| 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 | 43.7 | Very low | 54.4 | Low | 255 Ų | 255 | 138.5 Ų | 138.5 | 100% | 1.256 | 80% | 0.802 | S | S | * | * | 0 | 95.6 | 0 | -91.9 | 160 | 70.2 | 0 | 0 | 108.5 | |||||
| 2 | G | 59.9 | Low | 55.2 | Low | 70 Ų | 70 | 136.2 Ų | 136.2 | 72% | 0.722 | 80% | 0.795 | S | S | * | * | trans | -117.9 | 127.9 | -172.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 3 | K | 60.1 | Low | 56.3 | Low | 204 Ų | 204 | 133.5 Ų | 133.5 | 89% | 0.887 | 78% | 0.781 | S | S | * | * | trans | 74.6 | 110.3 | 161 | -49.5 | -179.8 | -178 | -175.7 | 0 | 115.6 | ||||
| 4 | K | 55.2 | Low | 57.1 | Low | 197 Ų | 197 | 129.4 Ų | 129.4 | 86% | 0.857 | 75% | 0.754 | S | S | * | * | trans | 160.2 | 85.9 | 131.9 | -88.1 | 160.6 | -179.7 | 177.7 | 0 | 109.4 | ||||
| 5 | D | 52.5 | Low | 58 | Low | 159 Ų | 159 | 127.7 Ų | 127.7 | 85% | 0.85 | 74% | 0.737 | S | S | * | * | trans | -155.7 | 17.5 | 156.9 | -80.7 | -44.2 | 0 | 0 | 0 | 112.9 | G7 | D5-G7 VanDerWaalsContact C-N 3.31Å; D5-G7 PolarHBondContact O-N 2.88Å | ||
| 6 | A | 49.8 | Very low | 58.9 | Low | 115 Ų | 115 | 129.4 Ų | 129.4 | 95% | 0.95 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | 19.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 7 | G | 52 | Low | 59.8 | Low | 59 Ų | 59 | 132.4 Ų | 132.4 | 61% | 0.608 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.5 | 17 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | D5 | D5-G7 VanDerWaalsContact C-N 3.31Å; D5-G7 PolarHBondContact O-N 2.88Å |
| 8 | A | 53.6 | Low | 60.5 | Low | 85 Ų | 85 | 132.8 Ų | 132.8 | 70% | 0.702 | 72% | 0.719 | S | S | * | * | trans | -84.7 | -1.5 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | K10 | A8-K10 PolarHBondContact O-N 3.33Š| ||
| 9 | T | 54.4 | Low | 61.2 | Low | 131 Ų | 131 | 132.2 Ų | 132.2 | 80% | 0.804 | 71% | 0.711 | S | S | * | * | trans | -81.5 | 66.1 | 163.1 | 33.5 | 0 | 0 | 0 | 0 | 109.3 | L11 | T9-L11 PolarHBondContact O-N 3.47Š| ||
| 10 | K | 58 | Low | 61.9 | Low | 130 Ų | 130 | 129 Ų | 129 | 57% | 0.565 | 69% | 0.693 | S | S | * | * | trans | -60.8 | 111.5 | 166.3 | -71.3 | -179 | -175.3 | 167.1 | 0 | 106.6 | A8 | A8-K10 PolarHBondContact O-N 3.33Š| ||
| 11 | L | 59.6 | Low | 62.4 | Low | 118 Ų | 118 | 125 Ų | 125 | 62% | 0.618 | 68% | 0.682 | S | S | * | * | trans | -51.8 | 134.7 | 174.1 | -79.6 | 98.5 | 0 | 0 | 0 | 108 | T9 V13 D14 Q15 | T9-L11 PolarHBondContact O-N 3.47Å; L11-V13 PolarHBondContact O-N 3.41Å; L11-D14 PolarHBondContact O-N 3.39Å; L11-Q15 PolarHBondContact O-N 2.9Å | ||
| 12 | P | 63.8 | Low | 64 | Low | 111 Ų | 111 | 120.1 Ų | 120.1 | 72% | 0.721 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -52.6 | -28.3 | -175.1 | 14.3 | -27.1 | 0 | 0 | 0 | 112.6 | Q15 Y16 | P12-Q15 PolarHBondContact O-N 2.93Å; P12-Y16 WeakPolarHBondContact O-CB 3.45Å; P12-Y16 PolarHBondContact O-N 3.29Å |
| 13 | V | 68.9 | Low | 64.4 | Low | 102 Ų | 102 | 122 Ų | 122 | 62% | 0.618 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -63.5 | -43.6 | 174.9 | -177.2 | 0 | 0 | 0 | 0 | 113.3 | L11 Q15 Y16 R17 | L11-V13 PolarHBondContact O-N 3.41Å; V13-Q15 VanDerWaalsContact C-N 3.32Å; V13-Q15 PolarHBondContact O-N 3.01Å; V13-Y16 WeakPolarHBondContact O-CB 3.44Å; V13-Y16 PolarHBondContact O-N 3.03Å; V13-R17 WeakPolarHBondContact O-CB 3.39Å; V13-R17 PolarHBondContact O-N 3.3Å |
| 14 | D | 68.1 | Low | 64.6 | Low | 75 Ų | 75 | 116.4 Ų | 116.4 | 40% | 0.401 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -72.3 | -29.4 | -179.7 | -88.4 | -25 | 0 | 0 | 0 | 112.4 | L11 R17 K18 | L11-D14 PolarHBondContact O-N 3.39Å; D14-R17 IonicContact OD1-NH1 3.63Å; D14-K18 PolarHBondContact O-N 3.05Å |
| 15 | Q | 70.2 | Confident | 65.2 | Low | 105 Ų | 105 | 113.9 Ų | 113.9 | 49% | 0.491 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -70.7 | -41.5 | 173.1 | -166.4 | 153.5 | -49.8 | 0 | 0 | 111.1 | L11 P12 V13 K18 Q19 | L11-Q15 PolarHBondContact O-N 2.9Å; P12-Q15 PolarHBondContact O-N 2.93Å; V13-Q15 VanDerWaalsContact C-N 3.32Å; V13-Q15 PolarHBondContact O-N 3.01Å; Q15-K18 PolarHBondContact O-N 3.1Å; Q15-Q19 PolarHBondContact O-N 3.5Å |
| 16 | Y | 72.8 | Confident | 65.7 | Low | 154 Ų | 154 | 114.3 Ų | 114.3 | 60% | 0.604 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -60.4 | -47.9 | 173 | -174.2 | -106.9 | 0 | 0 | 0 | 111.7 | P12 V13 K18 Q19 I20 | P12-Y16 WeakPolarHBondContact O-CB 3.45Å; P12-Y16 PolarHBondContact O-N 3.29Å; V13-Y16 WeakPolarHBondContact O-CB 3.44Å; V13-Y16 PolarHBondContact O-N 3.03Å; Y16-K18 VanDerWaalsContact C-N 3.3Å; Y16-K18 PolarHBondContact O-N 3.04Å; Y16-Q19 PolarHBondContact O-N 3.39Å; Y16-I20 HydrophobicContact CD1-CD1 3.9Å; Y16-I20 HydrophobicContact CE1-CD1 3.45Å; Y16-I20 VanDerWaalsContact CE1-CD1 3.45Å; Y16-I20 HydrophobicContact CE1-CG1 4.38Å; Y16-I20 PolarHBondContact O-N 3.17Å; Y16-I20 VanDerWaalsContact O-N 3.1Å |
| 17 | R | 73.4 | Confident | 66.2 | Low | 181 Ų | 181 | 114.7 Ų | 114.7 | 68% | 0.683 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -58.8 | -39.2 | 178.2 | -153.7 | 176.8 | 116.5 | -157.6 | 9 | 112.7 | V13 D14 G21 | V13-R17 WeakPolarHBondContact O-CB 3.39Å; V13-R17 PolarHBondContact O-N 3.3Å; D14-R17 IonicContact OD1-NH1 3.63Å; R17-G21 PolarHBondContact O-N 2.96Å |
| 18 | K | 73.3 | Confident | 66.7 | Low | 139 Ų | 139 | 116 Ų | 116 | 60% | 0.604 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -73.7 | -28.3 | 176 | -82.3 | 175.6 | 177.7 | 168.7 | 0 | 113.5 | D14 Q15 Y16 K22 | D14-K18 PolarHBondContact O-N 3.05Å; Q15-K18 PolarHBondContact O-N 3.1Å; Y16-K18 VanDerWaalsContact C-N 3.3Å; Y16-K18 PolarHBondContact O-N 3.04Å; K18-K22 VanDerWaalsContact O-CG 3.3Å; K18-K22 WeakPolarHBondContact O-CG 3.3Å; K18-K22 PolarHBondContact O-N 3Å |
| 19 | Q | 74.6 | Confident | 67.1 | Low | 121 Ų | 121 | 117 Ų | 117 | 57% | 0.565 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -70.7 | -41.5 | 174.7 | -86.2 | -175.5 | -13.8 | 0 | 0 | 111.8 | Q15 Y16 G21 K22 Q23 | Q15-Q19 PolarHBondContact O-N 3.5Å; Y16-Q19 PolarHBondContact O-N 3.39Å; Q19-G21 PolarHBondContact O-N 3.04Å; Q19-K22 PolarHBondContact O-N 3.47Å; Q19-Q23 WeakPolarHBondContact O-CB 3.48Å; Q19-Q23 PolarHBondContact O-N 3.14Å |
| 20 | I | 73.4 | Confident | 67.4 | Low | 68 Ų | 68 | 114 Ų | 114 | 35% | 0.349 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -57.9 | -51.5 | 175.9 | -65.7 | 176.6 | 0 | 0 | 0 | 110.4 | Y16 K22 Q23 D24 | Y16-I20 HydrophobicContact CD1-CD1 3.9Å; Y16-I20 HydrophobicContact CE1-CD1 3.45Å; Y16-I20 VanDerWaalsContact CE1-CD1 3.45Å; Y16-I20 HydrophobicContact CE1-CG1 4.38Å; Y16-I20 PolarHBondContact O-N 3.17Å; Y16-I20 VanDerWaalsContact O-N 3.1Å; I20-K22 VanDerWaalsContact C-N 3.29Å; I20-K22 PolarHBondContact O-N 3.29Å; I20-Q23 PolarHBondContact O-N 3.29Å; I20-Q23 VanDerWaalsContact O-N 3.11Å; I20-D24 PolarHBondContact O-N 2.83Å |
| 21 | G | 74.1 | Confident | 67.6 | Low | 45 Ų | 45 | 112.1 Ų | 112.1 | 46% | 0.464 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.1 | -34.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114 | R17 Q19 Y25 | R17-G21 PolarHBondContact O-N 2.96Å; Q19-G21 PolarHBondContact O-N 3.04Å; G21-Y25 VanDerWaalsContact O-CB 3.31Å; G21-Y25 WeakPolarHBondContact O-CB 3.31Å; G21-Y25 PolarHBondContact O-N 3.25Å |
| 22 | K | 76.1 | Confident | 67.6 | Low | 153 Ų | 153 | 110.7 Ų | 110.7 | 67% | 0.665 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.5 | -37.1 | 175.7 | -75 | 178 | -179.6 | -172.7 | 0 | 112.5 | K18 Q19 I20 K26 | K18-K22 VanDerWaalsContact O-CG 3.3Å; K18-K22 WeakPolarHBondContact O-CG 3.3Å; K18-K22 PolarHBondContact O-N 3Å; Q19-K22 PolarHBondContact O-N 3.47Å; I20-K22 VanDerWaalsContact C-N 3.29Å; I20-K22 PolarHBondContact O-N 3.29Å; K22-K26 PolarHBondContact O-N 3.04Å |
| 23 | Q | 69.8 | Low | 67.5 | Low | 110 Ų | 110 | 112.7 Ų | 112.7 | 51% | 0.514 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69.1 | -45.2 | 178 | -170.9 | 178 | 8.2 | 0 | 0 | 110.6 | Q19 I20 K26 K27 | Q19-Q23 WeakPolarHBondContact O-CB 3.48Å; Q19-Q23 PolarHBondContact O-N 3.14Å; I20-Q23 PolarHBondContact O-N 3.29Å; I20-Q23 VanDerWaalsContact O-N 3.11Å; Q23-K26 PolarHBondContact O-N 2.77Å; Q23-K27 PolarHBondContact O-N 3.5Å |
| 24 | D | 63.4 | Low | 67.1 | Low | 86 Ų | 86 | 110.3 Ų | 110.3 | 46% | 0.46 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.2 | -42.1 | 177.2 | -75.8 | -18.6 | 0 | 0 | 0 | 111.4 | I20 K26 K27 T28 | I20-D24 PolarHBondContact O-N 2.83Å; D24-K26 VanDerWaalsContact C-N 3.29Å; D24-K26 PolarHBondContact O-N 2.91Å; D24-K27 PolarHBondContact O-N 3.11Å; D24-K27 VanDerWaalsContact O-N 3.14Å; D24-T28 PolarHBondContact O-N 2.97Å; D24-T28 PolarHBondContact O-OG1 3.13Å |
| 25 | Y | 67.1 | Low | 66.7 | Low | 145 Ų | 145 | 110.7 Ų | 110.7 | 57% | 0.569 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -59.2 | -38.7 | 174.6 | -172.9 | -99.9 | 0 | 0 | 0 | 113 | G21 K29 | G21-Y25 VanDerWaalsContact O-CB 3.31Å; G21-Y25 WeakPolarHBondContact O-CB 3.31Å; G21-Y25 PolarHBondContact O-N 3.25Å; Y25-K29 HydrophobicContact CD1-CD 4.27Å; Y25-K29 HydrophobicContact CE1-CD 3.65Å; Y25-K29 HydrophobicContact CE1-CG 4.33Å; Y25-K29 VanDerWaalsContact CZ-CE 3.4Å; Y25-K29 WeakPolarHBondContact O-CB 3.35Å; Y25-K29 PolarHBondContact O-N 2.98Å; Y25-K29 VanDerWaalsContact O-N 3.12Å; Y25-K29 WeakPolarHBondContact OH-CE 3.45Å; Y25-K29 PolarHBondContact OH-NZ 3.26Å |
| 26 | K | 62.6 | Low | 66.2 | Low | 168 Ų | 168 | 113.7 Ų | 113.7 | 73% | 0.73 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.7 | -41.4 | 175.1 | -87.8 | -171 | 174.1 | -169.9 | 0 | 112.2 | K22 Q23 D24 S30 | K22-K26 PolarHBondContact O-N 3.04Å; Q23-K26 PolarHBondContact O-N 2.77Å; D24-K26 VanDerWaalsContact C-N 3.29Å; D24-K26 PolarHBondContact O-N 2.91Å; K26-S30 PolarHBondContact O-N 3Å |
| 27 | K | 62 | Low | 65.5 | Low | 123 Ų | 123 | 112.3 Ų | 112.3 | 54% | 0.535 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68.3 | -44.5 | 178.4 | -73.5 | -167.6 | 177.5 | -172.3 | 0 | 112 | Q23 D24 K29 S30 V31 | Q23-K27 PolarHBondContact O-N 3.5Å; D24-K27 PolarHBondContact O-N 3.11Å; D24-K27 VanDerWaalsContact O-N 3.14Å; K27-K29 VanDerWaalsContact C-N 3.32Å; K27-K29 PolarHBondContact O-N 3.46Å; K27-S30 PolarHBondContact O-N 3.4Å; K27-S30 PolarHBondContact O-OG 3.29Å; K27-V31 WeakPolarHBondContact O-CG2 3.37Å; K27-V31 PolarHBondContact O-N 2.96Å; K27-V31 VanDerWaalsContact O-N 3.17Å |
| 28 | T | 61.7 | Low | 64.8 | Low | 85 Ų | 85 | 111 Ų | 111 | 52% | 0.521 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.5 | -33.3 | 180 | -46.5 | 0 | 0 | 0 | 0 | 111.6 | D24 V31 L32 | D24-T28 PolarHBondContact O-N 2.97Å; D24-T28 PolarHBondContact O-OG1 3.13Å; T28-V31 PolarHBondContact O-N 3.49Å; T28-L32 HydrophobicContact CG2-CD1 4.44Å; T28-L32 WeakPolarHBondContact O-CB 3.45Å; T28-L32 PolarHBondContact O-N 3.26Å |
| 29 | K | 61.6 | Low | 64 | Low | 106 Ų | 106 | 106.4 Ų | 106.4 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 173 | -94.8 | -167.1 | 167.7 | -179.5 | 0 | 113.6 | Y25 K27 K33 | Y25-K29 HydrophobicContact CD1-CD 4.27Å; Y25-K29 HydrophobicContact CE1-CD 3.65Å; Y25-K29 HydrophobicContact CE1-CG 4.33Å; Y25-K29 VanDerWaalsContact CZ-CE 3.4Å; Y25-K29 WeakPolarHBondContact O-CB 3.35Å; Y25-K29 PolarHBondContact O-N 2.98Å; Y25-K29 VanDerWaalsContact O-N 3.12Å; Y25-K29 WeakPolarHBondContact OH-CE 3.45Å; Y25-K29 PolarHBondContact OH-NZ 3.26Å; K27-K29 VanDerWaalsContact C-N 3.32Å; K27-K29 PolarHBondContact O-N 3.46Å; K29-K33 WeakPolarHBondContact O-CG 3.33Å; K29-K33 PolarHBondContact O-N 2.87Å; K29-K33 VanDerWaalsContact O-N 3.13Å |
| 30 | S | 61.2 | Low | 63 | Low | 70 Ų | 70 | 107.2 Ų | 107.2 | 49% | 0.49 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -69.5 | -38.7 | 179 | 63.1 | 0 | 0 | 0 | 0 | 111.4 | K26 K27 K33 A34 | K26-S30 PolarHBondContact O-N 3Å; K27-S30 PolarHBondContact O-N 3.4Å; K27-S30 PolarHBondContact O-OG 3.29Å; S30-K33 PolarHBondContact O-N 2.98Å; S30-A34 PolarHBondContact O-N 3.19Å |
| 31 | V | 61.3 | Low | 62.1 | Low | 90 Ų | 90 | 106.7 Ų | 106.7 | 55% | 0.545 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 175.6 | 177.1 | 0 | 0 | 0 | 0 | 111.7 | K27 T28 K33 A34 T35 | K27-V31 WeakPolarHBondContact O-CG2 3.37Å; K27-V31 PolarHBondContact O-N 2.96Å; K27-V31 VanDerWaalsContact O-N 3.17Å; T28-V31 PolarHBondContact O-N 3.49Å; V31-K33 PolarHBondContact O-N 3.2Å; V31-A34 PolarHBondContact O-N 3.17Å; V31-T35 WeakPolarHBondContact O-CB 3.48Å; V31-T35 PolarHBondContact O-N 3.29Å; V31-T35 PolarHBondContact O-OG1 3.25Å |
| 32 | L | 61.2 | Low | 61.2 | Low | 88 Ų | 88 | 112.8 Ų | 112.8 | 46% | 0.461 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.6 | -39.1 | 174.3 | -91.7 | 160.6 | 0 | 0 | 0 | 112.8 | T28 T35 R36 | T28-L32 HydrophobicContact CG2-CD1 4.44Å; T28-L32 WeakPolarHBondContact O-CB 3.45Å; T28-L32 PolarHBondContact O-N 3.26Å; L32-T35 PolarHBondContact O-N 3.41Å; L32-R36 WeakPolarHBondContact O-CG 3.07Å; L32-R36 PolarHBondContact O-N 3.12Å |
| 33 | K | 61.4 | Low | 60.2 | Low | 153 Ų | 153 | 114.3 Ų | 114.3 | 67% | 0.665 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66.7 | -44.2 | 175.2 | -75.2 | -173.8 | 176.8 | -168 | 0 | 111.9 | K29 S30 V31 T35 R36 L37 | K29-K33 WeakPolarHBondContact O-CG 3.33Å; K29-K33 PolarHBondContact O-N 2.87Å; K29-K33 VanDerWaalsContact O-N 3.13Å; S30-K33 PolarHBondContact O-N 2.98Å; V31-K33 PolarHBondContact O-N 3.2Å; K33-T35 VanDerWaalsContact C-N 3.27Å; K33-T35 PolarHBondContact O-N 3.46Å; K33-R36 PolarHBondContact O-N 3.05Å; K33-L37 WeakPolarHBondContact O-CB 3.47Å; K33-L37 PolarHBondContact O-N 2.8Å |
| 34 | A | 60.5 | Low | 59.4 | Low | 51 Ų | 51 | 115.2 Ų | 115.2 | 42% | 0.421 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.7 | -35.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S30 V31 K38 | S30-A34 PolarHBondContact O-N 3.19Å; V31-A34 PolarHBondContact O-N 3.17Å; A34-K38 WeakPolarHBondContact O-CB 3.42Å; A34-K38 VanDerWaalsContact O-CG 3.31Å; A34-K38 WeakPolarHBondContact O-CG 3.31Å; A34-K38 PolarHBondContact O-N 3.44Å; A34-K38 VanDerWaalsContact O-N 3.1Å |
| 35 | T | 59.8 | Low | 59.1 | Low | 84 Ų | 84 | 114.8 Ų | 114.8 | 52% | 0.515 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.9 | -41 | 176.5 | -52.6 | 0 | 0 | 0 | 0 | 111.6 | V31 L32 K33 K38 A39 | V31-T35 WeakPolarHBondContact O-CB 3.48Å; V31-T35 PolarHBondContact O-N 3.29Å; V31-T35 PolarHBondContact O-OG1 3.25Å; L32-T35 PolarHBondContact O-N 3.41Å; K33-T35 VanDerWaalsContact C-N 3.27Å; K33-T35 PolarHBondContact O-N 3.46Å; T35-K38 PolarHBondContact O-N 3.11Å; T35-A39 WeakPolarHBondContact O-CB 3.48Å; T35-A39 PolarHBondContact O-N 3.46Å |
| 36 | R | 59.2 | Low | 58.6 | Low | 168 Ų | 168 | 111.8 Ų | 111.8 | 63% | 0.634 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.5 | -42 | 175 | -76.1 | -179.5 | -179.9 | 164.6 | 0.3 | 112.4 | L32 K33 K38 A39 E40 | L32-R36 WeakPolarHBondContact O-CG 3.07Å; L32-R36 PolarHBondContact O-N 3.12Å; K33-R36 PolarHBondContact O-N 3.05Å; R36-K38 VanDerWaalsContact C-N 3.34Å; R36-K38 PolarHBondContact O-N 2.93Å; R36-A39 CarbonylContact O-C 3.57Å; R36-A39 PolarHBondContact O-N 3.43Å; R36-A39 VanDerWaalsContact O-N 3.11Å; R36-E40 PolarHBondContact O-N 2.92Å |
| 37 | L | 58.1 | Low | 58.7 | Low | 125 Ų | 125 | 106.4 Ų | 106.4 | 65% | 0.654 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -67.3 | -35.7 | 179.3 | -156.2 | 144.9 | 0 | 0 | 0 | 111.6 | K33 A41 | K33-L37 WeakPolarHBondContact O-CB 3.47Å; K33-L37 PolarHBondContact O-N 2.8Å; L37-A41 VanDerWaalsContact O-CB 3.25Å; L37-A41 WeakPolarHBondContact O-CB 3.24Å; L37-A41 PolarHBondContact O-N 3.29Å |
| 38 | K | 58.3 | Low | 59.2 | Low | 152 Ų | 152 | 108.3 Ų | 108.3 | 66% | 0.661 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -68.5 | -33.9 | 170.3 | -73.8 | 179.7 | 178.3 | -175.1 | 0 | 112.9 | A34 T35 R36 K42 | A34-K38 WeakPolarHBondContact O-CB 3.42Å; A34-K38 VanDerWaalsContact O-CG 3.31Å; A34-K38 WeakPolarHBondContact O-CG 3.31Å; A34-K38 PolarHBondContact O-N 3.44Å; A34-K38 VanDerWaalsContact O-N 3.1Å; T35-K38 PolarHBondContact O-N 3.11Å; R36-K38 VanDerWaalsContact C-N 3.34Å; R36-K38 PolarHBondContact O-N 2.93Å; K38-K42 WeakPolarHBondContact O-CB 3.37Å; K38-K42 WeakPolarHBondContact O-CG 3.41Å; K38-K42 PolarHBondContact O-N 3.08Å; K38-K42 VanDerWaalsContact O-N 3.08Å |
| 39 | A | 56.8 | Low | 60 | Low | 43 Ų | 43 | 113 Ų | 113 | 36% | 0.355 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -74.6 | -38.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | T35 R36 K42 K43 | T35-A39 WeakPolarHBondContact O-CB 3.48Å; T35-A39 PolarHBondContact O-N 3.46Å; R36-A39 CarbonylContact O-C 3.57Å; R36-A39 PolarHBondContact O-N 3.43Å; R36-A39 VanDerWaalsContact O-N 3.11Å; A39-K42 PolarHBondContact O-N 3.1Å; A39-K43 VanDerWaalsContact O-CG 3.24Å; A39-K43 WeakPolarHBondContact O-CG 3.32Å; A39-K43 PolarHBondContact O-N 2.99Å |
| 40 | E | 54.1 | Low | 60.9 | Low | 138 Ų | 138 | 112.9 Ų | 112.9 | 65% | 0.645 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.5 | -40.5 | 172.9 | -81 | -178.5 | 142.1 | 0 | 0 | 111.7 | R36 K42 K43 N44 | R36-E40 PolarHBondContact O-N 2.92Å; E40-K42 PolarHBondContact O-N 3.39Å; E40-K43 PolarHBondContact O-N 3.46Å; E40-N44 PolarHBondContact O-N 3Å |
| 41 | A | 54.8 | Low | 62.2 | Low | 58 Ų | 58 | 112.2 Ų | 112.2 | 48% | 0.479 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -60.8 | -43.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L37 K43 N44 S45 | L37-A41 VanDerWaalsContact O-CB 3.25Å; L37-A41 WeakPolarHBondContact O-CB 3.24Å; L37-A41 PolarHBondContact O-N 3.29Å; A41-K43 VanDerWaalsContact C-N 3.34Å; A41-K43 PolarHBondContact O-N 3.47Å; A41-N44 PolarHBondContact O-N 3.38Å; A41-S45 VanDerWaalsContact O-CB 3.22Å; A41-S45 WeakPolarHBondContact O-CB 3.22Å; A41-S45 PolarHBondContact O-N 3.44Å; A41-S45 PolarHBondContact O-OG 3.3Å |
| 42 | K | 54.3 | Low | 63.5 | Low | 173 Ų | 173 | 114.3 Ų | 114.3 | 75% | 0.752 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.3 | -30.5 | 176.7 | -81.3 | -173 | 173.2 | -164.6 | 0 | 113.9 | K38 A39 E40 N44 S45 | K38-K42 WeakPolarHBondContact O-CB 3.37Å; K38-K42 WeakPolarHBondContact O-CG 3.41Å; K38-K42 PolarHBondContact O-N 3.08Å; K38-K42 VanDerWaalsContact O-N 3.08Å; A39-K42 PolarHBondContact O-N 3.1Å; E40-K42 PolarHBondContact O-N 3.39Å; K42-N44 VanDerWaalsContact C-N 3.3Å; K42-S45 PolarHBondContact O-OG 3.21Å |
| 43 | K | 55.1 | Low | 64.9 | Low | 184 Ų | 184 | 115.5 Ų | 115.5 | 80% | 0.8 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -71.8 | -26.3 | 176.5 | -74 | 173.4 | -179.4 | -167.5 | 0 | 112.4 | A39 E40 A41 | A39-K43 VanDerWaalsContact O-CG 3.24Å; A39-K43 WeakPolarHBondContact O-CG 3.32Å; A39-K43 PolarHBondContact O-N 2.99Å; E40-K43 PolarHBondContact O-N 3.46Å; A41-K43 VanDerWaalsContact C-N 3.34Å; A41-K43 PolarHBondContact O-N 3.47Å |
| 44 | N | 53.3 | Low | 66.4 | Low | 130 Ų | 130 | 111.9 Ų | 111.9 | 70% | 0.695 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -97.7 | -1.7 | -174.4 | -149.5 | 14.5 | 0 | 0 | 0 | 114.2 | E40 A41 K42 | E40-N44 PolarHBondContact O-N 3Å; A41-N44 PolarHBondContact O-N 3.38Å; K42-N44 VanDerWaalsContact C-N 3.3Å |
| 45 | S | 55.7 | Low | 68 | Low | 77 Ų | 77 | 113.4 Ų | 113.4 | 54% | 0.538 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -104.6 | 1.2 | -155.6 | 69.4 | 0 | 0 | 0 | 0 | 118.7 | A41 K42 | A41-S45 VanDerWaalsContact O-CB 3.22Å; A41-S45 WeakPolarHBondContact O-CB 3.22Å; A41-S45 PolarHBondContact O-N 3.44Å; A41-S45 PolarHBondContact O-OG 3.3Å; K42-S45 PolarHBondContact O-OG 3.21Å |
| 46 | S | 57.4 | Low | 69.7 | Low | 82 Ų | 82 | 111.4 Ų | 111.4 | 57% | 0.573 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -148.5 | -62.7 | -176.2 | -172 | 0 | 0 | 0 | 0 | 115.3 | F48 R49 D50 | S46-F48 PolarHBondContact O-N 2.97Å; S46-R49 PolarHBondContact O-N 3.02Å; S46-D50 WeakPolarHBondContact O-CB 3.35Å; S46-D50 PolarHBondContact O-N 3.38Å; S46-D50 VanDerWaalsContact O-N 3.08Å |
| 47 | G | 63.9 | Low | 71.4 | Confident | 55 Ų | 55 | 106.2 Ų | 106.2 | 57% | 0.567 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.7 | -42.9 | -169.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | A51 | G47-A51 WeakPolarHBondContact O-CB 3.25Å; G47-A51 PolarHBondContact O-N 3.46Å |
| 48 | F | 72.9 | Confident | 73.2 | Confident | 163 Ų | 163 | 105 Ų | 105 | 72% | 0.715 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -70.2 | -40.1 | -178.1 | -173.7 | -97.6 | 0 | 0 | 0 | 112.6 | S46 F52 | S46-F48 PolarHBondContact O-N 2.97Å; F48-F52 WeakPolarHBondContact O-CB 3.35Å; F48-F52 PolarHBondContact O-N 3.08Å |
| 49 | R | 79.7 | Confident | 75 | Confident | 184 Ų | 184 | 103.3 Ų | 103.3 | 69% | 0.694 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.7 | -41.2 | 177 | -84.3 | -176.1 | 71.3 | 172.5 | 1.4 | 111.4 | S46 F52 L53 | S46-R49 PolarHBondContact O-N 3.02Å; R49-F52 PolarHBondContact O-N 2.88Å; R49-L53 WeakPolarHBondContact O-CB 3.41Å; R49-L53 PolarHBondContact O-N 3.45Å |
| 50 | D | 80.8 | Confident | 76.9 | Confident | 103 Ų | 103 | 108 Ų | 108 | 55% | 0.551 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.9 | -48 | -179.4 | -161.8 | 38.5 | 0 | 0 | 0 | 111.2 | S46 F52 L53 V54 | S46-D50 WeakPolarHBondContact O-CB 3.35Å; S46-D50 PolarHBondContact O-N 3.38Å; S46-D50 VanDerWaalsContact O-N 3.08Å; D50-F52 VanDerWaalsContact C-N 3.34Å; D50-F52 PolarHBondContact O-N 3.43Å; D50-L53 PolarHBondContact O-N 3.49Å; D50-L53 VanDerWaalsContact O-N 3.16Å; D50-V54 WeakPolarHBondContact O-CG2 3.14Å; D50-V54 PolarHBondContact O-N 2.91Å |
| 51 | A | 86.7 | Confident | 78.8 | Confident | 56 Ų | 56 | 108.2 Ų | 108.2 | 46% | 0.463 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -59.4 | -42.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | G47 V54 V55 | G47-A51 WeakPolarHBondContact O-CB 3.25Å; G47-A51 PolarHBondContact O-N 3.46Å; A51-V54 PolarHBondContact O-N 3.16Å; A51-V55 VanDerWaalsContact O-CG2 3.29Å; A51-V55 WeakPolarHBondContact O-CG2 3.29Å; A51-V55 PolarHBondContact O-N 2.97Å |
| 52 | F | 88.9 | Confident | 80.7 | Confident | 134 Ų | 134 | 109.7 Ų | 109.7 | 59% | 0.588 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.6 | -41.1 | 175.8 | -178.1 | -95.3 | 0 | 0 | 0 | 112 | F48 R49 D50 V55 A56 | F48-F52 WeakPolarHBondContact O-CB 3.35Å; F48-F52 PolarHBondContact O-N 3.08Å; R49-F52 PolarHBondContact O-N 2.88Å; D50-F52 VanDerWaalsContact C-N 3.34Å; D50-F52 PolarHBondContact O-N 3.43Å; F52-V55 PolarHBondContact O-N 3.3Å; F52-A56 VanDerWaalsContact O-CB 3.25Å; F52-A56 WeakPolarHBondContact O-CB 3.34Å; F52-A56 PolarHBondContact O-N 2.88Å |
| 53 | L | 90.4 | Very high | 82.6 | Confident | 113 Ų | 113 | 107.9 Ų | 107.9 | 59% | 0.592 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.4 | -42.8 | 179 | -141 | 104.1 | 0 | 0 | 0 | 111.4 | R49 D50 A56 A57 | R49-L53 WeakPolarHBondContact O-CB 3.41Å; R49-L53 PolarHBondContact O-N 3.45Å; D50-L53 PolarHBondContact O-N 3.49Å; D50-L53 VanDerWaalsContact O-N 3.16Å; L53-A56 PolarHBondContact O-N 3.31Å; L53-A57 WeakPolarHBondContact O-CB 3.33Å; L53-A57 PolarHBondContact O-N 3.44Å |
| 54 | V | 93.1 | Very high | 84.4 | Confident | 77 Ų | 77 | 101.6 Ų | 101.6 | 47% | 0.467 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.2 | -47.2 | 177.3 | 173.4 | 0 | 0 | 0 | 0 | 110.6 | D50 A51 A56 A57 I58 | D50-V54 WeakPolarHBondContact O-CG2 3.14Å; D50-V54 PolarHBondContact O-N 2.91Å; A51-V54 PolarHBondContact O-N 3.16Å; V54-A56 PolarHBondContact O-N 3.03Å; V54-A57 PolarHBondContact O-N 3.44Å; V54-I58 HydrophobicContact CG1-CD1 4.02Å; V54-I58 WeakPolarHBondContact O-CG1 3.38Å; V54-I58 PolarHBondContact O-N 3.44Å |
| 55 | V | 94.3 | Very high | 86.2 | Confident | 83 Ų | 83 | 98.4 Ų | 98.4 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.2 | -44.6 | 177.3 | 173 | 0 | 0 | 0 | 0 | 111 | A51 F52 A57 I58 L59 | A51-V55 VanDerWaalsContact O-CG2 3.29Å; A51-V55 WeakPolarHBondContact O-CG2 3.29Å; A51-V55 PolarHBondContact O-N 2.97Å; F52-V55 PolarHBondContact O-N 3.3Å; V55-A57 VanDerWaalsContact C-N 3.33Å; V55-A57 PolarHBondContact O-N 3.49Å; V55-I58 PolarHBondContact O-N 2.98Å; V55-L59 HydrophobicContact CG1-CD1 4.09Å; V55-L59 HydrophobicContact CG1-CG 4.44Å; V55-L59 WeakPolarHBondContact O-CG 3.36Å; V55-L59 PolarHBondContact O-N 2.87Å |
| 56 | A | 95.4 | Very high | 87.8 | Confident | 41 Ų | 41 | 102 Ų | 102 | 34% | 0.339 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F52 L53 V54 L59 F60 | F52-A56 VanDerWaalsContact O-CB 3.25Å; F52-A56 WeakPolarHBondContact O-CB 3.34Å; F52-A56 PolarHBondContact O-N 2.88Å; L53-A56 PolarHBondContact O-N 3.31Å; V54-A56 PolarHBondContact O-N 3.03Å; A56-L59 PolarHBondContact O-N 2.9Å; A56-F60 VanDerWaalsContact O-CB 3.31Å; A56-F60 WeakPolarHBondContact O-CB 3.37Å; A56-F60 PolarHBondContact O-N 3.25Å |
| 57 | A | 95.2 | Very high | 89.2 | Confident | 59 Ų | 59 | 99.5 Ų | 99.5 | 49% | 0.488 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L53 V54 V55 F60 F61 | L53-A57 WeakPolarHBondContact O-CB 3.33Å; L53-A57 PolarHBondContact O-N 3.44Å; V54-A57 PolarHBondContact O-N 3.44Å; V55-A57 VanDerWaalsContact C-N 3.33Å; V55-A57 PolarHBondContact O-N 3.49Å; A57-F60 PolarHBondContact O-N 3.42Å; A57-F61 WeakPolarHBondContact O-CB 3.32Å; A57-F61 PolarHBondContact O-N 2.9Å |
| 58 | I | 96 | Very high | 90.3 | Very high | 100 Ų | 100 | 103.5 Ų | 103.5 | 51% | 0.513 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.7 | -47.3 | 176.3 | -65.6 | 165.4 | 0 | 0 | 0 | 110.5 | V54 V55 F60 F61 V62 | V54-I58 HydrophobicContact CG1-CD1 4.02Å; V54-I58 WeakPolarHBondContact O-CG1 3.38Å; V54-I58 PolarHBondContact O-N 3.44Å; V55-I58 PolarHBondContact O-N 2.98Å; I58-F60 VanDerWaalsContact C-N 3.33Å; I58-F60 PolarHBondContact O-N 3.44Å; I58-F61 PolarHBondContact O-N 3.26Å; I58-V62 HydrophobicContact CG2-CG2 4.5Å; I58-V62 WeakPolarHBondContact O-CG2 3.38Å; I58-V62 PolarHBondContact O-N 2.9Å |
| 59 | L | 95.8 | Very high | 90.9 | Very high | 116 Ų | 116 | 102.3 Ų | 102.3 | 61% | 0.607 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.3 | -43.6 | 178.2 | -72.5 | 176 | 0 | 0 | 0 | 111.8 | V55 A56 V62 F63 | V55-L59 HydrophobicContact CG1-CD1 4.09Å; V55-L59 HydrophobicContact CG1-CG 4.44Å; V55-L59 WeakPolarHBondContact O-CG 3.36Å; V55-L59 PolarHBondContact O-N 2.87Å; A56-L59 PolarHBondContact O-N 2.9Å; L59-V62 PolarHBondContact O-N 2.93Å; L59-F63 WeakPolarHBondContact O-CB 3.25Å; L59-F63 PolarHBondContact O-N 3.45Å |
| 60 | F | 96.2 | Very high | 91.1 | Very high | 142 Ų | 142 | 100.2 Ų | 100.2 | 62% | 0.623 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64 | -42.6 | 176.9 | -175.1 | -100.4 | 0 | 0 | 0 | 111.8 | A56 A57 I58 F63 C64 | A56-F60 VanDerWaalsContact O-CB 3.31Å; A56-F60 WeakPolarHBondContact O-CB 3.37Å; A56-F60 PolarHBondContact O-N 3.25Å; A57-F60 PolarHBondContact O-N 3.42Å; I58-F60 VanDerWaalsContact C-N 3.33Å; I58-F60 PolarHBondContact O-N 3.44Å; F60-F63 PolarHBondContact O-N 3.4Å; F60-C64 WeakPolarHBondContact CE1-SG 3.2Å; F60-C64 VanDerWaalsContact CZ-SG 3.53Å; F60-C64 WeakPolarHBondContact O-CB 3.47Å; F60-C64 PolarHBondContact O-N 3.46Å; F60-C64 PolarHBondContact O-SG 2.86Å; F60-C64 VanDerWaalsContact O-SG 3.4Å |
| 61 | F | 95.7 | Very high | 91.1 | Very high | 143 Ų | 143 | 100.4 Ų | 100.4 | 63% | 0.627 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.1 | -46.4 | 177.5 | -174.1 | -99.1 | 0 | 0 | 0 | 111.8 | A57 I58 F63 C64 V65 | A57-F61 WeakPolarHBondContact O-CB 3.32Å; A57-F61 PolarHBondContact O-N 2.9Å; I58-F61 PolarHBondContact O-N 3.26Å; F61-F63 VanDerWaalsContact C-N 3.31Å; F61-F63 PolarHBondContact O-N 3.47Å; F61-C64 PolarHBondContact O-N 2.95Å; F61-V65 HydrophobicContact CD1-CG2 4.23Å; F61-V65 HydrophobicContact CE1-CG2 3.86Å; F61-V65 HydrophobicContact CE2-CG2 4.5Å; F61-V65 HydrophobicContact CZ-CG2 4Å; F61-V65 WeakPolarHBondContact O-CG2 3.19Å; F61-V65 PolarHBondContact O-N 3.44Å |
| 62 | V | 94.4 | Very high | 90.5 | Very high | 89 Ų | 89 | 101.3 Ų | 101.3 | 54% | 0.539 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 175.1 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | I58 L59 C64 V65 Y66 | I58-V62 HydrophobicContact CG2-CG2 4.5Å; I58-V62 WeakPolarHBondContact O-CG2 3.38Å; I58-V62 PolarHBondContact O-N 2.9Å; L59-V62 PolarHBondContact O-N 2.93Å; V62-C64 PolarHBondContact O-N 3.25Å; V62-V65 PolarHBondContact O-N 3.41Å; V62-Y66 VanDerWaalsContact O-CB 3.26Å; V62-Y66 WeakPolarHBondContact O-CB 3.31Å; V62-Y66 PolarHBondContact O-N 3.38Å |
| 63 | F | 93.7 | Very high | 89.4 | Confident | 134 Ų | 134 | 99.3 Ų | 99.3 | 59% | 0.588 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.6 | -43.2 | 176.6 | -175.6 | -95.2 | 0 | 0 | 0 | 112 | L59 F60 F61 Y66 A67 | L59-F63 WeakPolarHBondContact O-CB 3.25Å; L59-F63 PolarHBondContact O-N 3.45Å; F60-F63 PolarHBondContact O-N 3.4Å; F61-F63 VanDerWaalsContact C-N 3.31Å; F61-F63 PolarHBondContact O-N 3.47Å; F63-Y66 PolarHBondContact O-N 2.82Å; F63-A67 WeakPolarHBondContact O-CB 3.42Å; F63-A67 PolarHBondContact O-N 3.49Å |
| 64 | C | 92.4 | Very high | 88.2 | Confident | 52 Ų | 52 | 95.7 Ų | 95.7 | 35% | 0.351 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -44.3 | 176.6 | -76.4 | 0 | 0 | 0 | 0 | 112.3 | F60 F61 V62 A67 F68 | F60-C64 WeakPolarHBondContact CE1-SG 3.2Å; F60-C64 VanDerWaalsContact CZ-SG 3.53Å; F60-C64 WeakPolarHBondContact O-CB 3.47Å; F60-C64 PolarHBondContact O-N 3.46Å; F60-C64 PolarHBondContact O-SG 2.86Å; F60-C64 VanDerWaalsContact O-SG 3.4Å; F61-C64 PolarHBondContact O-N 2.95Å; V62-C64 PolarHBondContact O-N 3.25Å; C64-A67 PolarHBondContact O-N 2.82Å; C64-F68 WeakPolarHBondContact O-CB 3.45Å; C64-F68 PolarHBondContact O-N 2.78Å |
| 65 | V | 91.2 | Very high | 86.9 | Confident | 64 Ų | 64 | 96.4 Ų | 96.4 | 39% | 0.388 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.4 | -43.1 | 176.8 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | F61 V62 F68 F69 | F61-V65 HydrophobicContact CD1-CG2 4.23Å; F61-V65 HydrophobicContact CE1-CG2 3.86Å; F61-V65 HydrophobicContact CE2-CG2 4.5Å; F61-V65 HydrophobicContact CZ-CG2 4Å; F61-V65 WeakPolarHBondContact O-CG2 3.19Å; F61-V65 PolarHBondContact O-N 3.44Å; V62-V65 PolarHBondContact O-N 3.41Å; V65-F68 PolarHBondContact O-N 3.38Å; V65-F69 HydrophobicContact CG1-CD2 4.2Å; V65-F69 WeakPolarHBondContact O-CB 3.26Å; V65-F69 PolarHBondContact O-N 2.86Å |
| 66 | Y | 90.1 | Very high | 85.3 | Confident | 152 Ų | 152 | 99.2 Ų | 99.2 | 60% | 0.596 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.2 | -45.2 | 177 | -178 | -97.1 | 0 | 0 | 0 | 111.9 | V62 F63 F68 F69 Y70 | V62-Y66 VanDerWaalsContact O-CB 3.26Å; V62-Y66 WeakPolarHBondContact O-CB 3.31Å; V62-Y66 PolarHBondContact O-N 3.38Å; F63-Y66 PolarHBondContact O-N 2.82Å; Y66-F68 VanDerWaalsContact C-N 3.35Å; Y66-F69 PolarHBondContact O-N 3.48Å; Y66-Y70 WeakPolarHBondContact O-CB 3.04Å; Y66-Y70 PolarHBondContact O-N 3.49Å |
| 67 | A | 87.3 | Confident | 83.7 | Confident | 29 Ų | 29 | 101.7 Ų | 101.7 | 24% | 0.24 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -65.1 | -39 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | F63 C64 Y70 L71 | F63-A67 WeakPolarHBondContact O-CB 3.42Å; F63-A67 PolarHBondContact O-N 3.49Å; C64-A67 PolarHBondContact O-N 2.82Å; A67-Y70 PolarHBondContact O-N 2.81Å; A67-L71 VanDerWaalsContact O-CB 3.27Å; A67-L71 WeakPolarHBondContact O-CB 3.19Å; A67-L71 WeakPolarHBondContact O-CG 3.13Å; A67-L71 PolarHBondContact O-N 3.45Å |
| 68 | F | 86.4 | Confident | 82.1 | Confident | 139 Ų | 139 | 103.4 Ų | 103.4 | 61% | 0.61 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66 | -45.9 | 176 | -172.3 | -99.5 | 0 | 0 | 0 | 111.3 | C64 V65 Y66 L71 N72 | C64-F68 WeakPolarHBondContact O-CB 3.45Å; C64-F68 PolarHBondContact O-N 2.78Å; V65-F68 PolarHBondContact O-N 3.38Å; Y66-F68 VanDerWaalsContact C-N 3.35Å; F68-L71 PolarHBondContact O-N 2.77Å; F68-N72 WeakPolarHBondContact CD1-ND2 3.42Å; F68-N72 WeakPolarHBondContact CD2-ND2 3.09Å; F68-N72 WeakPolarHBondContact CE1-ND2 3.37Å; F68-N72 VanDerWaalsContact CE2-ND2 3.35Å; F68-N72 WeakPolarHBondContact CE2-ND2 3.21Å; F68-N72 WeakPolarHBondContact CG-ND2 3.49Å; F68-N72 WeakPolarHBondContact CZ-ND2 3.27Å; F68-N72 WeakPolarHBondContact O-CB 3.35Å; F68-N72 PolarHBondContact O-N 2.82Å; F68-N72 PolarHBondContact O-ND2 3.44Å |
| 69 | F | 85.1 | Confident | 80.4 | Confident | 139 Ų | 139 | 104 Ų | 104 | 61% | 0.61 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.7 | -44.9 | 173.5 | -105.1 | -87.5 | 0 | 0 | 0 | 111.6 | V65 Y66 L71 N72 L73 | V65-F69 HydrophobicContact CG1-CD2 4.2Å; V65-F69 WeakPolarHBondContact O-CB 3.26Å; V65-F69 PolarHBondContact O-N 2.86Å; Y66-F69 PolarHBondContact O-N 3.48Å; F69-L71 PolarHBondContact O-N 3.48Å; F69-N72 PolarHBondContact O-N 3.43Å; F69-L73 WeakPolarHBondContact O-CB 3.15Å; F69-L73 PolarHBondContact O-N 2.89Å |
| 70 | Y | 84.3 | Confident | 78.5 | Confident | 139 Ų | 139 | 104.4 Ų | 104.4 | 55% | 0.545 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 179 | -176.5 | -93.2 | 0 | 0 | 0 | 111.5 | Y66 A67 S74 | Y66-Y70 WeakPolarHBondContact O-CB 3.04Å; Y66-Y70 PolarHBondContact O-N 3.49Å; A67-Y70 PolarHBondContact O-N 2.81Å; Y70-S74 WeakPolarHBondContact CE1-OG 3.46Å; Y70-S74 WeakPolarHBondContact O-CA 3.44Å; Y70-S74 WeakPolarHBondContact O-CB 3.15Å; Y70-S74 PolarHBondContact O-N 3.4Å; Y70-S74 PolarHBondContact O-OG 2.63Å |
| 71 | L | 79.9 | Confident | 76.8 | Confident | 108 Ų | 108 | 103.2 Ų | 103.2 | 57% | 0.565 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -70.6 | -44.1 | 178.4 | -70.7 | 173.4 | 0 | 0 | 0 | 111.9 | A67 F68 F69 S74 T75 | A67-L71 VanDerWaalsContact O-CB 3.27Å; A67-L71 WeakPolarHBondContact O-CB 3.19Å; A67-L71 WeakPolarHBondContact O-CG 3.13Å; A67-L71 PolarHBondContact O-N 3.45Å; F68-L71 PolarHBondContact O-N 2.77Å; F69-L71 PolarHBondContact O-N 3.48Å; L71-S74 PolarHBondContact O-N 2.77Å; L71-T75 VanDerWaalsContact O-CB 3.23Å; L71-T75 WeakPolarHBondContact O-CB 3.23Å; L71-T75 PolarHBondContact O-N 3.37Å; L71-T75 PolarHBondContact O-OG1 2.96Å |
| 72 | N | 75.1 | Confident | 75 | Confident | 74 Ų | 74 | 102.4 Ų | 102.4 | 40% | 0.396 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 176.4 | -76.2 | -72.1 | 0 | 0 | 0 | 111.5 | F68 F69 T75 E76 | F68-N72 WeakPolarHBondContact CD1-ND2 3.42Å; F68-N72 WeakPolarHBondContact CD2-ND2 3.09Å; F68-N72 WeakPolarHBondContact CE1-ND2 3.37Å; F68-N72 VanDerWaalsContact CE2-ND2 3.35Å; F68-N72 WeakPolarHBondContact CE2-ND2 3.21Å; F68-N72 WeakPolarHBondContact CG-ND2 3.49Å; F68-N72 WeakPolarHBondContact CZ-ND2 3.27Å; F68-N72 WeakPolarHBondContact O-CB 3.35Å; F68-N72 PolarHBondContact O-N 2.82Å; F68-N72 PolarHBondContact O-ND2 3.44Å; F69-N72 PolarHBondContact O-N 3.43Å; N72-T75 PolarHBondContact O-N 3Å; N72-E76 PolarHBondContact O-N 2.79Å |
| 73 | L | 65.6 | Low | 73.2 | Confident | 93 Ų | 93 | 105 Ų | 105 | 49% | 0.487 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.3 | -39 | 177.8 | -154.7 | 87.6 | 0 | 0 | 0 | 111.7 | F69 T75 E76 I77 | F69-L73 WeakPolarHBondContact O-CB 3.15Å; F69-L73 PolarHBondContact O-N 2.89Å; L73-T75 VanDerWaalsContact C-N 3.34Å; L73-E76 PolarHBondContact O-N 2.85Å; L73-I77 HydrophobicContact CD2-CD1 3.92Å; L73-I77 HydrophobicContact CG-CD1 3.93Å; L73-I77 VanDerWaalsContact O-CB 3.31Å; L73-I77 WeakPolarHBondContact O-CB 3.31Å; L73-I77 WeakPolarHBondContact O-CD1 3.44Å; L73-I77 WeakPolarHBondContact O-CG1 3.04Å; L73-I77 PolarHBondContact O-N 2.77Å |
| 74 | S | 65.2 | Low | 71.1 | Confident | 37 Ų | 37 | 108.9 Ų | 108.9 | 26% | 0.259 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67.8 | -35.9 | 174.6 | -60.8 | 0 | 0 | 0 | 0 | 111.3 | Y70 L71 N78 | Y70-S74 WeakPolarHBondContact CE1-OG 3.46Å; Y70-S74 WeakPolarHBondContact O-CA 3.44Å; Y70-S74 WeakPolarHBondContact O-CB 3.15Å; Y70-S74 PolarHBondContact O-N 3.4Å; Y70-S74 PolarHBondContact O-OG 2.63Å; L71-S74 PolarHBondContact O-N 2.77Å; S74-N78 WeakPolarHBondContact O-CB 3.44Å; S74-N78 PolarHBondContact O-N 2.96Å |
| 75 | T | 65.2 | Low | 70.1 | Confident | 92 Ų | 92 | 111.8 Ų | 111.8 | 56% | 0.564 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.4 | -44.9 | 173.4 | -72.2 | 0 | 0 | 0 | 0 | 110.8 | L71 N72 L73 L79 | L71-T75 VanDerWaalsContact O-CB 3.23Å; L71-T75 WeakPolarHBondContact O-CB 3.23Å; L71-T75 PolarHBondContact O-N 3.37Å; L71-T75 PolarHBondContact O-OG1 2.96Å; N72-T75 PolarHBondContact O-N 3Å; L73-T75 VanDerWaalsContact C-N 3.34Å; T75-L79 VanDerWaalsContact O-CB 3.22Å; T75-L79 WeakPolarHBondContact O-CB 3.22Å; T75-L79 PolarHBondContact O-N 3.43Å |
| 76 | E | 61.8 | Low | 68.9 | Low | 142 Ų | 142 | 114.3 Ų | 114.3 | 66% | 0.664 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.6 | -46.8 | 175.8 | -74.4 | -169.4 | 170.4 | 0 | 0 | 112.3 | N72 L73 N78 L79 D80 | N72-E76 PolarHBondContact O-N 2.79Å; L73-E76 PolarHBondContact O-N 2.85Å; E76-N78 VanDerWaalsContact C-N 3.34Å; E76-N78 PolarHBondContact O-N 3.5Å; E76-L79 PolarHBondContact O-N 2.83Å; E76-D80 WeakPolarHBondContact O-CB 3Å; E76-D80 PolarHBondContact O-N 3.47Å |
| 77 | I | 61.2 | Low | 67.8 | Low | 92 Ų | 92 | 112.2 Ų | 112.2 | 47% | 0.472 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.8 | -40.1 | 178.2 | -68.9 | 166.3 | 0 | 0 | 0 | 111.5 | L73 D80 L81 | L73-I77 HydrophobicContact CD2-CD1 3.92Å; L73-I77 HydrophobicContact CG-CD1 3.93Å; L73-I77 VanDerWaalsContact O-CB 3.31Å; L73-I77 WeakPolarHBondContact O-CB 3.31Å; L73-I77 WeakPolarHBondContact O-CD1 3.44Å; L73-I77 WeakPolarHBondContact O-CG1 3.04Å; L73-I77 PolarHBondContact O-N 2.77Å; I77-D80 PolarHBondContact O-N 3.1Å; I77-L81 HydrophobicContact CG2-CD1 4Å; I77-L81 WeakPolarHBondContact O-CB 3.42Å; I77-L81 WeakPolarHBondContact O-CG 3.45Å; I77-L81 PolarHBondContact O-N 3.37Å |
| 78 | N | 62.3 | Low | 66.6 | Low | 96 Ų | 96 | 117.1 Ų | 117.1 | 51% | 0.513 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -73.1 | -35 | 179.8 | -161.9 | -119.3 | 0 | 0 | 0 | 111.5 | S74 E76 L81 D82 | S74-N78 WeakPolarHBondContact O-CB 3.44Å; S74-N78 PolarHBondContact O-N 2.96Å; E76-N78 VanDerWaalsContact C-N 3.34Å; E76-N78 PolarHBondContact O-N 3.5Å; N78-L81 PolarHBondContact O-N 3.32Å; N78-D82 PolarHBondContact O-N 2.94Å; N78-D82 VanDerWaalsContact O-N 3.1Å |
| 79 | L | 59.3 | Low | 65.4 | Low | 113 Ų | 113 | 115.7 Ų | 115.7 | 59% | 0.592 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -65.4 | -38.2 | 172.6 | -163 | 79.5 | 0 | 0 | 0 | 112 | T75 E76 M83 | T75-L79 VanDerWaalsContact O-CB 3.22Å; T75-L79 WeakPolarHBondContact O-CB 3.22Å; T75-L79 PolarHBondContact O-N 3.43Å; E76-L79 PolarHBondContact O-N 2.83Å; L79-M83 WeakPolarHBondContact O-CG 3.34Å; L79-M83 PolarHBondContact O-N 3.04Å |
| 80 | D | 56.7 | Low | 64.1 | Low | 123 Ų | 123 | 114.1 Ų | 114.1 | 66% | 0.658 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69.4 | -37.2 | 176.8 | -156.4 | 39.4 | 0 | 0 | 0 | 111.7 | E76 I77 M83 | E76-D80 WeakPolarHBondContact O-CB 3Å; E76-D80 PolarHBondContact O-N 3.47Å; I77-D80 PolarHBondContact O-N 3.1Å; D80-M83 PolarHBondContact O-N 3.43Å |
| 81 | L | 59.8 | Low | 62.6 | Low | 117 Ų | 117 | 112.4 Ų | 112.4 | 61% | 0.613 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -70.9 | -28.2 | 175.7 | -82.3 | 165.4 | 0 | 0 | 0 | 114.5 | I77 N78 M83 | I77-L81 HydrophobicContact CG2-CD1 4Å; I77-L81 WeakPolarHBondContact O-CB 3.42Å; I77-L81 WeakPolarHBondContact O-CG 3.45Å; I77-L81 PolarHBondContact O-N 3.37Å; N78-L81 PolarHBondContact O-N 3.32Å; L81-M83 VanDerWaalsContact C-N 3.3Å |
| 82 | D | 57.3 | Low | 61.3 | Low | 126 Ų | 126 | 112.7 Ų | 112.7 | 67% | 0.674 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | -7.1 | 176.7 | -78.1 | -18 | 0 | 0 | 0 | 112.5 | N78 | N78-D82 PolarHBondContact O-N 2.94Å; N78-D82 VanDerWaalsContact O-N 3.1Å |
| 83 | M | 56.7 | Low | 60.2 | Low | 145 Ų | 145 | 115.9 Ų | 115.9 | 71% | 0.714 | 61% | 0.613 | S | S | * | * | trans | -96.7 | -8.1 | -178.6 | -81.2 | -170.7 | 51.2 | 0 | 0 | 114.9 | L79 D80 L81 | L79-M83 WeakPolarHBondContact O-CG 3.34Å; L79-M83 PolarHBondContact O-N 3.04Å; D80-M83 PolarHBondContact O-N 3.43Å; L81-M83 VanDerWaalsContact C-N 3.3Å | ||
| 84 | D | 50.7 | Low | 59.7 | Low | 215 Ų | 215 | 118 Ų | 118 | 100% | 1.15 | 63% | 0.625 | S | S | * | * | trans | -95.9 | 0 | 171 | -92.1 | -12.4 | 0 | 0 | 0 | 112.2 |
Retrieved 84 of 84 residues in 40.8 ms
(Link to these results)