; K180-Q184 PolarHBondContact O-N 3.23Å; Q184-H187 PolarHBondContact O-N 3.33Å; Q184-E188 WeakPolarHBondContact O-CB 3.48Å; Q184-E188 PolarHBondContact O-N 2.88Å |
| 185 | Q | 75.7 | Confident | 69.3 | Low | 134 Ų | 134 | 93.8 Ų | 93.8 | 63% | 0.626 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -67.5 | -40.5 | 178.4 | -168.6 | 169.5 | -1.2 | 0 | 0 | 111.6 | N181 S182 D183 E188 E189 | N181-Q185 WeakPolarHBondContact O-CB 3.47Å; N181-Q185 PolarHBondContact O-N 3.14Å; S182-Q185 PolarHBondContact O-N 3.27Å; D183-Q185 VanDerWaalsContact C-N 3.35Å; Q185-E188 PolarHBondContact O-N 3.01Å; Q185-E189 WeakPolarHBondContact O-CB 3.3Å; Q185-E189 PolarHBondContact O-N 3.28Å |
| 186 | Q | 75.5 | Confident | 71.7 | Confident | 135 Ų | 135 | 95.8 Ų | 95.8 | 63% | 0.631 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -66 | -38.6 | 172.4 | -73.3 | -164.3 | -15.5 | 0 | 0 | 112.5 | S182 E188 E189 L190 | S182-Q186 WeakPolarHBondContact O-CG 3.37Å; S182-Q186 PolarHBondContact O-N 3.32Å; Q186-E188 VanDerWaalsContact C-N 3.35Å; Q186-E189 PolarHBondContact O-N 3.37Å; Q186-L190 VanDerWaalsContact O-CB 3.26Å; Q186-L190 WeakPolarHBondContact O-CB 3.48Å; Q186-L190 PolarHBondContact O-N 2.66Å |
| 187 | H | 82.3 | Confident | 73.9 | Confident | 73 Ų | 73 | 95 Ų | 95 | 34% | 0.338 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -66.1 | -38.6 | 176.5 | -163.7 | -97.1 | 0 | 0 | 0 | 111.8 | D183 Q184 R191 L208 | D183-H187 VanDerWaalsContact O-CB 3.28Å; D183-H187 WeakPolarHBondContact O-CB 3.34Å; D183-H187 PolarHBondContact O-N 3.14Å; Q184-H187 PolarHBondContact O-N 3.33Å; H187-R191 WeakPolarHBondContact O-CB 3.4Å; H187-R191 PolarHBondContact O-N 3.27Å; H187-L208 PolarHBondContact NE2-O 3.14Å; H187-L208 VanDerWaalsContact NE2-O 3.11Å |
| 188 | E | 84.7 | Confident | 76.1 | Confident | 108 Ų | 108 | 91.9 Ų | 91.9 | 51% | 0.505 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -72.8 | -37.2 | 176 | -167.7 | 171.6 | 172.4 | 0 | 0 | 112.6 | Q184 Q185 Q186 R191 K192 | Q184-E188 WeakPolarHBondContact O-CB 3.48Å; Q184-E188 PolarHBondContact O-N 2.88Å; Q185-E188 PolarHBondContact O-N 3.01Å; Q186-E188 VanDerWaalsContact C-N 3.35Å; E188-R191 WeakPolarHBondContact O-CB 3.31Å; E188-R191 PolarHBondContact O-N 3.19Å; E188-K192 WeakPolarHBondContact O-CG 3.23Å; E188-K192 PolarHBondContact O-N 3.07Å; E188-K192 IonicContact OE1-NZ 3.29Å |
| 189 | E | 86.3 | Confident | 78.3 | Confident | 104 Ų | 104 | 89.9 Ų | 89.9 | 49% | 0.486 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.6 | -43.7 | 173.2 | -167 | -177.3 | 155.3 | 0 | 0 | 111.4 | Q185 Q186 R191 K192 R193 | Q185-E189 WeakPolarHBondContact O-CB 3.3Å; Q185-E189 PolarHBondContact O-N 3.28Å; Q186-E189 PolarHBondContact O-N 3.37Å; E189-R191 VanDerWaalsContact C-N 3.34Å; E189-R191 PolarHBondContact O-N 3.36Å; E189-K192 PolarHBondContact O-N 3.05Å; E189-R193 WeakPolarHBondContact O-CB 3.28Å; E189-R193 PolarHBondContact O-N 3.44Å; E189-R193 IonicContact OE1-NH2 3.93Å; E189-R193 PolarHBondContact OE1-NH2 3.06Å |
| 190 | L | 86.6 | Confident | 80.3 | Confident | 38 Ų | 38 | 93.2 Ų | 93.2 | 20% | 0.199 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.3 | -44 | 173.1 | -178.6 | 60.7 | 0 | 0 | 0 | 110.9 | Q186 K192 R193 L194 L208 L216 I219 | Q186-L190 VanDerWaalsContact O-CB 3.26Å; Q186-L190 WeakPolarHBondContact O-CB 3.48Å; Q186-L190 PolarHBondContact O-N 2.66Å; L190-K192 PolarHBondContact O-N 2.74Å; L190-R193 PolarHBondContact O-N 3.1Å; L190-L194 HydrophobicContact CD1-CD1 4.31Å; L190-L194 HydrophobicContact CD1-CG 4.32Å; L190-L194 HydrophobicContact CG-CD1 4.1Å; L190-L194 VanDerWaalsContact O-CG 3.25Å; L190-L194 WeakPolarHBondContact O-CG 3.4Å; L190-L194 PolarHBondContact O-N 2.93Å; L190-L208 HydrophobicContact CD2-CD2 3.89Å; L190-L208 HydrophobicContact CG-CD2 4.33Å; L190-L216 HydrophobicContact CD2-CB 4.4Å; L190-I219 HydrophobicContact CD1-CG2 4.39Å; L190-I219 HydrophobicContact CD2-CG2 4.31Å |
| 191 | R | 90 | Very high | 82.1 | Confident | 102 Ų | 102 | 90.6 Ų | 90.6 | 39% | 0.385 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -56.6 | -49.9 | 173.8 | -176 | -177.1 | -178.1 | 167.9 | 6.5 | 111.6 | H187 E188 E189 R193 L194 L195 V204 E205 L208 | H187-R191 WeakPolarHBondContact O-CB 3.4Å; H187-R191 PolarHBondContact O-N 3.27Å; E188-R191 WeakPolarHBondContact O-CB 3.31Å; E188-R191 PolarHBondContact O-N 3.19Å; E189-R191 VanDerWaalsContact C-N 3.34Å; E189-R191 PolarHBondContact O-N 3.36Å; R191-R193 VanDerWaalsContact C-N 3.35Å; R191-R193 PolarHBondContact O-N 2.77Å; R191-L194 PolarHBondContact O-N 3.15Å; R191-L195 HydrophobicContact CG-CD1 4.14Å; R191-L195 WeakPolarHBondContact O-CG 3.4Å; R191-L195 PolarHBondContact O-N 2.79Å; R191-V204 HydrophobicContact CG-CG1 3.93Å; R191-E205 IonicContact NH2-OE2 2.61Å; R191-L208 HydrophobicContact CB-CD1 3.66Å; R191-L208 HydrophobicContact CG-CD1 3.97Å |
| 192 | K | 90.1 | Very high | 83.7 | Confident | 127 Ų | 127 | 88.7 Ų | 88.7 | 55% | 0.552 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -59 | -46.2 | 177.8 | -75.7 | 176.1 | -176.7 | 172.7 | 0 | 110.9 | E188 E189 L190 L194 L195 T196 | E188-K192 WeakPolarHBondContact O-CG 3.23Å; E188-K192 PolarHBondContact O-N 3.07Å; E188-K192 IonicContact OE1-NZ 3.29Å; E189-K192 PolarHBondContact O-N 3.05Å; L190-K192 PolarHBondContact O-N 2.74Å; K192-L194 PolarHBondContact O-N 3.29Å; K192-L195 PolarHBondContact O-N 2.95Å; K192-T196 PolarHBondContact O-N 3.15Å; K192-T196 PolarHBondContact O-OG1 3.22Å |
| 193 | R | 90 | Very high | 84.9 | Confident | 135 Ų | 135 | 86.3 Ų | 86.3 | 51% | 0.509 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.8 | -44.7 | 178.4 | -170.1 | 178.2 | -63.2 | -176.6 | 1.5 | 112.4 | E189 L190 R191 T196 K197 | E189-R193 WeakPolarHBondContact O-CB 3.28Å; E189-R193 PolarHBondContact O-N 3.44Å; E189-R193 IonicContact OE1-NH2 3.93Å; E189-R193 PolarHBondContact OE1-NH2 3.06Å; L190-R193 PolarHBondContact O-N 3.1Å; R191-R193 VanDerWaalsContact C-N 3.35Å; R191-R193 PolarHBondContact O-N 2.77Å; R193-T196 PolarHBondContact O-N 3.29Å; R193-K197 WeakPolarHBondContact O-CG 3.15Å; R193-K197 PolarHBondContact O-N 3.39Å |
| 194 | L | 89.8 | Confident | 86 | Confident | 0 Ų | 0 | 82.8 Ų | 82.8 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -66.7 | -39.3 | 178.6 | -66.9 | 169.8 | 0 | 0 | 0 | 112.2 | L190 R191 K192 K197 Y199 V204 I219 E220 M223 | L190-L194 HydrophobicContact CD1-CD1 4.31Å; L190-L194 HydrophobicContact CD1-CG 4.32Å; L190-L194 HydrophobicContact CG-CD1 4.1Å; L190-L194 VanDerWaalsContact O-CG 3.25Å; L190-L194 WeakPolarHBondContact O-CG 3.4Å; L190-L194 PolarHBondContact O-N 2.93Å; R191-L194 PolarHBondContact O-N 3.15Å; K192-L194 PolarHBondContact O-N 3.29Å; L194-K197 PolarHBondContact O-N 3.49Å; L194-Y199 HydrophobicContact CB-CD2 4.35Å; L194-Y199 HydrophobicContact CD2-CD2 4.12Å; L194-Y199 HydrophobicContact CD2-CE2 4.17Å; L194-Y199 WeakPolarHBondContact O-CD2 3.02Å; L194-Y199 PolarHBondContact O-N 3.08Å; L194-V204 HydrophobicContact CB-CG1 4.15Å; L194-V204 HydrophobicContact CB-CG2 3.86Å; L194-V204 HydrophobicContact CD1-CG1 4.07Å; L194-I219 HydrophobicContact CD1-CD1 4.08Å; L194-I219 HydrophobicContact CD1-CG2 4.14Å; L194-I219 HydrophobicContact CD2-CG2 4.41Å; L194-E220 HydrophobicContact CD2-CG 3.56Å; L194-M223 HydrophobicContact CD1-SD 3.9Å; L194-M223 HydrophobicContact CD2-SD 4.06Å; L194-M223 HydrophobicContact CG-SD 4.48Å |
| 195 | L | 90.6 | Very high | 86.9 | Confident | 69 Ų | 69 | 80.5 Ų | 80.5 | 36% | 0.361 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 175.6 | -68.9 | 173.2 | 0 | 0 | 0 | 111.8 | R191 K192 K197 G198 A201 V204 | R191-L195 HydrophobicContact CG-CD1 4.14Å; R191-L195 WeakPolarHBondContact O-CG 3.4Å; R191-L195 PolarHBondContact O-N 2.79Å; K192-L195 PolarHBondContact O-N 2.95Å; L195-K197 VanDerWaalsContact C-N 3.26Å; L195-K197 PolarHBondContact O-N 3.07Å; L195-G198 WeakPolarHBondContact O-CA 3.45Å; L195-G198 PolarHBondContact O-N 3.14Å; L195-A201 HydrophobicContact CD2-CB 3.84Å; L195-V204 HydrophobicContact CD2-CB 4.49Å; L195-V204 HydrophobicContact CD2-CG2 4.14Å |
| 196 | T | 90.8 | Very high | 87.5 | Confident | 127 Ų | 127 | 76.8 Ų | 76.8 | 78% | 0.779 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -63.1 | -32.6 | 175.5 | -54.6 | 0 | 0 | 0 | 0 | 112.2 | K192 R193 G198 | K192-T196 PolarHBondContact O-N 3.15Å; K192-T196 PolarHBondContact O-OG1 3.22Å; R193-T196 PolarHBondContact O-N 3.29Å; T196-G198 PolarHBondContact O-N 3.41Å |
| 197 | K | 87.9 | Confident | 88 | Confident | 114 Ų | 114 | 70.4 Ų | 70.4 | 50% | 0.496 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -5.2 | 171.6 | -77.8 | -176.3 | 170 | -173.9 | 0 | 113.9 | R193 L194 L195 Y199 E220 | R193-K197 WeakPolarHBondContact O-CG 3.15Å; R193-K197 PolarHBondContact O-N 3.39Å; L194-K197 PolarHBondContact O-N 3.49Å; L195-K197 VanDerWaalsContact C-N 3.26Å; L195-K197 PolarHBondContact O-N 3.07Å; K197-Y199 HydrophobicContact CB-CD2 3.93Å; K197-Y199 HydrophobicContact CB-CE2 4Å; K197-Y199 HydrophobicContact CD-CE2 4.3Å; K197-E220 IonicContact NZ-OE1 2.74Å; K197-E220 PolarHBondContact NZ-OE1 3.36Å; K197-E220 IonicContact NZ-OE2 2.75Å; K197-E220 PolarHBondContact NZ-OE2 3.35Å |
| 198 | G | 87.2 | Confident | 88.3 | Confident | 59 Ų | 59 | 67.5 Ų | 67.5 | 61% | 0.608 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.1 | 17.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | L195 T196 | L195-G198 WeakPolarHBondContact O-CA 3.45Å; L195-G198 PolarHBondContact O-N 3.14Å; T196-G198 PolarHBondContact O-N 3.41Å |
| 199 | Y | 89.2 | Confident | 88.4 | Confident | 49 Ų | 49 | 70.5 Ų | 70.5 | 19% | 0.192 | 34% | 0.339 | C | S | . | . | trans | -73.6 | 145.6 | 170.3 | -68.5 | -76.8 | 0 | 0 | 0 | 111 | L194 K197 M223 | L194-Y199 HydrophobicContact CB-CD2 4.35Å; L194-Y199 HydrophobicContact CD2-CD2 4.12Å; L194-Y199 HydrophobicContact CD2-CE2 4.17Å; L194-Y199 WeakPolarHBondContact O-CD2 3.02Å; L194-Y199 PolarHBondContact O-N 3.08Å; K197-Y199 HydrophobicContact CB-CD2 3.93Å; K197-Y199 HydrophobicContact CB-CE2 4Å; K197-Y199 HydrophobicContact CD-CE2 4.3Å; Y199-M223 HydrophobicContact CD1-CB 4.37Å; Y199-M223 HydrophobicContact CD1-CE 3.55Å; Y199-M223 HydrophobicContact CD2-CE 3.87Å; Y199-M223 HydrophobicContact CE1-CB 4.22Å; Y199-M223 HydrophobicContact CE1-CE 4.28Å; Y199-M223 HydrophobicContact CG-CE 3.31Å | ||
| 200 | R | 88.4 | Confident | 88.4 | Confident | 125 Ų | 125 | 68.7 Ų | 68.7 | 47% | 0.472 | 34% | 0.337 | S | S | . | . | trans | -66.1 | 140.3 | 177.5 | -63.9 | 164.2 | 46.5 | -179.3 | 5.8 | 111 | D202 I203 V204 E230 | R200-D202 VanDerWaalsContact C-N 3.31Å; R200-D202 WeakPolarHBondContact CB-OD1 3.27Å; R200-D202 IonicContact CZ-OD1 3.07Å; R200-D202 IonicContact CZ-OD2 3.78Å; R200-D202 IonicContact NE-OD1 3.78Å; R200-D202 PolarHBondContact NE-OD1 3.06Å; R200-D202 IonicContact NE-OD2 2.66Å; R200-D202 IonicContact NH2-OD1 3.67Å; R200-D202 IonicContact NH2-OD2 3.27Å; R200-D202 PolarHBondContact NH2-OD2 3.19Å; R200-D202 PolarHBondContact O-N 3.43Å; R200-I203 HydrophobicContact CB-CB 4.49Å; R200-I203 HydrophobicContact CB-CD1 4.21Å; R200-I203 HydrophobicContact CB-CG1 4.16Å; R200-I203 PolarHBondContact O-N 2.94Å; R200-V204 WeakPolarHBondContact O-CG2 3.27Å; R200-V204 PolarHBondContact O-N 3.16Å; R200-E230 IonicContact CZ-OE1 3.4Å; R200-E230 IonicContact NH1-OE1 2.7Å; R200-E230 PolarHBondContact NH1-OE1 3.35Å; R200-E230 IonicContact NH1-OE2 3.37Å; R200-E230 PolarHBondContact NH1-OE2 3.06Å; R200-E230 VanDerWaalsContact NH1-OE2 3.1Å; R200-E230 IonicContact NH2-OE1 2.81Å | ||
| 201 | A | 87.1 | Confident | 88.3 | Confident | 53 Ų | 53 | 67.4 Ų | 67.4 | 44% | 0.438 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.8 | -35.3 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L195 V204 E205 | L195-A201 HydrophobicContact CD2-CB 3.84Å; A201-V204 PolarHBondContact O-N 3.42Å; A201-E205 VanDerWaalsContact O-CB 3.32Å; A201-E205 WeakPolarHBondContact O-CB 3.45Å; A201-E205 PolarHBondContact O-N 2.87Å |
| 202 | D | 87 | Confident | 88.1 | Confident | 59 Ų | 59 | 65 Ų | 65 | 32% | 0.316 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.1 | -39.6 | 177.2 | 64.4 | -41.9 | 0 | 0 | 0 | 112.3 | R200 K206 | R200-D202 VanDerWaalsContact C-N 3.31Å; R200-D202 WeakPolarHBondContact CB-OD1 3.27Å; R200-D202 IonicContact CZ-OD1 3.07Å; R200-D202 IonicContact CZ-OD2 3.78Å; R200-D202 IonicContact NE-OD1 3.78Å; R200-D202 PolarHBondContact NE-OD1 3.06Å; R200-D202 IonicContact NE-OD2 2.66Å; R200-D202 IonicContact NH2-OD1 3.67Å; R200-D202 IonicContact NH2-OD2 3.27Å; R200-D202 PolarHBondContact NH2-OD2 3.19Å; R200-D202 PolarHBondContact O-N 3.43Å; D202-K206 WeakPolarHBondContact O-CB 3.33Å; D202-K206 PolarHBondContact O-N 2.74Å; D202-K206 VanDerWaalsContact O-N 3.08Å |
| 203 | I | 86.4 | Confident | 87.7 | Confident | 5 Ų | 5 | 66.1 Ų | 66.1 | 3% | 0.026 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -66.7 | -46.9 | 175.9 | -62 | -176.4 | 0 | 0 | 0 | 110.6 | R200 A207 M223 I237 | R200-I203 HydrophobicContact CB-CB 4.49Å; R200-I203 HydrophobicContact CB-CD1 4.21Å; R200-I203 HydrophobicContact CB-CG1 4.16Å; R200-I203 PolarHBondContact O-N 2.94Å; I203-A207 WeakPolarHBondContact O-CB 3.44Å; I203-A207 PolarHBondContact O-N 2.91Å; I203-M223 HydrophobicContact CG2-CB 4.06Å; I203-M223 HydrophobicContact CG2-CE 3.8Å; I203-M223 HydrophobicContact CG2-CG 3.83Å; I203-I237 HydrophobicContact CB-CD1 3.72Å; I203-I237 HydrophobicContact CD1-CD1 4.16Å; I203-I237 HydrophobicContact CG1-CD1 3.53Å; I203-I237 HydrophobicContact CG2-CD1 3.41Å; I203-I237 VanDerWaalsContact CG2-CD1 3.41Å |
| 204 | V | 89.8 | Confident | 87.4 | Confident | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.6 | -48.2 | 178.4 | 174.5 | 0 | 0 | 0 | 0 | 110.4 | R191 L194 L195 R200 A201 A207 L208 M223 | R191-V204 HydrophobicContact CG-CG1 3.93Å; L194-V204 HydrophobicContact CB-CG1 4.15Å; L194-V204 HydrophobicContact CB-CG2 3.86Å; L194-V204 HydrophobicContact CD1-CG1 4.07Å; L195-V204 HydrophobicContact CD2-CB 4.49Å; L195-V204 HydrophobicContact CD2-CG2 4.14Å; R200-V204 WeakPolarHBondContact O-CG2 3.27Å; R200-V204 PolarHBondContact O-N 3.16Å; A201-V204 PolarHBondContact O-N 3.42Å; V204-A207 PolarHBondContact O-N 3.38Å; V204-L208 HydrophobicContact CG1-CD1 3.65Å; V204-L208 HydrophobicContact CG1-CG 4.33Å; V204-L208 VanDerWaalsContact O-CB 3.25Å; V204-L208 WeakPolarHBondContact O-CB 3.49Å; V204-L208 VanDerWaalsContact O-CG 3.27Å; V204-L208 WeakPolarHBondContact O-CG 3.26Å; V204-L208 PolarHBondContact O-N 3.13Å; V204-M223 HydrophobicContact CB-CE 4.25Å; V204-M223 HydrophobicContact CG2-CE 3.34Å; V204-M223 HydrophobicContact CG2-SD 4.46Å |
| 205 | E | 89.3 | Confident | 87 | Confident | 75 Ų | 75 | 66.4 Ų | 66.4 | 35% | 0.35 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -66.4 | -41.7 | -176.6 | -168.1 | 177 | 152.9 | 0 | 0 | 112.3 | R191 A201 R209 | R191-E205 IonicContact NH2-OE2 2.61Å; A201-E205 VanDerWaalsContact O-CB 3.32Å; A201-E205 WeakPolarHBondContact O-CB 3.45Å; A201-E205 PolarHBondContact O-N 2.87Å; E205-R209 VanDerWaalsContact O-CB 3.3Å; E205-R209 WeakPolarHBondContact O-CB 3.26Å; E205-R209 PolarHBondContact O-N 3.42Å; E205-R209 IonicContact OE1-CZ 2.74Å; E205-R209 IonicContact OE1-NH1 2.74Å; E205-R209 IonicContact OE1-NH2 2.71Å; E205-R209 PolarHBondContact OE1-NH2 3.46Å |
| 206 | K | 87.6 | Confident | 86.8 | Confident | 56 Ų | 56 | 64.6 Ų | 64.6 | 24% | 0.243 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.9 | -46.7 | 174.3 | -86.3 | 175.3 | -174.7 | 165.2 | 0 | 112.3 | D202 L208 R209 C210 I237 D238 L241 | D202-K206 WeakPolarHBondContact O-CB 3.33Å; D202-K206 PolarHBondContact O-N 2.74Å; D202-K206 VanDerWaalsContact O-N 3.08Å; K206-L208 VanDerWaalsContact C-N 3.32Å; K206-L208 PolarHBondContact O-N 3.35Å; K206-R209 PolarHBondContact O-N 2.84Å; K206-C210 WeakPolarHBondContact O-CB 3.28Å; K206-C210 PolarHBondContact O-N 3.35Å; K206-C210 PolarHBondContact O-SG 2.81Å; K206-I237 HydrophobicContact CD-CG2 3.86Å; K206-D238 VanDerWaalsContact CD-OD1 3.31Å; K206-D238 WeakPolarHBondContact CD-OD1 3.29Å; K206-D238 WeakPolarHBondContact CE-OD1 3.3Å; K206-D238 IonicContact NZ-OD1 3.86Å; K206-D238 PolarHBondContact NZ-OD1 2.92Å; K206-D238 IonicContact NZ-OD2 3.73Å; K206-D238 PolarHBondContact NZ-OD2 3.47Å; K206-L241 HydrophobicContact CB-CD2 4.13Å |
| 207 | A | 87.9 | Confident | 86.6 | Confident | 1 Ų | 1 | 64.2 Ų | 64.2 | 1% | 0.008 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -57.9 | -47.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | I203 V204 R209 C210 L211 I219 M223 L241 | I203-A207 WeakPolarHBondContact O-CB 3.44Å; I203-A207 PolarHBondContact O-N 2.91Å; V204-A207 PolarHBondContact O-N 3.38Å; A207-R209 VanDerWaalsContact C-N 3.33Å; A207-R209 PolarHBondContact O-N 3.49Å; A207-C210 PolarHBondContact O-N 2.87Å; A207-L211 VanDerWaalsContact O-CB 3.28Å; A207-L211 WeakPolarHBondContact O-CB 3.38Å; A207-L211 PolarHBondContact O-N 2.85Å; A207-I219 HydrophobicContact CB-CD1 3.88Å; A207-I219 HydrophobicContact CB-CG1 3.9Å; A207-M223 HydrophobicContact CB-CG 3.83Å; A207-M223 HydrophobicContact CB-SD 4.28Å; A207-L241 HydrophobicContact CB-CD2 4.38Å |
| 208 | L | 88.3 | Confident | 86.6 | Confident | 12 Ų | 12 | 61.2 Ų | 61.2 | 6% | 0.063 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -67 | -28 | 179.3 | -77.6 | 175.8 | 0 | 0 | 0 | 114.4 | H187 L190 R191 V204 K206 L216 I219 | H187-L208 PolarHBondContact NE2-O 3.14Å; H187-L208 VanDerWaalsContact NE2-O 3.11Å; L190-L208 HydrophobicContact CD2-CD2 3.89Å; L190-L208 HydrophobicContact CG-CD2 4.33Å; R191-L208 HydrophobicContact CB-CD1 3.66Å; R191-L208 HydrophobicContact CG-CD1 3.97Å; V204-L208 HydrophobicContact CG1-CD1 3.65Å; V204-L208 HydrophobicContact CG1-CG 4.33Å; V204-L208 VanDerWaalsContact O-CB 3.25Å; V204-L208 WeakPolarHBondContact O-CB 3.49Å; V204-L208 VanDerWaalsContact O-CG 3.27Å; V204-L208 WeakPolarHBondContact O-CG 3.26Å; V204-L208 PolarHBondContact O-N 3.13Å; K206-L208 VanDerWaalsContact C-N 3.32Å; K206-L208 PolarHBondContact O-N 3.35Å; L208-L216 HydrophobicContact CD2-CD2 4.08Å; L208-I219 HydrophobicContact CD2-CD1 3.46Å; L208-I219 VanDerWaalsContact CD2-CD1 3.46Å; L208-I219 HydrophobicContact CG-CD1 3.77Å |
| 209 | R | 86.8 | Confident | 86.8 | Confident | 171 Ų | 171 | 58.5 Ų | 58.5 | 65% | 0.645 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -82.4 | -37.2 | 177.5 | -175.7 | -178.1 | -69.3 | 138.4 | 4.7 | 112.4 | E205 K206 A207 | E205-R209 VanDerWaalsContact O-CB 3.3Å; E205-R209 WeakPolarHBondContact O-CB 3.26Å; E205-R209 PolarHBondContact O-N 3.42Å; E205-R209 IonicContact OE1-CZ 2.74Å; E205-R209 IonicContact OE1-NH1 2.74Å; E205-R209 IonicContact OE1-NH2 2.71Å; E205-R209 PolarHBondContact OE1-NH2 3.46Å; K206-R209 PolarHBondContact O-N 2.84Å; A207-R209 VanDerWaalsContact C-N 3.33Å; A207-R209 PolarHBondContact O-N 3.49Å |
| 210 | C | 85.1 | Confident | 86.9 | Confident | 65 Ų | 65 | 58.5 Ų | 58.5 | 44% | 0.439 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -96 | -26.7 | -172.2 | -64.1 | 0 | 0 | 0 | 0 | 113.6 | K206 A207 L241 I245 | K206-C210 WeakPolarHBondContact O-CB 3.28Å; K206-C210 PolarHBondContact O-N 3.35Å; K206-C210 PolarHBondContact O-SG 2.81Å; A207-C210 PolarHBondContact O-N 2.87Å; C210-L241 HydrophobicContact CB-CD2 4.09Å; C210-I245 HydrophobicContact CB-CD1 3.9Å |
| 211 | L | 85.8 | Confident | 87.1 | Confident | 11 Ų | 11 | 56 Ų | 56 | 6% | 0.058 | 29% | 0.289 | C | S | . | . | S | Bend | trans | -72.2 | 136.7 | 178.6 | -104.7 | 79.4 | 0 | 0 | 0 | 111.6 | A207 R215 L216 I219 Y222 L241 I245 | A207-L211 VanDerWaalsContact O-CB 3.28Å; A207-L211 WeakPolarHBondContact O-CB 3.38Å; A207-L211 PolarHBondContact O-N 2.85Å; L211-R215 HydrophobicContact CD2-CB 3.96Å; L211-R215 WeakPolarHBondContact CD2-O 3.48Å; L211-R215 HydrophobicContact CG-CB 4.46Å; L211-L216 HydrophobicContact CB-CD2 4.07Å; L211-I219 HydrophobicContact CD2-CB 4.17Å; L211-I219 HydrophobicContact CD2-CG1 4.24Å; L211-Y222 HydrophobicContact CD1-CD1 4.4Å; L211-Y222 HydrophobicContact CD1-CG 4.2Å; L211-Y222 HydrophobicContact CD2-CD2 3.93Å; L211-Y222 HydrophobicContact CD2-CE2 4.36Å; L211-Y222 HydrophobicContact CD2-CG 4.3Å; L211-L241 HydrophobicContact CD1-CD1 3.77Å; L211-I245 HydrophobicContact CD1-CD1 4.01Å; L211-I245 HydrophobicContact CD1-CG1 4.12Å |
| 212 | P | 84.4 | Confident | 87.3 | Confident | 51 Ų | 51 | 53.5 Ų | 53.5 | 33% | 0.331 | 27% | 0.268 | S | S | . | . | trans | -60.3 | 144.9 | 166 | -19.5 | 31 | 0 | 0 | 0 | 111.5 | S214 R215 L216 | P212-S214 PolarHBondContact O-N 3.31Å; P212-S214 VanDerWaalsContact O-N 3.15Å; P212-R215 PolarHBondContact O-N 3.43Å; P212-L216 PolarHBondContact O-N 3.11Å | ||
| 213 | K | 83.1 | Confident | 87.6 | Confident | 151 Ų | 151 | 50.7 Ų | 50.7 | 66% | 0.657 | 25% | 0.253 | S | S | * | . | G | 310 helix | trans | -52 | -39.8 | 179.4 | -70.2 | -172 | 176.8 | -173.5 | 0 | 113.2 | D183 R215 L216 | D183-K213 IonicContact OD2-NZ 2.75Å; D183-K213 PolarHBondContact OD2-NZ 3.47Å; K213-R215 PolarHBondContact O-N 3.24Å; K213-L216 HydrophobicContact CB-CD1 4.48Å; K213-L216 WeakPolarHBondContact O-CB 3.37Å; K213-L216 PolarHBondContact O-N 2.96Å |
| 214 | S | 82.4 | Confident | 87.9 | Confident | 99 Ų | 99 | 55.9 Ų | 55.9 | 69% | 0.692 | 28% | 0.276 | S | S | * | . | G | 310 helix | trans | -62.1 | -21.5 | 178 | 53.6 | 0 | 0 | 0 | 0 | 114.1 | P212 | P212-S214 PolarHBondContact O-N 3.31Å; P212-S214 VanDerWaalsContact O-N 3.15Å |
| 215 | R | 82.7 | Confident | 88.1 | Confident | 42 Ų | 42 | 55.9 Ų | 55.9 | 16% | 0.158 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -103.3 | -1.9 | -178.7 | -63 | -167.5 | -174.8 | 156.4 | 11 | 113.8 | L211 P212 K213 V217 H218 I245 N248 | L211-R215 HydrophobicContact CD2-CB 3.96Å; L211-R215 WeakPolarHBondContact CD2-O 3.48Å; L211-R215 HydrophobicContact CG-CB 4.46Å; P212-R215 PolarHBondContact O-N 3.43Å; K213-R215 PolarHBondContact O-N 3.24Å; R215-V217 PolarHBondContact O-N 2.99Å; R215-V217 VanDerWaalsContact O-N 3.12Å; R215-H218 PolarHBondContact O-N 3.02Å; R215-I245 PolarHBondContact NH1-O 3.32Å; R215-N248 PolarHBondContact NH1-OD1 2.98Å; R215-N248 VanDerWaalsContact NH2-CG 3.34Å; R215-N248 PolarHBondContact NH2-OD1 3.45Å |
| 216 | L | 85.2 | Confident | 88.3 | Confident | 32 Ų | 32 | 52.3 Ų | 52.3 | 17% | 0.168 | 26% | 0.259 | C | S | . | . | G | 310 helix | trans | -59.6 | -24.9 | 179.1 | -70.6 | 175.6 | 0 | 0 | 0 | 112.4 | L190 L208 L211 P212 K213 H218 I219 | L190-L216 HydrophobicContact CD2-CB 4.4Å; L208-L216 HydrophobicContact CD2-CD2 4.08Å; L211-L216 HydrophobicContact CB-CD2 4.07Å; P212-L216 PolarHBondContact O-N 3.11Å; K213-L216 HydrophobicContact CB-CD1 4.48Å; K213-L216 WeakPolarHBondContact O-CB 3.37Å; K213-L216 PolarHBondContact O-N 2.96Å; L216-H218 PolarHBondContact O-N 2.86Å; L216-I219 HydrophobicContact CD2-CD1 3.95Å; L216-I219 VanDerWaalsContact O-CB 3.31Å; L216-I219 WeakPolarHBondContact O-CB 3.38Å; L216-I219 WeakPolarHBondContact O-CG2 3.12Å; L216-I219 PolarHBondContact O-N 3.21Å; L216-I219 VanDerWaalsContact O-N 3.14Å |
| 217 | V | 86.4 | Confident | 88.4 | Confident | 119 Ų | 119 | 56.2 Ų | 56.2 | 72% | 0.721 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -57.2 | -30.9 | 171.7 | -172.9 | 0 | 0 | 0 | 0 | 112.1 | R215 | R215-V217 PolarHBondContact O-N 2.99Å; R215-V217 VanDerWaalsContact O-N 3.12Å |
| 218 | H | 89.1 | Confident | 88.7 | Confident | 51 Ų | 51 | 58 Ų | 58 | 24% | 0.236 | 28% | 0.283 | C | S | . | . | G | 310 helix | trans | -103.5 | 9.5 | -178.4 | -54.7 | -45.8 | 0 | 0 | 0 | 113.2 | R215 L216 E220 Y221 Y222 S250 I255 | R215-H218 PolarHBondContact O-N 3.02Å; L216-H218 PolarHBondContact O-N 2.86Å; H218-E220 PolarHBondContact O-N 3.2Å; H218-E220 VanDerWaalsContact O-N 3.16Å; H218-Y221 HydrophobicContact CB-CD2 3.93Å; H218-Y221 AromaticContact ND1-CE2 3.99Å; H218-Y221 WeakPolarHBondContact O-CB 3.44Å; H218-Y221 PolarHBondContact O-N 3.25Å; H218-Y222 HydrophobicContact CB-CD2 4.21Å; H218-Y222 HydrophobicContact CB-CE2 4.18Å; H218-Y222 WeakPolarHBondContact O-CD2 3.45Å; H218-Y222 PolarHBondContact O-N 3.24Å; H218-S250 PolarHBondContact CD2-O 3.07Å; H218-S250 VanDerWaalsContact CD2-O 3.29Å; H218-S250 PolarHBondContact NE2-O 3.03Å; H218-S250 VanDerWaalsContact NE2-O 3.15Å; H218-I255 HydrophobicContact CB-CD1 4.2Å |
| 219 | I | 90.7 | Very high | 88.8 | Confident | 2 Ų | 2 | 57.5 Ų | 57.5 | 1% | 0.01 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -55 | -38.7 | -173.3 | -167.1 | 168.3 | 0 | 0 | 0 | 112.7 | L190 L194 A207 L208 L211 L216 Y221 Y222 M223 | L190-I219 HydrophobicContact CD1-CG2 4.39Å; L190-I219 HydrophobicContact CD2-CG2 4.31Å; L194-I219 HydrophobicContact CD1-CD1 4.08Å; L194-I219 HydrophobicContact CD1-CG2 4.14Å; L194-I219 HydrophobicContact CD2-CG2 4.41Å; A207-I219 HydrophobicContact CB-CD1 3.88Å; A207-I219 HydrophobicContact CB-CG1 3.9Å; L208-I219 HydrophobicContact CD2-CD1 3.46Å; L208-I219 VanDerWaalsContact CD2-CD1 3.46Å; L208-I219 HydrophobicContact CG-CD1 3.77Å; L211-I219 HydrophobicContact CD2-CB 4.17Å; L211-I219 HydrophobicContact CD2-CG1 4.24Å; L216-I219 HydrophobicContact CD2-CD1 3.95Å; L216-I219 VanDerWaalsContact O-CB 3.31Å; L216-I219 WeakPolarHBondContact O-CB 3.38Å; L216-I219 WeakPolarHBondContact O-CG2 3.12Å; L216-I219 PolarHBondContact O-N 3.21Å; L216-I219 VanDerWaalsContact O-N 3.14Å; I219-Y221 VanDerWaalsContact C-N 3.26Å; I219-Y221 PolarHBondContact O-N 3.08Å; I219-Y222 PolarHBondContact O-N 3.25Å; I219-M223 HydrophobicContact CG1-CG 4.31Å; I219-M223 HydrophobicContact CG1-SD 3.98Å; I219-M223 VanDerWaalsContact O-CG 3.27Å; I219-M223 WeakPolarHBondContact O-CG 3.43Å; I219-M223 PolarHBondContact O-N 3.12Å |
| 220 | E | 91.4 | Very high | 89 | Confident | 49 Ų | 49 | 51.7 Ų | 51.7 | 23% | 0.229 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61 | -37.2 | 178.4 | -68.6 | -169.5 | -160.6 | 0 | 0 | 111.9 | L194 K197 H218 M223 K224 | L194-E220 HydrophobicContact CD2-CG 3.56Å; K197-E220 IonicContact NZ-OE1 2.74Å; K197-E220 PolarHBondContact NZ-OE1 3.36Å; K197-E220 IonicContact NZ-OE2 2.75Å; K197-E220 PolarHBondContact NZ-OE2 3.35Å; H218-E220 PolarHBondContact O-N 3.2Å; H218-E220 VanDerWaalsContact O-N 3.16Å; E220-M223 PolarHBondContact O-N 3.19Å; E220-K224 VanDerWaalsContact O-CB 3.29Å; E220-K224 WeakPolarHBondContact O-CB 3.45Å; E220-K224 PolarHBondContact O-N 3.02Å |
| 221 | Y | 93 | Very high | 89.3 | Confident | 72 Ų | 72 | 56.1 Ų | 56.1 | 28% | 0.282 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -71.9 | -40.5 | 178.4 | -51.1 | -44.9 | 0 | 0 | 0 | 111.4 | H218 I219 M223 K224 A225 K252 | H218-Y221 HydrophobicContact CB-CD2 3.93Å; H218-Y221 AromaticContact ND1-CE2 3.99Å; H218-Y221 WeakPolarHBondContact O-CB 3.44Å; H218-Y221 PolarHBondContact O-N 3.25Å; I219-Y221 VanDerWaalsContact C-N 3.26Å; I219-Y221 PolarHBondContact O-N 3.08Å; Y221-M223 VanDerWaalsContact C-N 3.34Å; Y221-M223 PolarHBondContact O-N 3.03Å; Y221-K224 PolarHBondContact O-N 3.05Å; Y221-A225 VanDerWaalsContact O-CB 3.25Å; Y221-A225 WeakPolarHBondContact O-CB 3.49Å; Y221-A225 PolarHBondContact O-N 2.91Å; Y221-K252 HydrophobicContact CD1-CD 4.33Å; Y221-K252 HydrophobicContact CD1-CG 3.81Å; Y221-K252 HydrophobicContact CD2-CB 3.88Å; Y221-K252 HydrophobicContact CD2-CG 4Å; Y221-K252 HydrophobicContact CE1-CD 3.72Å; Y221-K252 HydrophobicContact CE1-CG 3.7Å; Y221-K252 HydrophobicContact CE2-CB 3.78Å; Y221-K252 HydrophobicContact CE2-CD 4.14Å; Y221-K252 HydrophobicContact CE2-CG 3.87Å; Y221-K252 HydrophobicContact CG-CB 4.29Å; Y221-K252 HydrophobicContact CG-CG 3.98Å |
| 222 | Y | 91.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.2 | -42.7 | 172.6 | -82.1 | -88.3 | 0 | 0 | 0 | 111.9 | L211 H218 I219 A225 C226 L241 L244 I245 L249 I255 | L211-Y222 HydrophobicContact CD1-CD1 4.4Å; L211-Y222 HydrophobicContact CD1-CG 4.2Å; L211-Y222 HydrophobicContact CD2-CD2 3.93Å; L211-Y222 HydrophobicContact CD2-CE2 4.36Å; L211-Y222 HydrophobicContact CD2-CG 4.3Å; H218-Y222 HydrophobicContact CB-CD2 4.21Å; H218-Y222 HydrophobicContact CB-CE2 4.18Å; H218-Y222 WeakPolarHBondContact O-CD2 3.45Å; H218-Y222 PolarHBondContact O-N 3.24Å; I219-Y222 PolarHBondContact O-N 3.25Å; Y222-A225 PolarHBondContact O-N 3.41Å; Y222-C226 PolarHBondContact O-N 3.47Å; Y222-C226 PolarHBondContact O-SG 3.18Å; Y222-L241 HydrophobicContact CD1-CD1 4.44Å; Y222-L244 HydrophobicContact CD1-CB 3.75Å; Y222-L244 HydrophobicContact CD1-CD1 4.34Å; Y222-L244 HydrophobicContact CE1-CB 3.7Å; Y222-I245 HydrophobicContact CE1-CG1 4.33Å; Y222-L249 PolarHBondContact OH-O 2.93Å; Y222-I255 HydrophobicContact CD2-CD1 3.95Å; Y222-I255 HydrophobicContact CE2-CD1 3.53Å; Y222-I255 HydrophobicContact CE2-CG1 4.26Å |
| 223 | M | 92.3 | Very high | 89.5 | Confident | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.005 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.8 | -41.4 | 176.9 | -69.4 | 171.8 | 64.8 | 0 | 0 | 112.1 | L194 Y199 I203 V204 A207 I219 E220 Y221 C226 R227 | L194-M223 HydrophobicContact CD1-SD 3.9Å; L194-M223 HydrophobicContact CD2-SD 4.06Å; L194-M223 HydrophobicContact CG-SD 4.48Å; Y199-M223 HydrophobicContact CD1-CB 4.37Å; Y199-M223 HydrophobicContact CD1-CE 3.55Å; Y199-M223 HydrophobicContact CD2-CE 3.87Å; Y199-M223 HydrophobicContact CE1-CB 4.22Å; Y199-M223 HydrophobicContact CE1-CE 4.28Å; Y199-M223 HydrophobicContact CG-CE 3.31Å; I203-M223 HydrophobicContact CG2-CB 4.06Å; I203-M223 HydrophobicContact CG2-CE 3.8Å; I203-M223 HydrophobicContact CG2-CG 3.83Å; V204-M223 HydrophobicContact CB-CE 4.25Å; V204-M223 HydrophobicContact CG2-CE 3.34Å; V204-M223 HydrophobicContact CG2-SD 4.46Å; A207-M223 HydrophobicContact CB-CG 3.83Å; A207-M223 HydrophobicContact CB-SD 4.28Å; I219-M223 HydrophobicContact CG1-CG 4.31Å; I219-M223 HydrophobicContact CG1-SD 3.98Å; I219-M223 VanDerWaalsContact O-CG 3.27Å; I219-M223 WeakPolarHBondContact O-CG 3.43Å; I219-M223 PolarHBondContact O-N 3.12Å; E220-M223 PolarHBondContact O-N 3.19Å; Y221-M223 VanDerWaalsContact C-N 3.34Å; Y221-M223 PolarHBondContact O-N 3.03Å; M223-C226 PolarHBondContact O-N 3.1Å; M223-R227 PolarHBondContact O-N 3.27Å |
| 224 | K | 93.1 | Very high | 89.6 | Confident | 113 Ų | 113 | 55.7 Ų | 55.7 | 49% | 0.491 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.5 | -44.3 | 174.7 | -173.5 | 173.1 | 180 | -178.9 | 0 | 111.2 | E220 Y221 R227 T228 L256 | E220-K224 VanDerWaalsContact O-CB 3.29Å; E220-K224 WeakPolarHBondContact O-CB 3.45Å; E220-K224 PolarHBondContact O-N 3.02Å; Y221-K224 PolarHBondContact O-N 3.05Å; K224-R227 PolarHBondContact O-N 2.75Å; K224-T228 PolarHBondContact O-N 3.4Å; K224-T228 PolarHBondContact O-OG1 3.32Å; K224-T228 VanDerWaalsContact O-OG1 3.11Å; K224-L256 HydrophobicContact CB-CD2 4.12Å; K224-L256 HydrophobicContact CD-CD2 3.91Å; K224-L256 HydrophobicContact CG-CD2 3.94Å |
| 225 | A | 93.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.4 | -48.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y221 Y222 R227 T228 V229 L244 I255 S259 | Y221-A225 VanDerWaalsContact O-CB 3.25Å; Y221-A225 WeakPolarHBondContact O-CB 3.49Å; Y221-A225 PolarHBondContact O-N 2.91Å; Y222-A225 PolarHBondContact O-N 3.41Å; A225-R227 VanDerWaalsContact C-N 3.31Å; A225-R227 PolarHBondContact O-N 3.45Å; A225-T228 WeakPolarHBondContact O-CB 3.46Å; A225-T228 PolarHBondContact O-N 2.98Å; A225-T228 VanDerWaalsContact O-N 3.13Å; A225-V229 WeakPolarHBondContact O-CG2 3.25Å; A225-V229 PolarHBondContact O-N 3.31Å; A225-V229 VanDerWaalsContact O-N 3.14Å; A225-L244 HydrophobicContact CB-CD1 3.63Å; A225-I255 HydrophobicContact CB-CG2 3.83Å; A225-S259 VanDerWaalsContact CA-CB 3.45Å; A225-S259 VanDerWaalsContact CB-CB 3.42Å; A225-S259 WeakPolarHBondContact O-CB 3.29Å |
| 226 | C | 92.9 | Very high | 90 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57.4 | -44.3 | 175.6 | -68.1 | 0 | 0 | 0 | 0 | 111.7 | Y222 M223 T228 V229 E230 I237 | Y222-C226 PolarHBondContact O-N 3.47Å; Y222-C226 PolarHBondContact O-SG 3.18Å; M223-C226 PolarHBondContact O-N 3.1Å; C226-T228 VanDerWaalsContact C-N 3.34Å; C226-T228 PolarHBondContact O-N 2.98Å; C226-V229 PolarHBondContact O-N 2.97Å; C226-E230 VanDerWaalsContact O-CB 3.27Å; C226-E230 WeakPolarHBondContact O-CB 3.36Å; C226-E230 PolarHBondContact O-N 3.03Å; C226-I237 HydrophobicContact CB-CD1 3.67Å; C226-I237 HydrophobicContact CB-CG1 3.92Å |
| 227 | R | 91.6 | Very high | 90.1 | Very high | 139 Ų | 139 | 50.3 Ų | 50.3 | 53% | 0.525 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.5 | -38.7 | 176.9 | -168.8 | 178.9 | -176.2 | -176.6 | 1.9 | 112.4 | M223 K224 A225 V229 E230 K231 | M223-R227 PolarHBondContact O-N 3.27Å; K224-R227 PolarHBondContact O-N 2.75Å; A225-R227 VanDerWaalsContact C-N 3.31Å; A225-R227 PolarHBondContact O-N 3.45Å; R227-V229 VanDerWaalsContact C-N 3.34Å; R227-E230 PolarHBondContact O-N 2.83Å; R227-K231 WeakPolarHBondContact O-CB 3.34Å; R227-K231 VanDerWaalsContact O-CG 3.26Å; R227-K231 WeakPolarHBondContact O-CG 3.27Å; R227-K231 PolarHBondContact O-N 3.38Å |
| 228 | T | 92.5 | Very high | 90.1 | Very high | 39 Ų | 39 | 48.7 Ų | 48.7 | 24% | 0.239 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.6 | -40.6 | 177.5 | -62.7 | 0 | 0 | 0 | 0 | 112.2 | K224 A225 C226 S263 | K224-T228 PolarHBondContact O-N 3.4Å; K224-T228 PolarHBondContact O-OG1 3.32Å; K224-T228 VanDerWaalsContact O-OG1 3.11Å; A225-T228 WeakPolarHBondContact O-CB 3.46Å; A225-T228 PolarHBondContact O-N 2.98Å; A225-T228 VanDerWaalsContact O-N 3.13Å; C226-T228 VanDerWaalsContact C-N 3.34Å; C226-T228 PolarHBondContact O-N 2.98Å; T228-S263 PolarHBondContact O-OG 2.94Å |
| 229 | V | 91.8 | Very high | 90.1 | Very high | 1 Ų | 1 | 49.8 Ų | 49.8 | 1% | 0.006 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -75.4 | -42.7 | 177.4 | -173.8 | 0 | 0 | 0 | 0 | 110.4 | A225 C226 R227 K231 T232 T240 S259 C262 L266 | A225-V229 WeakPolarHBondContact O-CG2 3.25Å; A225-V229 PolarHBondContact O-N 3.31Å; A225-V229 VanDerWaalsContact O-N 3.14Å; C226-V229 PolarHBondContact O-N 2.97Å; R227-V229 VanDerWaalsContact C-N 3.34Å; V229-K231 VanDerWaalsContact C-N 3.27Å; V229-K231 PolarHBondContact O-N 3.26Å; V229-T232 WeakPolarHBondContact O-CB 3.33Å; V229-T232 WeakPolarHBondContact O-CG2 3.36Å; V229-T232 PolarHBondContact O-N 2.86Å; V229-T232 PolarHBondContact O-OG1 3.28Å; V229-T240 HydrophobicContact CB-CG2 3.8Å; V229-T240 HydrophobicContact CG1-CG2 4.01Å; V229-T240 HydrophobicContact CG2-CG2 3.74Å; V229-S259 WeakPolarHBondContact CG2-O 3.48Å; V229-C262 HydrophobicContact CG2-CB 4.05Å; V229-L266 HydrophobicContact CG1-CD1 3.41Å; V229-L266 VanDerWaalsContact CG1-CD1 3.41Å |
| 230 | E | 91.3 | Very high | 90.1 | Very high | 48 Ų | 48 | 49.7 Ų | 49.7 | 22% | 0.224 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61.3 | -34.1 | 179 | -170.7 | -177.2 | -152.7 | 0 | 0 | 112.2 | R200 C226 R227 T232 G233 | R200-E230 IonicContact CZ-OE1 3.4Å; R200-E230 IonicContact NH1-OE1 2.7Å; R200-E230 PolarHBondContact NH1-OE1 3.35Å; R200-E230 IonicContact NH1-OE2 3.37Å; R200-E230 PolarHBondContact NH1-OE2 3.06Å; R200-E230 VanDerWaalsContact NH1-OE2 3.1Å; R200-E230 IonicContact NH2-OE1 2.81Å; C226-E230 VanDerWaalsContact O-CB 3.27Å; C226-E230 WeakPolarHBondContact O-CB 3.36Å; C226-E230 PolarHBondContact O-N 3.03Å; R227-E230 PolarHBondContact O-N 2.83Å; E230-T232 PolarHBondContact O-N 3.14Å; E230-G233 PolarHBondContact O-N 3.26Å |
| 231 | K | 91 | Very high | 90.1 | Very high | 159 Ų | 159 | 47.5 Ų | 47.5 | 69% | 0.691 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -20.5 | 173.5 | -84 | 176.5 | 178.7 | -173 | 0 | 114.2 | R227 V229 G233 | R227-K231 WeakPolarHBondContact O-CB 3.34Å; R227-K231 VanDerWaalsContact O-CG 3.26Å; R227-K231 WeakPolarHBondContact O-CG 3.27Å; R227-K231 PolarHBondContact O-N 3.38Å; V229-K231 VanDerWaalsContact C-N 3.27Å; V229-K231 PolarHBondContact O-N 3.26Å; K231-G233 PolarHBondContact O-N 3.3Å |
| 232 | T | 88.4 | Confident | 90 | Very high | 26 Ų | 26 | 47.1 Ų | 47.1 | 16% | 0.16 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -16.3 | 174.5 | 67.8 | 0 | 0 | 0 | 0 | 113.1 | V229 E230 K234 S263 L266 K267 | V229-T232 WeakPolarHBondContact O-CB 3.33Å; V229-T232 WeakPolarHBondContact O-CG2 3.36Å; V229-T232 PolarHBondContact O-N 2.86Å; V229-T232 PolarHBondContact O-OG1 3.28Å; E230-T232 PolarHBondContact O-N 3.14Å; T232-K234 PolarHBondContact O-N 3.48Å; T232-K234 PolarHBondContact OG1-N 3.17Å; T232-S263 WeakPolarHBondContact CG2-OG 3.38Å; T232-L266 HydrophobicContact CG2-CB 4.25Å; T232-K267 HydrophobicContact CG2-CG 4.2Å |
| 233 | G | 85.4 | Confident | 90 | Very high | 72 Ų | 72 | 47.7 Ų | 47.7 | 74% | 0.742 | 25% | 0.249 | S | C | * | . | S | Bend | trans | 70.6 | 1.7 | -174 | 0 | 0 | 0 | 0 | 0 | 114.4 | E230 K231 | E230-G233 PolarHBondContact O-N 3.26Å; K231-G233 PolarHBondContact O-N 3.3Å |
| 234 | K | 85.1 | Confident | 89.9 | Confident | 106 Ų | 106 | 47.7 Ų | 47.7 | 46% | 0.461 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -107.8 | -3.4 | -173.4 | -63.7 | -178.2 | -174.7 | -176.4 | 0 | 114.1 | T232 L266 | T232-K234 PolarHBondContact O-N 3.48Å; T232-K234 PolarHBondContact OG1-N 3.17Å; K234-L266 HydrophobicContact CB-CB 4.42Å; K234-L266 HydrophobicContact CB-CD2 4.01Å; K234-L266 HydrophobicContact CD-CB 4.4Å; K234-L266 WeakPolarHBondContact CD-O 3.17Å; K234-L266 WeakPolarHBondContact CE-O 3.38Å; K234-L266 PolarHBondContact NZ-O 3.38Å |
| 235 | S | 86.8 | Confident | 89.8 | Confident | 10 Ų | 10 | 43.7 Ų | 43.7 | 7% | 0.07 | 23% | 0.233 | C | C | . | . | trans | -144 | 141.3 | 178.4 | -168.8 | 0 | 0 | 0 | 0 | 110.4 | T240 R272 F276 | S235-T240 PolarHBondContact OG-OG1 3.5Å; S235-R272 WeakPolarHBondContact OG-CD 3.39Å; S235-F276 WeakPolarHBondContact OG-CZ 3.45Å | ||
| 236 | S | 87.9 | Confident | 89.6 | Confident | 43 Ų | 43 | 51 Ų | 51 | 30% | 0.301 | 27% | 0.267 | S | S | . | . | trans | -92.6 | 167.2 | 176.5 | 69.9 | 0 | 0 | 0 | 0 | 111.3 | D238 E239 T240 | S236-D238 VanDerWaalsContact C-N 3.31Å; S236-E239 PolarHBondContact O-N 2.95Å; S236-E239 PolarHBondContact OG-N 3.37Å; S236-E239 VanDerWaalsContact OG-N 3.14Å; S236-E239 PolarHBondContact OG-OE2 3.46Å; S236-T240 WeakPolarHBondContact O-CB 3.05Å; S236-T240 PolarHBondContact O-N 2.88Å; S236-T240 PolarHBondContact O-OG1 3.38Å | ||
| 237 | I | 86.8 | Confident | 89.4 | Confident | 6 Ų | 6 | 52.2 Ų | 52.2 | 3% | 0.031 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -68.6 | -32.1 | 172.7 | -166 | 154.4 | 0 | 0 | 0 | 113 | I203 K206 C226 E239 T240 L241 | I203-I237 HydrophobicContact CB-CD1 3.72Å; I203-I237 HydrophobicContact CD1-CD1 4.16Å; I203-I237 HydrophobicContact CG1-CD1 3.53Å; I203-I237 HydrophobicContact CG2-CD1 3.41Å; I203-I237 VanDerWaalsContact CG2-CD1 3.41Å; K206-I237 HydrophobicContact CD-CG2 3.86Å; C226-I237 HydrophobicContact CB-CD1 3.67Å; C226-I237 HydrophobicContact CB-CG1 3.92Å; I237-E239 PolarHBondContact O-N 3.46Å; I237-T240 PolarHBondContact O-N 2.81Å; I237-L241 HydrophobicContact CG1-CB 4.08Å; I237-L241 VanDerWaalsContact O-CB 3.27Å; I237-L241 WeakPolarHBondContact O-CB 3.17Å; I237-L241 PolarHBondContact O-N 3.17Å |
| 238 | D | 86.8 | Confident | 89.1 | Confident | 86 Ų | 86 | 50.9 Ų | 50.9 | 46% | 0.46 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.1 | -35.8 | 173.1 | -69.2 | -50.7 | 0 | 0 | 0 | 111.5 | K206 S236 P242 | K206-D238 VanDerWaalsContact CD-OD1 3.31Å; K206-D238 WeakPolarHBondContact CD-OD1 3.29Å; K206-D238 WeakPolarHBondContact CE-OD1 3.3Å; K206-D238 IonicContact NZ-OD1 3.86Å; K206-D238 PolarHBondContact NZ-OD1 2.92Å; K206-D238 IonicContact NZ-OD2 3.73Å; K206-D238 PolarHBondContact NZ-OD2 3.47Å; S236-D238 VanDerWaalsContact C-N 3.31Å; D238-P242 WeakPolarHBondContact O-CD 3.37Å; D238-P242 WeakPolarHBondContact O-CG 3.19Å |
| 239 | E | 88.3 | Confident | 88.8 | Confident | 73 Ų | 73 | 49.4 Ų | 49.4 | 34% | 0.341 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -63.9 | -57.5 | 173.3 | 47 | 74 | 135.3 | 0 | 0 | 113.2 | S236 I237 R272 | S236-E239 PolarHBondContact O-N 2.95Å; S236-E239 PolarHBondContact OG-N 3.37Å; S236-E239 VanDerWaalsContact OG-N 3.14Å; S236-E239 PolarHBondContact OG-OE2 3.46Å; I237-E239 PolarHBondContact O-N 3.46Å; E239-R272 VanDerWaalsContact CD-NE 3.33Å; E239-R272 IonicContact OE1-CZ 3.94Å; E239-R272 IonicContact OE1-NE 3.1Å; E239-R272 PolarHBondContact OE1-NE 3.16Å; E239-R272 IonicContact OE1-NH1 2.7Å; E239-R272 IonicContact OE1-NH2 3.69Å; E239-R272 PolarHBondContact OE1-NH2 2.78Å; E239-R272 WeakPolarHBondContact OE2-CD 3.32Å; E239-R272 IonicContact OE2-CZ 3.71Å; E239-R272 VanDerWaalsContact OE2-CZ 3.29Å; E239-R272 IonicContact OE2-NE 3.97Å; E239-R272 PolarHBondContact OE2-NE 3.29Å; E239-R272 VanDerWaalsContact OE2-NE 3.07Å; E239-R272 IonicContact OE2-NH1 2.62Å; E239-R272 IonicContact OE2-NH2 3.36Å |
| 240 | T | 90.7 | Very high | 88.5 | Confident | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -84.7 | -38.8 | -158.6 | -50.8 | 0 | 0 | 0 | 0 | 112 | V229 S235 S236 I237 F243 L244 | V229-T240 HydrophobicContact CB-CG2 3.8Å; V229-T240 HydrophobicContact CG1-CG2 4.01Å; V229-T240 HydrophobicContact CG2-CG2 3.74Å; S235-T240 PolarHBondContact OG-OG1 3.5Å; S236-T240 WeakPolarHBondContact O-CB 3.05Å; S236-T240 PolarHBondContact O-N 2.88Å; S236-T240 PolarHBondContact O-OG1 3.38Å; I237-T240 PolarHBondContact O-N 2.81Å; T240-F243 PolarHBondContact O-N 3.45Å; T240-L244 HydrophobicContact CG2-CD1 4.1Å; T240-L244 HydrophobicContact CG2-CG 4.43Å; T240-L244 WeakPolarHBondContact O-CG 3.46Å; T240-L244 PolarHBondContact O-N 2.91Å |
| 241 | L | 91.1 | Very high | 88.4 | Confident | 4 Ų | 4 | 55 Ų | 55 | 2% | 0.021 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.2 | -47.7 | -176.3 | 179.6 | 68.9 | 0 | 0 | 0 | 112 | K206 A207 C210 L211 Y222 I237 F243 L244 I245 | K206-L241 HydrophobicContact CB-CD2 4.13Å; A207-L241 HydrophobicContact CB-CD2 4.38Å; C210-L241 HydrophobicContact CB-CD2 4.09Å; L211-L241 HydrophobicContact CD1-CD1 3.77Å; Y222-L241 HydrophobicContact CD1-CD1 4.44Å; I237-L241 HydrophobicContact CG1-CB 4.08Å; I237-L241 VanDerWaalsContact O-CB 3.27Å; I237-L241 WeakPolarHBondContact O-CB 3.17Å; I237-L241 PolarHBondContact O-N 3.17Å; L241-F243 VanDerWaalsContact C-N 3.31Å; L241-F243 PolarHBondContact O-N 3.49Å; L241-L244 PolarHBondContact O-N 2.9Å; L241-I245 HydrophobicContact CD1-CD1 4.22Å; L241-I245 HydrophobicContact CG-CD1 3.93Å; L241-I245 VanDerWaalsContact O-CG1 3.28Å; L241-I245 WeakPolarHBondContact O-CG1 3.24Å; L241-I245 PolarHBondContact O-N 2.67Å |
| 242 | P | 90.7 | Very high | 88.4 | Confident | 64 Ų | 64 | 51.8 Ų | 51.8 | 42% | 0.416 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61 | -39 | 176 | -24.8 | 37.1 | 0 | 0 | 0 | 112.9 | D238 I245 Q246 | D238-P242 WeakPolarHBondContact O-CD 3.37Å; D238-P242 WeakPolarHBondContact O-CG 3.19Å; P242-I245 PolarHBondContact O-N 2.99Å; P242-Q246 WeakPolarHBondContact O-CB 3.23Å; P242-Q246 PolarHBondContact O-N 3.31Å |
| 243 | F | 92.1 | Very high | 88.5 | Confident | 12 Ų | 12 | 56.8 Ų | 56.8 | 5% | 0.053 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -58.2 | -48.9 | 175.2 | 157.4 | -105 | 0 | 0 | 0 | 111.9 | T240 L241 I245 Q246 C247 Y258 C262 F276 V279 A280 | T240-F243 PolarHBondContact O-N 3.45Å; L241-F243 VanDerWaalsContact C-N 3.31Å; L241-F243 PolarHBondContact O-N 3.49Å; F243-I245 VanDerWaalsContact C-N 3.3Å; F243-I245 PolarHBondContact O-N 2.87Å; F243-Q246 WeakPolarHBondContact O-CB 3.23Å; F243-Q246 PolarHBondContact O-N 3.29Å; F243-C247 WeakPolarHBondContact CE2-SG 3.37Å; F243-C247 PolarHBondContact O-N 3.22Å; F243-C247 PolarHBondContact O-SG 3.27Å; F243-Y258 HydrophobicContact CZ-CD1 4.19Å; F243-C262 VanDerWaalsContact CE1-SG 3.57Å; F243-F276 HydrophobicContact CB-CD2 3.85Å; F243-F276 HydrophobicContact CB-CE2 4.15Å; F243-F276 HydrophobicContact CB-CG 4.27Å; F243-F276 HydrophobicContact CD1-CD1 4.14Å; F243-F276 HydrophobicContact CD1-CD2 4.47Å; F243-F276 HydrophobicContact CD1-CE1 4.33Å; F243-F276 HydrophobicContact CD1-CG 4.22Å; F243-F276 HydrophobicContact CD2-CB 3.64Å; F243-F276 HydrophobicContact CD2-CD1 4.49Å; F243-F276 HydrophobicContact CD2-CD2 4.34Å; F243-F276 AromaticContact CD2-CG 3.94Å; F243-F276 HydrophobicContact CD2-CG 3.94Å; F243-F276 HydrophobicContact CE1-CD1 4.28Å; F243-F276 HydrophobicContact CE2-CB 3.91Å; F243-F276 HydrophobicContact CE2-CG 4.36Å; F243-F276 WeakPolarHBondContact CE2-O 3.4Å; F243-F276 HydrophobicContact CG-CB 4.09Å; F243-F276 HydrophobicContact CG-CD1 4.25Å; F243-F276 AromaticContact CG-CD2 3.95Å; F243-F276 HydrophobicContact CG-CD2 3.95Å; F243-F276 HydrophobicContact CG-CE2 4.42Å; F243-F276 AromaticContact CG-CG 3.85Å; F243-F276 HydrophobicContact CG-CG 3.85Å; F243-V279 HydrophobicContact CZ-CB 4.12Å; F243-V279 HydrophobicContact CZ-CG1 3.9Å; F243-A280 HydrophobicContact CE2-CB 4.05Å |
| 244 | L | 90.8 | Very high | 88.8 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.5 | -38.1 | 178.8 | -68.1 | 171 | 0 | 0 | 0 | 111.7 | Y222 A225 T240 L241 C247 L249 | Y222-L244 HydrophobicContact CD1-CB 3.75Å; Y222-L244 HydrophobicContact CD1-CD1 4.34Å; Y222-L244 HydrophobicContact CE1-CB 3.7Å; A225-L244 HydrophobicContact CB-CD1 3.63Å; T240-L244 HydrophobicContact CG2-CD1 4.1Å; T240-L244 HydrophobicContact CG2-CG 4.43Å; T240-L244 WeakPolarHBondContact O-CG 3.46Å; T240-L244 PolarHBondContact O-N 2.91Å; L241-L244 PolarHBondContact O-N 2.9Å; L244-C247 PolarHBondContact O-N 3.46Å; L244-L249 HydrophobicContact CD2-CD1 4.23Å |
| 245 | I | 90.4 | Very high | 89.2 | Confident | 29 Ų | 29 | 50.9 Ų | 50.9 | 15% | 0.149 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.4 | -43 | 176.5 | -66.1 | 163.8 | 0 | 0 | 0 | 110.4 | C210 L211 R215 Y222 L241 P242 F243 C247 N248 | C210-I245 HydrophobicContact CB-CD1 3.9Å; L211-I245 HydrophobicContact CD1-CD1 4.01Å; L211-I245 HydrophobicContact CD1-CG1 4.12Å; R215-I245 PolarHBondContact NH1-O 3.32Å; Y222-I245 HydrophobicContact CE1-CG1 4.33Å; L241-I245 HydrophobicContact CD1-CD1 4.22Å; L241-I245 HydrophobicContact CG-CD1 3.93Å; L241-I245 VanDerWaalsContact O-CG1 3.28Å; L241-I245 WeakPolarHBondContact O-CG1 3.24Å; L241-I245 PolarHBondContact O-N 2.67Å; P242-I245 PolarHBondContact O-N 2.99Å; F243-I245 VanDerWaalsContact C-N 3.3Å; F243-I245 PolarHBondContact O-N 2.87Å; I245-C247 VanDerWaalsContact C-N 3.28Å; I245-C247 PolarHBondContact O-N 2.64Å; I245-N248 PolarHBondContact O-N 3.04Å; I245-N248 VanDerWaalsContact O-N 3.09Å; I245-N248 PolarHBondContact O-OD1 3.25Å |
| 246 | Q | 90.1 | Very high | 89.5 | Confident | 154 Ų | 154 | 52 Ų | 52 | 72% | 0.72 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -62.4 | -34.2 | 178.2 | -176 | 178.5 | 3.3 | 0 | 0 | 112.4 | P242 F243 N248 | P242-Q246 WeakPolarHBondContact O-CB 3.23Å; P242-Q246 PolarHBondContact O-N 3.31Å; F243-Q246 WeakPolarHBondContact O-CB 3.23Å; F243-Q246 PolarHBondContact O-N 3.29Å; Q246-N248 PolarHBondContact O-N 2.98Å; Q246-N248 VanDerWaalsContact O-N 3.11Å |
| 247 | C | 87.6 | Confident | 89.8 | Confident | 25 Ų | 25 | 52.3 Ų | 52.3 | 17% | 0.169 | 28% | 0.282 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.5 | -4.8 | 176.4 | -65.3 | 0 | 0 | 0 | 0 | 113.7 | F243 L244 I245 L249 Y258 | F243-C247 WeakPolarHBondContact CE2-SG 3.37Å; F243-C247 PolarHBondContact O-N 3.22Å; F243-C247 PolarHBondContact O-SG 3.27Å; L244-C247 PolarHBondContact O-N 3.46Å; I245-C247 VanDerWaalsContact C-N 3.28Å; I245-C247 PolarHBondContact O-N 2.64Å; C247-L249 VanDerWaalsContact C-N 3.31Å; C247-L249 HydrophobicContact CB-CD1 4.06Å; C247-L249 HydrophobicContact CB-CD2 3.87Å; C247-L249 HydrophobicContact CB-CG 3.71Å; C247-L249 WeakPolarHBondContact O-CD2 3.36Å; C247-L249 PolarHBondContact O-N 3.28Å; C247-Y258 HydrophobicContact CB-CD1 4.29Å; C247-Y258 HydrophobicContact CB-CE1 3.88Å |
| 248 | N | 85.5 | Confident | 90.1 | Very high | 111 Ų | 111 | 52.8 Ų | 52.8 | 59% | 0.594 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.8 | 40.9 | 175.8 | -72.2 | -25.2 | 0 | 0 | 0 | 114.8 | R215 I245 Q246 | R215-N248 PolarHBondContact NH1-OD1 2.98Å; R215-N248 VanDerWaalsContact NH2-CG 3.34Å; R215-N248 PolarHBondContact NH2-OD1 3.45Å; I245-N248 PolarHBondContact O-N 3.04Å; I245-N248 VanDerWaalsContact O-N 3.09Å; I245-N248 PolarHBondContact O-OD1 3.25Å; Q246-N248 PolarHBondContact O-N 2.98Å; Q246-N248 VanDerWaalsContact O-N 3.11Å |
| 249 | L | 87.1 | Confident | 90.5 | Very high | 9 Ų | 9 | 48.8 Ų | 48.8 | 5% | 0.047 | 26% | 0.262 | C | S | . | . | trans | -81.6 | 128.6 | -174.8 | -50.3 | 178.7 | 0 | 0 | 0 | 111.8 | Y222 L244 C247 V254 I255 Y258 | Y222-L249 PolarHBondContact OH-O 2.93Å; L244-L249 HydrophobicContact CD2-CD1 4.23Å; C247-L249 VanDerWaalsContact C-N 3.31Å; C247-L249 HydrophobicContact CB-CD1 4.06Å; C247-L249 HydrophobicContact CB-CD2 3.87Å; C247-L249 HydrophobicContact CB-CG 3.71Å; C247-L249 WeakPolarHBondContact O-CD2 3.36Å; C247-L249 PolarHBondContact O-N 3.28Å; L249-V254 HydrophobicContact CD2-CG1 3.86Å; L249-I255 HydrophobicContact CB-CD1 4.35Å; L249-I255 HydrophobicContact CB-CG1 3.49Å; L249-I255 VanDerWaalsContact CB-CG1 3.49Å; L249-I255 HydrophobicContact CD1-CG1 4.14Å; L249-I255 HydrophobicContact CG-CG1 4.47Å; L249-Y258 HydrophobicContact CD1-CD1 3.76Å; L249-Y258 HydrophobicContact CD1-CD2 4.12Å; L249-Y258 HydrophobicContact CD1-CE1 4.14Å; L249-Y258 HydrophobicContact CD1-CE2 4.47Å; L249-Y258 HydrophobicContact CD1-CG 3.71Å; L249-Y258 HydrophobicContact CD2-CD1 4.4Å; L249-Y258 HydrophobicContact CD2-CD2 4.44Å; L249-Y258 HydrophobicContact CD2-CE1 3.94Å; L249-Y258 HydrophobicContact CD2-CE2 3.99Å | ||
| 250 | S | 84.4 | Confident | 90.8 | Very high | 83 Ų | 83 | 50.9 Ų | 50.9 | 58% | 0.58 | 27% | 0.272 | S | S | * | . | trans | -115.1 | -19 | 175.8 | 53.2 | 0 | 0 | 0 | 0 | 113.3 | H218 | H218-S250 PolarHBondContact CD2-O 3.07Å; H218-S250 VanDerWaalsContact CD2-O 3.29Å; H218-S250 PolarHBondContact NE2-O 3.03Å; H218-S250 VanDerWaalsContact NE2-O 3.15Å | ||
| 251 | D | 89.7 | Confident | 91 | Very high | 83 Ų | 83 | 51.3 Ų | 51.3 | 44% | 0.444 | 28% | 0.275 | S | S | . | . | trans | -91.3 | 131.1 | -178.4 | -172.8 | -45 | 0 | 0 | 0 | 111.2 | M253 V254 I255 | D251-M253 VanDerWaalsContact C-N 3.35Å; D251-M253 PolarHBondContact O-N 3.19Å; D251-M253 PolarHBondContact OD1-N 3.05Å; D251-V254 HydrophobicContact CB-CB 4.01Å; D251-V254 HydrophobicContact CB-CG2 3.69Å; D251-V254 PolarHBondContact O-N 2.91Å; D251-I255 WeakPolarHBondContact O-CD1 3.27Å; D251-I255 VanDerWaalsContact O-CG1 3.24Å; D251-I255 WeakPolarHBondContact O-CG1 3.35Å; D251-I255 PolarHBondContact O-N 3.09Å | ||
| 252 | K | 90 | Very high | 91.1 | Very high | 91 Ų | 91 | 51.1 Ų | 51.1 | 40% | 0.396 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -49.1 | -51.7 | 175 | 173.4 | -174.4 | 178.4 | -173.6 | 0 | 112.4 | Y221 V254 I255 L256 | Y221-K252 HydrophobicContact CD1-CD 4.33Å; Y221-K252 HydrophobicContact CD1-CG 3.81Å; Y221-K252 HydrophobicContact CD2-CB 3.88Å; Y221-K252 HydrophobicContact CD2-CG 4Å; Y221-K252 HydrophobicContact CE1-CD 3.72Å; Y221-K252 HydrophobicContact CE1-CG 3.7Å; Y221-K252 HydrophobicContact CE2-CB 3.78Å; Y221-K252 HydrophobicContact CE2-CD 4.14Å; Y221-K252 HydrophobicContact CE2-CG 3.87Å; Y221-K252 HydrophobicContact CG-CB 4.29Å; Y221-K252 HydrophobicContact CG-CG 3.98Å; K252-V254 VanDerWaalsContact C-N 3.33Å; K252-I255 PolarHBondContact O-N 3.27Å; K252-L256 HydrophobicContact CG-CD1 4.37Å; K252-L256 WeakPolarHBondContact O-CG 3.47Å; K252-L256 PolarHBondContact O-N 2.7Å; K252-L256 VanDerWaalsContact O-N 3.16Å |
| 253 | M | 91.3 | Very high | 91.3 | Very high | 131 Ų | 131 | 48.4 Ų | 48.4 | 65% | 0.645 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -68.3 | -37.8 | -174.7 | -65.6 | -57 | -69.3 | 0 | 0 | 110.8 | D251 L256 S257 | D251-M253 VanDerWaalsContact C-N 3.35Å; D251-M253 PolarHBondContact O-N 3.19Å; D251-M253 PolarHBondContact OD1-N 3.05Å; M253-L256 PolarHBondContact O-N 2.75Å; M253-S257 VanDerWaalsContact O-CB 3.25Å; M253-S257 WeakPolarHBondContact O-CB 3.49Å; M253-S257 PolarHBondContact O-N 3.03Å |
| 254 | V | 92.1 | Very high | 91.4 | Very high | 55 Ų | 55 | 50 Ų | 50 | 33% | 0.333 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -68.1 | -44.1 | 178 | -175.4 | 0 | 0 | 0 | 0 | 111.1 | L249 D251 K252 L256 S257 Y258 | L249-V254 HydrophobicContact CD2-CG1 3.86Å; D251-V254 HydrophobicContact CB-CB 4.01Å; D251-V254 HydrophobicContact CB-CG2 3.69Å; D251-V254 PolarHBondContact O-N 2.91Å; K252-V254 VanDerWaalsContact C-N 3.33Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 3.26Å; V254-S257 PolarHBondContact O-N 3.42Å; V254-Y258 HydrophobicContact CG1-CD2 3.78Å; V254-Y258 HydrophobicContact CG1-CE2 3.46Å; V254-Y258 VanDerWaalsContact CG1-CE2 3.46Å; V254-Y258 WeakPolarHBondContact O-CD2 3.34Å; V254-Y258 PolarHBondContact O-N 3.21Å |
| 255 | I | 92.5 | Very high | 91.5 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -56.9 | -46 | 176.3 | -67.9 | 161.6 | 0 | 0 | 0 | 111.1 | H218 Y222 A225 L249 D251 K252 S259 | H218-I255 HydrophobicContact CB-CD1 4.2Å; Y222-I255 HydrophobicContact CD2-CD1 3.95Å; Y222-I255 HydrophobicContact CE2-CD1 3.53Å; Y222-I255 HydrophobicContact CE2-CG1 4.26Å; A225-I255 HydrophobicContact CB-CG2 3.83Å; L249-I255 HydrophobicContact CB-CD1 4.35Å; L249-I255 HydrophobicContact CB-CG1 3.49Å; L249-I255 VanDerWaalsContact CB-CG1 3.49Å; L249-I255 HydrophobicContact CD1-CG1 4.14Å; L249-I255 HydrophobicContact CG-CG1 4.47Å; D251-I255 WeakPolarHBondContact O-CD1 3.27Å; D251-I255 VanDerWaalsContact O-CG1 3.24Å; D251-I255 WeakPolarHBondContact O-CG1 3.35Å; D251-I255 PolarHBondContact O-N 3.09Å; K252-I255 PolarHBondContact O-N 3.27Å; I255-S259 PolarHBondContact O-N 2.89Å |
| 256 | L | 93.1 | Very high | 91.6 | Very high | 32 Ų | 32 | 48.7 Ų | 48.7 | 17% | 0.168 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -69.9 | -41.6 | -179.7 | -64.6 | 178.9 | 0 | 0 | 0 | 111.7 | K224 K252 M253 V254 Y258 S259 E260 | K224-L256 HydrophobicContact CB-CD2 4.12Å; K224-L256 HydrophobicContact CD-CD2 3.91Å; K224-L256 HydrophobicContact CG-CD2 3.94Å; K252-L256 HydrophobicContact CG-CD1 4.37Å; K252-L256 WeakPolarHBondContact O-CG 3.47Å; K252-L256 PolarHBondContact O-N 2.7Å; K252-L256 VanDerWaalsContact O-N 3.16Å; M253-L256 PolarHBondContact O-N 2.75Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 3.26Å; L256-Y258 PolarHBondContact O-N 3.43Å; L256-S259 WeakPolarHBondContact O-CB 3.25Å; L256-S259 PolarHBondContact O-N 3.13Å; L256-S259 VanDerWaalsContact O-N 3.17Å; L256-S259 PolarHBondContact O-OG 2.9Å; L256-E260 PolarHBondContact O-N 3.29Å |
| 257 | S | 93.9 | Very high | 91.8 | Very high | 51 Ų | 51 | 47.6 Ų | 47.6 | 36% | 0.357 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 176.1 | 175.9 | 0 | 0 | 0 | 0 | 111.8 | M253 V254 S259 E260 V261 | M253-S257 VanDerWaalsContact O-CB 3.25Å; M253-S257 WeakPolarHBondContact O-CB 3.49Å; M253-S257 PolarHBondContact O-N 3.03Å; V254-S257 PolarHBondContact O-N 3.42Å; S257-S259 VanDerWaalsContact C-N 3.26Å; S257-S259 PolarHBondContact O-N 3.01Å; S257-E260 PolarHBondContact O-N 3.48Å; S257-E260 VanDerWaalsContact O-N 3.09Å; S257-V261 WeakPolarHBondContact O-CG2 3.36Å; S257-V261 PolarHBondContact O-N 2.96Å |
| 258 | Y | 94.4 | Very high | 92 | Very high | 16 Ų | 16 | 51 Ų | 51 | 6% | 0.063 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -57 | -42.7 | 176.2 | -88.7 | -125.3 | 0 | 0 | 0 | 111.7 | F243 C247 L249 V254 L256 E260 C262 V279 K283 | F243-Y258 HydrophobicContact CZ-CD1 4.19Å; C247-Y258 HydrophobicContact CB-CD1 4.29Å; C247-Y258 HydrophobicContact CB-CE1 3.88Å; L249-Y258 HydrophobicContact CD1-CD1 3.76Å; L249-Y258 HydrophobicContact CD1-CD2 4.12Å; L249-Y258 HydrophobicContact CD1-CE1 4.14Å; L249-Y258 HydrophobicContact CD1-CE2 4.47Å; L249-Y258 HydrophobicContact CD1-CG 3.71Å; L249-Y258 HydrophobicContact CD2-CD1 4.4Å; L249-Y258 HydrophobicContact CD2-CD2 4.44Å; L249-Y258 HydrophobicContact CD2-CE1 3.94Å; L249-Y258 HydrophobicContact CD2-CE2 3.99Å; V254-Y258 HydrophobicContact CG1-CD2 3.78Å; V254-Y258 HydrophobicContact CG1-CE2 3.46Å; V254-Y258 VanDerWaalsContact CG1-CE2 3.46Å; V254-Y258 WeakPolarHBondContact O-CD2 3.34Å; V254-Y258 PolarHBondContact O-N 3.21Å; L256-Y258 PolarHBondContact O-N 3.43Å; Y258-E260 VanDerWaalsContact C-N 3.33Å; Y258-E260 PolarHBondContact O-N 3.08Å; Y258-C262 WeakPolarHBondContact O-CB 3.21Å; Y258-C262 PolarHBondContact O-N 3.24Å; Y258-C262 PolarHBondContact O-SG 3.38Å; Y258-C262 VanDerWaalsContact O-SG 3.35Å; Y258-V279 HydrophobicContact CD1-CG1 3.79Å; Y258-V279 HydrophobicContact CE1-CG1 4.26Å; Y258-V279 HydrophobicContact CG-CG1 4.26Å; Y258-K283 VanDerWaalsContact CE2-C 3.44Å; Y258-K283 WeakPolarHBondContact CE2-O 3.47Å; Y258-K283 WeakPolarHBondContact OH-CA 3.47Å; Y258-K283 PolarHBondContact OH-O 3.42Å |
| 259 | S | 94.3 | Very high | 92.2 | Very high | 2 Ų | 2 | 48.2 Ų | 48.2 | 1% | 0.014 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.3 | -35.8 | 179 | 81.9 | 0 | 0 | 0 | 0 | 113 | A225 V229 I255 L256 S257 S263 | A225-S259 VanDerWaalsContact CA-CB 3.45Å; A225-S259 VanDerWaalsContact CB-CB 3.42Å; A225-S259 WeakPolarHBondContact O-CB 3.29Å; V229-S259 WeakPolarHBondContact CG2-O 3.48Å; I255-S259 PolarHBondContact O-N 2.89Å; L256-S259 WeakPolarHBondContact O-CB 3.25Å; L256-S259 PolarHBondContact O-N 3.13Å; L256-S259 VanDerWaalsContact O-N 3.17Å; L256-S259 PolarHBondContact O-OG 2.9Å; S257-S259 VanDerWaalsContact C-N 3.26Å; S257-S259 PolarHBondContact O-N 3.01Å; S259-S263 VanDerWaalsContact O-CB 3.25Å; S259-S263 WeakPolarHBondContact O-CB 3.12Å; S259-S263 PolarHBondContact O-N 3.48Å |
| 260 | E | 94.4 | Very high | 92.4 | Very high | 117 Ų | 117 | 49.8 Ų | 49.8 | 55% | 0.547 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -71.4 | -44 | 178.5 | -172.8 | 163.4 | -160.3 | 0 | 0 | 111 | L256 S257 Y258 S263 N264 | L256-E260 PolarHBondContact O-N 3.29Å; S257-E260 PolarHBondContact O-N 3.48Å; S257-E260 VanDerWaalsContact O-N 3.09Å; Y258-E260 VanDerWaalsContact C-N 3.33Å; Y258-E260 PolarHBondContact O-N 3.08Å; E260-S263 WeakPolarHBondContact O-CB 3.4Å; E260-S263 PolarHBondContact O-N 3.38Å; E260-N264 WeakPolarHBondContact O-CB 3.11Å; E260-N264 PolarHBondContact O-N 2.92Å; E260-N264 PolarHBondContact O-ND2 2.91Å |
| 261 | V | 94.9 | Very high | 92.6 | Very high | 9 Ų | 9 | 48.7 Ų | 48.7 | 6% | 0.055 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.9 | -47 | 174.4 | 176.3 | 0 | 0 | 0 | 0 | 111 | S257 S263 N264 L265 V279 G284 Q286 | S257-V261 WeakPolarHBondContact O-CG2 3.36Å; S257-V261 PolarHBondContact O-N 2.96Å; V261-S263 VanDerWaalsContact C-N 3.31Å; V261-S263 PolarHBondContact O-N 3.3Å; V261-N264 PolarHBondContact O-N 3.25Å; V261-L265 HydrophobicContact CG1-CD1 3.81Å; V261-L265 HydrophobicContact CG1-CG 4.32Å; V261-L265 WeakPolarHBondContact O-CB 3.45Å; V261-L265 VanDerWaalsContact O-CG 3.27Å; V261-L265 WeakPolarHBondContact O-CG 3.48Å; V261-L265 PolarHBondContact O-N 2.84Å; V261-V279 HydrophobicContact CG1-CG2 3.88Å; V261-G284 WeakPolarHBondContact CG2-O 3.31Å; V261-Q286 HydrophobicContact CG1-CB 3.91Å; V261-Q286 HydrophobicContact CG1-CG 4.19Å; V261-Q286 HydrophobicContact CG2-CB 3.95Å |
| 262 | C | 94.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.4 | -44.1 | 172.9 | -76.6 | 0 | 0 | 0 | 0 | 111.9 | V229 F243 Y258 N264 L265 L266 I275 F276 | V229-C262 HydrophobicContact CG2-CB 4.05Å; F243-C262 VanDerWaalsContact CE1-SG 3.57Å; Y258-C262 WeakPolarHBondContact O-CB 3.21Å; Y258-C262 PolarHBondContact O-N 3.24Å; Y258-C262 PolarHBondContact O-SG 3.38Å; Y258-C262 VanDerWaalsContact O-SG 3.35Å; C262-N264 PolarHBondContact O-N 3.09Å; C262-L265 PolarHBondContact O-N 2.89Å; C262-L266 WeakPolarHBondContact O-CB 3.26Å; C262-L266 WeakPolarHBondContact O-CD1 3.18Å; C262-L266 WeakPolarHBondContact O-CG 3.47Å; C262-L266 PolarHBondContact O-N 3.4Å; C262-I275 HydrophobicContact CB-CG2 4.44Å; C262-F276 HydrophobicContact CB-CE1 4.36Å |
| 263 | S | 94.6 | Very high | 92.7 | Very high | 6 Ų | 6 | 47.2 Ų | 47.2 | 4% | 0.042 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 178 | -170.6 | 0 | 0 | 0 | 0 | 111.8 | T228 T232 S259 E260 V261 L266 K267 | T228-S263 PolarHBondContact O-OG 2.94Å; T232-S263 WeakPolarHBondContact CG2-OG 3.38Å; S259-S263 VanDerWaalsContact O-CB 3.25Å; S259-S263 WeakPolarHBondContact O-CB 3.12Å; S259-S263 PolarHBondContact O-N 3.48Å; E260-S263 WeakPolarHBondContact O-CB 3.4Å; E260-S263 PolarHBondContact O-N 3.38Å; V261-S263 VanDerWaalsContact C-N 3.31Å; V261-S263 PolarHBondContact O-N 3.3Å; S263-L266 PolarHBondContact O-N 3.2Å; S263-K267 VanDerWaalsContact O-CG 3.24Å; S263-K267 WeakPolarHBondContact O-CG 3.26Å; S263-K267 PolarHBondContact O-N 3.03Å |
| 264 | N | 94.8 | Very high | 92.7 | Very high | 45 Ų | 45 | 45.7 Ų | 45.7 | 24% | 0.241 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.6 | -47 | 178.5 | -68.9 | -16.8 | 0 | 0 | 0 | 111.5 | E260 V261 C262 L266 K267 M268 Q286 | E260-N264 WeakPolarHBondContact O-CB 3.11Å; E260-N264 PolarHBondContact O-N 2.92Å; E260-N264 PolarHBondContact O-ND2 2.91Å; V261-N264 PolarHBondContact O-N 3.25Å; C262-N264 PolarHBondContact O-N 3.09Å; N264-L266 VanDerWaalsContact C-N 3.33Å; N264-L266 PolarHBondContact O-N 3.01Å; N264-K267 WeakPolarHBondContact O-CB 3.44Å; N264-K267 PolarHBondContact O-N 2.76Å; N264-M268 WeakPolarHBondContact O-CG 3.47Å; N264-M268 PolarHBondContact O-N 3.2Å; N264-Q286 PolarHBondContact ND2-OE1 2.85Å; N264-Q286 VanDerWaalsContact ND2-OE1 3.1Å |
| 265 | L | 92.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.1 | -38.9 | 177.7 | -66.3 | 172.3 | 0 | 0 | 0 | 112 | V261 C262 M268 G269 F270 I275 V279 A289 L290 L293 | V261-L265 HydrophobicContact CG1-CD1 3.81Å; V261-L265 HydrophobicContact CG1-CG 4.32Å; V261-L265 WeakPolarHBondContact O-CB 3.45Å; V261-L265 VanDerWaalsContact O-CG 3.27Å; V261-L265 WeakPolarHBondContact O-CG 3.48Å; V261-L265 PolarHBondContact O-N 2.84Å; C262-L265 PolarHBondContact O-N 2.89Å; L265-M268 HydrophobicContact CB-CE 4.44Å; L265-M268 HydrophobicContact CD2-CE 3.42Å; L265-M268 VanDerWaalsContact CD2-CE 3.42Å; L265-M268 HydrophobicContact CG-CE 4.18Å; L265-M268 PolarHBondContact O-N 3.44Å; L265-G269 PolarHBondContact O-N 3.46Å; L265-F270 HydrophobicContact CD2-CD2 4.4Å; L265-F270 PolarHBondContact O-N 3.22Å; L265-I275 HydrophobicContact CB-CB 4.43Å; L265-I275 HydrophobicContact CB-CD1 3.82Å; L265-I275 HydrophobicContact CB-CG1 3.87Å; L265-I275 HydrophobicContact CB-CG2 3.72Å; L265-I275 HydrophobicContact CD1-CG2 3.78Å; L265-I275 HydrophobicContact CG-CG2 4.41Å; L265-V279 HydrophobicContact CD1-CG2 3.49Å; L265-V279 VanDerWaalsContact CD1-CG2 3.49Å; L265-A289 HydrophobicContact CD1-CB 4.04Å; L265-L290 HydrophobicContact CD2-CD2 3.4Å; L265-L290 HydrophobicContact CD2-CG 3.62Å; L265-L293 HydrophobicContact CD1-CD1 4.09Å; L265-L293 HydrophobicContact CD2-CD1 3.9Å; L265-L293 HydrophobicContact CG-CD1 4.45Å |
| 266 | L | 92.7 | Very high | 92.8 | Very high | 2 Ų | 2 | 43.9 Ų | 43.9 | 1% | 0.01 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.1 | -41.9 | 174.2 | -75.5 | 167.7 | 0 | 0 | 0 | 111.3 | V229 T232 K234 C262 S263 N264 M268 G269 R272 I275 | V229-L266 HydrophobicContact CG1-CD1 3.41Å; V229-L266 VanDerWaalsContact CG1-CD1 3.41Å; T232-L266 HydrophobicContact CG2-CB 4.25Å; K234-L266 HydrophobicContact CB-CB 4.42Å; K234-L266 HydrophobicContact CB-CD2 4.01Å; K234-L266 HydrophobicContact CD-CB 4.4Å; K234-L266 WeakPolarHBondContact CD-O 3.17Å; K234-L266 WeakPolarHBondContact CE-O 3.38Å; K234-L266 PolarHBondContact NZ-O 3.38Å; C262-L266 WeakPolarHBondContact O-CB 3.26Å; C262-L266 WeakPolarHBondContact O-CD1 3.18Å; C262-L266 WeakPolarHBondContact O-CG 3.47Å; C262-L266 PolarHBondContact O-N 3.4Å; S263-L266 PolarHBondContact O-N 3.2Å; N264-L266 VanDerWaalsContact C-N 3.33Å; N264-L266 PolarHBondContact O-N 3.01Å; L266-M268 VanDerWaalsContact C-N 3.27Å; L266-M268 PolarHBondContact O-N 2.95Å; L266-G269 PolarHBondContact O-N 3.45Å; L266-R272 HydrophobicContact CD2-CB 4.03Å; L266-R272 HydrophobicContact CD2-CG 4.34Å; L266-I275 HydrophobicContact CB-CD1 4.32Å; L266-I275 HydrophobicContact CD2-CD1 3.56Å; L266-I275 HydrophobicContact CG-CD1 3.71Å |
| 267 | K | 92.6 | Very high | 92.8 | Very high | 132 Ų | 132 | 47.9 Ų | 47.9 | 57% | 0.574 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -59.8 | -38.5 | 175.4 | -73.5 | 167.8 | -171.5 | 170.3 | 0 | 111.7 | T232 S263 N264 G269 | T232-K267 HydrophobicContact CG2-CG 4.2Å; S263-K267 VanDerWaalsContact O-CG 3.24Å; S263-K267 WeakPolarHBondContact O-CG 3.26Å; S263-K267 PolarHBondContact O-N 3.03Å; N264-K267 WeakPolarHBondContact O-CB 3.44Å; N264-K267 PolarHBondContact O-N 2.76Å; K267-G269 PolarHBondContact O-N 3.43Å |
| 268 | M | 91.9 | Very high | 92.7 | Very high | 97 Ų | 97 | 45.6 Ų | 45.6 | 48% | 0.478 | 24% | 0.238 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -12.2 | 175 | -71.1 | -175 | -77.3 | 0 | 0 | 114.2 | N264 L265 L266 F270 L290 | N264-M268 WeakPolarHBondContact O-CG 3.47Å; N264-M268 PolarHBondContact O-N 3.2Å; L265-M268 HydrophobicContact CB-CE 4.44Å; L265-M268 HydrophobicContact CD2-CE 3.42Å; L265-M268 VanDerWaalsContact CD2-CE 3.42Å; L265-M268 HydrophobicContact CG-CE 4.18Å; L265-M268 PolarHBondContact O-N 3.44Å; L266-M268 VanDerWaalsContact C-N 3.27Å; L266-M268 PolarHBondContact O-N 2.95Å; M268-F270 HydrophobicContact CB-CD2 3.81Å; M268-F270 HydrophobicContact CB-CE2 3.81Å; M268-F270 HydrophobicContact CE-CE2 4.47Å; M268-F270 HydrophobicContact SD-CE2 4.38Å; M268-L290 HydrophobicContact CE-CD1 4.18Å; M268-L290 HydrophobicContact CE-CD2 3.64Å; M268-L290 HydrophobicContact CE-CG 4.26Å; M268-L290 HydrophobicContact SD-CD2 4.05Å |
| 269 | G | 89.9 | Confident | 92.6 | Very high | 52 Ų | 52 | 44.8 Ų | 44.8 | 54% | 0.536 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 92.3 | 8.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L265 L266 K267 | L265-G269 PolarHBondContact O-N 3.46Å; L266-G269 PolarHBondContact O-N 3.45Å; K267-G269 PolarHBondContact O-N 3.43Å |
| 270 | F | 91.1 | Very high | 92.5 | Very high | 42 Ų | 42 | 46.7 Ų | 46.7 | 18% | 0.184 | 25% | 0.25 | C | S | . | . | trans | -64.1 | 148.4 | 171.3 | -66 | -77.7 | 0 | 0 | 0 | 110.8 | L265 M268 R272 I275 L290 L293 L294 | L265-F270 HydrophobicContact CD2-CD2 4.4Å; L265-F270 PolarHBondContact O-N 3.22Å; M268-F270 HydrophobicContact CB-CD2 3.81Å; M268-F270 HydrophobicContact CB-CE2 3.81Å; M268-F270 HydrophobicContact CE-CE2 4.47Å; M268-F270 HydrophobicContact SD-CE2 4.38Å; F270-R272 PolarHBondContact O-N 3.4Å; F270-I275 HydrophobicContact CB-CD1 3.74Å; F270-I275 HydrophobicContact CB-CG1 3.65Å; F270-I275 VanDerWaalsContact O-CD1 3.27Å; F270-I275 WeakPolarHBondContact O-CD1 3.47Å; F270-L290 HydrophobicContact CE2-CD2 3.62Å; F270-L290 HydrophobicContact CZ-CD2 4.04Å; F270-L293 HydrophobicContact CB-CD1 4.31Å; F270-L293 HydrophobicContact CD1-CB 3.95Å; F270-L293 HydrophobicContact CD1-CD1 4.31Å; F270-L293 HydrophobicContact CD2-CD1 4.25Å; F270-L293 HydrophobicContact CE1-CB 3.88Å; F270-L293 HydrophobicContact CG-CD1 4.04Å; F270-L293 HydrophobicContact CZ-CB 4.39Å; F270-L294 HydrophobicContact CE1-CD2 4.11Å; F270-L294 HydrophobicContact CZ-CD2 3.87Å; F270-L294 HydrophobicContact CZ-CG 4.32Å | ||
| 271 | P | 90.6 | Very high | 92.4 | Very high | 60 Ų | 60 | 44.6 Ų | 44.6 | 39% | 0.39 | 25% | 0.245 | S | C | . | . | trans | -69.9 | 133.6 | 179.3 | 28.4 | -34.1 | 0 | 0 | 0 | 110.8 | P273 Q274 I275 | P271-P273 VanDerWaalsContact C-CD 3.43Å; P271-Q274 HydrophobicContact CG-CB 4.05Å; P271-Q274 HydrophobicContact CG-CG 3.79Å; P271-Q274 PolarHBondContact O-N 2.77Å; P271-Q274 VanDerWaalsContact O-N 3.14Å; P271-I275 WeakPolarHBondContact O-CG1 3.46Å; P271-I275 PolarHBondContact O-N 3.47Å; P271-I275 VanDerWaalsContact O-N 3.14Å | ||
| 272 | R | 90.6 | Very high | 92.3 | Very high | 62 Ų | 62 | 45.2 Ų | 45.2 | 23% | 0.234 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -48 | -46.5 | -176 | -177.1 | -171.6 | 64.3 | 71.2 | -0.3 | 114.8 | S235 E239 L266 F270 Q274 I275 F276 | S235-R272 WeakPolarHBondContact OG-CD 3.39Å; E239-R272 VanDerWaalsContact CD-NE 3.33Å; E239-R272 IonicContact OE1-CZ 3.94Å; E239-R272 IonicContact OE1-NE 3.1Å; E239-R272 PolarHBondContact OE1-NE 3.16Å; E239-R272 IonicContact OE1-NH1 2.7Å; E239-R272 IonicContact OE1-NH2 3.69Å; E239-R272 PolarHBondContact OE1-NH2 2.78Å; E239-R272 WeakPolarHBondContact OE2-CD 3.32Å; E239-R272 IonicContact OE2-CZ 3.71Å; E239-R272 VanDerWaalsContact OE2-CZ 3.29Å; E239-R272 IonicContact OE2-NE 3.97Å; E239-R272 PolarHBondContact OE2-NE 3.29Å; E239-R272 VanDerWaalsContact OE2-NE 3.07Å; E239-R272 IonicContact OE2-NH1 2.62Å; E239-R272 IonicContact OE2-NH2 3.36Å; L266-R272 HydrophobicContact CD2-CB 4.03Å; L266-R272 HydrophobicContact CD2-CG 4.34Å; F270-R272 PolarHBondContact O-N 3.4Å; R272-Q274 VanDerWaalsContact C-N 3.34Å; R272-Q274 PolarHBondContact O-N 2.93Å; R272-I275 PolarHBondContact O-N 2.99Å; R272-F276 HydrophobicContact CG-CD1 4.46Å; R272-F276 HydrophobicContact CG-CD2 4.15Å; R272-F276 HydrophobicContact CG-CE1 4.06Å; R272-F276 HydrophobicContact CG-CE2 3.73Å; R272-F276 HydrophobicContact CG-CZ 3.68Å; R272-F276 PolarHBondContact O-N 3.4Å |
| 273 | P | 90.6 | Very high | 92.1 | Very high | 81 Ų | 81 | 53.2 Ų | 53.2 | 53% | 0.526 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.1 | -41.5 | -177.8 | -21.8 | 34 | 0 | 0 | 0 | 112.5 | P271 F276 E277 | P271-P273 VanDerWaalsContact C-CD 3.43Å; P273-F276 PolarHBondContact O-N 3.28Å; P273-E277 WeakPolarHBondContact O-CB 3.16Å; P273-E277 PolarHBondContact O-N 3.21Å |
| 274 | Q | 91.5 | Very high | 91.8 | Very high | 98 Ų | 98 | 53.3 Ų | 53.3 | 46% | 0.458 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -68.5 | -37.7 | 179.2 | -61.7 | 177.6 | 1.4 | 0 | 0 | 111.1 | P271 R272 A278 L293 | P271-Q274 HydrophobicContact CG-CB 4.05Å; P271-Q274 HydrophobicContact CG-CG 3.79Å; P271-Q274 PolarHBondContact O-N 2.77Å; P271-Q274 VanDerWaalsContact O-N 3.14Å; R272-Q274 VanDerWaalsContact C-N 3.34Å; R272-Q274 PolarHBondContact O-N 2.93Å; Q274-A278 VanDerWaalsContact O-CB 3.23Å; Q274-A278 WeakPolarHBondContact O-CB 3.24Å; Q274-A278 PolarHBondContact O-N 3.01Å; Q274-L293 HydrophobicContact CB-CD2 3.55Å |
| 275 | I | 92.9 | Very high | 91.7 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.9 | -51.9 | 175.3 | -65.5 | 170.5 | 0 | 0 | 0 | 110.4 | C262 L265 L266 F270 P271 R272 E277 A278 V279 L293 | C262-I275 HydrophobicContact CB-CG2 4.44Å; L265-I275 HydrophobicContact CB-CB 4.43Å; L265-I275 HydrophobicContact CB-CD1 3.82Å; L265-I275 HydrophobicContact CB-CG1 3.87Å; L265-I275 HydrophobicContact CB-CG2 3.72Å; L265-I275 HydrophobicContact CD1-CG2 3.78Å; L265-I275 HydrophobicContact CG-CG2 4.41Å; L266-I275 HydrophobicContact CB-CD1 4.32Å; L266-I275 HydrophobicContact CD2-CD1 3.56Å; L266-I275 HydrophobicContact CG-CD1 3.71Å; F270-I275 HydrophobicContact CB-CD1 3.74Å; F270-I275 HydrophobicContact CB-CG1 3.65Å; F270-I275 VanDerWaalsContact O-CD1 3.27Å; F270-I275 WeakPolarHBondContact O-CD1 3.47Å; P271-I275 WeakPolarHBondContact O-CG1 3.46Å; P271-I275 PolarHBondContact O-N 3.47Å; P271-I275 VanDerWaalsContact O-N 3.14Å; R272-I275 PolarHBondContact O-N 2.99Å; I275-E277 VanDerWaalsContact C-N 3.31Å; I275-E277 PolarHBondContact O-N 2.89Å; I275-A278 PolarHBondContact O-N 3.15Å; I275-V279 HydrophobicContact CG2-CG2 4.08Å; I275-V279 WeakPolarHBondContact O-CB 3.25Å; I275-V279 VanDerWaalsContact O-CG2 3.23Å; I275-V279 WeakPolarHBondContact O-CG2 3.27Å; I275-V279 PolarHBondContact O-N 2.9Å; I275-L293 HydrophobicContact CG1-CD1 4.25Å |
| 276 | F | 93.3 | Very high | 91.7 | Very high | 17 Ų | 17 | 57.3 Ų | 57.3 | 8% | 0.075 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.9 | -41.2 | -177 | -71.2 | -2.2 | 0 | 0 | 0 | 111.3 | S235 F243 C262 R272 P273 A280 | S235-F276 WeakPolarHBondContact OG-CZ 3.45Å; F243-F276 HydrophobicContact CB-CD2 3.85Å; F243-F276 HydrophobicContact CB-CE2 4.15Å; F243-F276 HydrophobicContact CB-CG 4.27Å; F243-F276 HydrophobicContact CD1-CD1 4.14Å; F243-F276 HydrophobicContact CD1-CD2 4.47Å; F243-F276 HydrophobicContact CD1-CE1 4.33Å; F243-F276 HydrophobicContact CD1-CG 4.22Å; F243-F276 HydrophobicContact CD2-CB 3.64Å; F243-F276 HydrophobicContact CD2-CD1 4.49Å; F243-F276 HydrophobicContact CD2-CD2 4.34Å; F243-F276 AromaticContact CD2-CG 3.94Å; F243-F276 HydrophobicContact CD2-CG 3.94Å; F243-F276 HydrophobicContact CE1-CD1 4.28Å; F243-F276 HydrophobicContact CE2-CB 3.91Å; F243-F276 HydrophobicContact CE2-CG 4.36Å; F243-F276 WeakPolarHBondContact CE2-O 3.4Å; F243-F276 HydrophobicContact CG-CB 4.09Å; F243-F276 HydrophobicContact CG-CD1 4.25Å; F243-F276 AromaticContact CG-CD2 3.95Å; F243-F276 HydrophobicContact CG-CD2 3.95Å; F243-F276 HydrophobicContact CG-CE2 4.42Å; F243-F276 AromaticContact CG-CG 3.85Å; F243-F276 HydrophobicContact CG-CG 3.85Å; C262-F276 HydrophobicContact CB-CE1 4.36Å; R272-F276 HydrophobicContact CG-CD1 4.46Å; R272-F276 HydrophobicContact CG-CD2 4.15Å; R272-F276 HydrophobicContact CG-CE1 4.06Å; R272-F276 HydrophobicContact CG-CE2 3.73Å; R272-F276 HydrophobicContact CG-CZ 3.68Å; R272-F276 PolarHBondContact O-N 3.4Å; P273-F276 PolarHBondContact O-N 3.28Å; F276-A280 VanDerWaalsContact O-CB 3.28Å; F276-A280 WeakPolarHBondContact O-CB 3.27Å; F276-A280 PolarHBondContact O-N 3.13Å |
| 277 | E | 92.2 | Very high | 91.6 | Very high | 117 Ų | 117 | 62.7 Ų | 62.7 | 55% | 0.547 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.7 | -50.3 | 173.7 | -171.8 | -177.2 | 170.4 | 0 | 0 | 111.9 | P273 I275 V279 A280 V281 | P273-E277 WeakPolarHBondContact O-CB 3.16Å; P273-E277 PolarHBondContact O-N 3.21Å; I275-E277 VanDerWaalsContact C-N 3.31Å; I275-E277 PolarHBondContact O-N 2.89Å; E277-V279 PolarHBondContact O-N 3.1Å; E277-A280 PolarHBondContact O-N 3.1Å; E277-V281 VanDerWaalsContact O-CG2 3.29Å; E277-V281 WeakPolarHBondContact O-CG2 3.4Å; E277-V281 PolarHBondContact O-N 3.45Å |
| 278 | A | 92.3 | Very high | 91.6 | Very high | 2 Ų | 2 | 63.1 Ų | 63.1 | 2% | 0.017 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62.2 | -43.6 | -179 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q274 I275 V281 E282 A289 L293 | Q274-A278 VanDerWaalsContact O-CB 3.23Å; Q274-A278 WeakPolarHBondContact O-CB 3.24Å; Q274-A278 PolarHBondContact O-N 3.01Å; I275-A278 PolarHBondContact O-N 3.15Å; A278-V281 PolarHBondContact O-N 3.09Å; A278-E282 WeakPolarHBondContact O-CB 3.46Å; A278-E282 VanDerWaalsContact O-CG 3.3Å; A278-E282 WeakPolarHBondContact O-CG 3.48Å; A278-E282 PolarHBondContact O-N 3.04Å; A278-A289 HydrophobicContact CB-CB 4.21Å; A278-L293 HydrophobicContact CB-CD1 4.37Å; A278-L293 HydrophobicContact CB-CD2 4.09Å; A278-L293 HydrophobicContact CB-CG 3.96Å |
| 279 | V | 93.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -67.5 | -38 | 178.9 | 176 | 0 | 0 | 0 | 0 | 111.4 | F243 Y258 V261 L265 I275 E277 K283 G284 A289 | F243-V279 HydrophobicContact CZ-CB 4.12Å; F243-V279 HydrophobicContact CZ-CG1 3.9Å; Y258-V279 HydrophobicContact CD1-CG1 3.79Å; Y258-V279 HydrophobicContact CE1-CG1 4.26Å; Y258-V279 HydrophobicContact CG-CG1 4.26Å; V261-V279 HydrophobicContact CG1-CG2 3.88Å; L265-V279 HydrophobicContact CD1-CG2 3.49Å; L265-V279 VanDerWaalsContact CD1-CG2 3.49Å; I275-V279 HydrophobicContact CG2-CG2 4.08Å; I275-V279 WeakPolarHBondContact O-CB 3.25Å; I275-V279 VanDerWaalsContact O-CG2 3.23Å; I275-V279 WeakPolarHBondContact O-CG2 3.27Å; I275-V279 PolarHBondContact O-N 2.9Å; E277-V279 PolarHBondContact O-N 3.1Å; V279-K283 PolarHBondContact O-N 2.95Å; V279-K283 VanDerWaalsContact O-N 3.1Å; V279-G284 PolarHBondContact O-N 2.93Å; V279-A289 HydrophobicContact CG2-CB 4.28Å |
| 280 | A | 92.2 | Very high | 91.7 | Very high | 42 Ų | 42 | 57.5 Ų | 57.5 | 35% | 0.347 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.4 | -46.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F243 F276 E277 K283 | F243-A280 HydrophobicContact CE2-CB 4.05Å; F276-A280 VanDerWaalsContact O-CB 3.28Å; F276-A280 WeakPolarHBondContact O-CB 3.27Å; F276-A280 PolarHBondContact O-N 3.13Å; E277-A280 PolarHBondContact O-N 3.1Å; A280-K283 PolarHBondContact O-N 3.35Å |
| 281 | V | 92 | Very high | 91.7 | Very high | 72 Ų | 72 | 59 Ų | 59 | 44% | 0.436 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68.5 | -44.7 | -177.7 | 174 | 0 | 0 | 0 | 0 | 111.3 | E277 A278 K283 | E277-V281 VanDerWaalsContact O-CG2 3.29Å; E277-V281 WeakPolarHBondContact O-CG2 3.4Å; E277-V281 PolarHBondContact O-N 3.45Å; A278-V281 PolarHBondContact O-N 3.09Å; V281-K283 PolarHBondContact O-N 3.19Å |
| 282 | E | 92.5 | Very high | 91.7 | Very high | 23 Ų | 23 | 62.3 Ų | 62.3 | 11% | 0.107 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | 10.7 | -177.6 | -54.6 | -57.4 | 149 | 0 | 0 | 112.9 | A278 G284 D285 R288 A289 R292 | A278-E282 WeakPolarHBondContact O-CB 3.46Å; A278-E282 VanDerWaalsContact O-CG 3.3Å; A278-E282 WeakPolarHBondContact O-CG 3.48Å; A278-E282 PolarHBondContact O-N 3.04Å; E282-G284 VanDerWaalsContact C-N 3.29Å; E282-G284 PolarHBondContact O-N 2.93Å; E282-D285 WeakPolarHBondContact O-CB 3.43Å; E282-D285 PolarHBondContact O-N 3.19Å; E282-D285 VanDerWaalsContact O-N 3.08Å; E282-R288 HydrophobicContact CB-CB 3.92Å; E282-R288 HydrophobicContact CG-CB 3.93Å; E282-R288 IonicContact OE2-CZ 2.78Å; E282-R288 IonicContact OE2-NE 3.04Å; E282-R288 PolarHBondContact OE2-NE 2.76Å; E282-R288 IonicContact OE2-NH2 3.66Å; E282-R288 PolarHBondContact OE2-NH2 3.39Å; E282-A289 HydrophobicContact CB-CB 4.44Å; E282-R292 IonicContact OE1-NH1 2.65Å; E282-R292 PolarHBondContact OE1-NH1 3.26Å |
| 283 | K | 90.4 | Very high | 91.6 | Very high | 167 Ų | 167 | 60.4 Ų | 60.4 | 73% | 0.726 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.7 | 37.6 | 174.6 | -58.2 | -176.7 | 179.8 | -179.1 | 0 | 114.9 | Y258 V279 A280 V281 | Y258-K283 VanDerWaalsContact CE2-C 3.44Å; Y258-K283 WeakPolarHBondContact CE2-O 3.47Å; Y258-K283 WeakPolarHBondContact OH-CA 3.47Å; Y258-K283 PolarHBondContact OH-O 3.42Å; V279-K283 PolarHBondContact O-N 2.95Å; V279-K283 VanDerWaalsContact O-N 3.1Å; A280-K283 PolarHBondContact O-N 3.35Å; V281-K283 PolarHBondContact O-N 3.19Å |
| 284 | G | 87.7 | Confident | 91.5 | Very high | 8 Ų | 8 | 60.7 Ų | 60.7 | 8% | 0.082 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 83.2 | 7.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115 | V261 V279 E282 Q286 | V261-G284 WeakPolarHBondContact CG2-O 3.31Å; V279-G284 PolarHBondContact O-N 2.93Å; E282-G284 VanDerWaalsContact C-N 3.29Å; E282-G284 PolarHBondContact O-N 2.93Å; G284-Q286 PolarHBondContact O-N 3.18Å |
| 285 | D | 92.3 | Very high | 90.8 | Very high | 65 Ų | 65 | 61.7 Ų | 61.7 | 35% | 0.348 | 32% | 0.316 | S | S | . | . | trans | -77.6 | 116 | 171.2 | -173.7 | -45.3 | 0 | 0 | 0 | 110.8 | E282 N287 R288 A289 | E282-D285 WeakPolarHBondContact O-CB 3.43Å; E282-D285 PolarHBondContact O-N 3.19Å; E282-D285 VanDerWaalsContact O-N 3.08Å; D285-N287 PolarHBondContact OD1-N 3.21Å; D285-R288 HydrophobicContact CB-CB 4.03Å; D285-R288 HydrophobicContact CB-CG 4.2Å; D285-R288 PolarHBondContact OD1-N 2.78Å; D285-R288 WeakPolarHBondContact OD2-CD 3.35Å; D285-A289 WeakPolarHBondContact O-CB 3.32Å; D285-A289 PolarHBondContact O-N 3.15Å | ||
| 286 | Q | 92.1 | Very high | 89.3 | Confident | 64 Ų | 64 | 69 Ų | 69 | 30% | 0.299 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65 | -42.6 | -178 | -175.4 | 171.9 | -46.8 | 0 | 0 | 113.4 | V261 N264 G284 A289 L290 | V261-Q286 HydrophobicContact CG1-CB 3.91Å; V261-Q286 HydrophobicContact CG1-CG 4.19Å; V261-Q286 HydrophobicContact CG2-CB 3.95Å; N264-Q286 PolarHBondContact ND2-OE1 2.85Å; N264-Q286 VanDerWaalsContact ND2-OE1 3.1Å; G284-Q286 PolarHBondContact O-N 3.18Å; Q286-A289 PolarHBondContact O-N 3.41Å; Q286-L290 HydrophobicContact CG-CD1 4.17Å; Q286-L290 WeakPolarHBondContact O-CB 3.19Å; Q286-L290 WeakPolarHBondContact O-CG 3.33Å; Q286-L290 PolarHBondContact O-N 3.44Å |
| 287 | N | 92.2 | Very high | 86.8 | Confident | 116 Ų | 116 | 77.2 Ų | 77.2 | 62% | 0.62 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -71.5 | -39.9 | -174.5 | -68.9 | -32.9 | 0 | 0 | 0 | 110.7 | D285 L290 S291 | D285-N287 PolarHBondContact OD1-N 3.21Å; N287-L290 PolarHBondContact O-N 2.77Å; N287-S291 WeakPolarHBondContact O-CB 3.45Å; N287-S291 PolarHBondContact O-N 2.95Å; N287-S291 PolarHBondContact O-OG 2.82Å |
| 288 | R | 92.1 | Very high | 86.6 | Confident | 141 Ų | 141 | 75.3 Ų | 75.3 | 53% | 0.532 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -68.8 | -42.5 | 175.2 | -66.3 | 179.9 | 58.2 | 171.2 | -0.4 | 111.5 | E282 D285 L290 S291 R292 | E282-R288 HydrophobicContact CB-CB 3.92Å; E282-R288 HydrophobicContact CG-CB 3.93Å; E282-R288 IonicContact OE2-CZ 2.78Å; E282-R288 IonicContact OE2-NE 3.04Å; E282-R288 PolarHBondContact OE2-NE 2.76Å; E282-R288 IonicContact OE2-NH2 3.66Å; E282-R288 PolarHBondContact OE2-NH2 3.39Å; D285-R288 HydrophobicContact CB-CB 4.03Å; D285-R288 HydrophobicContact CB-CG 4.2Å; D285-R288 PolarHBondContact OD1-N 2.78Å; D285-R288 WeakPolarHBondContact OD2-CD 3.35Å; R288-L290 VanDerWaalsContact C-N 3.31Å; R288-L290 PolarHBondContact O-N 3.27Å; R288-S291 PolarHBondContact O-N 3.05Å; R288-R292 PolarHBondContact O-N 3.2Å |
| 289 | A | 92.1 | Very high | 86.3 | Confident | 0 Ų | 0 | 79.1 Ų | 79.1 | 0% | 0 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -60.4 | -42.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L265 A278 V279 E282 D285 Q286 R292 L293 | L265-A289 HydrophobicContact CD1-CB 4.04Å; A278-A289 HydrophobicContact CB-CB 4.21Å; V279-A289 HydrophobicContact CG2-CB 4.28Å; E282-A289 HydrophobicContact CB-CB 4.44Å; D285-A289 WeakPolarHBondContact O-CB 3.32Å; D285-A289 PolarHBondContact O-N 3.15Å; Q286-A289 PolarHBondContact O-N 3.41Å; A289-R292 PolarHBondContact O-N 3.38Å; A289-L293 VanDerWaalsContact O-CG 3.26Å; A289-L293 WeakPolarHBondContact O-CG 3.48Å; A289-L293 PolarHBondContact O-N 3.48Å |
| 290 | L | 91.9 | Very high | 85.9 | Confident | 30 Ų | 30 | 83.5 Ų | 83.5 | 16% | 0.157 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 173.5 | -82.5 | 172 | 0 | 0 | 0 | 112.7 | L265 M268 F270 Q286 N287 R288 R292 L293 L294 | L265-L290 HydrophobicContact CD2-CD2 3.4Å; L265-L290 HydrophobicContact CD2-CG 3.62Å; M268-L290 HydrophobicContact CE-CD1 4.18Å; M268-L290 HydrophobicContact CE-CD2 3.64Å; M268-L290 HydrophobicContact CE-CG 4.26Å; M268-L290 HydrophobicContact SD-CD2 4.05Å; F270-L290 HydrophobicContact CE2-CD2 3.62Å; F270-L290 HydrophobicContact CZ-CD2 4.04Å; Q286-L290 HydrophobicContact CG-CD1 4.17Å; Q286-L290 WeakPolarHBondContact O-CB 3.19Å; Q286-L290 WeakPolarHBondContact O-CG 3.33Å; Q286-L290 PolarHBondContact O-N 3.44Å; N287-L290 PolarHBondContact O-N 2.77Å; R288-L290 VanDerWaalsContact C-N 3.31Å; R288-L290 PolarHBondContact O-N 3.27Å; L290-R292 PolarHBondContact O-N 3Å; L290-L293 PolarHBondContact O-N 3.08Å; L290-L293 VanDerWaalsContact O-N 3.13Å; L290-L294 WeakPolarHBondContact O-CB 3.44Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.33Å; L290-L294 PolarHBondContact O-N 3.32Å |
| 291 | S | 90.7 | Very high | 85.5 | Confident | 74 Ų | 74 | 85.9 Ų | 85.9 | 52% | 0.517 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.9 | -31.1 | 178.4 | -56.6 | 0 | 0 | 0 | 0 | 112 | N287 R288 | N287-S291 WeakPolarHBondContact O-CB 3.45Å; N287-S291 PolarHBondContact O-N 2.95Å; N287-S291 PolarHBondContact O-OG 2.82Å; R288-S291 PolarHBondContact O-N 3.05Å |
| 292 | R | 89.7 | Confident | 85.1 | Confident | 130 Ų | 130 | 86.8 Ų | 86.8 | 49% | 0.491 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -77.3 | -35.6 | 175.3 | -168.5 | -177.5 | -173.2 | 92.3 | 6.5 | 113.2 | E282 R288 A289 L290 | E282-R292 IonicContact OE1-NH1 2.65Å; E282-R292 PolarHBondContact OE1-NH1 3.26Å; R288-R292 PolarHBondContact O-N 3.2Å; A289-R292 PolarHBondContact O-N 3.38Å; L290-R292 PolarHBondContact O-N 3Å |
| 293 | L | 89.3 | Confident | 84.6 | Confident | 21 Ų | 21 | 91.1 Ų | 91.1 | 11% | 0.11 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -77 | -29.5 | -179.9 | -72.5 | 170.8 | 0 | 0 | 0 | 112.7 | L265 F270 Q274 I275 A278 A289 L290 | L265-L293 HydrophobicContact CD1-CD1 4.09Å; L265-L293 HydrophobicContact CD2-CD1 3.9Å; L265-L293 HydrophobicContact CG-CD1 4.45Å; F270-L293 HydrophobicContact CB-CD1 4.31Å; F270-L293 HydrophobicContact CD1-CB 3.95Å; F270-L293 HydrophobicContact CD1-CD1 4.31Å; F270-L293 HydrophobicContact CD2-CD1 4.25Å; F270-L293 HydrophobicContact CE1-CB 3.88Å; F270-L293 HydrophobicContact CG-CD1 4.04Å; F270-L293 HydrophobicContact CZ-CB 4.39Å; Q274-L293 HydrophobicContact CB-CD2 3.55Å; I275-L293 HydrophobicContact CG1-CD1 4.25Å; A278-L293 HydrophobicContact CB-CD1 4.37Å; A278-L293 HydrophobicContact CB-CD2 4.09Å; A278-L293 HydrophobicContact CB-CG 3.96Å; A289-L293 VanDerWaalsContact O-CG 3.26Å; A289-L293 WeakPolarHBondContact O-CG 3.48Å; A289-L293 PolarHBondContact O-N 3.48Å; L290-L293 PolarHBondContact O-N 3.08Å; L290-L293 VanDerWaalsContact O-N 3.13Å |
| 294 | L | 87.9 | Confident | 84.2 | Confident | 88 Ų | 88 | 85.6 Ų | 85.6 | 46% | 0.461 | 47% | 0.467 | S | S | . | . | S | Bend | trans | -81.7 | 131.8 | 175.1 | -67 | 170.5 | 0 | 0 | 0 | 109.1 | F270 L290 N296 | F270-L294 HydrophobicContact CE1-CD2 4.11Å; F270-L294 HydrophobicContact CZ-CD2 3.87Å; F270-L294 HydrophobicContact CZ-CG 4.32Å; L290-L294 WeakPolarHBondContact O-CB 3.44Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.33Å; L290-L294 PolarHBondContact O-N 3.32Å; L294-N296 PolarHBondContact O-N 3.28Å |
| 295 | P | 76.7 | Confident | 83.9 | Confident | 118 Ų | 118 | 91.6 Ų | 91.6 | 77% | 0.766 | 50% | 0.496 | S | S | * | . | trans | -60.8 | 128.9 | 170.3 | 23.9 | -29.7 | 0 | 0 | 0 | 108.6 | S297 | P295-S297 PolarHBondContact O-N 3.41Š| ||
| 296 | N | 61.5 | Low | 83.2 | Confident | 155 Ų | 155 | 93.8 Ų | 93.8 | 83% | 0.829 | 51% | 0.509 | S | S | * | . | trans | -54.7 | 107.8 | 170.3 | -69.1 | -20.3 | 0 | 0 | 0 | 107.8 | L294 | L294-N296 PolarHBondContact O-N 3.28Š| ||
| 297 | S | 42.2 | Very low | 82.4 | Confident | 189 Ų | 189 | 96.5 Ų | 96.5 | 100% | 1.322 | 53% | 0.528 | S | S | * | . | trans | -77.8 | 0 | 173.1 | 67.8 | 0 | 0 | 0 | 0 | 110.8 | P295 | P295-S297 PolarHBondContact O-N 3.41Š|
Retrieved 297 of 297 residues in 47.7 ms
(Link to these results)