| 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 | 33.1 | Very low | 34.4 | Very low | 246 Ų | 246 | 135.6 Ų | 135.6 | 100% | 1.212 | 82% | 0.815 | S | S | * | * | 0 | 123.4 | 0 | -74.1 | -173.7 | 173.6 | 0 | 0 | 108.2 | |||||
| 2 | A | 33.6 | Very low | 34.2 | Very low | 107 Ų | 107 | 135.7 Ų | 135.7 | 88% | 0.884 | 82% | 0.816 | S | S | * | * | trans | 46 | 136.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 3 | A | 32.7 | Very low | 34.2 | Very low | 88 Ų | 88 | 132.5 Ų | 132.5 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | cis | -157.3 | 146.9 | 28.4 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 4 | K | 33.4 | Very low | 34.5 | Very low | 190 Ų | 190 | 130.7 Ų | 130.7 | 83% | 0.826 | 81% | 0.808 | S | S | * | * | 48.4 | 113.5 | 59.3 | -153 | 135.5 | 170.4 | 172.6 | 0 | 109.4 | |||||
| 5 | T | 37 | Very low | 34.9 | Very low | 118 Ų | 118 | 129.7 Ų | 129.7 | 72% | 0.724 | 81% | 0.808 | S | S | * | * | 179.9 | 131.1 | 63.8 | -14.3 | 0 | 0 | 0 | 0 | 105 | |||||
| 6 | D | 39.7 | Very low | 34.8 | Very low | 146 Ų | 146 | 130.1 Ų | 130.1 | 78% | 0.781 | 81% | 0.81 | S | S | * | * | 52.9 | 110.5 | 111.5 | -159.7 | -94.8 | 0 | 0 | 0 | 115.4 | |||||
| 7 | E | 33.1 | Very low | 35.2 | Very low | 181 Ų | 181 | 128.7 Ų | 128.7 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -167.5 | 111 | 138.1 | -163.8 | 134 | 71.7 | 0 | 0 | 111.3 | ||||
| 8 | S | 29.1 | Very low | 35.9 | Very low | 105 Ų | 105 | 127.2 Ų | 127.2 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | trans | 46 | 114.2 | 139.6 | -161.2 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 9 | S | 34.6 | Very low | 36.2 | Very low | 101 Ų | 101 | 129 Ų | 129 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | trans | -30.3 | 167.7 | 143.3 | -77.6 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 10 | P | 42.7 | Very low | 37.1 | Very low | 121 Ų | 121 | 128.2 Ų | 128.2 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | cis | -135.5 | 136.7 | 26.9 | 20.6 | 6 | 0 | 0 | 0 | 116 | ||||
| 11 | A | 29.4 | Very low | 37.4 | Very low | 89 Ų | 89 | 126.6 Ų | 126.6 | 74% | 0.736 | 80% | 0.799 | S | S | * | * | 82.8 | 78.7 | 83.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 12 | V | 31.6 | Very low | 38.3 | Very low | 136 Ų | 136 | 120.2 Ų | 120.2 | 82% | 0.824 | 78% | 0.777 | S | S | * | * | trans | -86.1 | 102.3 | 155.6 | -70.3 | 0 | 0 | 0 | 0 | 107 | S14 | V12-S14 PolarHBondContact O-N 3.13Š| ||
| 13 | A | 35 | Very low | 38.8 | Very low | 94 Ų | 94 | 120.1 Ų | 120.1 | 78% | 0.777 | 77% | 0.77 | S | S | * | * | trans | -85.2 | 91 | 178.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 14 | S | 37.9 | Very low | 39.1 | Very low | 108 Ų | 108 | 121.8 Ų | 121.8 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | trans | -79.9 | 117.5 | 159.9 | -18.8 | 0 | 0 | 0 | 0 | 107.6 | V12 | V12-S14 PolarHBondContact O-N 3.13Š| ||
| 15 | S | 40 | Very low | 39.6 | Very low | 115 Ų | 115 | 116.3 Ų | 116.3 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | -107.9 | 100.8 | 177.8 | -51.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 16 | T | 34.3 | Very low | 40.1 | Very low | 137 Ų | 137 | 122 Ų | 122 | 84% | 0.84 | 78% | 0.781 | S | S | * | * | trans | -130.4 | 136.5 | 162.5 | -45.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 17 | S | 41.3 | Very low | 40.2 | Very low | 106 Ų | 106 | 123.5 Ų | 123.5 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | trans | 94.8 | 116.6 | 155.4 | -171.2 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 18 | S | 47.2 | Very low | 41 | Very low | 101 Ų | 101 | 123.9 Ų | 123.9 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | trans | -24 | 152.7 | 150.6 | 48.5 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 19 | N | 42.8 | Very low | 42 | Very low | 162 Ų | 162 | 125.9 Ų | 125.9 | 87% | 0.866 | 79% | 0.787 | S | S | * | * | trans | 107.8 | 144.5 | 147.7 | -97.3 | 6.5 | 0 | 0 | 0 | 121 | ||||
| 20 | P | 54.3 | Low | 42.3 | Very low | 112 Ų | 112 | 131.8 Ų | 131.8 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | -117.6 | 155.2 | -146.1 | 39.4 | -25.8 | 0 | 0 | 0 | 118.2 | ||||
| 21 | A | 42.3 | Very low | 43 | Very low | 95 Ų | 95 | 131.5 Ų | 131.5 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | 73.3 | 159.7 | 151.1 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 22 | P | 52.8 | Low | 44.3 | Very low | 113 Ų | 113 | 132.7 Ų | 132.7 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | cis | -140.1 | 166 | 5.8 | 38.4 | -18.2 | 0 | 0 | 0 | 118.6 | ||||
| 23 | S | 42.9 | Very low | 45.3 | Very low | 105 Ų | 105 | 134.4 Ų | 134.4 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | trans | 75.6 | 112 | 143.2 | 70.5 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 24 | S | 40 | Very low | 46.3 | Very low | 122 Ų | 122 | 137.1 Ų | 137.1 | 85% | 0.853 | 78% | 0.78 | S | S | * | * | 167.5 | 120.8 | 113.4 | -83.5 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 25 | G | 44.1 | Very low | 47.4 | Very low | 75 Ų | 75 | 138.2 Ų | 138.2 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | trans | 83.3 | 95 | 134.8 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 26 | R | 47.6 | Very low | 48.3 | Very low | 238 Ų | 238 | 140.6 Ų | 140.6 | 90% | 0.898 | 77% | 0.77 | S | S | * | * | trans | 62.5 | 80.7 | 140.1 | -63.7 | -175.8 | -174.4 | 150.1 | 1.3 | 119.8 | ||||
| 27 | H | 42 | Very low | 49.4 | Very low | 177 Ų | 177 | 136.6 Ų | 136.6 | 82% | 0.819 | 75% | 0.751 | S | S | * | * | -160.3 | 100.3 | 119.2 | -107.1 | 85.4 | 0 | 0 | 0 | 107.2 | L29 | H27-L29 VanDerWaalsContact C-N 3.25Å; H27-L29 PolarHBondContact O-N 3.38Å | |||
| 28 | Q | 48.4 | Very low | 50.2 | Low | 190 Ų | 190 | 138.7 Ų | 138.7 | 89% | 0.888 | 75% | 0.754 | S | S | * | * | trans | -73.5 | 76.2 | 179.4 | -69.7 | -83 | 75.8 | 0 | 0 | 109.7 | R30 | Q28-R30 PolarHBondContact O-N 3.16Š| ||
| 29 | L | 50.8 | Low | 51.5 | Low | 146 Ų | 146 | 136.5 Ų | 136.5 | 76% | 0.764 | 74% | 0.738 | S | S | * | * | trans | -74.8 | 114.6 | 152.1 | -74.2 | 106.3 | 0 | 0 | 0 | 106 | H27 P31 | H27-L29 VanDerWaalsContact C-N 3.25Å; H27-L29 PolarHBondContact O-N 3.38Å; L29-P31 WeakPolarHBondContact O-CD 3.23Å; L29-P31 VanDerWaalsContact O-N 3.14Å | ||
| 30 | R | 40.8 | Very low | 53.2 | Low | 226 Ų | 226 | 137.6 Ų | 137.6 | 85% | 0.853 | 74% | 0.736 | S | S | * | * | trans | -39.3 | 121.8 | 172 | -77.9 | -83.2 | -153.8 | 173.5 | 5.1 | 108.6 | Q28 V32 | Q28-R30 PolarHBondContact O-N 3.16Å; R30-V32 VanDerWaalsContact C-N 3.26Å; R30-V32 PolarHBondContact O-N 3.14Å | ||
| 31 | P | 57.4 | Low | 54.3 | Low | 114 Ų | 114 | 134.9 Ų | 134.9 | 74% | 0.74 | 72% | 0.723 | S | S | * | * | trans | -62.9 | 99.9 | 165.3 | -12.4 | 26.4 | 0 | 0 | 0 | 105.3 | L29 K33 | L29-P31 WeakPolarHBondContact O-CD 3.23Å; L29-P31 VanDerWaalsContact O-N 3.14Å; P31-K33 VanDerWaalsContact C-N 3.31Å; P31-K33 PolarHBondContact O-N 2.83Å | ||
| 32 | V | 55.8 | Low | 55.9 | Low | 114 Ų | 114 | 130.7 Ų | 130.7 | 69% | 0.691 | 69% | 0.688 | S | S | * | * | trans | -60.5 | 108.3 | 165.3 | -172.8 | 0 | 0 | 0 | 0 | 102.7 | R30 F34 | R30-V32 VanDerWaalsContact C-N 3.26Å; R30-V32 PolarHBondContact O-N 3.14Å; V32-F34 HydrophobicContact CB-CD2 4.47Å; V32-F34 HydrophobicContact CG1-CD2 4.41Å; V32-F34 HydrophobicContact CG1-CE2 4.37Å; V32-F34 PolarHBondContact O-N 3.29Å | ||
| 33 | K | 54.4 | Low | 57.3 | Low | 173 Ų | 173 | 128.4 Ų | 128.4 | 75% | 0.752 | 67% | 0.672 | S | S | * | * | trans | -57.9 | 91.4 | -179.3 | -75.6 | -169 | 176.1 | 82.1 | 0 | 108.1 | P31 D35 | P31-K33 VanDerWaalsContact C-N 3.31Å; P31-K33 PolarHBondContact O-N 2.83Å; K33-D35 WeakPolarHBondContact CB-OD2 2.95Å; K33-D35 WeakPolarHBondContact CD-OD2 3.44Å; K33-D35 PolarHBondContact O-N 2.97Å | ||
| 34 | F | 55.6 | Low | 59.4 | Low | 151 Ų | 151 | 131.3 Ų | 131.3 | 66% | 0.662 | 67% | 0.668 | S | S | * | * | trans | -81.5 | 61.3 | 164.3 | -94.6 | -84.9 | 0 | 0 | 0 | 107.3 | V32 Y36 A37 | V32-F34 HydrophobicContact CB-CD2 4.47Å; V32-F34 HydrophobicContact CG1-CD2 4.41Å; V32-F34 HydrophobicContact CG1-CE2 4.37Å; V32-F34 PolarHBondContact O-N 3.29Å; F34-Y36 PolarHBondContact O-N 3.17Å; F34-A37 HydrophobicContact CB-CB 3.92Å; F34-A37 HydrophobicContact CD1-CB 4.35Å; F34-A37 PolarHBondContact O-N 3.44Å | ||
| 35 | D | 60.6 | Low | 61.7 | Low | 131 Ų | 131 | 129.7 Ų | 129.7 | 70% | 0.701 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -9.6 | 173.6 | -94.3 | -77.7 | 0 | 0 | 0 | 112 | K33 | K33-D35 WeakPolarHBondContact CB-OD2 2.95Å; K33-D35 WeakPolarHBondContact CD-OD2 3.44Å; K33-D35 PolarHBondContact O-N 2.97Å |
| 36 | Y | 58.4 | Low | 63.6 | Low | 165 Ų | 165 | 130.9 Ų | 130.9 | 65% | 0.647 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -32.7 | 171.1 | -169.6 | -108.3 | 0 | 0 | 0 | 112.9 | F34 D38 S39 C42 | F34-Y36 PolarHBondContact O-N 3.17Å; Y36-D38 VanDerWaalsContact C-N 3.29Å; Y36-D38 PolarHBondContact O-N 3.43Å; Y36-S39 PolarHBondContact O-N 2.86Å; Y36-C42 HydrophobicContact CD1-CB 4.05Å; Y36-C42 WeakPolarHBondContact CD1-SG 3.28Å; Y36-C42 HydrophobicContact CE1-CB 3.92Å; Y36-C42 WeakPolarHBondContact CE1-SG 3.48Å; Y36-C42 WeakPolarHBondContact CE2-SG 3.25Å; Y36-C42 WeakPolarHBondContact O-CB 2.95Å; Y36-C42 PolarHBondContact O-SG 2.82Å |
| 37 | A | 58 | Low | 65.5 | Low | 52 Ų | 52 | 123.1 Ų | 123.1 | 43% | 0.43 | 62% | 0.623 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.2 | -17.8 | -171.3 | 0 | 0 | 0 | 0 | 0 | 114 | F34 T43 | F34-A37 HydrophobicContact CB-CB 3.92Å; F34-A37 HydrophobicContact CD1-CB 4.35Å; F34-A37 PolarHBondContact O-N 3.44Å; A37-T43 WeakPolarHBondContact O-CG2 3.33Å |
| 38 | D | 58 | Low | 67.6 | Low | 150 Ų | 150 | 117.8 Ų | 117.8 | 80% | 0.802 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -4.5 | 177.9 | -158.7 | 42.1 | 0 | 0 | 0 | 113 | Y36 | Y36-D38 VanDerWaalsContact C-N 3.29Å; Y36-D38 PolarHBondContact O-N 3.43Å |
| 39 | S | 73.8 | Confident | 69.5 | Low | 55 Ų | 55 | 112.4 Ų | 112.4 | 39% | 0.385 | 58% | 0.583 | S | S | . | * | S | Bend | trans | -76 | 130 | 174.4 | 175.3 | 0 | 0 | 0 | 0 | 110.5 | Y36 A41 C42 T43 | Y36-S39 PolarHBondContact O-N 2.86Å; S39-A41 PolarHBondContact O-N 3.46Å; S39-C42 WeakPolarHBondContact O-CA 3.43Å; S39-C42 WeakPolarHBondContact O-CB 3.46Å; S39-C42 PolarHBondContact O-N 2.78Å; S39-T43 PolarHBondContact O-N 2.85Å; S39-T43 VanDerWaalsContact O-N 3.15Å |
| 40 | F | 79.4 | Confident | 71.1 | Confident | 185 Ų | 185 | 108.1 Ų | 108.1 | 81% | 0.811 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -50.7 | -34.1 | 177.5 | -73.3 | -76 | 0 | 0 | 0 | 113.3 | C42 T43 Y44 | F40-C42 VanDerWaalsContact C-N 3.33Å; F40-T43 WeakPolarHBondContact CA-OG1 3.46Å; F40-T43 PolarHBondContact O-OG1 2.91Å; F40-Y44 VanDerWaalsContact O-CB 3.27Å; F40-Y44 WeakPolarHBondContact O-CB 3.47Å; F40-Y44 PolarHBondContact O-N 3.46Å |
| 41 | A | 77.3 | Confident | 72.9 | Confident | 55 Ų | 55 | 99.7 Ų | 99.7 | 46% | 0.455 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.7 | -37.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S39 Y44 I45 | S39-A41 PolarHBondContact O-N 3.46Å; A41-Y44 PolarHBondContact O-N 3.16Å; A41-I45 WeakPolarHBondContact O-CB 3.39Å; A41-I45 WeakPolarHBondContact O-CD1 3.38Å; A41-I45 WeakPolarHBondContact O-CG1 3.18Å; A41-I45 PolarHBondContact O-N 2.87Å |
| 42 | C | 76.5 | Confident | 74.1 | Confident | 7 Ų | 7 | 96.9 Ų | 96.9 | 5% | 0.047 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -76.2 | -43 | -176.1 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | Y36 S39 F40 Y44 I45 V46 | Y36-C42 HydrophobicContact CD1-CB 4.05Å; Y36-C42 WeakPolarHBondContact CD1-SG 3.28Å; Y36-C42 HydrophobicContact CE1-CB 3.92Å; Y36-C42 WeakPolarHBondContact CE1-SG 3.48Å; Y36-C42 WeakPolarHBondContact CE2-SG 3.25Å; Y36-C42 WeakPolarHBondContact O-CB 2.95Å; Y36-C42 PolarHBondContact O-SG 2.82Å; S39-C42 WeakPolarHBondContact O-CA 3.43Å; S39-C42 WeakPolarHBondContact O-CB 3.46Å; S39-C42 PolarHBondContact O-N 2.78Å; F40-C42 VanDerWaalsContact C-N 3.33Å; C42-Y44 VanDerWaalsContact C-N 3.26Å; C42-Y44 PolarHBondContact O-N 3.41Å; C42-I45 PolarHBondContact O-N 3.18Å; C42-V46 WeakPolarHBondContact O-CB 3.39Å; C42-V46 VanDerWaalsContact O-CG2 3.24Å; C42-V46 WeakPolarHBondContact O-CG2 3.16Å; C42-V46 PolarHBondContact O-N 3.12Å |
| 43 | T | 82.4 | Confident | 75.3 | Confident | 66 Ų | 66 | 96.5 Ų | 96.5 | 41% | 0.405 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.9 | -38.5 | 172.2 | 56.2 | 0 | 0 | 0 | 0 | 111.3 | A37 S39 F40 S47 | A37-T43 WeakPolarHBondContact O-CG2 3.33Å; S39-T43 PolarHBondContact O-N 2.85Å; S39-T43 VanDerWaalsContact O-N 3.15Å; F40-T43 WeakPolarHBondContact CA-OG1 3.46Å; F40-T43 PolarHBondContact O-OG1 2.91Å; T43-S47 VanDerWaalsContact O-CB 3.29Å; T43-S47 WeakPolarHBondContact O-CB 3.27Å; T43-S47 PolarHBondContact O-N 3.08Å; T43-S47 PolarHBondContact O-OG 2.64Å |
| 44 | Y | 86.1 | Confident | 76.5 | Confident | 165 Ų | 165 | 90.7 Ų | 90.7 | 65% | 0.647 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.5 | -51 | 176.3 | -177.8 | -99.2 | 0 | 0 | 0 | 111.9 | F40 A41 C42 V46 S47 V48 | F40-Y44 VanDerWaalsContact O-CB 3.27Å; F40-Y44 WeakPolarHBondContact O-CB 3.47Å; F40-Y44 PolarHBondContact O-N 3.46Å; A41-Y44 PolarHBondContact O-N 3.16Å; C42-Y44 VanDerWaalsContact C-N 3.26Å; C42-Y44 PolarHBondContact O-N 3.41Å; Y44-V46 PolarHBondContact O-N 3.48Å; Y44-S47 WeakPolarHBondContact O-CB 3.33Å; Y44-S47 PolarHBondContact O-N 3.43Å; Y44-V48 HydrophobicContact CD1-CG2 4.34Å; Y44-V48 HydrophobicContact CE1-CG2 3.98Å; Y44-V48 HydrophobicContact CE2-CG2 4.38Å; Y44-V48 WeakPolarHBondContact O-CG2 2.8Å; Y44-V48 PolarHBondContact O-N 3.4Å |
| 45 | I | 88.3 | Confident | 77.4 | Confident | 89 Ų | 89 | 88 Ų | 88 | 46% | 0.456 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -46.2 | -179.9 | -68 | 163.7 | 0 | 0 | 0 | 110.8 | A41 C42 S47 V48 V49 | A41-I45 WeakPolarHBondContact O-CB 3.39Å; A41-I45 WeakPolarHBondContact O-CD1 3.38Å; A41-I45 WeakPolarHBondContact O-CG1 3.18Å; A41-I45 PolarHBondContact O-N 2.87Å; C42-I45 PolarHBondContact O-N 3.18Å; I45-S47 VanDerWaalsContact C-N 3.28Å; I45-S47 PolarHBondContact O-N 3.28Å; I45-V48 PolarHBondContact O-N 3.46Å; I45-V49 HydrophobicContact CG2-CG2 4.36Å; I45-V49 VanDerWaalsContact O-CG2 3.3Å; I45-V49 WeakPolarHBondContact O-CG2 3.06Å; I45-V49 PolarHBondContact O-N 3.23Å |
| 46 | V | 84.4 | Confident | 78 | Confident | 100 Ų | 100 | 88 Ų | 88 | 61% | 0.606 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.1 | -38 | 178.1 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | C42 Y44 A50 | C42-V46 WeakPolarHBondContact O-CB 3.39Å; C42-V46 VanDerWaalsContact O-CG2 3.24Å; C42-V46 WeakPolarHBondContact O-CG2 3.16Å; C42-V46 PolarHBondContact O-N 3.12Å; Y44-V46 PolarHBondContact O-N 3.48Å; V46-A50 WeakPolarHBondContact O-CB 3.35Å; V46-A50 PolarHBondContact O-N 3.42Å |
| 47 | S | 86.6 | Confident | 78.6 | Confident | 74 Ų | 74 | 82.5 Ų | 82.5 | 52% | 0.517 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.3 | -44.4 | 176.6 | -60 | 0 | 0 | 0 | 0 | 112.3 | T43 Y44 I45 A50 A51 | T43-S47 VanDerWaalsContact O-CB 3.29Å; T43-S47 WeakPolarHBondContact O-CB 3.27Å; T43-S47 PolarHBondContact O-N 3.08Å; T43-S47 PolarHBondContact O-OG 2.64Å; Y44-S47 WeakPolarHBondContact O-CB 3.33Å; Y44-S47 PolarHBondContact O-N 3.43Å; I45-S47 VanDerWaalsContact C-N 3.28Å; I45-S47 PolarHBondContact O-N 3.28Å; S47-A50 PolarHBondContact O-N 3.1Å; S47-A51 WeakPolarHBondContact O-CB 3.35Å; S47-A51 PolarHBondContact O-N 2.83Å |
| 48 | V | 87.4 | Confident | 79.2 | Confident | 66 Ų | 66 | 83.3 Ų | 83.3 | 40% | 0.4 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.1 | -46.1 | 178.2 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | Y44 I45 A50 A51 S52 | Y44-V48 HydrophobicContact CD1-CG2 4.34Å; Y44-V48 HydrophobicContact CE1-CG2 3.98Å; Y44-V48 HydrophobicContact CE2-CG2 4.38Å; Y44-V48 WeakPolarHBondContact O-CG2 2.8Å; Y44-V48 PolarHBondContact O-N 3.4Å; I45-V48 PolarHBondContact O-N 3.46Å; V48-A50 PolarHBondContact O-N 3.24Å; V48-A51 PolarHBondContact O-N 3.42Å; V48-S52 PolarHBondContact O-N 3.02Å; V48-S52 PolarHBondContact O-OG 3.46Å; V48-S52 VanDerWaalsContact O-OG 3.12Å |
| 49 | V | 88.8 | Confident | 79.4 | Confident | 77 Ų | 77 | 84.2 Ų | 84.2 | 47% | 0.467 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 177.8 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | I45 A51 S52 I53 | I45-V49 HydrophobicContact CG2-CG2 4.36Å; I45-V49 VanDerWaalsContact O-CG2 3.3Å; I45-V49 WeakPolarHBondContact O-CG2 3.06Å; I45-V49 PolarHBondContact O-N 3.23Å; V49-A51 VanDerWaalsContact C-N 3.34Å; V49-A51 PolarHBondContact O-N 3.36Å; V49-S52 PolarHBondContact O-N 2.93Å; V49-I53 HydrophobicContact CG1-CD1 3.94Å; V49-I53 WeakPolarHBondContact O-CG1 3.47Å; V49-I53 PolarHBondContact O-N 3.26Å |
| 50 | A | 82.4 | Confident | 78.7 | Confident | 55 Ų | 55 | 84.7 Ų | 84.7 | 46% | 0.455 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.6 | -41.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V46 S47 V48 I53 A54 | V46-A50 WeakPolarHBondContact O-CB 3.35Å; V46-A50 PolarHBondContact O-N 3.42Å; S47-A50 PolarHBondContact O-N 3.1Å; V48-A50 PolarHBondContact O-N 3.24Å; A50-I53 PolarHBondContact O-N 2.84Å; A50-A54 WeakPolarHBondContact O-CB 3.44Å; A50-A54 PolarHBondContact O-N 2.9Å |
| 51 | A | 80.1 | Confident | 77.8 | Confident | 49 Ų | 49 | 81.1 Ų | 81.1 | 41% | 0.405 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63.2 | -45 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | S47 V48 V49 I53 A54 E55 | S47-A51 WeakPolarHBondContact O-CB 3.35Å; S47-A51 PolarHBondContact O-N 2.83Å; V48-A51 PolarHBondContact O-N 3.42Å; V49-A51 VanDerWaalsContact C-N 3.34Å; V49-A51 PolarHBondContact O-N 3.36Å; A51-I53 VanDerWaalsContact C-N 3.35Å; A51-I53 PolarHBondContact O-N 3.42Å; A51-A54 WeakPolarHBondContact O-CB 3.2Å; A51-A54 PolarHBondContact O-N 3.26Å; A51-E55 PolarHBondContact O-N 2.97Å |
| 52 | S | 82.9 | Confident | 76.9 | Confident | 55 Ų | 55 | 82.2 Ų | 82.2 | 39% | 0.385 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.6 | -40 | 177.4 | -57.3 | 0 | 0 | 0 | 0 | 112.6 | V48 V49 E55 L56 | V48-S52 PolarHBondContact O-N 3.02Å; V48-S52 PolarHBondContact O-OG 3.46Å; V48-S52 VanDerWaalsContact O-OG 3.12Å; V49-S52 PolarHBondContact O-N 2.93Å; S52-E55 PolarHBondContact O-N 3.43Å; S52-L56 WeakPolarHBondContact O-CB 3.23Å; S52-L56 VanDerWaalsContact O-CG 3.3Å; S52-L56 WeakPolarHBondContact O-CG 3.43Å; S52-L56 PolarHBondContact O-N 3.19Å |
| 53 | I | 80.4 | Confident | 75.9 | Confident | 106 Ų | 106 | 87.1 Ų | 87.1 | 54% | 0.544 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.9 | -39.2 | 175.8 | -66.4 | 168.6 | 0 | 0 | 0 | 110.7 | V49 A50 A51 L56 A57 | V49-I53 HydrophobicContact CG1-CD1 3.94Å; V49-I53 WeakPolarHBondContact O-CG1 3.47Å; V49-I53 PolarHBondContact O-N 3.26Å; A50-I53 PolarHBondContact O-N 2.84Å; A51-I53 VanDerWaalsContact C-N 3.35Å; A51-I53 PolarHBondContact O-N 3.42Å; I53-L56 PolarHBondContact O-N 3.41Å; I53-A57 VanDerWaalsContact O-CB 3.27Å; I53-A57 WeakPolarHBondContact O-CB 3.37Å; I53-A57 PolarHBondContact O-N 2.98Å |
| 54 | A | 78.4 | Confident | 74.6 | Confident | 52 Ų | 52 | 87.7 Ų | 87.7 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A50 A51 A57 T58 | A50-A54 WeakPolarHBondContact O-CB 3.44Å; A50-A54 PolarHBondContact O-N 2.9Å; A51-A54 WeakPolarHBondContact O-CB 3.2Å; A51-A54 PolarHBondContact O-N 3.26Å; A54-A57 PolarHBondContact O-N 3.36Å; A54-T58 VanDerWaalsContact O-CB 3.23Å; A54-T58 WeakPolarHBondContact O-CB 3.47Å; A54-T58 PolarHBondContact O-N 3.43Å; A54-T58 PolarHBondContact O-OG1 2.89Å |
| 55 | E | 75.8 | Confident | 73.1 | Confident | 94 Ų | 94 | 85.9 Ų | 85.9 | 44% | 0.439 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65 | -45.6 | 174.2 | -73.9 | 176.5 | -177.1 | 0 | 0 | 111.5 | A51 S52 A57 T58 Y59 | A51-E55 PolarHBondContact O-N 2.97Å; S52-E55 PolarHBondContact O-N 3.43Å; E55-A57 VanDerWaalsContact C-N 3.29Å; E55-A57 PolarHBondContact O-N 3.43Å; E55-T58 PolarHBondContact O-N 3.05Å; E55-Y59 WeakPolarHBondContact O-CB 3.36Å; E55-Y59 WeakPolarHBondContact O-CD2 3.21Å; E55-Y59 PolarHBondContact O-N 2.69Å |
| 56 | L | 72 | Confident | 71.5 | Confident | 132 Ų | 132 | 84.8 Ų | 84.8 | 69% | 0.691 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -65.8 | -27 | 176.5 | -73.2 | 175.1 | 0 | 0 | 0 | 113.8 | S52 I53 P60 | S52-L56 WeakPolarHBondContact O-CB 3.23Å; S52-L56 VanDerWaalsContact O-CG 3.3Å; S52-L56 WeakPolarHBondContact O-CG 3.43Å; S52-L56 PolarHBondContact O-N 3.19Å; I53-L56 PolarHBondContact O-N 3.41Å; L56-P60 WeakPolarHBondContact O-CD 3.42Å; L56-P60 WeakPolarHBondContact O-CG 3.3Å |
| 57 | A | 71.3 | Confident | 69.9 | Low | 48 Ų | 48 | 88.1 Ų | 88.1 | 40% | 0.397 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -80.8 | -37 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I53 A54 E55 L61 | I53-A57 VanDerWaalsContact O-CB 3.27Å; I53-A57 WeakPolarHBondContact O-CB 3.37Å; I53-A57 PolarHBondContact O-N 2.98Å; A54-A57 PolarHBondContact O-N 3.36Å; E55-A57 VanDerWaalsContact C-N 3.29Å; E55-A57 PolarHBondContact O-N 3.43Å; A57-L61 WeakPolarHBondContact O-CB 3.41Å; A57-L61 WeakPolarHBondContact O-CD1 3.48Å; A57-L61 PolarHBondContact O-N 2.94Å |
| 58 | T | 71.3 | Confident | 68.6 | Low | 70 Ų | 70 | 90.5 Ų | 90.5 | 43% | 0.429 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -79.1 | -38 | -175.5 | -54.9 | 0 | 0 | 0 | 0 | 111.7 | A54 E55 L61 D62 | A54-T58 VanDerWaalsContact O-CB 3.23Å; A54-T58 WeakPolarHBondContact O-CB 3.47Å; A54-T58 PolarHBondContact O-N 3.43Å; A54-T58 PolarHBondContact O-OG1 2.89Å; E55-T58 PolarHBondContact O-N 3.05Å; T58-L61 PolarHBondContact O-N 3.28Å; T58-D62 WeakPolarHBondContact CG2-OD2 3.24Å; T58-D62 WeakPolarHBondContact O-CB 3.4Å; T58-D62 PolarHBondContact O-N 2.94Å |
| 59 | Y | 61 | Low | 66.8 | Low | 168 Ų | 168 | 93.4 Ų | 93.4 | 66% | 0.659 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -54.8 | -54 | 176.1 | -103.2 | -84.5 | 0 | 0 | 0 | 114.1 | E55 D62 L63 | E55-Y59 WeakPolarHBondContact O-CB 3.36Å; E55-Y59 WeakPolarHBondContact O-CD2 3.21Å; E55-Y59 PolarHBondContact O-N 2.69Å; Y59-D62 PolarHBondContact O-N 2.9Å; Y59-L63 WeakPolarHBondContact O-CB 3.41Å; Y59-L63 WeakPolarHBondContact O-CG 3.36Å; Y59-L63 PolarHBondContact O-N 2.8Å |
| 60 | P | 60.4 | Low | 65.4 | Low | 65 Ų | 65 | 95.2 Ų | 95.2 | 42% | 0.422 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -70.8 | -30.8 | 177.9 | 27.9 | -34 | 0 | 0 | 0 | 112.4 | L56 D62 T64 | L56-P60 WeakPolarHBondContact O-CD 3.42Å; L56-P60 WeakPolarHBondContact O-CG 3.3Å; P60-D62 VanDerWaalsContact C-N 3.35Å; P60-T64 WeakPolarHBondContact O-CB 3.17Å; P60-T64 PolarHBondContact O-N 3.47Å; P60-T64 PolarHBondContact O-OG1 2.91Å |
| 61 | L | 60 | Low | 63.7 | Low | 111 Ų | 111 | 98.3 Ų | 98.3 | 58% | 0.581 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.5 | -37.1 | 174.6 | -112.8 | 95.1 | 0 | 0 | 0 | 112.1 | A57 T58 T64 K65 | A57-L61 WeakPolarHBondContact O-CB 3.41Å; A57-L61 WeakPolarHBondContact O-CD1 3.48Å; A57-L61 PolarHBondContact O-N 2.94Å; T58-L61 PolarHBondContact O-N 3.28Å; L61-T64 PolarHBondContact O-N 2.93Å; L61-K65 PolarHBondContact O-N 3.42Å |
| 62 | D | 59.2 | Low | 62.6 | Low | 78 Ų | 78 | 97.9 Ų | 97.9 | 42% | 0.417 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -79.8 | -35.3 | 178.7 | -73.2 | -19.2 | 0 | 0 | 0 | 111.9 | T58 Y59 P60 T64 K65 T66 | T58-D62 WeakPolarHBondContact CG2-OD2 3.24Å; T58-D62 WeakPolarHBondContact O-CB 3.4Å; T58-D62 PolarHBondContact O-N 2.94Å; Y59-D62 PolarHBondContact O-N 2.9Å; P60-D62 VanDerWaalsContact C-N 3.35Å; D62-T64 PolarHBondContact O-N 3.24Å; D62-K65 PolarHBondContact O-N 3.47Å; D62-T66 PolarHBondContact O-N 3.12Å; D62-T66 VanDerWaalsContact O-N 3.08Å; D62-T66 PolarHBondContact O-OG1 3.41Å |
| 63 | L | 55.4 | Low | 61.2 | Low | 110 Ų | 110 | 101.5 Ų | 101.5 | 58% | 0.576 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.3 | -27.9 | 168.4 | -68.5 | 178.4 | 0 | 0 | 0 | 112.4 | Y59 T66 R67 | Y59-L63 WeakPolarHBondContact O-CB 3.41Å; Y59-L63 WeakPolarHBondContact O-CG 3.36Å; Y59-L63 PolarHBondContact O-N 2.8Å; L63-T66 PolarHBondContact O-OG1 2.73Å; L63-T66 VanDerWaalsContact O-OG1 3.1Å; L63-R67 WeakPolarHBondContact O-CB 3.47Å; L63-R67 PolarHBondContact O-N 2.96Å; L63-R67 VanDerWaalsContact O-N 3.12Å |
| 64 | T | 55.5 | Low | 59.9 | Low | 78 Ų | 78 | 98.4 Ų | 98.4 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -77.3 | -37.3 | 173.4 | -53.3 | 0 | 0 | 0 | 0 | 111.6 | P60 L61 D62 T66 R67 L68 | P60-T64 WeakPolarHBondContact O-CB 3.17Å; P60-T64 PolarHBondContact O-N 3.47Å; P60-T64 PolarHBondContact O-OG1 2.91Å; L61-T64 PolarHBondContact O-N 2.93Å; D62-T64 PolarHBondContact O-N 3.24Å; T64-T66 VanDerWaalsContact C-N 3.35Å; T64-T66 PolarHBondContact O-N 2.97Å; T64-R67 PolarHBondContact O-N 3.2Å; T64-L68 PolarHBondContact O-N 3.37Å |
| 65 | K | 53.6 | Low | 58.4 | Low | 127 Ų | 127 | 98.8 Ų | 98.8 | 55% | 0.552 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -59.8 | -42.5 | 172.8 | -90.9 | -165.9 | -176.6 | 75.1 | 0 | 112.2 | L61 D62 Q69 | L61-K65 PolarHBondContact O-N 3.42Å; D62-K65 PolarHBondContact O-N 3.47Å; K65-Q69 PolarHBondContact O-N 3.37Å |
| 66 | T | 53.9 | Low | 57.1 | Low | 66 Ų | 66 | 97.3 Ų | 97.3 | 41% | 0.405 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -73 | -30.6 | 176.2 | 58.8 | 0 | 0 | 0 | 0 | 112.2 | D62 L63 T64 L68 Q69 I70 | D62-T66 PolarHBondContact O-N 3.12Å; D62-T66 VanDerWaalsContact O-N 3.08Å; D62-T66 PolarHBondContact O-OG1 3.41Å; L63-T66 PolarHBondContact O-OG1 2.73Å; L63-T66 VanDerWaalsContact O-OG1 3.1Å; T64-T66 VanDerWaalsContact C-N 3.35Å; T64-T66 PolarHBondContact O-N 2.97Å; T66-L68 PolarHBondContact O-N 2.98Å; T66-Q69 PolarHBondContact O-N 2.95Å; T66-I70 WeakPolarHBondContact O-CB 3.46Å; T66-I70 WeakPolarHBondContact O-CD1 3.39Å; T66-I70 WeakPolarHBondContact O-CG1 3.17Å; T66-I70 PolarHBondContact O-N 3.06Å |
| 67 | R | 52.5 | Low | 55.9 | Low | 170 Ų | 170 | 98.6 Ų | 98.6 | 64% | 0.642 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.2 | -37.1 | 175.7 | -119.4 | -168.5 | -174.6 | -85.4 | 1.1 | 113.9 | L63 T64 Q71 | L63-R67 WeakPolarHBondContact O-CB 3.47Å; L63-R67 PolarHBondContact O-N 2.96Å; L63-R67 VanDerWaalsContact O-N 3.12Å; T64-R67 PolarHBondContact O-N 3.2Å; R67-Q71 PolarHBondContact O-N 3.09Å |
| 68 | L | 57.7 | Low | 54.6 | Low | 123 Ų | 123 | 101 Ų | 101 | 64% | 0.644 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -75.1 | -33.9 | 178.6 | -70 | 172.4 | 0 | 0 | 0 | 112.2 | T64 T66 G72 | T64-L68 PolarHBondContact O-N 3.37Å; T66-L68 PolarHBondContact O-N 2.98Å; L68-G72 PolarHBondContact O-N 3.05Å |
| 69 | Q | 50.7 | Low | 53.5 | Low | 128 Ų | 128 | 101.8 Ų | 101.8 | 60% | 0.598 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -73.3 | -36.3 | 174.6 | -71.5 | -179.3 | -21.4 | 0 | 0 | 112.3 | K65 T66 Q71 G72 E73 | K65-Q69 PolarHBondContact O-N 3.37Å; T66-Q69 PolarHBondContact O-N 2.95Å; Q69-Q71 VanDerWaalsContact C-N 3.32Å; Q69-Q71 PolarHBondContact O-N 3.06Å; Q69-G72 PolarHBondContact O-N 3.45Å; Q69-G72 VanDerWaalsContact O-N 3.17Å; Q69-E73 WeakPolarHBondContact O-CB 3.41Å; Q69-E73 PolarHBondContact O-N 2.95Å |
| 70 | I | 58.6 | Low | 52.6 | Low | 115 Ų | 115 | 96.6 Ų | 96.6 | 59% | 0.59 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -69.1 | -30.3 | 177.3 | -69.7 | 165.2 | 0 | 0 | 0 | 111.8 | T66 G74 | T66-I70 WeakPolarHBondContact O-CB 3.46Å; T66-I70 WeakPolarHBondContact O-CD1 3.39Å; T66-I70 WeakPolarHBondContact O-CG1 3.17Å; T66-I70 PolarHBondContact O-N 3.06Å; I70-G74 VanDerWaalsContact O-CA 3.25Å; I70-G74 WeakPolarHBondContact O-CA 3.19Å; I70-G74 PolarHBondContact O-N 2.98Å |
| 71 | Q | 47.2 | Very low | 51.8 | Low | 119 Ų | 119 | 102.2 Ų | 102.2 | 56% | 0.556 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -77.8 | -34.1 | 169.1 | -74.2 | -178.5 | 3.2 | 0 | 0 | 112.4 | R67 Q69 A75 | R67-Q71 PolarHBondContact O-N 3.09Å; Q69-Q71 VanDerWaalsContact C-N 3.32Å; Q69-Q71 PolarHBondContact O-N 3.06Å; Q71-A75 WeakPolarHBondContact O-CA 3.4Å; Q71-A75 WeakPolarHBondContact O-CB 3.48Å; Q71-A75 PolarHBondContact O-N 2.89Å |
| 72 | G | 56.5 | Low | 50.9 | Low | 41 Ų | 41 | 102.6 Ų | 102.6 | 42% | 0.423 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -65.5 | -46.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L68 Q69 A76 | L68-G72 PolarHBondContact O-N 3.05Å; Q69-G72 PolarHBondContact O-N 3.45Å; Q69-G72 VanDerWaalsContact O-N 3.17Å; G72-A76 WeakPolarHBondContact O-CA 3.49Å; G72-A76 WeakPolarHBondContact O-CB 3.48Å; G72-A76 PolarHBondContact O-N 2.96Å |
| 73 | E | 54 | Low | 50.2 | Low | 130 Ų | 130 | 105.8 Ų | 105.8 | 61% | 0.607 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -78.5 | -39.9 | 176.4 | -66.1 | -175.4 | 178.2 | 0 | 0 | 111.6 | Q69 A75 A76 H77 | Q69-E73 WeakPolarHBondContact O-CB 3.41Å; Q69-E73 PolarHBondContact O-N 2.95Å; E73-A75 PolarHBondContact O-N 2.99Å; E73-A76 PolarHBondContact O-N 3.28Å; E73-H77 VanDerWaalsContact O-CB 3.28Å; E73-H77 WeakPolarHBondContact O-CB 3.3Å; E73-H77 PolarHBondContact O-CD2 3.19Å; E73-H77 PolarHBondContact O-N 3.38Å |
| 74 | G | 52.2 | Low | 49.4 | Very low | 42 Ų | 42 | 111.5 Ų | 111.5 | 43% | 0.433 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -64.3 | -35.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | I70 S78 | I70-G74 VanDerWaalsContact O-CA 3.25Å; I70-G74 WeakPolarHBondContact O-CA 3.19Å; I70-G74 PolarHBondContact O-N 2.98Å; G74-S78 PolarHBondContact O-OG 2.97Å |
| 75 | A | 47.4 | Very low | 48.7 | Very low | 59 Ų | 59 | 113.4 Ų | 113.4 | 49% | 0.488 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -84.8 | -32.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q71 E73 S78 A79 | Q71-A75 WeakPolarHBondContact O-CA 3.4Å; Q71-A75 WeakPolarHBondContact O-CB 3.48Å; Q71-A75 PolarHBondContact O-N 2.89Å; E73-A75 PolarHBondContact O-N 2.99Å; A75-S78 CarbonylContact O-C 3.52Å; A75-S78 PolarHBondContact O-N 3.46Å; A75-S78 VanDerWaalsContact O-N 3.16Å; A75-A79 VanDerWaalsContact O-CB 3.23Å; A75-A79 WeakPolarHBondContact O-CB 3.29Å; A75-A79 PolarHBondContact O-N 2.92Å |
| 76 | A | 49.1 | Very low | 48.5 | Very low | 63 Ų | 63 | 115.5 Ų | 115.5 | 52% | 0.521 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -70.9 | -31.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | G72 E73 S78 | G72-A76 WeakPolarHBondContact O-CA 3.49Å; G72-A76 WeakPolarHBondContact O-CB 3.48Å; G72-A76 PolarHBondContact O-N 2.96Å; E73-A76 PolarHBondContact O-N 3.28Å; A76-S78 PolarHBondContact O-N 3.38Å |
| 77 | H | 46.3 | Very low | 48.1 | Very low | 160 Ų | 160 | 119.1 Ų | 119.1 | 74% | 0.741 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -19.9 | 169.7 | -86.3 | -101.3 | 0 | 0 | 0 | 112.9 | E73 | E73-H77 VanDerWaalsContact O-CB 3.28Å; E73-H77 WeakPolarHBondContact O-CB 3.3Å; E73-H77 PolarHBondContact O-CD2 3.19Å; E73-H77 PolarHBondContact O-N 3.38Å |
| 78 | S | 44.9 | Very low | 47.9 | Very low | 99 Ų | 99 | 117.4 Ų | 117.4 | 69% | 0.692 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | -18.1 | 175.8 | -56.7 | 0 | 0 | 0 | 0 | 114.1 | G74 A75 A76 | G74-S78 PolarHBondContact O-OG 2.97Å; A75-S78 CarbonylContact O-C 3.52Å; A75-S78 PolarHBondContact O-N 3.46Å; A75-S78 VanDerWaalsContact O-N 3.16Å; A76-S78 PolarHBondContact O-N 3.38Å |
| 79 | A | 46.7 | Very low | 47.3 | Very low | 85 Ų | 85 | 119.3 Ų | 119.3 | 70% | 0.702 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -90.7 | -0.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | A75 | A75-A79 VanDerWaalsContact O-CB 3.23Å; A75-A79 WeakPolarHBondContact O-CB 3.29Å; A75-A79 PolarHBondContact O-N 2.92Å |
| 80 | G | 43.5 | Very low | 47 | Very low | 60 Ų | 60 | 120.1 Ų | 120.1 | 62% | 0.619 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -102.4 | 1.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||
| 81 | K | 41.8 | Very low | 46.2 | Very low | 182 Ų | 182 | 125.4 Ų | 125.4 | 79% | 0.791 | 69% | 0.69 | S | S | * | * | trans | -142.8 | 58.9 | 175.6 | -82.3 | 115.8 | 172.4 | -176 | 0 | 111.7 | N83 | K81-N83 PolarHBondContact O-N 2.65Å; K81-N83 VanDerWaalsContact O-N 3.13Å | ||
| 82 | S | 41.8 | Very low | 46.8 | Very low | 119 Ų | 119 | 124.2 Ų | 124.2 | 83% | 0.832 | 69% | 0.693 | S | S | * | * | trans | -84 | 74.5 | 165.5 | -169.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 83 | N | 45.6 | Very low | 46.1 | Very low | 145 Ų | 145 | 129.5 Ų | 129.5 | 78% | 0.775 | 71% | 0.711 | S | S | * | * | trans | -167.7 | 47.8 | 161.8 | 44.4 | -32.7 | 0 | 0 | 0 | 111.5 | K81 | K81-N83 PolarHBondContact O-N 2.65Å; K81-N83 VanDerWaalsContact O-N 3.13Å | ||
| 84 | R | 37.7 | Very low | 45.7 | Very low | 230 Ų | 230 | 128.3 Ų | 128.3 | 87% | 0.868 | 72% | 0.724 | S | S | * | * | trans | -145.7 | 118.5 | 148.6 | -122.1 | -171.5 | -67.4 | 167.1 | -1.2 | 112.2 | E86 | R84-E86 PolarHBondContact O-N 3.15Š| ||
| 85 | C | 40.9 | Very low | 45.1 | Very low | 119 Ų | 119 | 135.8 Ų | 135.8 | 80% | 0.804 | 75% | 0.747 | S | S | * | * | trans | -64.3 | 108.7 | 169.8 | 173.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 86 | E | 48.6 | Very low | 44.6 | Very low | 171 Ų | 171 | 136.5 Ų | 136.5 | 80% | 0.799 | 76% | 0.76 | S | S | * | * | trans | -157.7 | 104.9 | 151.1 | -76.3 | -160.9 | 87.4 | 0 | 0 | 103.6 | R84 | R84-E86 PolarHBondContact O-N 3.15Š| ||
| 87 | D | 45.6 | Very low | 44 | Very low | 141 Ų | 141 | 140.2 Ų | 140.2 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | 47.5 | 64.3 | 52.2 | -148.8 | -115.2 | 0 | 0 | 0 | 113.7 | |||||
| 88 | L | 49.5 | Very low | 43.7 | Very low | 135 Ų | 135 | 140.7 Ų | 140.7 | 71% | 0.707 | 78% | 0.778 | S | S | * | * | trans | -173.2 | 108.2 | 135.9 | -124.6 | 57.2 | 0 | 0 | 0 | 108.5 | ||||
| 89 | Q | 44 | Very low | 43.5 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 76% | 0.757 | 79% | 0.785 | S | S | * | * | 66.4 | 123.6 | 97.5 | -119.1 | 168.7 | -102.5 | 0 | 0 | 112 | |||||
| 90 | L | 44.3 | Very low | 43.1 | Very low | 146 Ų | 146 | 144.6 Ų | 144.6 | 76% | 0.764 | 78% | 0.78 | S | S | * | * | cis | -164.7 | 148.6 | 37.8 | -95.6 | 106.2 | 0 | 0 | 0 | 110.6 | ||||
| 91 | R | 41.5 | Very low | 42.6 | Very low | 225 Ų | 225 | 151.2 Ų | 151.2 | 85% | 0.849 | 79% | 0.787 | S | S | * | * | trans | -98.3 | 171.1 | 136.4 | -69.4 | -162.6 | 80 | 164.1 | 5.3 | 107.4 | ||||
| 92 | P | 60 | Low | 42.6 | Very low | 95 Ų | 95 | 151.2 Ų | 151.2 | 62% | 0.617 | 79% | 0.789 | S | S | * | * | cis | -130.4 | -165.8 | -16.2 | 25 | 0.7 | 0 | 0 | 0 | 112.2 | ||||
| 93 | D | 41.7 | Very low | 42.7 | Very low | 152 Ų | 152 | 150.9 Ų | 150.9 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | 97.5 | 108.1 | 161.1 | -55.4 | -44.3 | 0 | 0 | 0 | 119.9 | ||||
| 94 | A | 46.3 | Very low | 42.3 | Very low | 105 Ų | 105 | 146.6 Ų | 146.6 | 87% | 0.868 | 77% | 0.774 | S | S | * | * | trans | -160.5 | 137.2 | 139.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 95 | Q | 40.5 | Very low | 42.8 | Very low | 199 Ų | 199 | 141.9 Ų | 141.9 | 93% | 0.93 | 78% | 0.776 | S | S | * | * | trans | -72.8 | 149.9 | -169.7 | -70.3 | 157.1 | -40.8 | 0 | 0 | 115.9 | ||||
| 96 | G | 35.8 | Very low | 43.1 | Very low | 74 Ų | 74 | 141.1 Ų | 141.1 | 76% | 0.763 | 78% | 0.779 | S | S | * | * | trans | 33.4 | 123.9 | 136.2 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 97 | V | 37.1 | Very low | 42.8 | Very low | 140 Ų | 140 | 136.5 Ų | 136.5 | 85% | 0.848 | 78% | 0.777 | S | S | * | * | trans | -142.2 | 126.7 | 142.4 | 163.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 98 | H | 39.3 | Very low | 42.8 | Very low | 171 Ų | 171 | 135.9 Ų | 135.9 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | trans | -58.2 | 132.8 | 170.4 | -146.5 | -110.6 | 0 | 0 | 0 | 110.6 | ||||
| 99 | T | 41.3 | Very low | 42.4 | Very low | 134 Ų | 134 | 137.8 Ų | 137.8 | 82% | 0.822 | 78% | 0.778 | S | S | * | * | trans | -131.2 | 93.2 | 156.9 | -73.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 100 | E | 37.2 | Very low | 42.8 | Very low | 132 Ų | 132 | 136.3 Ų | 136.3 | 62% | 0.617 | 78% | 0.78 | S | S | * | * | trans | -69 | 128.3 | 155.1 | -155.1 | -89.3 | 101.6 | 0 | 0 | 106.4 | ||||
| 101 | R | 34.4 | Very low | 43.1 | Very low | 199 Ų | 199 | 131.8 Ų | 131.8 | 75% | 0.751 | 77% | 0.768 | S | S | * | * | trans | 158 | 103.2 | 142.3 | -83.1 | -78.5 | -158.4 | 164.1 | 7.2 | 110.2 | P103 | R101-P103 WeakPolarHBondContact O-CD 3.27Š| ||
| 102 | H | 42.3 | Very low | 43.2 | Very low | 182 Ų | 182 | 125.2 Ų | 125.2 | 84% | 0.843 | 76% | 0.762 | S | S | * | * | trans | -61 | 130.6 | 144.9 | -104.9 | -86.9 | 0 | 0 | 0 | 108.8 | ||||
| 103 | P | 42.1 | Very low | 42.6 | Very low | 112 Ų | 112 | 127.2 Ų | 127.2 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | -131.4 | 134 | 119.6 | 32.2 | -19.4 | 0 | 0 | 0 | 108.5 | R101 | R101-P103 WeakPolarHBondContact O-CD 3.27Š| |||
| 104 | G | 38 | Very low | 42.6 | Very low | 54 Ų | 54 | 131 Ų | 131 | 56% | 0.557 | 78% | 0.775 | S | S | * | * | 71.4 | 101.2 | 70.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 105 | S | 49 | Very low | 42.4 | Very low | 131 Ų | 131 | 136.8 Ų | 136.8 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | trans | 56.4 | 93.7 | 163.6 | 53.1 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 106 | A | 45.8 | Very low | 42.4 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 86% | 0.86 | 77% | 0.769 | S | S | * | * | trans | -119.1 | 120.3 | 150.4 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 107 | G | 43.9 | Very low | 42.5 | Very low | 74 Ų | 74 | 135.6 Ų | 135.6 | 76% | 0.763 | 77% | 0.769 | S | S | * | * | trans | -58.1 | 143.7 | -168.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | E109 | G107-E109 PolarHBondContact O-N 3.4Š| ||
| 108 | L | 44 | Very low | 43.1 | Very low | 127 Ų | 127 | 139.7 Ų | 139.7 | 67% | 0.665 | 77% | 0.769 | S | S | * | * | trans | -58.2 | 84.2 | 156.9 | -159.9 | 81.2 | 0 | 0 | 0 | 107.7 | V110 | L108-V110 HydrophobicContact CD2-CG2 3.88Å; L108-V110 HydrophobicContact CG-CG2 4.03Å; L108-V110 PolarHBondContact O-N 2.9Å | ||
| 109 | E | 41.7 | Very low | 43.1 | Very low | 176 Ų | 176 | 136.5 Ų | 136.5 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | trans | -72.9 | 88.4 | 167.1 | -159.1 | -157.3 | 108 | 0 | 0 | 107.4 | G107 G111 | G107-E109 PolarHBondContact O-N 3.4Å; E109-G111 PolarHBondContact O-N 2.94Å | ||
| 110 | V | 52.5 | Low | 43.6 | Very low | 131 Ų | 131 | 140.5 Ų | 140.5 | 79% | 0.794 | 77% | 0.766 | S | S | * | * | trans | -64.7 | 88.2 | 164.9 | 179.1 | 0 | 0 | 0 | 0 | 106.9 | L108 | L108-V110 HydrophobicContact CD2-CG2 3.88Å; L108-V110 HydrophobicContact CG-CG2 4.03Å; L108-V110 PolarHBondContact O-N 2.9Å | ||
| 111 | G | 49.8 | Very low | 43.4 | Very low | 50 Ų | 50 | 140.3 Ų | 140.3 | 52% | 0.515 | 78% | 0.778 | S | S | . | * | trans | -146.7 | 26 | -163 | 0 | 0 | 0 | 0 | 0 | 116.9 | E109 | E109-G111 PolarHBondContact O-N 2.94Š| ||
| 112 | A | 44.2 | Very low | 44 | Very low | 88 Ų | 88 | 135.6 Ų | 135.6 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -156.8 | 78.7 | 165.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | R114 | A112-R114 PolarHBondContact O-N 3.3Š| ||
| 113 | V | 47.7 | Very low | 44.4 | Very low | 136 Ų | 136 | 134 Ų | 134 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -70.5 | 77.7 | 155.4 | 100.9 | 0 | 0 | 0 | 0 | 107.8 | R115 | V113-R115 VanDerWaalsContact C-N 3.26Å; V113-R115 PolarHBondContact O-N 2.85Å | ||
| 114 | R | 41.7 | Very low | 44.7 | Very low | 232 Ų | 232 | 132.8 Ų | 132.8 | 88% | 0.875 | 78% | 0.775 | S | S | * | * | trans | -74.9 | 89.3 | 163.8 | -89.2 | -139.2 | -147.6 | 171.3 | 10 | 107.7 | A112 H116 | A112-R114 PolarHBondContact O-N 3.3Å; R114-H116 PolarHBondContact O-N 3.32Å | ||
| 115 | R | 42.6 | Very low | 44.9 | Very low | 227 Ų | 227 | 136.2 Ų | 136.2 | 86% | 0.857 | 79% | 0.789 | S | S | * | * | trans | -52 | 104.5 | 162.5 | -72.4 | -99 | -159 | -158.3 | 2.5 | 108.3 | V113 G117 | V113-R115 VanDerWaalsContact C-N 3.26Å; V113-R115 PolarHBondContact O-N 2.85Å; R115-G117 VanDerWaalsContact C-N 3.31Å; R115-G117 PolarHBondContact O-N 2.98Å | ||
| 116 | H | 39.3 | Very low | 44.8 | Very low | 173 Ų | 173 | 136.8 Ų | 136.8 | 80% | 0.801 | 78% | 0.781 | S | S | * | * | trans | -76 | 85.7 | 174.1 | -146.3 | -71.5 | 0 | 0 | 0 | 108.7 | R114 R118 | R114-H116 PolarHBondContact O-N 3.32Å; H116-R118 PolarHBondContact O-N 2.82Å; H116-R118 VanDerWaalsContact O-N 3.09Å | ||
| 117 | G | 38.9 | Very low | 44.9 | Very low | 74 Ų | 74 | 136.9 Ų | 136.9 | 76% | 0.763 | 78% | 0.781 | S | S | * | * | trans | -66.9 | 97.8 | 159.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | R115 S119 | R115-G117 VanDerWaalsContact C-N 3.31Å; R115-G117 PolarHBondContact O-N 2.98Å; G117-S119 PolarHBondContact O-N 3.06Å | ||
| 118 | R | 50.1 | Low | 44.7 | Very low | 227 Ų | 227 | 147.8 Ų | 147.8 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | -78.4 | 109.6 | -179 | -166.2 | 176.1 | 173.6 | -174.9 | -1.8 | 109.2 | H116 | H116-R118 PolarHBondContact O-N 2.82Å; H116-R118 VanDerWaalsContact O-N 3.09Å | ||
| 119 | S | 39.2 | Very low | 44.7 | Very low | 103 Ų | 103 | 148.8 Ų | 148.8 | 72% | 0.72 | 81% | 0.806 | S | S | * | * | trans | -148.1 | 97.4 | 151.6 | -160.6 | 0 | 0 | 0 | 0 | 106.8 | G117 | G117-S119 PolarHBondContact O-N 3.06Š| ||
| 120 | R | 50.8 | Low | 44.9 | Very low | 219 Ų | 219 | 147.4 Ų | 147.4 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | 48.9 | 112.1 | 112.9 | -61.4 | -177.3 | -177.7 | -131.3 | 2.7 | 110.7 | |||||
| 121 | C | 34.4 | Very low | 44.4 | Very low | 128 Ų | 128 | 148.3 Ų | 148.3 | 87% | 0.865 | 81% | 0.806 | S | S | * | * | -142.1 | 147.2 | 78.5 | -68 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 122 | P | 46.3 | Very low | 44.1 | Very low | 100 Ų | 100 | 154.1 Ų | 154.1 | 65% | 0.649 | 82% | 0.823 | S | S | * | * | trans | -85.5 | 148.1 | 171.3 | 38.6 | -32.9 | 0 | 0 | 0 | 110.4 | A124 | P122-A124 PolarHBondContact O-N 3.06Š| ||
| 123 | V | 50.2 | Low | 44.1 | Very low | 149 Ų | 149 | 158.2 Ų | 158.2 | 90% | 0.903 | 83% | 0.829 | S | S | * | * | S | Bend | trans | 42.1 | 62.6 | 145.9 | -53.5 | 0 | 0 | 0 | 0 | 118.3 | ||
| 124 | A | 48.3 | Very low | 43.9 | Very low | 86 Ų | 86 | 159.7 Ų | 159.7 | 71% | 0.711 | 83% | 0.829 | S | S | * | * | trans | -161.6 | 136.8 | 156.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | P122 | P122-A124 PolarHBondContact O-N 3.06Š| ||
| 125 | C | 42.3 | Very low | 44.1 | Very low | 125 Ų | 125 | 154.5 Ų | 154.5 | 85% | 0.845 | 83% | 0.826 | S | S | * | * | S | Bend | trans | 77.6 | 118.6 | -174.1 | -61.4 | 0 | 0 | 0 | 0 | 114 | ||
| 126 | L | 47.7 | Very low | 44.2 | Very low | 143 Ų | 143 | 148.9 Ų | 148.9 | 75% | 0.749 | 82% | 0.824 | S | S | * | * | cis | -164.1 | 113.3 | 6.8 | -162.1 | 67.7 | 0 | 0 | 0 | 107.7 | R128 | L126-R128 PolarHBondContact O-N 2.98Š| ||
| 127 | A | 46.5 | Very low | 44.6 | Very low | 106 Ų | 106 | 146.9 Ų | 146.9 | 88% | 0.876 | 83% | 0.826 | S | S | * | * | trans | -61.4 | 110.1 | 147.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 128 | R | 40.2 | Very low | 45.1 | Very low | 303 Ų | 303 | 153.5 Ų | 153.5 | 100% | 1.143 | 83% | 0.831 | S | S | * | * | trans | -165.2 | 0 | 143.4 | -160.6 | 163.3 | 177.9 | -136.7 | -1.8 | 111.5 | L126 | L126-R128 PolarHBondContact O-N 2.98Š|
Retrieved 128 of 128 residues in 26 ms
(Link to these results)