| 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 | 35.3 | Very low | 37.3 | Very low | 226 Ų | 226 | 114 Ų | 114 | 100% | 1.113 | 67% | 0.665 | S | S | * | * | 0 | 126.9 | 0 | -147.3 | 170.3 | -171.1 | 0 | 0 | 107.9 | I3 | M1-I3 VanDerWaalsContact C-N 3.33Å; M1-I3 PolarHBondContact O-N 2.95Å; M1-I3 VanDerWaalsContact O-N 3.08Å | |||
| 2 | A | 36.5 | Very low | 36.7 | Very low | 101 Ų | 101 | 119 Ų | 119 | 84% | 0.835 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | 31.9 | -154.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 3 | I | 39 | Very low | 36.2 | Very low | 114 Ų | 114 | 121.8 Ų | 121.8 | 59% | 0.585 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.3 | -21.3 | -166.9 | -60.8 | 174.7 | 0 | 0 | 0 | 113 | M1 C5 A6 | M1-I3 VanDerWaalsContact C-N 3.33Å; M1-I3 PolarHBondContact O-N 2.95Å; M1-I3 VanDerWaalsContact O-N 3.08Å; I3-C5 PolarHBondContact O-N 3.43Å; I3-A6 PolarHBondContact O-N 3.22Å |
| 4 | S | 43.5 | Very low | 35.6 | Very low | 97 Ų | 97 | 121.2 Ų | 121.2 | 68% | 0.678 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -17.9 | -170.2 | -157.4 | 0 | 0 | 0 | 0 | 115.8 | ||
| 5 | C | 41 | Very low | 35.1 | Very low | 51 Ų | 51 | 126.3 Ų | 126.3 | 35% | 0.345 | 71% | 0.707 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.5 | -14.7 | 177.9 | -140.9 | 0 | 0 | 0 | 0 | 113.5 | I3 C289 | I3-C5 PolarHBondContact O-N 3.43Å; C5-C289 WeakPolarHBondContact CB-SG 3.43Å; C5-C289 WeakPolarHBondContact SG-CB 3.3Å; C5-C289 CovalentContact SG-SG 2.07Å; C5-C289 PolarHBondContact SG-SG 2.66Å |
| 6 | A | 39.6 | Very low | 34.6 | Very low | 55 Ų | 55 | 129.8 Ų | 129.8 | 46% | 0.455 | 72% | 0.719 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.9 | -34.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | I3 G8 M9 | I3-A6 PolarHBondContact O-N 3.22Å; A6-G8 PolarHBondContact O-N 3.3Å; A6-G8 VanDerWaalsContact O-N 3.08Å; A6-M9 WeakPolarHBondContact O-CB 3.39Å; A6-M9 PolarHBondContact O-N 3.27Å |
| 7 | V | 42.2 | Very low | 34.2 | Very low | 91 Ų | 91 | 132.6 Ų | 132.6 | 55% | 0.552 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | -19.1 | -175.3 | -179.1 | 0 | 0 | 0 | 0 | 113 | ||
| 8 | G | 34.2 | Very low | 33.7 | Very low | 45 Ų | 45 | 128.8 Ų | 128.8 | 46% | 0.464 | 73% | 0.729 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.6 | 5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | A6 | A6-G8 PolarHBondContact O-N 3.3Å; A6-G8 VanDerWaalsContact O-N 3.08Å |
| 9 | M | 35.5 | Very low | 33.3 | Very low | 127 Ų | 127 | 129.2 Ų | 129.2 | 63% | 0.626 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -31.5 | 173.7 | -75.7 | 177.5 | 61.4 | 0 | 0 | 112.9 | A6 | A6-M9 WeakPolarHBondContact O-CB 3.39Å; A6-M9 PolarHBondContact O-N 3.27Å |
| 10 | E | 31.5 | Very low | 32.9 | Very low | 173 Ų | 173 | 135.2 Ų | 135.2 | 81% | 0.808 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | -9.3 | -168.7 | -71 | -173.3 | 116.8 | 0 | 0 | 114.9 | ||
| 11 | M | 31.9 | Very low | 32.5 | Very low | 174 Ų | 174 | 134.7 Ų | 134.7 | 86% | 0.857 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | 4.7 | -176.4 | -102.1 | -174.3 | -124.5 | 0 | 0 | 115.7 | ||
| 12 | Q | 29.8 | Very low | 32 | Very low | 174 Ų | 174 | 128 Ų | 128 | 81% | 0.813 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -119.8 | -8.9 | -178.1 | -135.2 | 165.3 | -1.4 | 0 | 0 | 115.5 | ||
| 13 | D | 30.6 | Very low | 31.4 | Very low | 155 Ų | 155 | 128.8 Ų | 128.8 | 83% | 0.829 | 73% | 0.731 | S | S | * | * | trans | -116.4 | 74.2 | 174.1 | -88 | -32.3 | 0 | 0 | 0 | 111 | ||||
| 14 | S | 28.3 | Very low | 30.7 | Very low | 114 Ų | 114 | 127.7 Ų | 127.7 | 80% | 0.797 | 74% | 0.739 | S | S | * | * | trans | -155.1 | 85.5 | 156.8 | -152.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 15 | K | 27.5 | Very low | 29.8 | Very low | 197 Ų | 197 | 127.7 Ų | 127.7 | 86% | 0.857 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -161.2 | 120.8 | 146.5 | -108.7 | 165.4 | -172.7 | -177.8 | 0 | 111.1 | ||
| 16 | M | 26.8 | Very low | 29 | Very low | 182 Ų | 182 | 130.3 Ų | 130.3 | 90% | 0.897 | 77% | 0.771 | S | S | * | * | trans | 82.8 | 99.3 | 161.2 | -68.1 | 178.5 | -170.1 | 0 | 0 | 118.8 | ||||
| 17 | N | 27.4 | Very low | 28.3 | Very low | 178 Ų | 178 | 131 Ų | 131 | 95% | 0.952 | 78% | 0.783 | S | S | * | * | trans | -109.2 | 133.1 | 144.9 | -114.2 | -11.8 | 0 | 0 | 0 | 108.5 | ||||
| 18 | G | 25.8 | Very low | 27.4 | Very low | 65 Ų | 65 | 137.8 Ų | 137.8 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | trans | -176 | 77.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 19 | T | 26.8 | Very low | 27 | Very low | 135 Ų | 135 | 147.3 Ų | 147.3 | 83% | 0.828 | 82% | 0.822 | S | S | * | * | trans | 58.4 | 120.1 | 141.8 | 49.6 | 0 | 0 | 0 | 0 | 124 | ||||
| 20 | R | 25.2 | Very low | 26.6 | Very low | 249 Ų | 249 | 150.4 Ų | 150.4 | 94% | 0.94 | 84% | 0.835 | S | S | * | * | trans | 56.7 | 122 | 136.8 | -74.6 | -178.1 | 165.9 | 177.1 | -3.8 | 121.3 | ||||
| 21 | S | 23.8 | Very low | 26.3 | Very low | 126 Ų | 126 | 151.1 Ų | 151.1 | 88% | 0.881 | 84% | 0.839 | S | S | * | * | 170 | 165.8 | 104.4 | -166.1 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 22 | A | 25.4 | Very low | 26.1 | Very low | 86 Ų | 86 | 154.8 Ų | 154.8 | 71% | 0.711 | 84% | 0.843 | S | S | * | * | trans | -70.3 | 158.5 | -162.3 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 23 | S | 23.3 | Very low | 26.1 | Very low | 117 Ų | 117 | 156.2 Ų | 156.2 | 82% | 0.818 | 85% | 0.85 | S | S | * | * | trans | 54 | 113.6 | 138 | 175.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 24 | A | 25.2 | Very low | 25.8 | Very low | 91 Ų | 91 | 152 Ų | 152 | 75% | 0.752 | 84% | 0.843 | S | S | * | * | 175.6 | 136.9 | 116.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 25 | A | 24.9 | Very low | 25.8 | Very low | 96 Ų | 96 | 156.5 Ų | 156.5 | 79% | 0.793 | 85% | 0.848 | S | S | * | * | trans | 48.5 | 105 | 144.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 26 | A | 23.9 | Very low | 25.9 | Very low | 107 Ų | 107 | 155 Ų | 155 | 88% | 0.884 | 85% | 0.849 | S | S | * | * | 78.9 | 120.2 | 85.2 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 27 | G | 23.5 | Very low | 26.3 | Very low | 70 Ų | 70 | 152.1 Ų | 152.1 | 72% | 0.722 | 84% | 0.844 | S | S | * | * | trans | 139.7 | 104.6 | 154.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 28 | Y | 23.9 | Very low | 26.5 | Very low | 233 Ų | 233 | 150 Ų | 150 | 91% | 0.914 | 84% | 0.837 | S | S | * | * | trans | 73.7 | 98.5 | 154.9 | -82 | -97.2 | 0 | 0 | 0 | 118.9 | ||||
| 29 | R | 26.8 | Very low | 26.7 | Very low | 244 Ų | 244 | 156.5 Ų | 156.5 | 92% | 0.921 | 85% | 0.85 | S | S | * | * | 163.3 | 76.2 | 98.9 | -166.3 | 173.4 | -134.9 | 178.7 | 3.3 | 109.5 | |||||
| 30 | Q | 25.6 | Very low | 26.6 | Very low | 192 Ų | 192 | 153.4 Ų | 153.4 | 90% | 0.897 | 85% | 0.845 | S | S | * | * | trans | -107.3 | 103 | 167.6 | -174.3 | 171.2 | 9.1 | 0 | 0 | 106.4 | ||||
| 31 | E | 25.9 | Very low | 27 | Very low | 189 Ų | 189 | 148.8 Ų | 148.8 | 88% | 0.883 | 84% | 0.844 | S | S | * | * | trans | -169.6 | 114.1 | 158.9 | -113.5 | 176.1 | -173.1 | 0 | 0 | 111.6 | ||||
| 32 | R | 27.2 | Very low | 27.3 | Very low | 251 Ų | 251 | 147.3 Ų | 147.3 | 95% | 0.947 | 84% | 0.84 | S | S | * | * | trans | 130.3 | 55.5 | 158.5 | -73.8 | -165.2 | 177.4 | -164.5 | 0.7 | 113.9 | ||||
| 33 | E | 29.7 | Very low | 27.9 | Very low | 204 Ų | 204 | 149.9 Ų | 149.9 | 95% | 0.953 | 85% | 0.853 | S | S | * | * | trans | -117.8 | 124.5 | 142.6 | -74.6 | -162 | 162.5 | 0 | 0 | 107.7 | ||||
| 34 | G | 24.7 | Very low | 28.2 | Very low | 67 Ų | 67 | 147.2 Ų | 147.2 | 69% | 0.691 | 84% | 0.844 | S | S | * | * | trans | 158.2 | 84.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 35 | F | 28.2 | Very low | 28.6 | Very low | 207 Ų | 207 | 154.8 Ų | 154.8 | 91% | 0.908 | 85% | 0.853 | S | S | * | * | trans | -171.7 | 99.6 | 138.9 | -102.1 | -73.1 | 0 | 0 | 0 | 107.6 | ||||
| 36 | L | 30.3 | Very low | 28.7 | Very low | 167 Ų | 167 | 159.2 Ų | 159.2 | 87% | 0.874 | 86% | 0.855 | S | S | * | * | 179.5 | 134.7 | 122.7 | -88.6 | 169.7 | 0 | 0 | 0 | 109.7 | |||||
| 37 | P | 34.2 | Very low | 29.1 | Very low | 120 Ų | 120 | 159.8 Ų | 159.8 | 78% | 0.779 | 85% | 0.849 | S | S | * | * | trans | -82.8 | 145.4 | -171.9 | 32.1 | -33.1 | 0 | 0 | 0 | 113.4 | ||||
| 38 | T | 31.5 | Very low | 29.5 | Very low | 133 Ų | 133 | 162.8 Ų | 162.8 | 82% | 0.816 | 85% | 0.853 | S | S | * | * | trans | -75.7 | 120.6 | 167.9 | 17.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 39 | H | 30.9 | Very low | 30 | Very low | 202 Ų | 202 | 158.7 Ų | 158.7 | 94% | 0.935 | 84% | 0.843 | S | S | * | * | trans | -172 | 140.1 | 140.8 | -107.5 | -75 | 0 | 0 | 0 | 111.2 | ||||
| 40 | G | 25.1 | Very low | 30.7 | Very low | 70 Ų | 70 | 153.4 Ų | 153.4 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | 108.1 | 107.4 | 149.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | A42 | G40-A42 PolarHBondContact O-N 3.32Š| ||
| 41 | T | 32.4 | Very low | 31.4 | Very low | 152 Ų | 152 | 150.9 Ų | 150.9 | 93% | 0.933 | 82% | 0.816 | S | S | * | * | trans | -49.6 | 117.9 | 169 | 35.2 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 42 | A | 30.2 | Very low | 32.1 | Very low | 95 Ų | 95 | 149.8 Ų | 149.8 | 79% | 0.785 | 82% | 0.816 | S | S | * | * | trans | -152.9 | 130 | 154.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | G40 G44 | G40-A42 PolarHBondContact O-N 3.32Å; A42-G44 PolarHBondContact O-N 3.25Å | ||
| 43 | S | 38.6 | Very low | 33.3 | Very low | 140 Ų | 140 | 144 Ų | 144 | 98% | 0.979 | 80% | 0.798 | S | S | * | * | trans | -59.5 | 95.9 | 177.9 | -176.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 44 | G | 29.8 | Very low | 34.8 | Very low | 62 Ų | 62 | 142.1 Ų | 142.1 | 64% | 0.639 | 79% | 0.79 | S | S | * | * | trans | -113.6 | 116.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | A42 K46 | A42-G44 PolarHBondContact O-N 3.25Å; G44-K46 PolarHBondContact O-N 2.85Å | ||
| 45 | R | 33.6 | Very low | 36.9 | Very low | 250 Ų | 250 | 139 Ų | 139 | 94% | 0.943 | 76% | 0.758 | S | S | * | * | trans | -48 | 112.4 | 169 | -88.7 | 176 | 171.1 | 161.9 | -2.1 | 108.8 | ||||
| 46 | K | 27.2 | Very low | 39.5 | Very low | 189 Ų | 189 | 137.6 Ų | 137.6 | 82% | 0.822 | 75% | 0.751 | S | S | * | * | trans | -52.4 | 130.5 | 162 | -73.1 | -176.6 | 177 | -178.3 | 0 | 107.2 | G44 V48 | G44-K46 PolarHBondContact O-N 2.85Å; K46-V48 PolarHBondContact O-N 3.23Å | ||
| 47 | P | 31.3 | Very low | 42 | Very low | 119 Ų | 119 | 130.7 Ų | 130.7 | 77% | 0.773 | 72% | 0.716 | S | S | * | * | trans | -57.2 | 131.8 | 169.1 | 24.7 | -30.5 | 0 | 0 | 0 | 107 | Q49 | P47-Q49 VanDerWaalsContact C-N 3.29Å; P47-Q49 PolarHBondContact O-N 2.95Å | ||
| 48 | V | 33.3 | Very low | 44.7 | Very low | 133 Ų | 133 | 126.9 Ų | 126.9 | 81% | 0.806 | 69% | 0.692 | S | S | * | * | trans | -63.6 | 93.3 | -178.3 | -174.6 | 0 | 0 | 0 | 0 | 107.7 | K46 F50 | K46-V48 PolarHBondContact O-N 3.23Å; V48-F50 PolarHBondContact O-N 3.36Å | ||
| 49 | Q | 33.9 | Very low | 47.6 | Very low | 147 Ų | 147 | 123.6 Ų | 123.6 | 69% | 0.687 | 67% | 0.667 | S | S | * | * | trans | -64.9 | 119.3 | 162.8 | -102.1 | 173 | -24.2 | 0 | 0 | 106 | P47 M51 | P47-Q49 VanDerWaalsContact C-N 3.29Å; P47-Q49 PolarHBondContact O-N 2.95Å; Q49-M51 HydrophobicContact CB-CB 4.45Å; Q49-M51 HydrophobicContact CB-CG 4.35Å; Q49-M51 PolarHBondContact O-N 3.11Å | ||
| 50 | F | 40.5 | Very low | 50.5 | Low | 133 Ų | 133 | 115.6 Ų | 115.6 | 58% | 0.583 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | 34.4 | 177.1 | -121.8 | -86.1 | 0 | 0 | 0 | 111.9 | V48 | V48-F50 PolarHBondContact O-N 3.36Š|
| 51 | M | 41.4 | Very low | 53.6 | Low | 139 Ų | 139 | 114 Ų | 114 | 69% | 0.685 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104 | -2.9 | -170 | -67.6 | -167.3 | 95.7 | 0 | 0 | 114.8 | Q49 F53 | Q49-M51 HydrophobicContact CB-CB 4.45Å; Q49-M51 HydrophobicContact CB-CG 4.35Å; Q49-M51 PolarHBondContact O-N 3.11Å; M51-F53 PolarHBondContact O-N 3.26Å |
| 52 | D | 40.1 | Very low | 56.4 | Low | 165 Ų | 165 | 106.7 Ų | 106.7 | 88% | 0.882 | 57% | 0.568 | S | S | * | * | trans | -93.6 | 16.6 | -175.7 | -69.5 | -21.5 | 0 | 0 | 0 | 115 | ||||
| 53 | F | 53.5 | Low | 59.4 | Low | 130 Ų | 130 | 103 Ų | 103 | 57% | 0.57 | 54% | 0.536 | S | S | * | . | trans | -107.1 | 104.3 | 172.2 | -163.1 | -100.1 | 0 | 0 | 0 | 110.6 | M51 G55 | M51-F53 PolarHBondContact O-N 3.26Å; F53-G55 PolarHBondContact O-N 2.98Å | ||
| 54 | E | 60.4 | Low | 61.9 | Low | 165 Ų | 165 | 100.8 Ų | 100.8 | 77% | 0.771 | 51% | 0.508 | S | S | * | . | trans | -75.2 | 107.7 | 172.4 | -147.6 | 175.7 | -171.2 | 0 | 0 | 108.9 | K56 | E54-K56 PolarHBondContact O-N 2.86Š| ||
| 55 | G | 68.9 | Low | 64.8 | Low | 2 Ų | 2 | 98.2 Ų | 98.2 | 2% | 0.021 | 48% | 0.48 | C | S | . | . | trans | -58 | 132 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | F53 E287 C289 | F53-G55 PolarHBondContact O-N 2.98Å; G55-E287 CarbonylContact C-O 3.34Å; G55-E287 WeakPolarHBondContact CA-O 3.46Å; G55-C289 WeakPolarHBondContact O-CA 3.22Å; G55-C289 WeakPolarHBondContact O-CB 3.43Å | ||
| 56 | K | 81.8 | Confident | 67.6 | Low | 176 Ų | 176 | 86.3 Ų | 86.3 | 77% | 0.765 | 44% | 0.435 | S | S | * | . | trans | -101 | -7.3 | -175.8 | -62.5 | -177.8 | -178.4 | 177.6 | 0 | 113.2 | E54 E287 | E54-K56 PolarHBondContact O-N 2.86Å; K56-E287 PolarHBondContact N-O 2.79Å; K56-E287 VanDerWaalsContact N-O 3.13Å | ||
| 57 | T | 84.4 | Confident | 70.8 | Confident | 23 Ų | 23 | 77.5 Ų | 77.5 | 14% | 0.141 | 40% | 0.397 | C | S | . | . | B | Isolated β-bridge | trans | -83.7 | 128.9 | -171.6 | -58 | 0 | 0 | 0 | 0 | 110.3 | M61 S62 E287 C289 | T57-M61 HydrophobicContact CG2-CB 3.65Å; T57-S62 WeakPolarHBondContact CG2-OG 3.34Å; T57-E287 VanDerWaalsContact CB-O 3.28Å; T57-E287 WeakPolarHBondContact CB-O 3.48Å; T57-E287 PolarHBondContact N-O 2.94Å; T57-E287 PolarHBondContact OG1-O 3.11Å; T57-E287 PolarHBondContact OG1-OE2 3.39Å; T57-C289 WeakPolarHBondContact O-CB 3.4Å; T57-C289 PolarHBondContact O-N 2.92Å |
| 58 | S | 90.7 | Very high | 73.7 | Confident | 40 Ų | 40 | 71.9 Ų | 71.9 | 28% | 0.28 | 36% | 0.361 | S | S | . | . | trans | -69 | 164.2 | 179.3 | 72.1 | 0 | 0 | 0 | 0 | 111.7 | G60 M61 S62 | S58-G60 PolarHBondContact O-N 3.2Å; S58-M61 PolarHBondContact O-N 3.39Å; S58-M61 WeakPolarHBondContact OG-CB 3.49Å; S58-M61 VanDerWaalsContact OG-CG 3.22Å; S58-M61 WeakPolarHBondContact OG-CG 3.35Å; S58-M61 PolarHBondContact OG-N 3.44Å; S58-S62 PolarHBondContact O-N 3.23Å; S58-S62 PolarHBondContact O-OG 3.06Å | ||
| 59 | F | 92.3 | Very high | 76.3 | Confident | 64 Ų | 64 | 66.3 Ų | 66.3 | 28% | 0.281 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -58.5 | -49 | 178.4 | 179 | -93.5 | 0 | 0 | 0 | 111.9 | M61 S62 V63 A298 V299 M302 | F59-M61 PolarHBondContact O-N 3.18Å; F59-S62 WeakPolarHBondContact O-CB 3.3Å; F59-S62 PolarHBondContact O-N 3.46Å; F59-S62 VanDerWaalsContact O-N 3.17Å; F59-V63 HydrophobicContact CD1-CG2 4.38Å; F59-V63 HydrophobicContact CE1-CG2 4.03Å; F59-V63 HydrophobicContact CZ-CG2 4.34Å; F59-V63 PolarHBondContact O-N 3.38Å; F59-A298 HydrophobicContact CE2-CB 4.04Å; F59-A298 HydrophobicContact CZ-CB 4.07Å; F59-V299 HydrophobicContact CD2-CG2 3.55Å; F59-V299 HydrophobicContact CE2-CB 4.45Å; F59-V299 HydrophobicContact CE2-CG2 3.39Å; F59-V299 HydrophobicContact CG-CG2 4.37Å; F59-V299 HydrophobicContact CZ-CG2 4.09Å; F59-M302 HydrophobicContact CE1-CE 4.36Å; F59-M302 HydrophobicContact CE1-SD 3.56Å; F59-M302 VanDerWaalsContact CE1-SD 3.56Å; F59-M302 HydrophobicContact CZ-SD 3.61Å |
| 60 | G | 91 | Very high | 79.2 | Confident | 33 Ų | 33 | 59.5 Ų | 59.5 | 34% | 0.34 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.7 | -40.3 | 179 | 0 | 0 | 0 | 0 | 0 | 113.3 | S58 S62 V63 F64 | S58-G60 PolarHBondContact O-N 3.2Å; G60-S62 VanDerWaalsContact C-N 3.26Å; G60-S62 PolarHBondContact O-N 3Å; G60-V63 WeakPolarHBondContact O-CB 3.11Å; G60-V63 PolarHBondContact O-N 3.44Å; G60-F64 WeakPolarHBondContact O-CD2 3.45Å; G60-F64 PolarHBondContact O-N 3.48Å |
| 61 | M | 89.6 | Confident | 81.5 | Confident | 36 Ų | 36 | 53.2 Ų | 53.2 | 18% | 0.177 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.3 | -33.7 | 174.9 | -70.6 | -73.4 | -95.8 | 0 | 0 | 112.1 | T57 S58 F59 F64 N65 G204 Y205 | T57-M61 HydrophobicContact CG2-CB 3.65Å; S58-M61 PolarHBondContact O-N 3.39Å; S58-M61 WeakPolarHBondContact OG-CB 3.49Å; S58-M61 VanDerWaalsContact OG-CG 3.22Å; S58-M61 WeakPolarHBondContact OG-CG 3.35Å; S58-M61 PolarHBondContact OG-N 3.44Å; F59-M61 PolarHBondContact O-N 3.18Å; M61-F64 PolarHBondContact O-N 3.08Å; M61-N65 WeakPolarHBondContact O-CB 3.34Å; M61-N65 VanDerWaalsContact O-CG 3.29Å; M61-N65 PolarHBondContact O-N 3.5Å; M61-G204 VanDerWaalsContact CE-C 3.48Å; M61-G204 VanDerWaalsContact CE-CA 3.41Å; M61-Y205 HydrophobicContact CE-CD1 4.07Å; M61-Y205 HydrophobicContact CE-CD2 3.79Å; M61-Y205 HydrophobicContact CE-CE1 4.04Å; M61-Y205 HydrophobicContact CE-CE2 3.74Å; M61-Y205 HydrophobicContact CE-CG 3.96Å |
| 62 | S | 91.4 | Very high | 83.4 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -69.3 | -36.8 | 175 | -54.4 | 0 | 0 | 0 | 0 | 111.8 | T57 S58 F59 G60 L66 L288 | T57-S62 WeakPolarHBondContact CG2-OG 3.34Å; S58-S62 PolarHBondContact O-N 3.23Å; S58-S62 PolarHBondContact O-OG 3.06Å; F59-S62 WeakPolarHBondContact O-CB 3.3Å; F59-S62 PolarHBondContact O-N 3.46Å; F59-S62 VanDerWaalsContact O-N 3.17Å; G60-S62 VanDerWaalsContact C-N 3.26Å; G60-S62 PolarHBondContact O-N 3Å; S62-L66 WeakPolarHBondContact O-CB 3.27Å; S62-L66 PolarHBondContact O-N 3.19Å; S62-L288 VanDerWaalsContact OG-CD1 3.25Å; S62-L288 WeakPolarHBondContact OG-CD1 3.41Å |
| 63 | V | 93.9 | Very high | 85.5 | Confident | 17 Ų | 17 | 39.1 Ų | 39.1 | 10% | 0.103 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.3 | -49 | 170.2 | 174.4 | 0 | 0 | 0 | 0 | 109.8 | F59 G60 N65 L66 S67 V299 M302 S303 | F59-V63 HydrophobicContact CD1-CG2 4.38Å; F59-V63 HydrophobicContact CE1-CG2 4.03Å; F59-V63 HydrophobicContact CZ-CG2 4.34Å; F59-V63 PolarHBondContact O-N 3.38Å; G60-V63 WeakPolarHBondContact O-CB 3.11Å; G60-V63 PolarHBondContact O-N 3.44Å; V63-N65 PolarHBondContact O-N 3.04Å; V63-L66 PolarHBondContact O-N 2.94Å; V63-S67 WeakPolarHBondContact O-CB 3.49Å; V63-S67 PolarHBondContact O-N 3.23Å; V63-S67 PolarHBondContact O-OG 3.01Å; V63-S67 VanDerWaalsContact O-OG 3.06Å; V63-V299 HydrophobicContact CG2-CB 4.3Å; V63-V299 HydrophobicContact CG2-CG1 4.04Å; V63-V299 HydrophobicContact CG2-CG2 4.22Å; V63-M302 HydrophobicContact CG1-CB 4.44Å; V63-M302 HydrophobicContact CG2-CB 4.36Å; V63-S303 PolarHBondContact O-OG 3.37Å |
| 64 | F | 91.8 | Very high | 87 | Confident | 93 Ų | 93 | 33 Ų | 33 | 41% | 0.408 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62.1 | -40.8 | 178.5 | -67 | -44.2 | 0 | 0 | 0 | 113.5 | G60 M61 N68 L211 | G60-F64 WeakPolarHBondContact O-CD2 3.45Å; G60-F64 PolarHBondContact O-N 3.48Å; M61-F64 PolarHBondContact O-N 3.08Å; F64-N68 WeakPolarHBondContact O-CB 3.39Å; F64-N68 PolarHBondContact O-N 3.47Å; F64-L211 HydrophobicContact CB-CD1 3.91Å; F64-L211 HydrophobicContact CD1-CD1 3.43Å; F64-L211 VanDerWaalsContact CD1-CD1 3.43Å; F64-L211 HydrophobicContact CE1-CD1 4.35Å; F64-L211 HydrophobicContact CG-CD1 4.08Å |
| 65 | N | 90.4 | Very high | 88.4 | Confident | 9 Ų | 9 | 25.3 Ų | 25.3 | 5% | 0.048 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.9 | -47.8 | 175.1 | -76.6 | -11.2 | 0 | 0 | 0 | 111.7 | M61 V63 N68 A69 L203 G204 S207 I284 | M61-N65 WeakPolarHBondContact O-CB 3.34Å; M61-N65 VanDerWaalsContact O-CG 3.29Å; M61-N65 PolarHBondContact O-N 3.5Å; V63-N65 PolarHBondContact O-N 3.04Å; N65-N68 PolarHBondContact O-N 3.33Å; N65-A69 PolarHBondContact O-N 3.38Å; N65-A69 VanDerWaalsContact O-N 3.07Å; N65-L203 PolarHBondContact OD1-O 3.32Å; N65-G204 WeakPolarHBondContact OD1-CA 3.37Å; N65-G204 PolarHBondContact OD1-N 3.32Å; N65-G204 VanDerWaalsContact OD1-N 3.14Å; N65-S207 PolarHBondContact OD1-OG 3.12Å; N65-I284 HydrophobicContact CB-CD1 3.97Å; N65-I284 HydrophobicContact CB-CG1 4.4Å |
| 66 | L | 92.6 | Very high | 89.4 | Confident | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -71.2 | -38.1 | -178.4 | -172.5 | 63.5 | 0 | 0 | 0 | 111.6 | S62 V63 A69 I70 C277 V281 I284 M296 V299 A300 | S62-L66 WeakPolarHBondContact O-CB 3.27Å; S62-L66 PolarHBondContact O-N 3.19Å; V63-L66 PolarHBondContact O-N 2.94Å; L66-A69 WeakPolarHBondContact O-CB 3.41Å; L66-A69 PolarHBondContact O-N 3.44Å; L66-I70 HydrophobicContact CG-CD1 4.33Å; L66-I70 VanDerWaalsContact O-CG1 3.31Å; L66-I70 WeakPolarHBondContact O-CG1 3.16Å; L66-I70 PolarHBondContact O-N 3.5Å; L66-C277 HydrophobicContact CD1-CB 3.77Å; L66-V281 HydrophobicContact CD1-CG2 4.04Å; L66-I284 HydrophobicContact CB-CD1 3.91Å; L66-I284 HydrophobicContact CD1-CD1 3.98Å; L66-M296 HydrophobicContact CD2-CE 4.33Å; L66-V299 HydrophobicContact CB-CG1 4.35Å; L66-V299 HydrophobicContact CD2-CG1 3.99Å; L66-A300 HydrophobicContact CD2-CB 4.03Å |
| 67 | S | 93.8 | Very high | 89.7 | Confident | 3 Ų | 3 | 17 Ų | 17 | 2% | 0.021 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -59.8 | -43.1 | 171.5 | -72.8 | 0 | 0 | 0 | 0 | 112 | V63 A69 I70 M71 S303 M307 | V63-S67 WeakPolarHBondContact O-CB 3.49Å; V63-S67 PolarHBondContact O-N 3.23Å; V63-S67 PolarHBondContact O-OG 3.01Å; V63-S67 VanDerWaalsContact O-OG 3.06Å; S67-A69 VanDerWaalsContact C-N 3.31Å; S67-A69 PolarHBondContact O-N 2.84Å; S67-I70 PolarHBondContact O-N 2.89Å; S67-M71 VanDerWaalsContact O-CB 3.28Å; S67-M71 WeakPolarHBondContact O-CB 3.45Å; S67-M71 PolarHBondContact O-N 3.05Å; S67-S303 WeakPolarHBondContact OG-CA 3.25Å; S67-S303 WeakPolarHBondContact OG-CB 3.43Å; S67-M307 VanDerWaalsContact CB-CE 3.48Å; S67-M307 WeakPolarHBondContact OG-CE 3.36Å |
| 68 | N | 91.2 | Very high | 90.1 | Very high | 2 Ų | 2 | 15.9 Ų | 15.9 | 1% | 0.011 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65 | -36.2 | 176.6 | -170.4 | 55.1 | 0 | 0 | 0 | 112.1 | F64 N65 S210 L211 T355 | F64-N68 WeakPolarHBondContact O-CB 3.39Å; F64-N68 PolarHBondContact O-N 3.47Å; N65-N68 PolarHBondContact O-N 3.33Å; N68-S210 WeakPolarHBondContact OD1-CB 3.45Å; N68-S210 PolarHBondContact OD1-OG 3.34Å; N68-L211 HydrophobicContact CB-CG 4.49Å; N68-T355 PolarHBondContact ND2-OG1 3.47Å; N68-T355 PolarHBondContact OD1-OG1 3.36Å |
| 69 | A | 89.7 | Confident | 90.2 | Very high | 15 Ų | 15 | 14 Ų | 14 | 12% | 0.124 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -65.1 | -37.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | N65 L66 S67 E280 | N65-A69 PolarHBondContact O-N 3.38Å; N65-A69 VanDerWaalsContact O-N 3.07Å; L66-A69 WeakPolarHBondContact O-CB 3.41Å; L66-A69 PolarHBondContact O-N 3.44Å; S67-A69 VanDerWaalsContact C-N 3.31Å; S67-A69 PolarHBondContact O-N 2.84Å; A69-E280 HydrophobicContact CB-CB 4.15Å; A69-E280 HydrophobicContact CB-CG 3.73Å |
| 70 | I | 93.3 | Very high | 90.1 | Very high | 5 Ų | 5 | 11.3 Ų | 11.3 | 3% | 0.026 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -71.9 | -55.2 | 176.6 | -62 | 161.7 | 0 | 0 | 0 | 109.9 | L66 S67 G72 A274 F275 C277 I304 M307 Y311 | L66-I70 HydrophobicContact CG-CD1 4.33Å; L66-I70 VanDerWaalsContact O-CG1 3.31Å; L66-I70 WeakPolarHBondContact O-CG1 3.16Å; L66-I70 PolarHBondContact O-N 3.5Å; S67-I70 PolarHBondContact O-N 2.89Å; I70-G72 VanDerWaalsContact C-N 3.32Å; I70-G72 PolarHBondContact O-N 3.43Å; I70-A274 WeakPolarHBondContact CG2-O 3.42Å; I70-A274 VanDerWaalsContact O-O 3.08Å; I70-F275 HydrophobicContact CG2-CD1 4.11Å; I70-C277 HydrophobicContact CD1-CB 4.35Å; I70-C277 HydrophobicContact CG1-CB 3.48Å; I70-C277 VanDerWaalsContact CG1-CB 3.48Å; I70-I304 HydrophobicContact CD1-CG1 3.82Å; I70-M307 HydrophobicContact CB-CB 4.47Å; I70-M307 HydrophobicContact CB-CG 3.67Å; I70-M307 HydrophobicContact CD1-CG 4.24Å; I70-M307 HydrophobicContact CG2-CB 3.74Å; I70-M307 HydrophobicContact CG2-CG 3.47Å; I70-M307 VanDerWaalsContact CG2-CG 3.47Å; I70-Y311 HydrophobicContact CG2-CE2 4.17Å; I70-Y311 PolarHBondContact O-OH 3.03Å |
| 71 | M | 89.1 | Confident | 90.2 | Very high | 1 Ų | 1 | 9.8 Ų | 9.8 | 1% | 0.005 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -44.8 | -52.6 | -170.9 | 177.8 | 179.4 | -92.9 | 0 | 0 | 113.6 | S67 L211 M214 M307 M310 Y311 | S67-M71 VanDerWaalsContact O-CB 3.28Å; S67-M71 WeakPolarHBondContact O-CB 3.45Å; S67-M71 PolarHBondContact O-N 3.05Å; M71-L211 HydrophobicContact CB-CD2 4.45Å; M71-L211 HydrophobicContact CE-CD2 3.32Å; M71-L211 HydrophobicContact CE-CG 4.48Å; M71-L211 HydrophobicContact SD-CD2 3.66Å; M71-M214 HydrophobicContact CE-CB 3.32Å; M71-M214 HydrophobicContact CE-CG 4.14Å; M71-M214 HydrophobicContact CG-CB 4.36Å; M71-M214 HydrophobicContact CG-CG 4.27Å; M71-M214 HydrophobicContact SD-CB 3.16Å; M71-M214 WeakPolarHBondContact SD-CB 3.19Å; M71-M214 HydrophobicContact SD-CG 3.26Å; M71-M214 WeakPolarHBondContact SD-CG 3.41Å; M71-M214 HydrophobicContact SD-SD 4.38Å; M71-M307 HydrophobicContact CB-SD 3.8Å; M71-M307 HydrophobicContact CE-SD 4.26Å; M71-M310 HydrophobicContact CE-CE 3.13Å; M71-M310 HydrophobicContact CE-SD 3.87Å; M71-Y311 WeakPolarHBondContact CA-OH 3.45Å; M71-Y311 PolarHBondContact N-OH 2.69Å; M71-Y311 PolarHBondContact O-OH 2.99Å |
| 72 | G | 80.9 | Confident | 90.3 | Very high | 7 Ų | 7 | 8 Ų | 8 | 7% | 0.072 | 4% | 0.043 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 33 | -152.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | I70 G74 Y151 | I70-G72 VanDerWaalsContact C-N 3.32Å; I70-G72 PolarHBondContact O-N 3.43Å; G72-G74 VanDerWaalsContact C-N 3.33Å; G72-Y151 WeakPolarHBondContact CA-OH 3.19Å |
| 73 | S | 85 | Confident | 90.2 | Very high | 1 Ų | 1 | 8.5 Ų | 8.5 | 1% | 0.007 | 5% | 0.047 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86 | -13.1 | 177.7 | 54 | 0 | 0 | 0 | 0 | 111.6 | I75 L76 S150 F407 | S73-I75 PolarHBondContact O-N 2.88Å; S73-L76 PolarHBondContact O-N 3.39Å; S73-S150 WeakPolarHBondContact OG-CB 3.29Å; S73-S150 PolarHBondContact OG-OG 3.08Å; S73-F407 WeakPolarHBondContact O-CZ 3.5Å; S73-F407 WeakPolarHBondContact OG-CE1 3.42Å |
| 74 | G | 84.9 | Confident | 90 | Very high | 1 Ų | 1 | 9 Ų | 9 | 1% | 0.01 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -59.8 | -32.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | G72 L76 G77 L78 | G72-G74 VanDerWaalsContact C-N 3.33Å; G74-L76 PolarHBondContact O-N 2.97Å; G74-L76 VanDerWaalsContact O-N 3.17Å; G74-G77 PolarHBondContact O-N 3.44Å; G74-L78 WeakPolarHBondContact O-CG 3.47Å; G74-L78 PolarHBondContact O-N 3.46Å |
| 75 | I | 90.7 | Very high | 89.9 | Confident | 3 Ų | 3 | 4.6 Ų | 4.6 | 2% | 0.015 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -53.6 | -35.8 | 177.8 | -166.3 | 170.4 | 0 | 0 | 0 | 113.4 | S73 G77 L78 M214 F217 Y311 T314 | S73-I75 PolarHBondContact O-N 2.88Å; I75-G77 VanDerWaalsContact C-N 3.3Å; I75-G77 PolarHBondContact O-N 2.72Å; I75-L78 PolarHBondContact O-N 2.92Å; I75-M214 HydrophobicContact CG2-SD 4.34Å; I75-F217 HydrophobicContact CD1-CD1 4.48Å; I75-F217 HydrophobicContact CD1-CE1 4.33Å; I75-F217 HydrophobicContact CG1-CE1 4.38Å; I75-Y311 HydrophobicContact CB-CD1 4.11Å; I75-Y311 HydrophobicContact CB-CE1 3.79Å; I75-Y311 HydrophobicContact CD1-CD1 3.97Å; I75-Y311 HydrophobicContact CD1-CE1 4.12Å; I75-Y311 HydrophobicContact CG1-CD1 3.83Å; I75-Y311 HydrophobicContact CG1-CE1 4Å; I75-T314 HydrophobicContact CD1-CG2 4.3Å; I75-T314 HydrophobicContact CG1-CG2 4.05Å |
| 76 | L | 88.8 | Confident | 89.9 | Confident | 2 Ų | 2 | 4.1 Ų | 4.1 | 1% | 0.01 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -71.9 | -24.7 | -178.1 | -59.3 | -173.4 | 0 | 0 | 0 | 113.1 | S73 G74 I154 F217 M330 L331 V348 | S73-L76 PolarHBondContact O-N 3.39Å; G74-L76 PolarHBondContact O-N 2.97Å; G74-L76 VanDerWaalsContact O-N 3.17Å; L76-I154 HydrophobicContact CD1-CD1 3.49Å; L76-I154 VanDerWaalsContact CD1-CD1 3.49Å; L76-I154 HydrophobicContact CD1-CG1 3.87Å; L76-I154 HydrophobicContact CD1-CG2 4.37Å; L76-F217 HydrophobicContact CD2-CE1 3.7Å; L76-F217 HydrophobicContact CD2-CE2 4.29Å; L76-F217 HydrophobicContact CD2-CZ 3.49Å; L76-F217 VanDerWaalsContact CD2-CZ 3.49Å; L76-M330 PolarHBondContact O-N 3.43Å; L76-L331 HydrophobicContact CD1-CD1 4.38Å; L76-L331 HydrophobicContact CD2-CD1 3.49Å; L76-L331 VanDerWaalsContact CD2-CD1 3.49Å; L76-V348 HydrophobicContact CD1-CG1 4.29Å |
| 77 | G | 88.7 | Confident | 89.9 | Confident | 1 Ų | 1 | 5.2 Ų | 5.2 | 1% | 0.01 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -92.4 | -4.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | G74 I75 Y80 A81 A328 | G74-G77 PolarHBondContact O-N 3.44Å; I75-G77 VanDerWaalsContact C-N 3.3Å; I75-G77 PolarHBondContact O-N 2.72Å; G77-Y80 WeakPolarHBondContact O-CB 3.27Å; G77-Y80 PolarHBondContact O-N 3.49Å; G77-A81 PolarHBondContact O-N 2.94Å; G77-A81 VanDerWaalsContact O-N 3.1Å; G77-A328 WeakPolarHBondContact CA-O 3.31Å |
| 78 | L | 92.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -75.3 | -30.9 | -175.5 | -70.2 | -178.3 | 0 | 0 | 0 | 113.6 | G74 I75 Y80 A81 M82 F90 I270 M271 A274 Y311 A315 | G74-L78 WeakPolarHBondContact O-CG 3.47Å; G74-L78 PolarHBondContact O-N 3.46Å; I75-L78 PolarHBondContact O-N 2.92Å; L78-Y80 VanDerWaalsContact C-N 3.34Å; L78-A81 WeakPolarHBondContact O-CB 3.06Å; L78-A81 PolarHBondContact O-N 2.86Å; L78-M82 PolarHBondContact O-N 2.82Å; L78-F90 HydrophobicContact CB-CZ 4.05Å; L78-F90 HydrophobicContact CD2-CE2 4.34Å; L78-F90 HydrophobicContact CD2-CZ 4.18Å; L78-F90 WeakPolarHBondContact O-CE2 3.43Å; L78-I270 HydrophobicContact CD2-CG2 4.33Å; L78-M271 HydrophobicContact CD2-CG 4.09Å; L78-A274 HydrophobicContact CD2-CB 4.26Å; L78-Y311 VanDerWaalsContact CD1-CB 3.44Å; L78-Y311 HydrophobicContact CD1-CD1 3.77Å; L78-Y311 HydrophobicContact CD1-CD2 3.68Å; L78-Y311 HydrophobicContact CD1-CE1 4.39Å; L78-Y311 HydrophobicContact CD1-CE2 4.31Å; L78-Y311 HydrophobicContact CD1-CG 3.35Å; L78-A315 HydrophobicContact CB-CB 3.89Å |
| 79 | A | 92.8 | Very high | 89.9 | Confident | 1 Ų | 1 | 12.9 Ų | 12.9 | 1% | 0.008 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65.4 | -40.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | M82 A83 V326 M330 | A79-M82 PolarHBondContact O-N 3.28Å; A79-A83 PolarHBondContact O-N 2.77Å; A79-V326 HydrophobicContact CB-CG1 3.87Å; A79-M330 HydrophobicContact CB-CG 4.34Å; A79-M330 HydrophobicContact CB-SD 3.74Å |
| 80 | Y | 90.9 | Very high | 90.1 | Very high | 8 Ų | 8 | 12.1 Ų | 12.1 | 3% | 0.031 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -59.5 | -47.1 | 172 | 173.2 | -93 | 0 | 0 | 0 | 111.4 | G77 L78 M82 A83 H84 I270 V326 A328 R404 | G77-Y80 WeakPolarHBondContact O-CB 3.27Å; G77-Y80 PolarHBondContact O-N 3.49Å; L78-Y80 VanDerWaalsContact C-N 3.34Å; Y80-M82 VanDerWaalsContact C-N 3.3Å; Y80-M82 PolarHBondContact O-N 3.36Å; Y80-A83 WeakPolarHBondContact O-CB 3.44Å; Y80-A83 PolarHBondContact O-N 3.3Å; Y80-A83 VanDerWaalsContact O-N 3.15Å; Y80-H84 AromaticContact CD2-NE2 3.89Å; Y80-H84 AromaticContact CE1-CD2 3.87Å; Y80-H84 AromaticContact CE2-CD2 3.64Å; Y80-H84 AromaticContact CE2-NE2 3.26Å; Y80-H84 VanDerWaalsContact CE2-NE2 3.26Å; Y80-H84 WeakPolarHBondContact CE2-NE2 3.2Å; Y80-H84 AromaticContact CZ-CD2 3.55Å; Y80-H84 AromaticContact CZ-NE2 3.46Å; Y80-H84 PolarHBondContact O-CD2 2.82Å; Y80-H84 PolarHBondContact O-N 3.49Å; Y80-I270 HydrophobicContact CD1-CD1 3.88Å; Y80-I270 HydrophobicContact CE1-CD1 4.13Å; Y80-V326 WeakPolarHBondContact CD2-O 3.18Å; Y80-A328 HydrophobicContact CD2-CB 4.34Å; Y80-A328 HydrophobicContact CG-CB 4.44Å; Y80-R404 HydrophobicContact CE1-CG 4.43Å; Y80-R404 VanDerWaalsContact OH-CD 3.24Å; Y80-R404 WeakPolarHBondContact OH-CD 3.41Å; Y80-R404 PolarHBondContact OH-NH1 3.21Å |
| 81 | A | 91.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -56.9 | -42.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G77 L78 H84 T85 F90 T267 M271 | G77-A81 PolarHBondContact O-N 2.94Å; G77-A81 VanDerWaalsContact O-N 3.1Å; L78-A81 WeakPolarHBondContact O-CB 3.06Å; L78-A81 PolarHBondContact O-N 2.86Å; A81-H84 PolarHBondContact O-N 3.28Å; A81-T85 PolarHBondContact O-N 3.27Å; A81-T85 PolarHBondContact O-OG1 2.94Å; A81-F90 HydrophobicContact CB-CD2 4.19Å; A81-F90 HydrophobicContact CB-CE2 3.76Å; A81-T267 HydrophobicContact CB-CG2 3.56Å; A81-M271 HydrophobicContact CB-CG 4.46Å |
| 82 | M | 92.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -65.2 | -39.4 | 176.1 | -174.5 | 178.2 | -71.4 | 0 | 0 | 112.3 | L78 A79 Y80 H84 T85 G86 V87 F90 A315 Y319 | L78-M82 PolarHBondContact O-N 2.82Å; A79-M82 PolarHBondContact O-N 3.28Å; Y80-M82 VanDerWaalsContact C-N 3.3Å; Y80-M82 PolarHBondContact O-N 3.36Å; M82-H84 PolarHBondContact O-N 3.5Å; M82-T85 PolarHBondContact O-N 3.44Å; M82-G86 WeakPolarHBondContact O-CA 3.48Å; M82-G86 PolarHBondContact O-N 2.91Å; M82-V87 HydrophobicContact SD-CB 4.49Å; M82-V87 HydrophobicContact SD-CG1 4.45Å; M82-V87 HydrophobicContact SD-CG2 4.08Å; M82-F90 HydrophobicContact CB-CB 4.21Å; M82-F90 HydrophobicContact CB-CD1 4.24Å; M82-F90 HydrophobicContact CB-CD2 3.85Å; M82-F90 HydrophobicContact CB-CE2 4.27Å; M82-F90 HydrophobicContact CB-CG 3.82Å; M82-F90 HydrophobicContact CE-CB 4.25Å; M82-F90 HydrophobicContact CE-CD1 3.13Å; M82-F90 HydrophobicContact CE-CE1 3.54Å; M82-F90 HydrophobicContact CE-CG 3.81Å; M82-F90 HydrophobicContact CE-CZ 4.49Å; M82-F90 HydrophobicContact CG-CB 4Å; M82-F90 HydrophobicContact CG-CD1 4.33Å; M82-F90 HydrophobicContact CG-CG 4.03Å; M82-A315 HydrophobicContact CE-CB 3.77Å; M82-Y319 HydrophobicContact CB-CG 4.39Å; M82-Y319 HydrophobicContact CG-CD1 4.03Å; M82-Y319 HydrophobicContact CG-CD2 4.48Å; M82-Y319 HydrophobicContact CG-CG 3.88Å; M82-Y319 VanDerWaalsContact SD-CB 3.54Å; M82-Y319 HydrophobicContact SD-CD1 3.69Å; M82-Y319 HydrophobicContact SD-CG 3.81Å |
| 83 | A | 89.5 | Confident | 91.1 | Very high | 9 Ų | 9 | 18.5 Ų | 18.5 | 7% | 0.074 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -58 | -33.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | A79 Y80 Y319 V326 | A79-A83 PolarHBondContact O-N 2.77Å; Y80-A83 WeakPolarHBondContact O-CB 3.44Å; Y80-A83 PolarHBondContact O-N 3.3Å; Y80-A83 VanDerWaalsContact O-N 3.15Å; A83-Y319 HydrophobicContact CB-CD2 3.79Å; A83-Y319 HydrophobicContact CB-CE2 3.97Å; A83-V326 HydrophobicContact CB-CB 4.11Å; A83-V326 HydrophobicContact CB-CG2 4.26Å |
| 84 | H | 88.5 | Confident | 91.6 | Very high | 28 Ų | 28 | 18.4 Ų | 18.4 | 13% | 0.13 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -96.5 | -5 | -179.5 | -66.4 | -72.8 | 0 | 0 | 0 | 115 | Y80 A81 M82 D261 Q263 | Y80-H84 AromaticContact CD2-NE2 3.89Å; Y80-H84 AromaticContact CE1-CD2 3.87Å; Y80-H84 AromaticContact CE2-CD2 3.64Å; Y80-H84 AromaticContact CE2-NE2 3.26Å; Y80-H84 VanDerWaalsContact CE2-NE2 3.26Å; Y80-H84 WeakPolarHBondContact CE2-NE2 3.2Å; Y80-H84 AromaticContact CZ-CD2 3.55Å; Y80-H84 AromaticContact CZ-NE2 3.46Å; Y80-H84 PolarHBondContact O-CD2 2.82Å; Y80-H84 PolarHBondContact O-N 3.49Å; A81-H84 PolarHBondContact O-N 3.28Å; M82-H84 PolarHBondContact O-N 3.5Å; H84-D261 HydrophobicContact CB-CB 4.49Å; H84-D261 IonicContact CE1-OD2 2.85Å; H84-D261 PolarHBondContact CE1-OD2 3.27Å; H84-D261 IonicContact ND1-OD2 2.73Å; H84-D261 PolarHBondContact ND1-OD2 3.44Å; H84-Q263 HydrophobicContact CB-CB 4.4Å |
| 85 | T | 89.9 | Confident | 92.2 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -115.2 | -22.7 | 177.7 | 45.8 | 0 | 0 | 0 | 0 | 113.6 | A81 M82 F89 F90 L93 T259 M264 T267 | A81-T85 PolarHBondContact O-N 3.27Å; A81-T85 PolarHBondContact O-OG1 2.94Å; M82-T85 PolarHBondContact O-N 3.44Å; T85-F89 HydrophobicContact CG2-CD1 4.01Å; T85-F89 HydrophobicContact CG2-CE1 4.28Å; T85-F89 WeakPolarHBondContact O-CB 3.36Å; T85-F90 WeakPolarHBondContact OG1-CB 3.24Å; T85-L93 HydrophobicContact CG2-CD1 4.42Å; T85-T259 CarbonylContact C-O 3.58Å; T85-T259 WeakPolarHBondContact CA-O 3.19Å; T85-T259 PolarHBondContact O-N 3.2Å; T85-M264 HydrophobicContact CG2-CG 3.98Å; T85-M264 HydrophobicContact CG2-SD 4.48Å; T85-T267 HydrophobicContact CG2-CG2 3.38Å |
| 86 | G | 90.5 | Very high | 92.4 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 14% | 0.141 | C | C | . | . | trans | 81.1 | 158 | -170.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | M82 I88 F90 K256 L257 | M82-G86 WeakPolarHBondContact O-CA 3.48Å; M82-G86 PolarHBondContact O-N 2.91Å; G86-I88 PolarHBondContact O-N 3.49Å; G86-F90 WeakPolarHBondContact O-CB 3.46Å; G86-F90 PolarHBondContact O-N 3Å; G86-K256 CarbonylContact C-O 3.55Å; G86-K256 WeakPolarHBondContact CA-O 3.36Å; G86-L257 CarbonylContact C-O 3.51Å | ||
| 87 | V | 92.1 | Very high | 92.7 | Very high | 22 Ų | 22 | 25.3 Ų | 25.3 | 13% | 0.133 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.1 | -48.8 | -167.1 | -177.4 | 0 | 0 | 0 | 0 | 112.8 | M82 L91 K256 L257 Y319 | M82-V87 HydrophobicContact SD-CB 4.49Å; M82-V87 HydrophobicContact SD-CG1 4.45Å; M82-V87 HydrophobicContact SD-CG2 4.08Å; V87-L91 HydrophobicContact CG1-CD1 4.14Å; V87-L91 WeakPolarHBondContact O-CG 3.26Å; V87-L91 PolarHBondContact O-N 3.38Å; V87-L91 VanDerWaalsContact O-N 3.09Å; V87-K256 PolarHBondContact N-O 3.25Å; V87-L257 PolarHBondContact N-O 3.36Å; V87-Y319 HydrophobicContact CG2-CD1 3.76Å; V87-Y319 HydrophobicContact CG2-CE1 3.53Å |
| 88 | I | 93 | Very high | 93.1 | Very high | 104 Ų | 104 | 25.6 Ų | 25.6 | 53% | 0.533 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -68.8 | -47.4 | -174.3 | -62.8 | -178.8 | 0 | 0 | 0 | 110.1 | G86 L91 A92 L257 | G86-I88 PolarHBondContact O-N 3.49Å; I88-L91 PolarHBondContact O-N 3.49Å; I88-A92 WeakPolarHBondContact O-CB 3.31Å; I88-A92 PolarHBondContact O-N 2.99Å; I88-L257 HydrophobicContact CD1-CB 3.98Å; I88-L257 HydrophobicContact CD1-CD1 4.19Å; I88-L257 HydrophobicContact CD1-CD2 3.99Å; I88-L257 HydrophobicContact CD1-CG 4.28Å; I88-L257 HydrophobicContact CG1-CB 4.23Å; I88-L257 HydrophobicContact CG1-CD2 4.03Å; I88-L257 PolarHBondContact N-O 2.86Å; I88-L257 VanDerWaalsContact N-O 3.16Å |
| 89 | F | 92.1 | Very high | 93.3 | Very high | 62 Ų | 62 | 30.9 Ų | 30.9 | 27% | 0.272 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -65.8 | -40.4 | -178.5 | -171.5 | -128.5 | 0 | 0 | 0 | 111.6 | T85 A92 L93 F258 M264 | T85-F89 HydrophobicContact CG2-CD1 4.01Å; T85-F89 HydrophobicContact CG2-CE1 4.28Å; T85-F89 WeakPolarHBondContact O-CB 3.36Å; F89-A92 PolarHBondContact O-N 3.29Å; F89-L93 HydrophobicContact CD1-CD1 3.85Å; F89-L93 HydrophobicContact CD2-CD1 4.45Å; F89-L93 HydrophobicContact CD2-CG 4.33Å; F89-L93 HydrophobicContact CE1-CD1 3.51Å; F89-L93 HydrophobicContact CE1-CG 4.31Å; F89-L93 HydrophobicContact CE2-CD1 4.16Å; F89-L93 HydrophobicContact CE2-CD2 4.26Å; F89-L93 HydrophobicContact CE2-CG 4.05Å; F89-L93 HydrophobicContact CG-CD1 4.3Å; F89-L93 HydrophobicContact CZ-CD1 3.68Å; F89-L93 HydrophobicContact CZ-CD2 4.18Å; F89-L93 HydrophobicContact CZ-CG 4.04Å; F89-L93 WeakPolarHBondContact O-CB 3.3Å; F89-L93 WeakPolarHBondContact O-CG 3.43Å; F89-L93 PolarHBondContact O-N 3.16Å; F89-F258 HydrophobicContact CB-CD2 3.92Å; F89-F258 HydrophobicContact CB-CE2 4.24Å; F89-F258 HydrophobicContact CD1-CE2 4.31Å; F89-F258 HydrophobicContact CD2-CE2 4.1Å; F89-F258 HydrophobicContact CG-CD2 4.17Å; F89-F258 AromaticContact CG-CE2 3.98Å; F89-F258 HydrophobicContact CG-CE2 3.98Å; F89-M264 HydrophobicContact CE1-SD 3.97Å |
| 90 | F | 94.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -57.2 | -51.8 | 173.2 | 178.3 | -91.7 | 0 | 0 | 0 | 112.2 | L78 A81 M82 T85 G86 A92 L93 L94 M271 A315 | L78-F90 HydrophobicContact CB-CZ 4.05Å; L78-F90 HydrophobicContact CD2-CE2 4.34Å; L78-F90 HydrophobicContact CD2-CZ 4.18Å; L78-F90 WeakPolarHBondContact O-CE2 3.43Å; A81-F90 HydrophobicContact CB-CD2 4.19Å; A81-F90 HydrophobicContact CB-CE2 3.76Å; M82-F90 HydrophobicContact CB-CB 4.21Å; M82-F90 HydrophobicContact CB-CD1 4.24Å; M82-F90 HydrophobicContact CB-CD2 3.85Å; M82-F90 HydrophobicContact CB-CE2 4.27Å; M82-F90 HydrophobicContact CB-CG 3.82Å; M82-F90 HydrophobicContact CE-CB 4.25Å; M82-F90 HydrophobicContact CE-CD1 3.13Å; M82-F90 HydrophobicContact CE-CE1 3.54Å; M82-F90 HydrophobicContact CE-CG 3.81Å; M82-F90 HydrophobicContact CE-CZ 4.49Å; M82-F90 HydrophobicContact CG-CB 4Å; M82-F90 HydrophobicContact CG-CD1 4.33Å; M82-F90 HydrophobicContact CG-CG 4.03Å; T85-F90 WeakPolarHBondContact OG1-CB 3.24Å; G86-F90 WeakPolarHBondContact O-CB 3.46Å; G86-F90 PolarHBondContact O-N 3Å; F90-A92 VanDerWaalsContact C-N 3.31Å; F90-A92 PolarHBondContact O-N 2.96Å; F90-L93 PolarHBondContact O-N 3.15Å; F90-L94 HydrophobicContact CE1-CB 4.37Å; F90-L94 HydrophobicContact CE1-CD1 4.24Å; F90-L94 HydrophobicContact CE1-CD2 4.03Å; F90-L94 HydrophobicContact CE1-CG 4.46Å; F90-L94 HydrophobicContact CZ-CD1 3.97Å; F90-L94 VanDerWaalsContact O-CB 3.32Å; F90-L94 WeakPolarHBondContact O-CB 3.19Å; F90-L94 PolarHBondContact O-N 2.79Å; F90-M271 HydrophobicContact CD2-CE 4.09Å; F90-M271 HydrophobicContact CD2-SD 4.05Å; F90-M271 HydrophobicContact CE2-CE 3.97Å; F90-M271 HydrophobicContact CE2-CG 4.18Å; F90-M271 HydrophobicContact CE2-SD 3.98Å; F90-M271 HydrophobicContact CZ-CE 4.42Å; F90-A315 HydrophobicContact CD1-CB 4.49Å; F90-A315 HydrophobicContact CE1-CB 3.56Å; F90-A315 HydrophobicContact CZ-CB 3.62Å |
| 91 | L | 95.8 | Very high | 93.6 | Very high | 59 Ų | 59 | 32.3 Ų | 32.3 | 31% | 0.309 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -63.9 | -37.9 | -178 | -70.8 | 174.2 | 0 | 0 | 0 | 111.9 | V87 I88 L94 L95 | V87-L91 HydrophobicContact CG1-CD1 4.14Å; V87-L91 WeakPolarHBondContact O-CG 3.26Å; V87-L91 PolarHBondContact O-N 3.38Å; V87-L91 VanDerWaalsContact O-N 3.09Å; I88-L91 PolarHBondContact O-N 3.49Å; L91-L94 PolarHBondContact O-N 2.88Å; L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 PolarHBondContact O-N 3.44Å |
| 92 | A | 95.1 | Very high | 93.8 | Very high | 55 Ų | 55 | 33.5 Ų | 33.5 | 46% | 0.455 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -63.5 | -45.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I88 F89 F90 L95 C96 | I88-A92 WeakPolarHBondContact O-CB 3.31Å; I88-A92 PolarHBondContact O-N 2.99Å; F89-A92 PolarHBondContact O-N 3.29Å; F90-A92 VanDerWaalsContact C-N 3.31Å; F90-A92 PolarHBondContact O-N 2.96Å; A92-L95 PolarHBondContact O-N 2.89Å; A92-C96 VanDerWaalsContact O-CB 3.31Å; A92-C96 WeakPolarHBondContact O-CB 3.32Å; A92-C96 PolarHBondContact O-N 3.35Å |
| 93 | L | 93.9 | Very high | 94 | Very high | 32 Ų | 32 | 36.6 Ų | 36.6 | 17% | 0.168 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.1 | -39.8 | 175.3 | -75 | 175.5 | 0 | 0 | 0 | 112 | T85 F89 F90 C96 I97 V268 M271 | T85-L93 HydrophobicContact CG2-CD1 4.42Å; F89-L93 HydrophobicContact CD1-CD1 3.85Å; F89-L93 HydrophobicContact CD2-CD1 4.45Å; F89-L93 HydrophobicContact CD2-CG 4.33Å; F89-L93 HydrophobicContact CE1-CD1 3.51Å; F89-L93 HydrophobicContact CE1-CG 4.31Å; F89-L93 HydrophobicContact CE2-CD1 4.16Å; F89-L93 HydrophobicContact CE2-CD2 4.26Å; F89-L93 HydrophobicContact CE2-CG 4.05Å; F89-L93 HydrophobicContact CG-CD1 4.3Å; F89-L93 HydrophobicContact CZ-CD1 3.68Å; F89-L93 HydrophobicContact CZ-CD2 4.18Å; F89-L93 HydrophobicContact CZ-CG 4.04Å; F89-L93 WeakPolarHBondContact O-CB 3.3Å; F89-L93 WeakPolarHBondContact O-CG 3.43Å; F89-L93 PolarHBondContact O-N 3.16Å; F90-L93 PolarHBondContact O-N 3.15Å; L93-C96 WeakPolarHBondContact O-CB 3.45Å; L93-C96 PolarHBondContact O-N 2.9Å; L93-I97 WeakPolarHBondContact O-CG1 3.29Å; L93-I97 PolarHBondContact O-N 3.48Å; L93-V268 HydrophobicContact CD1-CG2 4.45Å; L93-M271 HydrophobicContact CB-CE 3.6Å; L93-M271 HydrophobicContact CB-SD 4.11Å |
| 94 | L | 95.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.9 | -45 | 179.8 | -166.2 | 79.9 | 0 | 0 | 0 | 110.2 | F90 L91 A98 M271 F275 F308 | F90-L94 HydrophobicContact CE1-CB 4.37Å; F90-L94 HydrophobicContact CE1-CD1 4.24Å; F90-L94 HydrophobicContact CE1-CD2 4.03Å; F90-L94 HydrophobicContact CE1-CG 4.46Å; F90-L94 HydrophobicContact CZ-CD1 3.97Å; F90-L94 VanDerWaalsContact O-CB 3.32Å; F90-L94 WeakPolarHBondContact O-CB 3.19Å; F90-L94 PolarHBondContact O-N 2.79Å; L91-L94 PolarHBondContact O-N 2.88Å; L94-A98 VanDerWaalsContact O-CB 3.31Å; L94-A98 WeakPolarHBondContact O-CB 3.32Å; L94-A98 PolarHBondContact O-N 2.92Å; L94-M271 HydrophobicContact CB-CE 3.62Å; L94-M271 HydrophobicContact CD1-CE 3.76Å; L94-M271 HydrophobicContact CG-CE 4.33Å; L94-F275 HydrophobicContact CD1-CE2 3.54Å; L94-F275 HydrophobicContact CD1-CZ 4.21Å; L94-F275 HydrophobicContact CG-CE2 3.93Å; L94-F275 HydrophobicContact CG-CZ 4.26Å; L94-F308 HydrophobicContact CB-CD2 4.48Å; L94-F308 HydrophobicContact CB-CE2 4.21Å; L94-F308 HydrophobicContact CD2-CD2 3.77Å; L94-F308 HydrophobicContact CD2-CE2 3.88Å; L94-F308 HydrophobicContact CG-CD2 3.93Å; L94-F308 HydrophobicContact CG-CE2 4.11Å |
| 95 | L | 96.8 | Very high | 94.7 | Very high | 80 Ų | 80 | 34.8 Ų | 34.8 | 42% | 0.419 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -63.9 | -44.2 | 175.4 | -179.7 | 62 | 0 | 0 | 0 | 111.1 | L91 A92 A98 L99 F308 | L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 PolarHBondContact O-N 3.44Å; A92-L95 PolarHBondContact O-N 2.89Å; L95-A98 PolarHBondContact O-N 3.41Å; L95-L99 HydrophobicContact CD1-CD1 4.21Å; L95-L99 HydrophobicContact CD1-CG 4.2Å; L95-L99 HydrophobicContact CG-CD1 4.07Å; L95-L99 HydrophobicContact CG-CG 4.46Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.35Å; L95-L99 PolarHBondContact O-N 3.33Å; L95-F308 HydrophobicContact CB-CE2 3.76Å; L95-F308 HydrophobicContact CB-CZ 4.1Å; L95-F308 HydrophobicContact CD1-CE1 4.48Å; L95-F308 HydrophobicContact CD1-CE2 4.14Å; L95-F308 HydrophobicContact CD1-CZ 4.04Å |
| 96 | C | 95.8 | Very high | 94.9 | Very high | 60 Ų | 60 | 38.6 Ų | 38.6 | 41% | 0.405 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -57.4 | -52.6 | 177.7 | -173.5 | 0 | 0 | 0 | 0 | 111.4 | A92 L93 A98 L99 L100 | A92-C96 VanDerWaalsContact O-CB 3.31Å; A92-C96 WeakPolarHBondContact O-CB 3.32Å; A92-C96 PolarHBondContact O-N 3.35Å; L93-C96 WeakPolarHBondContact O-CB 3.45Å; L93-C96 PolarHBondContact O-N 2.9Å; C96-A98 VanDerWaalsContact C-N 3.34Å; C96-A98 PolarHBondContact O-N 3.07Å; C96-L99 PolarHBondContact O-N 2.96Å; C96-L100 WeakPolarHBondContact O-CB 3.38Å; C96-L100 WeakPolarHBondContact O-CD1 3.36Å; C96-L100 WeakPolarHBondContact O-CG 3.45Å; C96-L100 PolarHBondContact O-N 2.9Å; C96-L100 VanDerWaalsContact SG-CD1 3.56Å |
| 97 | I | 94.9 | Very high | 95.1 | Very high | 11 Ų | 11 | 38.7 Ų | 38.7 | 6% | 0.056 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.5 | -39 | 179.4 | -67.2 | 170.8 | 0 | 0 | 0 | 111.3 | L93 L100 S101 V268 M271 F275 | L93-I97 WeakPolarHBondContact O-CG1 3.29Å; L93-I97 PolarHBondContact O-N 3.48Å; I97-L100 PolarHBondContact O-N 3.46Å; I97-S101 VanDerWaalsContact O-CB 3.26Å; I97-S101 WeakPolarHBondContact O-CB 3.46Å; I97-S101 PolarHBondContact O-N 3.18Å; I97-V268 HydrophobicContact CD1-CG1 4.36Å; I97-M271 HydrophobicContact CD1-CB 3.56Å; I97-M271 HydrophobicContact CD1-CE 4.42Å; I97-F275 HydrophobicContact CB-CD2 4.38Å; I97-F275 HydrophobicContact CG2-CB 3.9Å; I97-F275 HydrophobicContact CG2-CD2 3.71Å; I97-F275 HydrophobicContact CG2-CG 4.12Å |
| 98 | A | 96.2 | Very high | 95.2 | Very high | 6 Ų | 6 | 37.7 Ų | 37.7 | 5% | 0.05 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.6 | -45.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L94 L95 C96 S101 S102 F275 I304 F308 | L94-A98 VanDerWaalsContact O-CB 3.31Å; L94-A98 WeakPolarHBondContact O-CB 3.32Å; L94-A98 PolarHBondContact O-N 2.92Å; L95-A98 PolarHBondContact O-N 3.41Å; C96-A98 VanDerWaalsContact C-N 3.34Å; C96-A98 PolarHBondContact O-N 3.07Å; A98-S101 PolarHBondContact O-N 3.29Å; A98-S102 PolarHBondContact O-N 2.97Å; A98-F275 HydrophobicContact CB-CE1 3.98Å; A98-F275 HydrophobicContact CB-CE2 4.39Å; A98-F275 HydrophobicContact CB-CZ 3.88Å; A98-I304 HydrophobicContact CB-CG2 3.83Å; A98-F308 HydrophobicContact CB-CD2 4.31Å |
| 99 | L | 96.6 | Very high | 95.2 | Very high | 111 Ų | 111 | 32.7 Ų | 32.7 | 58% | 0.581 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -65.3 | -43.6 | 176.8 | -68.5 | 174.3 | 0 | 0 | 0 | 111.8 | L95 C96 S101 S102 Y103 | L95-L99 HydrophobicContact CD1-CD1 4.21Å; L95-L99 HydrophobicContact CD1-CG 4.2Å; L95-L99 HydrophobicContact CG-CD1 4.07Å; L95-L99 HydrophobicContact CG-CG 4.46Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.35Å; L95-L99 PolarHBondContact O-N 3.33Å; C96-L99 PolarHBondContact O-N 2.96Å; L99-S101 VanDerWaalsContact C-N 3.34Å; L99-S101 PolarHBondContact O-N 2.92Å; L99-S102 PolarHBondContact O-N 3.47Å; L99-Y103 PolarHBondContact O-N 3.4Å |
| 100 | L | 95.6 | Very high | 95.2 | Very high | 40 Ų | 40 | 30.9 Ų | 30.9 | 21% | 0.209 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63.3 | -39.7 | 176.9 | -68.4 | 166.8 | 0 | 0 | 0 | 111.6 | C96 I97 Y103 S104 F420 F449 | C96-L100 WeakPolarHBondContact O-CB 3.38Å; C96-L100 WeakPolarHBondContact O-CD1 3.36Å; C96-L100 WeakPolarHBondContact O-CG 3.45Å; C96-L100 PolarHBondContact O-N 2.9Å; C96-L100 VanDerWaalsContact SG-CD1 3.56Å; I97-L100 PolarHBondContact O-N 3.46Å; L100-Y103 PolarHBondContact O-N 3.24Å; L100-S104 WeakPolarHBondContact O-CB 3.16Å; L100-S104 PolarHBondContact O-N 3.45Å; L100-F420 HydrophobicContact CB-CE1 4.22Å; L100-F420 HydrophobicContact CB-CZ 4.41Å; L100-F420 HydrophobicContact CD1-CE1 3.94Å; L100-F420 HydrophobicContact CD1-CZ 4.15Å; L100-F420 HydrophobicContact CG-CE1 4.46Å; L100-F449 HydrophobicContact CB-CE2 3.96Å; L100-F449 HydrophobicContact CB-CZ 4.43Å; L100-F449 HydrophobicContact CD2-CD2 4.04Å; L100-F449 HydrophobicContact CD2-CE2 3.6Å; L100-F449 HydrophobicContact CG-CE2 4.3Å |
| 101 | S | 95.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64.6 | -43.3 | 175 | -170.8 | 0 | 0 | 0 | 0 | 111.8 | I97 A98 L99 Y103 S104 I105 F275 H278 | I97-S101 VanDerWaalsContact O-CB 3.26Å; I97-S101 WeakPolarHBondContact O-CB 3.46Å; I97-S101 PolarHBondContact O-N 3.18Å; A98-S101 PolarHBondContact O-N 3.29Å; L99-S101 VanDerWaalsContact C-N 3.34Å; L99-S101 PolarHBondContact O-N 2.92Å; S101-Y103 PolarHBondContact O-N 2.96Å; S101-S104 WeakPolarHBondContact O-CB 3.37Å; S101-S104 PolarHBondContact O-N 3.49Å; S101-I105 WeakPolarHBondContact O-CG1 3.08Å; S101-I105 PolarHBondContact O-N 2.81Å; S101-F275 PolarHBondContact OG-O 2.9Å; S101-H278 PolarHBondContact OG-CE1 2.99Å |
| 102 | S | 95.8 | Very high | 94.8 | Very high | 25 Ų | 25 | 28.1 Ų | 28.1 | 18% | 0.175 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.2 | -44.1 | 174.8 | 173.7 | 0 | 0 | 0 | 0 | 112.4 | A98 L99 I105 H106 Q297 N301 | A98-S102 PolarHBondContact O-N 2.97Å; L99-S102 PolarHBondContact O-N 3.47Å; S102-I105 PolarHBondContact O-N 3.32Å; S102-H106 PolarHBondContact O-N 3.14Å; S102-H106 VanDerWaalsContact O-N 3.13Å; S102-Q297 PolarHBondContact O-NE2 3Å; S102-N301 PolarHBondContact OG-OD1 3.08Å |
| 103 | Y | 95.9 | Very high | 94.4 | Very high | 64 Ų | 64 | 28.5 Ų | 28.5 | 25% | 0.251 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -63.5 | -42.5 | 175.8 | 175.8 | -109.1 | 0 | 0 | 0 | 112.4 | L99 L100 S101 I105 H106 L107 Q445 F449 | L99-Y103 PolarHBondContact O-N 3.4Å; L100-Y103 PolarHBondContact O-N 3.24Å; S101-Y103 PolarHBondContact O-N 2.96Å; Y103-I105 VanDerWaalsContact C-N 3.35Å; Y103-I105 PolarHBondContact O-N 3.24Å; Y103-H106 VanDerWaalsContact O-CB 3.3Å; Y103-H106 WeakPolarHBondContact O-CB 3.32Å; Y103-H106 PolarHBondContact O-N 2.96Å; Y103-H106 VanDerWaalsContact O-N 3.11Å; Y103-L107 HydrophobicContact CD1-CD1 4.22Å; Y103-L107 HydrophobicContact CE1-CD1 3.64Å; Y103-L107 HydrophobicContact CE1-CD2 4.48Å; Y103-L107 HydrophobicContact CE1-CG 4.11Å; Y103-L107 HydrophobicContact CE2-CD2 4.4Å; Y103-L107 PolarHBondContact O-N 3.13Å; Y103-Q445 WeakPolarHBondContact OH-CB 3.32Å; Y103-F449 HydrophobicContact CD1-CD1 4.22Å; Y103-F449 HydrophobicContact CD1-CD2 4.28Å; Y103-F449 HydrophobicContact CD1-CE1 4.25Å; Y103-F449 HydrophobicContact CD1-CE2 4.29Å; Y103-F449 HydrophobicContact CD1-CG 4.27Å; Y103-F449 HydrophobicContact CD1-CZ 4.3Å; Y103-F449 HydrophobicContact CE1-CB 4.37Å; Y103-F449 HydrophobicContact CE1-CD1 4.13Å; Y103-F449 HydrophobicContact CE1-CD2 4.45Å; Y103-F449 HydrophobicContact CE1-CG 4.08Å |
| 104 | S | 96.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.6 | -45.5 | 174.4 | 168.4 | 0 | 0 | 0 | 0 | 112.6 | L100 S101 H106 L107 L108 H278 I419 P423 | L100-S104 WeakPolarHBondContact O-CB 3.16Å; L100-S104 PolarHBondContact O-N 3.45Å; S101-S104 WeakPolarHBondContact O-CB 3.37Å; S101-S104 PolarHBondContact O-N 3.49Å; S104-H106 PolarHBondContact O-N 3.16Å; S104-L107 WeakPolarHBondContact O-CB 3.23Å; S104-L107 PolarHBondContact O-N 3.01Å; S104-L107 VanDerWaalsContact O-N 3.13Å; S104-L108 PolarHBondContact O-N 3.06Å; S104-H278 VanDerWaalsContact CB-NE2 3.31Å; S104-H278 WeakPolarHBondContact CB-NE2 3.35Å; S104-H278 PolarHBondContact OG-CD2 3.13Å; S104-H278 PolarHBondContact OG-NE2 2.93Å; S104-I419 WeakPolarHBondContact CB-O 3.49Å; S104-I419 PolarHBondContact OG-O 3.25Å; S104-P423 VanDerWaalsContact OG-CG 3.22Å; S104-P423 WeakPolarHBondContact OG-CG 3.13Å |
| 105 | I | 96.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.8 | -37.6 | 176.3 | -68.3 | 172.5 | 0 | 0 | 0 | 110.8 | S101 S102 Y103 L108 L109 V281 A300 I304 | S101-I105 WeakPolarHBondContact O-CG1 3.08Å; S101-I105 PolarHBondContact O-N 2.81Å; S102-I105 PolarHBondContact O-N 3.32Å; Y103-I105 VanDerWaalsContact C-N 3.35Å; Y103-I105 PolarHBondContact O-N 3.24Å; I105-L108 PolarHBondContact O-N 3.5Å; I105-L109 HydrophobicContact CG2-CD1 3.75Å; I105-L109 HydrophobicContact CG2-CG 4.02Å; I105-L109 WeakPolarHBondContact O-CB 3.34Å; I105-L109 VanDerWaalsContact O-CG 3.3Å; I105-L109 WeakPolarHBondContact O-CG 3.37Å; I105-L109 PolarHBondContact O-N 3.42Å; I105-V281 HydrophobicContact CD1-CG2 4Å; I105-V281 HydrophobicContact CG1-CG2 4.17Å; I105-V281 HydrophobicContact CG2-CG1 4.08Å; I105-V281 HydrophobicContact CG2-CG2 4.48Å; I105-A300 HydrophobicContact CD1-CB 3.85Å; I105-A300 HydrophobicContact CG2-CB 3.77Å; I105-I304 HydrophobicContact CD1-CD1 3.77Å |
| 106 | H | 94.9 | Very high | 93 | Very high | 79 Ų | 79 | 31.5 Ų | 31.5 | 37% | 0.366 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -61.3 | -44.5 | 174.6 | 176 | -88.4 | 0 | 0 | 0 | 112.3 | S102 Y103 S104 T110 | S102-H106 PolarHBondContact O-N 3.14Å; S102-H106 VanDerWaalsContact O-N 3.13Å; Y103-H106 VanDerWaalsContact O-CB 3.3Å; Y103-H106 WeakPolarHBondContact O-CB 3.32Å; Y103-H106 PolarHBondContact O-N 2.96Å; Y103-H106 VanDerWaalsContact O-N 3.11Å; S104-H106 PolarHBondContact O-N 3.16Å; H106-T110 WeakPolarHBondContact O-CB 3.34Å; H106-T110 PolarHBondContact O-N 2.9Å; H106-T110 PolarHBondContact O-OG1 3.11Å |
| 107 | L | 94.3 | Very high | 92.4 | Very high | 3 Ų | 3 | 30.3 Ų | 30.3 | 2% | 0.016 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.3 | -47 | 174.3 | -64.8 | 178.1 | 0 | 0 | 0 | 111.2 | Y103 S104 T110 C111 P423 Y427 A446 F449 | Y103-L107 HydrophobicContact CD1-CD1 4.22Å; Y103-L107 HydrophobicContact CE1-CD1 3.64Å; Y103-L107 HydrophobicContact CE1-CD2 4.48Å; Y103-L107 HydrophobicContact CE1-CG 4.11Å; Y103-L107 HydrophobicContact CE2-CD2 4.4Å; Y103-L107 PolarHBondContact O-N 3.13Å; S104-L107 WeakPolarHBondContact O-CB 3.23Å; S104-L107 PolarHBondContact O-N 3.01Å; S104-L107 VanDerWaalsContact O-N 3.13Å; L107-T110 PolarHBondContact O-N 3.19Å; L107-C111 PolarHBondContact O-N 3.32Å; L107-C111 PolarHBondContact O-SG 3.41Å; L107-P423 HydrophobicContact CB-CB 4.25Å; L107-Y427 HydrophobicContact CB-CD2 4.29Å; L107-Y427 HydrophobicContact CD2-CD1 4.29Å; L107-Y427 HydrophobicContact CD2-CD2 3.51Å; L107-Y427 HydrophobicContact CD2-CE2 3.79Å; L107-Y427 HydrophobicContact CD2-CG 3.77Å; L107-Y427 HydrophobicContact CG-CD2 4.49Å; L107-A446 HydrophobicContact CD1-CB 4.47Å; L107-F449 HydrophobicContact CD1-CD1 4Å; L107-F449 HydrophobicContact CD1-CE1 4.38Å |
| 108 | L | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.9 | -47.5 | 179.9 | -177.3 | 67.1 | 0 | 0 | 0 | 112 | S104 I105 T110 C111 A112 Y120 L123 L282 F426 | S104-L108 PolarHBondContact O-N 3.06Å; I105-L108 PolarHBondContact O-N 3.5Å; L108-T110 VanDerWaalsContact C-N 3.32Å; L108-T110 PolarHBondContact O-N 2.88Å; L108-C111 PolarHBondContact O-N 2.92Å; L108-A112 WeakPolarHBondContact O-CB 3.38Å; L108-A112 PolarHBondContact O-N 3.06Å; L108-Y120 HydrophobicContact CD1-CD2 4.22Å; L108-Y120 HydrophobicContact CD1-CE1 4.45Å; L108-Y120 HydrophobicContact CD1-CE2 3.77Å; L108-Y120 HydrophobicContact CD2-CD2 4.07Å; L108-Y120 HydrophobicContact CD2-CE2 3.59Å; L108-Y120 HydrophobicContact CG-CE2 4.36Å; L108-L123 HydrophobicContact CD1-CD2 3.72Å; L108-L282 HydrophobicContact CD1-CD1 4.43Å; L108-L282 HydrophobicContact CD2-CG 4.4Å; L108-F426 HydrophobicContact CD1-CD2 4.49Å |
| 109 | L | 93.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.9 | -34.1 | 179.1 | -70.1 | 177.3 | 0 | 0 | 0 | 112 | I105 A112 S113 V281 L282 Y285 Q293 M296 Q297 | I105-L109 HydrophobicContact CG2-CD1 3.75Å; I105-L109 HydrophobicContact CG2-CG 4.02Å; I105-L109 WeakPolarHBondContact O-CB 3.34Å; I105-L109 VanDerWaalsContact O-CG 3.3Å; I105-L109 WeakPolarHBondContact O-CG 3.37Å; I105-L109 PolarHBondContact O-N 3.42Å; L109-A112 PolarHBondContact O-N 3.33Å; L109-S113 VanDerWaalsContact O-CB 3.29Å; L109-S113 WeakPolarHBondContact O-CB 3.1Å; L109-S113 PolarHBondContact O-N 3.37Å; L109-V281 HydrophobicContact CD2-CG1 3.87Å; L109-V281 HydrophobicContact CG-CG1 4.34Å; L109-L282 HydrophobicContact CD2-CD2 4.3Å; L109-Y285 HydrophobicContact CD2-CD1 3.72Å; L109-Y285 HydrophobicContact CD2-CE1 4.04Å; L109-Y285 HydrophobicContact CD2-CG 4.45Å; L109-Q293 HydrophobicContact CB-CG 4.15Å; L109-M296 HydrophobicContact CD1-CB 4Å; L109-M296 HydrophobicContact CD1-CG 3.92Å; L109-M296 HydrophobicContact CD2-CB 4.27Å; L109-M296 HydrophobicContact CD2-CG 3.78Å; L109-Q297 HydrophobicContact CD1-CB 4.22Å |
| 110 | T | 91.4 | Very high | 90.7 | Very high | 23 Ų | 23 | 27.7 Ų | 27.7 | 14% | 0.141 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -63.6 | -47.3 | 174 | -57.5 | 0 | 0 | 0 | 0 | 110.6 | H106 L107 L108 A112 S113 V114 Q293 Y427 | H106-T110 WeakPolarHBondContact O-CB 3.34Å; H106-T110 PolarHBondContact O-N 2.9Å; H106-T110 PolarHBondContact O-OG1 3.11Å; L107-T110 PolarHBondContact O-N 3.19Å; L108-T110 VanDerWaalsContact C-N 3.32Å; L108-T110 PolarHBondContact O-N 2.88Å; T110-A112 VanDerWaalsContact C-N 3.34Å; T110-A112 PolarHBondContact O-N 2.95Å; T110-S113 WeakPolarHBondContact O-CB 3.23Å; T110-S113 PolarHBondContact O-N 3.18Å; T110-V114 WeakPolarHBondContact O-CG2 3.14Å; T110-V114 PolarHBondContact O-N 3.35Å; T110-Q293 PolarHBondContact OG1-NE2 3.29Å; T110-Y427 HydrophobicContact CG2-CE2 3.93Å |
| 111 | C | 91.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.3 | -45.2 | 175.8 | -62.4 | 0 | 0 | 0 | 0 | 112 | L107 L108 S113 V114 V115 L123 Y427 I430 | L107-C111 PolarHBondContact O-N 3.32Å; L107-C111 PolarHBondContact O-SG 3.41Å; L108-C111 PolarHBondContact O-N 2.92Å; C111-S113 VanDerWaalsContact C-N 3.3Å; C111-S113 PolarHBondContact O-N 3.14Å; C111-V114 PolarHBondContact O-N 2.92Å; C111-V115 WeakPolarHBondContact O-CG2 3.3Å; C111-V115 PolarHBondContact O-N 3.38Å; C111-L123 HydrophobicContact CB-CD1 4.13Å; C111-L123 HydrophobicContact CB-CD2 3.88Å; C111-L123 HydrophobicContact CB-CG 4.49Å; C111-Y427 WeakPolarHBondContact SG-CA 3.43Å; C111-Y427 PolarHBondContact SG-N 3.15Å; C111-Y427 VanDerWaalsContact SG-N 3.42Å; C111-I430 HydrophobicContact CB-CD1 4.38Å |
| 112 | A | 89.9 | Confident | 90.1 | Very high | 2 Ų | 2 | 28.9 Ų | 28.9 | 2% | 0.017 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.6 | -37.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L108 L109 T110 G116 I117 L282 | L108-A112 WeakPolarHBondContact O-CB 3.38Å; L108-A112 PolarHBondContact O-N 3.06Å; L109-A112 PolarHBondContact O-N 3.33Å; T110-A112 VanDerWaalsContact C-N 3.34Å; T110-A112 PolarHBondContact O-N 2.95Å; A112-G116 WeakPolarHBondContact O-CA 3.33Å; A112-G116 PolarHBondContact O-N 2.87Å; A112-I117 WeakPolarHBondContact CA-O 3.43Å; A112-I117 WeakPolarHBondContact CB-O 3.31Å; A112-I117 PolarHBondContact O-N 3.01Å; A112-L282 HydrophobicContact CB-CD2 3.78Å |
| 113 | S | 88.2 | Confident | 89.9 | Confident | 62 Ų | 62 | 27.7 Ų | 27.7 | 43% | 0.434 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -67.4 | -45.7 | 178 | -167.6 | 0 | 0 | 0 | 0 | 112 | L109 T110 C111 V115 G116 | L109-S113 VanDerWaalsContact O-CB 3.29Å; L109-S113 WeakPolarHBondContact O-CB 3.1Å; L109-S113 PolarHBondContact O-N 3.37Å; T110-S113 WeakPolarHBondContact O-CB 3.23Å; T110-S113 PolarHBondContact O-N 3.18Å; C111-S113 VanDerWaalsContact C-N 3.3Å; C111-S113 PolarHBondContact O-N 3.14Å; S113-V115 PolarHBondContact O-N 2.79Å; S113-G116 PolarHBondContact O-N 3.1Å |
| 114 | V | 86.7 | Confident | 89.7 | Confident | 78 Ų | 78 | 24.6 Ų | 24.6 | 47% | 0.473 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -63.1 | -41.4 | -179.4 | 170.8 | 0 | 0 | 0 | 0 | 112.1 | T110 C111 | T110-V114 WeakPolarHBondContact O-CG2 3.14Å; T110-V114 PolarHBondContact O-N 3.35Å; C111-V114 PolarHBondContact O-N 2.92Å |
| 115 | V | 85.9 | Confident | 89.5 | Confident | 43 Ų | 43 | 29 Ų | 29 | 26% | 0.261 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -91 | -18.4 | -176.6 | -165.9 | 0 | 0 | 0 | 0 | 112.4 | C111 S113 I117 L123 R126 I430 | C111-V115 WeakPolarHBondContact O-CG2 3.3Å; C111-V115 PolarHBondContact O-N 3.38Å; S113-V115 PolarHBondContact O-N 2.79Å; V115-I117 HydrophobicContact CB-CB 4.44Å; V115-I117 HydrophobicContact CB-CD1 4.38Å; V115-I117 HydrophobicContact CB-CG1 4.26Å; V115-I117 HydrophobicContact CG1-CB 4.34Å; V115-I117 HydrophobicContact CG1-CD1 3.44Å; V115-I117 VanDerWaalsContact CG1-CD1 3.44Å; V115-I117 HydrophobicContact CG1-CG1 3.66Å; V115-I117 PolarHBondContact O-N 2.94Å; V115-L123 HydrophobicContact CG2-CD1 4.47Å; V115-R126 HydrophobicContact CG1-CG 3.81Å; V115-R126 HydrophobicContact CG2-CG 4.31Å; V115-I430 HydrophobicContact CG2-CG2 3.15Å |
| 116 | G | 82.9 | Confident | 89.2 | Confident | 54 Ų | 54 | 36.3 Ų | 36.3 | 56% | 0.557 | 19% | 0.192 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 69.9 | 18.6 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | A112 S113 | A112-G116 WeakPolarHBondContact O-CA 3.33Å; A112-G116 PolarHBondContact O-N 2.87Å; S113-G116 PolarHBondContact O-N 3.1Å |
| 117 | I | 83 | Confident | 89.1 | Confident | 35 Ų | 35 | 33.6 Ų | 33.6 | 18% | 0.179 | 18% | 0.183 | C | C | . | . | trans | -98 | 127.6 | 178.1 | -69 | 177.3 | 0 | 0 | 0 | 109.5 | A112 V115 A119 Q122 R126 | A112-I117 WeakPolarHBondContact CA-O 3.43Å; A112-I117 WeakPolarHBondContact CB-O 3.31Å; A112-I117 PolarHBondContact O-N 3.01Å; V115-I117 HydrophobicContact CB-CB 4.44Å; V115-I117 HydrophobicContact CB-CD1 4.38Å; V115-I117 HydrophobicContact CB-CG1 4.26Å; V115-I117 HydrophobicContact CG1-CB 4.34Å; V115-I117 HydrophobicContact CG1-CD1 3.44Å; V115-I117 VanDerWaalsContact CG1-CD1 3.44Å; V115-I117 HydrophobicContact CG1-CG1 3.66Å; V115-I117 PolarHBondContact O-N 2.94Å; I117-A119 WeakPolarHBondContact CG2-O 3.3Å; I117-Q122 HydrophobicContact CD1-CB 4.47Å; I117-Q122 HydrophobicContact CG2-CB 3.4Å; I117-R126 HydrophobicContact CD1-CB 4.11Å | ||
| 118 | R | 80.4 | Confident | 89 | Confident | 68 Ų | 68 | 37.8 Ų | 37.8 | 26% | 0.257 | 20% | 0.202 | S | C | . | . | trans | -116.1 | 33 | -178.5 | -57.3 | -175.2 | 175.1 | -179.3 | -1.5 | 113.4 | T286 P291 | R118-T286 HydrophobicContact CB-CG2 3.36Å; R118-T286 HydrophobicContact CG-CG2 4.18Å; R118-P291 VanDerWaalsContact NH1-CG 3.31Å | ||
| 119 | A | 84.6 | Confident | 89 | Confident | 2 Ų | 2 | 38.9 Ų | 38.9 | 2% | 0.017 | 21% | 0.212 | C | C | . | . | trans | -136.5 | 133 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | I117 E121 Q122 L123 | I117-A119 WeakPolarHBondContact CG2-O 3.3Å; A119-E121 PolarHBondContact O-N 2.89Å; A119-Q122 HydrophobicContact CB-CB 4.1Å; A119-Q122 HydrophobicContact CB-CG 3.92Å; A119-Q122 PolarHBondContact O-N 2.87Å; A119-L123 PolarHBondContact O-N 3.1Å; A119-L123 VanDerWaalsContact O-N 3.1Å | ||
| 120 | Y | 88.4 | Confident | 88.8 | Confident | 4 Ų | 4 | 43.5 Ų | 43.5 | 2% | 0.016 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67 | -43 | -169.2 | -153.3 | -55.1 | 0 | 0 | 0 | 110.9 | L108 Q122 L123 G124 V136 I140 H278 L282 L418 L422 F426 | L108-Y120 HydrophobicContact CD1-CD2 4.22Å; L108-Y120 HydrophobicContact CD1-CE1 4.45Å; L108-Y120 HydrophobicContact CD1-CE2 3.77Å; L108-Y120 HydrophobicContact CD2-CD2 4.07Å; L108-Y120 HydrophobicContact CD2-CE2 3.59Å; L108-Y120 HydrophobicContact CG-CE2 4.36Å; Y120-Q122 VanDerWaalsContact C-N 3.29Å; Y120-Q122 PolarHBondContact O-N 3.26Å; Y120-L123 WeakPolarHBondContact O-CB 3.34Å; Y120-L123 PolarHBondContact O-N 3.36Å; Y120-L123 VanDerWaalsContact O-N 3.15Å; Y120-G124 PolarHBondContact O-N 2.92Å; Y120-G124 VanDerWaalsContact O-N 3.16Å; Y120-V136 HydrophobicContact CD1-CG1 3.46Å; Y120-V136 VanDerWaalsContact CD1-CG1 3.46Å; Y120-V136 HydrophobicContact CE1-CG1 4.05Å; Y120-V136 HydrophobicContact CG-CG1 4.38Å; Y120-I140 HydrophobicContact CD1-CD1 4.15Å; Y120-I140 HydrophobicContact CG-CD1 3.92Å; Y120-H278 HydrophobicContact CE2-CB 4Å; Y120-L282 HydrophobicContact CD2-CD1 4.3Å; Y120-L282 HydrophobicContact CG-CD1 4.35Å; Y120-L418 HydrophobicContact CE2-CD2 4.44Å; Y120-L418 PolarHBondContact OH-O 3.41Å; Y120-L422 HydrophobicContact CE1-CB 4.2Å; Y120-L422 HydrophobicContact CE1-CD1 3.98Å; Y120-F426 AromaticContact CD1-CE2 3.9Å; Y120-F426 HydrophobicContact CD1-CE2 3.9Å; Y120-F426 HydrophobicContact CE1-CD2 4.41Å; Y120-F426 AromaticContact CE1-CE2 3.47Å; Y120-F426 HydrophobicContact CE1-CE2 3.47Å; Y120-F426 VanDerWaalsContact CE1-CE2 3.47Å; Y120-F426 HydrophobicContact CE1-CZ 4.16Å |
| 121 | E | 89.5 | Confident | 88.9 | Confident | 13 Ų | 13 | 45.6 Ų | 45.6 | 6% | 0.061 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.1 | -34.1 | 176.9 | 72.5 | -76.1 | -174.9 | 0 | 0 | 112.8 | A119 L123 G124 H125 K133 V136 Q369 | A119-E121 PolarHBondContact O-N 2.89Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-G124 PolarHBondContact O-N 3.27Å; E121-H125 PolarHBondContact O-N 3.47Å; E121-K133 HydrophobicContact CB-CG 4.33Å; E121-V136 HydrophobicContact CB-CG1 4.45Å; E121-Q369 HydrophobicContact CG-CB 4.4Å |
| 122 | Q | 88.5 | Confident | 88.9 | Confident | 51 Ų | 51 | 45.9 Ų | 45.9 | 24% | 0.238 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -73.6 | -30.2 | 177.1 | -67.7 | -174.8 | -24.3 | 0 | 0 | 111.6 | I117 A119 Y120 G124 H125 R126 | I117-Q122 HydrophobicContact CD1-CB 4.47Å; I117-Q122 HydrophobicContact CG2-CB 3.4Å; A119-Q122 HydrophobicContact CB-CB 4.1Å; A119-Q122 HydrophobicContact CB-CG 3.92Å; A119-Q122 PolarHBondContact O-N 2.87Å; Y120-Q122 VanDerWaalsContact C-N 3.29Å; Y120-Q122 PolarHBondContact O-N 3.26Å; Q122-G124 VanDerWaalsContact C-N 3.34Å; Q122-H125 WeakPolarHBondContact O-CB 3.4Å; Q122-H125 PolarHBondContact O-N 3.26Å; Q122-R126 PolarHBondContact O-N 3.49Å |
| 123 | L | 90.5 | Very high | 89 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65 | -41.8 | 171.9 | -160.6 | 65.7 | 0 | 0 | 0 | 110.8 | L108 C111 V115 A119 Y120 E121 H125 R126 A127 F426 I430 | L108-L123 HydrophobicContact CD1-CD2 3.72Å; C111-L123 HydrophobicContact CB-CD1 4.13Å; C111-L123 HydrophobicContact CB-CD2 3.88Å; C111-L123 HydrophobicContact CB-CG 4.49Å; V115-L123 HydrophobicContact CG2-CD1 4.47Å; A119-L123 PolarHBondContact O-N 3.1Å; A119-L123 VanDerWaalsContact O-N 3.1Å; Y120-L123 WeakPolarHBondContact O-CB 3.34Å; Y120-L123 PolarHBondContact O-N 3.36Å; Y120-L123 VanDerWaalsContact O-N 3.15Å; E121-L123 VanDerWaalsContact C-N 3.35Å; L123-H125 VanDerWaalsContact C-N 3.32Å; L123-H125 PolarHBondContact O-N 3.39Å; L123-R126 PolarHBondContact O-N 2.83Å; L123-A127 PolarHBondContact O-N 3.44Å; L123-F426 HydrophobicContact CB-CD2 4.4Å; L123-F426 HydrophobicContact CB-CE2 4.19Å; L123-F426 HydrophobicContact CD2-CB 4.41Å; L123-F426 HydrophobicContact CD2-CD2 3.44Å; L123-F426 VanDerWaalsContact CD2-CD2 3.44Å; L123-F426 HydrophobicContact CD2-CE2 3.92Å; L123-F426 HydrophobicContact CD2-CG 4.2Å; L123-F426 HydrophobicContact CG-CD2 3.84Å; L123-F426 HydrophobicContact CG-CE2 4.14Å; L123-F426 HydrophobicContact CG-CG 4.29Å; L123-I430 HydrophobicContact CD1-CD1 3.36Å; L123-I430 HydrophobicContact CG-CD1 3.62Å |
| 124 | G | 92.3 | Very high | 89.1 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59 | -41.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y120 E121 Q122 R126 A127 F128 | Y120-G124 PolarHBondContact O-N 2.92Å; Y120-G124 VanDerWaalsContact O-N 3.16Å; E121-G124 PolarHBondContact O-N 3.27Å; Q122-G124 VanDerWaalsContact C-N 3.34Å; G124-R126 VanDerWaalsContact C-N 3.34Å; G124-R126 PolarHBondContact O-N 3.29Å; G124-A127 PolarHBondContact O-N 3.05Å; G124-F128 PolarHBondContact O-N 2.93Å |
| 125 | H | 91.8 | Very high | 89.5 | Confident | 92 Ų | 92 | 47.4 Ų | 47.4 | 43% | 0.426 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.6 | -42 | 174.8 | -169.4 | 59 | 0 | 0 | 0 | 112.5 | E121 Q122 L123 A127 G129 K133 | E121-H125 PolarHBondContact O-N 3.47Å; Q122-H125 WeakPolarHBondContact O-CB 3.4Å; Q122-H125 PolarHBondContact O-N 3.26Å; L123-H125 VanDerWaalsContact C-N 3.32Å; L123-H125 PolarHBondContact O-N 3.39Å; H125-A127 VanDerWaalsContact C-N 3.34Å; H125-A127 PolarHBondContact O-N 2.97Å; H125-G129 WeakPolarHBondContact CA-O 3.48Å; H125-G129 PolarHBondContact ND1-O 3.27Å; H125-G129 WeakPolarHBondContact O-CA 3.38Å; H125-G129 PolarHBondContact O-N 3Å; H125-K133 HydrophobicContact CB-CB 3.95Å; H125-K133 HydrophobicContact CB-CD 4.46Å; H125-K133 HydrophobicContact CB-CG 4.42Å |
| 126 | R | 91.4 | Very high | 89.8 | Confident | 154 Ų | 154 | 45.4 Ų | 45.4 | 58% | 0.581 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -67.5 | -35.2 | 179.5 | -177 | 65.8 | 179.8 | 81.1 | -1.1 | 112.7 | V115 I117 Q122 L123 G124 | V115-R126 HydrophobicContact CG1-CG 3.81Å; V115-R126 HydrophobicContact CG2-CG 4.31Å; I117-R126 HydrophobicContact CD1-CB 4.11Å; Q122-R126 PolarHBondContact O-N 3.49Å; L123-R126 PolarHBondContact O-N 2.83Å; G124-R126 VanDerWaalsContact C-N 3.34Å; G124-R126 PolarHBondContact O-N 3.29Å |
| 127 | A | 92 | Very high | 90.2 | Very high | 21 Ų | 21 | 43.1 Ų | 43.1 | 17% | 0.174 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -79.3 | -42.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L123 G124 H125 F426 R429 I430 | L123-A127 PolarHBondContact O-N 3.44Å; G124-A127 PolarHBondContact O-N 3.05Å; H125-A127 VanDerWaalsContact C-N 3.34Å; H125-A127 PolarHBondContact O-N 2.97Å; A127-F426 HydrophobicContact CB-CD1 3.87Å; A127-F426 HydrophobicContact CB-CE1 4.22Å; A127-R429 HydrophobicContact CB-CB 4.43Å; A127-I430 HydrophobicContact CB-CD1 4.19Å; A127-I430 HydrophobicContact CB-CG1 4.13Å |
| 128 | F | 93.3 | Very high | 90.7 | Very high | 92 Ų | 92 | 46.2 Ų | 46.2 | 40% | 0.404 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -133.2 | 15.7 | -171.3 | -61.5 | -75.7 | 0 | 0 | 0 | 114.4 | G124 V425 F426 R429 | G124-F128 PolarHBondContact O-N 2.93Å; F128-V425 HydrophobicContact CE1-CG1 4.47Å; F128-V425 HydrophobicContact CE2-CG1 3.36Å; F128-V425 HydrophobicContact CZ-CG1 3.19Å; F128-F426 HydrophobicContact CE2-CD1 4.46Å; F128-F426 HydrophobicContact CE2-CE1 4.49Å; F128-R429 HydrophobicContact CE1-CG 4.21Å; F128-R429 HydrophobicContact CZ-CG 3.85Å |
| 129 | G | 92.4 | Very high | 91.4 | Very high | 22 Ų | 22 | 44.1 Ų | 44.1 | 23% | 0.227 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | 67.8 | -154.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | H125 A131 G132 K133 | H125-G129 WeakPolarHBondContact CA-O 3.48Å; H125-G129 PolarHBondContact ND1-O 3.27Å; H125-G129 WeakPolarHBondContact O-CA 3.38Å; H125-G129 PolarHBondContact O-N 3Å; G129-A131 VanDerWaalsContact C-N 3.29Å; G129-A131 PolarHBondContact O-N 3.1Å; G129-G132 PolarHBondContact O-N 2.94Å; G129-K133 PolarHBondContact O-N 3.03Å |
| 130 | P | 90.8 | Very high | 91.8 | Very high | 97 Ų | 97 | 44.3 Ų | 44.3 | 63% | 0.63 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -57.4 | -37.8 | -175.5 | -25.2 | 34.1 | 0 | 0 | 0 | 114 | K133 V134 | P130-K133 WeakPolarHBondContact O-CB 3.42Å; P130-K133 PolarHBondContact O-N 3.32Å; P130-V134 WeakPolarHBondContact O-CG2 3.39Å; P130-V134 PolarHBondContact O-N 3.17Å |
| 131 | A | 92.6 | Very high | 91.9 | Very high | 68 Ų | 68 | 45.5 Ų | 45.5 | 56% | 0.562 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -62.7 | -44.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | G129 K133 V134 V135 | G129-A131 VanDerWaalsContact C-N 3.29Å; G129-A131 PolarHBondContact O-N 3.1Å; A131-K133 VanDerWaalsContact C-N 3.31Å; A131-K133 PolarHBondContact O-N 3.25Å; A131-V134 PolarHBondContact O-N 3.43Å; A131-V135 WeakPolarHBondContact O-CG2 3.36Å; A131-V135 PolarHBondContact O-N 3Å |
| 132 | G | 92.4 | Very high | 92.1 | Very high | 6 Ų | 6 | 47.8 Ų | 47.8 | 6% | 0.062 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.5 | -40.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G129 V134 V135 V136 | G129-G132 PolarHBondContact O-N 2.94Å; G132-V134 VanDerWaalsContact C-N 3.33Å; G132-V134 PolarHBondContact O-N 3.29Å; G132-V135 PolarHBondContact O-N 3.4Å; G132-V136 WeakPolarHBondContact O-CB 3.33Å; G132-V136 WeakPolarHBondContact O-CG2 3.49Å; G132-V136 PolarHBondContact O-N 3.44Å |
| 133 | K | 90.9 | Very high | 92.4 | Very high | 35 Ų | 35 | 45.8 Ų | 45.8 | 15% | 0.152 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.4 | -46.8 | 175.4 | -174.2 | -178.7 | 172.3 | -175.8 | 0 | 111.6 | E121 H125 G129 P130 A131 A137 Q369 | E121-K133 HydrophobicContact CB-CG 4.33Å; H125-K133 HydrophobicContact CB-CB 3.95Å; H125-K133 HydrophobicContact CB-CD 4.46Å; H125-K133 HydrophobicContact CB-CG 4.42Å; G129-K133 PolarHBondContact O-N 3.03Å; P130-K133 WeakPolarHBondContact O-CB 3.42Å; P130-K133 PolarHBondContact O-N 3.32Å; A131-K133 VanDerWaalsContact C-N 3.31Å; A131-K133 PolarHBondContact O-N 3.25Å; K133-A137 WeakPolarHBondContact O-CB 3.12Å; K133-A137 PolarHBondContact O-N 3.04Å; K133-A137 VanDerWaalsContact O-N 3.08Å; K133-Q369 WeakPolarHBondContact CE-O 3.37Å; K133-Q369 PolarHBondContact NZ-O 3.19Å |
| 134 | V | 91.8 | Very high | 92.5 | Very high | 62 Ų | 62 | 46 Ų | 46 | 38% | 0.376 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65.8 | -48.6 | -178.8 | 177.6 | 0 | 0 | 0 | 0 | 110.7 | P130 A131 G132 V136 A137 I138 L370 | P130-V134 WeakPolarHBondContact O-CG2 3.39Å; P130-V134 PolarHBondContact O-N 3.17Å; A131-V134 PolarHBondContact O-N 3.43Å; G132-V134 VanDerWaalsContact C-N 3.33Å; G132-V134 PolarHBondContact O-N 3.29Å; V134-V136 VanDerWaalsContact C-N 3.34Å; V134-V136 PolarHBondContact O-N 3.48Å; V134-A137 PolarHBondContact O-N 3.47Å; V134-I138 HydrophobicContact CG1-CD1 3.76Å; V134-I138 HydrophobicContact CG1-CG1 4.38Å; V134-I138 WeakPolarHBondContact O-CG1 3.46Å; V134-I138 PolarHBondContact O-N 2.98Å; V134-L370 HydrophobicContact CB-CD1 4.26Å; V134-L370 HydrophobicContact CG1-CD1 4.48Å; V134-L370 HydrophobicContact CG2-CD1 3.81Å |
| 135 | V | 94.1 | Very high | 92.6 | Very high | 77 Ų | 77 | 46.8 Ų | 46.8 | 47% | 0.467 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -57.8 | -47.1 | -179.4 | 169.8 | 0 | 0 | 0 | 0 | 111.3 | A131 G132 A137 I138 I139 | A131-V135 WeakPolarHBondContact O-CG2 3.36Å; A131-V135 PolarHBondContact O-N 3Å; G132-V135 PolarHBondContact O-N 3.4Å; V135-A137 PolarHBondContact O-N 3.39Å; V135-I138 PolarHBondContact O-N 2.8Å; V135-I139 HydrophobicContact CG1-CD1 3.76Å; V135-I139 WeakPolarHBondContact O-CG1 3.33Å; V135-I139 PolarHBondContact O-N 2.99Å |
| 136 | V | 93 | Very high | 92.6 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.006 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63 | -43.9 | 178.3 | 171.1 | 0 | 0 | 0 | 0 | 111.6 | Y120 E121 G132 V134 I138 I139 I140 L422 F426 | Y120-V136 HydrophobicContact CD1-CG1 3.46Å; Y120-V136 VanDerWaalsContact CD1-CG1 3.46Å; Y120-V136 HydrophobicContact CE1-CG1 4.05Å; Y120-V136 HydrophobicContact CG-CG1 4.38Å; E121-V136 HydrophobicContact CB-CG1 4.45Å; G132-V136 WeakPolarHBondContact O-CB 3.33Å; G132-V136 WeakPolarHBondContact O-CG2 3.49Å; G132-V136 PolarHBondContact O-N 3.44Å; V134-V136 VanDerWaalsContact C-N 3.34Å; V134-V136 PolarHBondContact O-N 3.48Å; V136-I138 VanDerWaalsContact C-N 3.31Å; V136-I138 PolarHBondContact O-N 3.27Å; V136-I139 PolarHBondContact O-N 3.17Å; V136-I140 HydrophobicContact CG1-CD1 3.75Å; V136-I140 HydrophobicContact CG1-CG1 4.46Å; V136-I140 WeakPolarHBondContact O-CG1 3.35Å; V136-I140 PolarHBondContact O-N 3.21Å; V136-L422 HydrophobicContact CG2-CD1 4.32Å; V136-L422 HydrophobicContact CG2-CD2 3.99Å; V136-F426 HydrophobicContact CG2-CE1 4.32Å; V136-F426 HydrophobicContact CG2-CZ 3.61Å |
| 137 | A | 91.5 | Very high | 92.7 | Very high | 5 Ų | 5 | 35.5 Ų | 35.5 | 4% | 0.041 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.2 | -39.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K133 V134 V135 C141 L370 | K133-A137 WeakPolarHBondContact O-CB 3.12Å; K133-A137 PolarHBondContact O-N 3.04Å; K133-A137 VanDerWaalsContact O-N 3.08Å; V134-A137 PolarHBondContact O-N 3.47Å; V135-A137 PolarHBondContact O-N 3.39Å; A137-C141 WeakPolarHBondContact O-CB 3.46Å; A137-C141 PolarHBondContact O-N 3.3Å; A137-L370 HydrophobicContact CB-CD1 4.27Å; A137-L370 HydrophobicContact CB-CD2 4.09Å |
| 138 | I | 92.9 | Very high | 92.8 | Very high | 100 Ų | 100 | 34.6 Ų | 34.6 | 51% | 0.513 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.8 | -46.4 | 175.3 | -69.3 | 168.5 | 0 | 0 | 0 | 110.8 | V134 V135 V136 I140 C141 L142 | V134-I138 HydrophobicContact CG1-CD1 3.76Å; V134-I138 HydrophobicContact CG1-CG1 4.38Å; V134-I138 WeakPolarHBondContact O-CG1 3.46Å; V134-I138 PolarHBondContact O-N 2.98Å; V135-I138 PolarHBondContact O-N 2.8Å; V136-I138 VanDerWaalsContact C-N 3.31Å; V136-I138 PolarHBondContact O-N 3.27Å; I138-I140 PolarHBondContact O-N 3.04Å; I138-C141 PolarHBondContact O-N 2.78Å; I138-L142 VanDerWaalsContact O-CB 3.32Å; I138-L142 WeakPolarHBondContact O-CB 3.25Å; I138-L142 PolarHBondContact O-N 2.93Å |
| 139 | I | 94.4 | Very high | 92.8 | Very high | 25 Ų | 25 | 30.2 Ų | 30.2 | 13% | 0.128 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.1 | -44.2 | -179.8 | -68.5 | 163.8 | 0 | 0 | 0 | 111.2 | V135 V136 L142 H143 L418 L422 | V135-I139 HydrophobicContact CG1-CD1 3.76Å; V135-I139 WeakPolarHBondContact O-CG1 3.33Å; V135-I139 PolarHBondContact O-N 2.99Å; V136-I139 PolarHBondContact O-N 3.17Å; I139-L142 PolarHBondContact O-N 2.99Å; I139-H143 WeakPolarHBondContact O-CB 3.15Å; I139-H143 PolarHBondContact O-N 3.43Å; I139-L418 HydrophobicContact CG2-CD1 4.25Å; I139-L418 HydrophobicContact CG2-CD2 3.92Å; I139-L418 HydrophobicContact CG2-CG 3.69Å; I139-L422 HydrophobicContact CB-CD1 4.47Å; I139-L422 HydrophobicContact CD1-CD1 3.9Å; I139-L422 HydrophobicContact CD1-CD2 4.33Å; I139-L422 HydrophobicContact CD1-CG 4.35Å; I139-L422 HydrophobicContact CG2-CD1 4.15Å |
| 140 | I | 92.4 | Very high | 92.9 | Very high | 6 Ų | 6 | 29.2 Ų | 29.2 | 3% | 0.031 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.7 | -44.2 | 176.1 | -69 | 169.6 | 0 | 0 | 0 | 110.8 | Y120 V136 I138 H143 N144 P279 L418 | Y120-I140 HydrophobicContact CD1-CD1 4.15Å; Y120-I140 HydrophobicContact CG-CD1 3.92Å; V136-I140 HydrophobicContact CG1-CD1 3.75Å; V136-I140 HydrophobicContact CG1-CG1 4.46Å; V136-I140 WeakPolarHBondContact O-CG1 3.35Å; V136-I140 PolarHBondContact O-N 3.21Å; I138-I140 PolarHBondContact O-N 3.04Å; I140-H143 PolarHBondContact O-N 2.86Å; I140-N144 WeakPolarHBondContact O-CB 3.5Å; I140-N144 PolarHBondContact O-N 3.47Å; I140-P279 HydrophobicContact CG1-CB 4.44Å; I140-P279 HydrophobicContact CG1-CG 4.37Å; I140-P279 HydrophobicContact CG2-CB 4.09Å; I140-P279 HydrophobicContact CG2-CG 4.47Å; I140-L418 HydrophobicContact CG1-CD2 4.05Å |
| 141 | C | 92.4 | Very high | 93.1 | Very high | 28 Ų | 28 | 24.9 Ų | 24.9 | 19% | 0.189 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.9 | -47 | 177.5 | -170.6 | 0 | 0 | 0 | 0 | 110.9 | A137 I138 H143 N144 V145 | A137-C141 WeakPolarHBondContact O-CB 3.46Å; A137-C141 PolarHBondContact O-N 3.3Å; I138-C141 PolarHBondContact O-N 2.78Å; C141-H143 PolarHBondContact O-N 3.46Å; C141-N144 PolarHBondContact O-N 3.39Å; C141-V145 VanDerWaalsContact O-CB 3.26Å; C141-V145 WeakPolarHBondContact O-CB 3.48Å; C141-V145 WeakPolarHBondContact O-CG2 3.28Å; C141-V145 PolarHBondContact O-N 3.1Å |
| 142 | L | 93.8 | Very high | 93.2 | Very high | 61 Ų | 61 | 21.7 Ų | 21.7 | 32% | 0.319 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -57.8 | -49.5 | 177.1 | 179.3 | 64 | 0 | 0 | 0 | 111.2 | I138 I139 G146 F409 I410 | I138-L142 VanDerWaalsContact O-CB 3.32Å; I138-L142 WeakPolarHBondContact O-CB 3.25Å; I138-L142 PolarHBondContact O-N 2.93Å; I139-L142 PolarHBondContact O-N 2.99Å; L142-G146 PolarHBondContact O-N 3.43Å; L142-F409 HydrophobicContact CD1-CE1 4.17Å; L142-I410 HydrophobicContact CD1-CD1 4.01Å; L142-I410 HydrophobicContact CG-CD1 4.23Å |
| 143 | H | 93.9 | Very high | 93.3 | Very high | 10 Ų | 10 | 22 Ų | 22 | 5% | 0.046 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58.6 | -53 | 179.9 | -175.4 | 62.3 | 0 | 0 | 0 | 112.1 | I139 I140 C141 G146 A147 F273 V276 S414 L418 | I139-H143 WeakPolarHBondContact O-CB 3.15Å; I139-H143 PolarHBondContact O-N 3.43Å; I140-H143 PolarHBondContact O-N 2.86Å; C141-H143 PolarHBondContact O-N 3.46Å; H143-G146 WeakPolarHBondContact O-CA 3.36Å; H143-G146 PolarHBondContact O-N 3.05Å; H143-G146 VanDerWaalsContact O-N 3.17Å; H143-A147 PolarHBondContact O-N 2.95Å; H143-F273 AromaticContact CE1-CD2 3.91Å; H143-V276 WeakPolarHBondContact CE1-CB 3.46Å; H143-V276 VanDerWaalsContact CE1-CG1 3.45Å; H143-V276 WeakPolarHBondContact CE1-CG1 3.43Å; H143-V276 WeakPolarHBondContact NE2-CB 3.24Å; H143-V276 WeakPolarHBondContact NE2-CG1 3.33Å; H143-S414 PolarHBondContact ND1-OG 2.87Å; H143-L418 HydrophobicContact CB-CD1 3.56Å |
| 144 | N | 92.8 | Very high | 93.4 | Very high | 5 Ų | 5 | 20.4 Ų | 20.4 | 3% | 0.027 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -73.4 | -32.5 | -174.2 | -72.3 | 13.9 | 0 | 0 | 0 | 112.1 | I140 C141 G146 A147 M148 V359 I363 | I140-N144 WeakPolarHBondContact O-CB 3.5Å; I140-N144 PolarHBondContact O-N 3.47Å; C141-N144 PolarHBondContact O-N 3.39Å; N144-G146 VanDerWaalsContact C-N 3.3Å; N144-A147 PolarHBondContact O-N 3.43Å; N144-M148 WeakPolarHBondContact O-CB 3.28Å; N144-M148 VanDerWaalsContact O-CG 3.28Å; N144-M148 WeakPolarHBondContact O-CG 3.49Å; N144-M148 PolarHBondContact O-N 2.97Å; N144-V359 HydrophobicContact CB-CG1 3.68Å; N144-V359 PolarHBondContact ND2-O 2.7Å; N144-I363 HydrophobicContact CB-CD1 3.25Å; N144-I363 HydrophobicContact CB-CG1 3.28Å |
| 145 | V | 93.4 | Very high | 93.5 | Very high | 15 Ų | 15 | 17.5 Ų | 17.5 | 9% | 0.091 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -61.3 | -42.6 | 169 | 166.9 | 0 | 0 | 0 | 0 | 110 | C141 M148 S149 I363 L389 V393 L396 | C141-V145 VanDerWaalsContact O-CB 3.26Å; C141-V145 WeakPolarHBondContact O-CB 3.48Å; C141-V145 WeakPolarHBondContact O-CG2 3.28Å; C141-V145 PolarHBondContact O-N 3.1Å; V145-M148 HydrophobicContact CG2-CE 4.1Å; V145-M148 PolarHBondContact O-N 3.34Å; V145-S149 WeakPolarHBondContact O-CB 3.34Å; V145-S149 PolarHBondContact O-N 2.93Å; V145-S149 PolarHBondContact O-OG 3.43Å; V145-I363 HydrophobicContact CG2-CD1 4.5Å; V145-L389 HydrophobicContact CG2-CD2 4.48Å; V145-V393 HydrophobicContact CG1-CG2 4.26Å; V145-L396 HydrophobicContact CG1-CD1 4.39Å |
| 146 | G | 93.5 | Very high | 93.5 | Very high | 3 Ų | 3 | 15.6 Ų | 15.6 | 3% | 0.031 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -56.1 | -52.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L142 H143 N144 S149 S150 | L142-G146 PolarHBondContact O-N 3.43Å; H143-G146 WeakPolarHBondContact O-CA 3.36Å; H143-G146 PolarHBondContact O-N 3.05Å; H143-G146 VanDerWaalsContact O-N 3.17Å; N144-G146 VanDerWaalsContact C-N 3.3Å; G146-S149 WeakPolarHBondContact O-CB 3.21Å; G146-S149 PolarHBondContact O-N 3.45Å; G146-S149 VanDerWaalsContact O-N 3.17Å; G146-S150 PolarHBondContact O-N 3.19Å; G146-S150 PolarHBondContact O-OG 2.73Å |
| 147 | A | 92.9 | Very high | 93.3 | Very high | 6 Ų | 6 | 16.8 Ų | 16.8 | 5% | 0.05 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -62.7 | -42.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | H143 N144 S149 S150 Y151 F273 V359 | H143-A147 PolarHBondContact O-N 2.95Å; N144-A147 PolarHBondContact O-N 3.43Å; A147-S149 VanDerWaalsContact C-N 3.3Å; A147-S149 PolarHBondContact O-N 3.24Å; A147-S150 PolarHBondContact O-N 2.9Å; A147-S150 PolarHBondContact O-OG 2.67Å; A147-Y151 HydrophobicContact CB-CE2 4.36Å; A147-Y151 WeakPolarHBondContact O-CD2 3.44Å; A147-Y151 WeakPolarHBondContact O-CE2 3.34Å; A147-Y151 PolarHBondContact O-N 3.45Å; A147-F273 HydrophobicContact CB-CE2 4.1Å; A147-F273 HydrophobicContact CB-CZ 4.13Å; A147-V359 HydrophobicContact CB-CG1 4.27Å |
| 148 | M | 93.6 | Very high | 93.3 | Very high | 3 Ų | 3 | 16.6 Ų | 16.6 | 2% | 0.015 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -63.5 | -38.1 | 173.7 | -70.2 | -176.2 | -54.8 | 0 | 0 | 112 | N144 V145 Y151 L152 V356 V359 L360 I363 V393 | N144-M148 WeakPolarHBondContact O-CB 3.28Å; N144-M148 VanDerWaalsContact O-CG 3.28Å; N144-M148 WeakPolarHBondContact O-CG 3.49Å; N144-M148 PolarHBondContact O-N 2.97Å; V145-M148 HydrophobicContact CG2-CE 4.1Å; V145-M148 PolarHBondContact O-N 3.34Å; M148-Y151 PolarHBondContact O-N 3.42Å; M148-L152 WeakPolarHBondContact O-CG 3.18Å; M148-L152 PolarHBondContact O-N 3.48Å; M148-V356 HydrophobicContact CG-CG1 4.25Å; M148-V356 HydrophobicContact SD-CG1 4.42Å; M148-V359 HydrophobicContact CG-CB 4.13Å; M148-V359 HydrophobicContact CG-CG1 3.76Å; M148-L360 HydrophobicContact SD-CB 3.91Å; M148-L360 HydrophobicContact SD-CD1 4.29Å; M148-L360 HydrophobicContact SD-CG 4.35Å; M148-I363 HydrophobicContact CE-CD1 3.12Å; M148-I363 HydrophobicContact SD-CD1 3.85Å; M148-V393 HydrophobicContact CB-CG1 3.91Å; M148-V393 HydrophobicContact CB-CG2 4.21Å; M148-V393 HydrophobicContact CE-CG2 3.58Å |
| 149 | S | 94.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -64.4 | -41.2 | 179.2 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | V145 G146 A147 L152 F153 V397 | V145-S149 WeakPolarHBondContact O-CB 3.34Å; V145-S149 PolarHBondContact O-N 2.93Å; V145-S149 PolarHBondContact O-OG 3.43Å; G146-S149 WeakPolarHBondContact O-CB 3.21Å; G146-S149 PolarHBondContact O-N 3.45Å; G146-S149 VanDerWaalsContact O-N 3.17Å; A147-S149 VanDerWaalsContact C-N 3.3Å; A147-S149 PolarHBondContact O-N 3.24Å; S149-L152 PolarHBondContact O-N 3.17Å; S149-F153 WeakPolarHBondContact O-CB 3.47Å; S149-F153 PolarHBondContact O-N 3.02Å; S149-V397 WeakPolarHBondContact O-CG2 3.4Å |
| 150 | S | 94.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -67.7 | -35.4 | 176 | 49.8 | 0 | 0 | 0 | 0 | 113.2 | S73 G146 A147 F153 I154 | S73-S150 WeakPolarHBondContact OG-CB 3.29Å; S73-S150 PolarHBondContact OG-OG 3.08Å; G146-S150 PolarHBondContact O-N 3.19Å; G146-S150 PolarHBondContact O-OG 2.73Å; A147-S150 PolarHBondContact O-N 2.9Å; A147-S150 PolarHBondContact O-OG 2.67Å; S150-F153 PolarHBondContact O-N 3.4Å; S150-I154 WeakPolarHBondContact O-CG1 3.26Å; S150-I154 PolarHBondContact O-N 2.87Å; S150-I154 VanDerWaalsContact O-N 3.14Å |
| 151 | Y | 94.3 | Very high | 92.8 | Very high | 6 Ų | 6 | 13.6 Ų | 13.6 | 2% | 0.024 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -63.9 | -45.2 | 171.6 | -62.1 | -47.7 | 0 | 0 | 0 | 112.8 | G72 A147 M148 F153 I154 I155 V352 T355 V356 V359 | G72-Y151 WeakPolarHBondContact CA-OH 3.19Å; A147-Y151 HydrophobicContact CB-CE2 4.36Å; A147-Y151 WeakPolarHBondContact O-CD2 3.44Å; A147-Y151 WeakPolarHBondContact O-CE2 3.34Å; A147-Y151 PolarHBondContact O-N 3.45Å; M148-Y151 PolarHBondContact O-N 3.42Å; Y151-F153 VanDerWaalsContact C-N 3.28Å; Y151-F153 PolarHBondContact O-N 3.2Å; Y151-I154 PolarHBondContact O-N 2.99Å; Y151-I155 PolarHBondContact O-N 2.68Å; Y151-I155 VanDerWaalsContact O-N 3.14Å; Y151-V352 HydrophobicContact CD1-CB 3.82Å; Y151-V352 HydrophobicContact CD1-CG1 3.75Å; Y151-V352 HydrophobicContact CE1-CG1 4.39Å; Y151-V352 HydrophobicContact CG-CB 4.26Å; Y151-T355 HydrophobicContact CE1-CG2 4.19Å; Y151-T355 HydrophobicContact CE2-CG2 3.83Å; Y151-T355 WeakPolarHBondContact OH-CG2 3.25Å; Y151-V356 VanDerWaalsContact CB-CG2 3.48Å; Y151-V356 HydrophobicContact CD2-CG2 3.72Å; Y151-V356 HydrophobicContact CG-CG2 3.95Å; Y151-V359 HydrophobicContact CE2-CG2 3.97Å |
| 152 | L | 94.6 | Very high | 92.7 | Very high | 1 Ų | 1 | 12.4 Ų | 12.4 | 1% | 0.005 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -68.2 | -29.8 | 177.7 | -70.8 | -160.1 | 0 | 0 | 0 | 111.8 | M148 S149 I155 K156 V183 I191 V356 L390 V393 V397 | M148-L152 WeakPolarHBondContact O-CG 3.18Å; M148-L152 PolarHBondContact O-N 3.48Å; S149-L152 PolarHBondContact O-N 3.17Å; L152-I155 HydrophobicContact CD2-CD1 3.93Å; L152-I155 PolarHBondContact O-N 3.2Å; L152-K156 WeakPolarHBondContact O-CB 3.33Å; L152-K156 PolarHBondContact O-N 3.4Å; L152-V183 HydrophobicContact CB-CG2 3.89Å; L152-V183 HydrophobicContact CD1-CG2 4.38Å; L152-V183 HydrophobicContact CD2-CG2 4.33Å; L152-V183 HydrophobicContact CG-CG2 4.42Å; L152-V183 WeakPolarHBondContact O-CG2 3.21Å; L152-I191 HydrophobicContact CD2-CD1 3.44Å; L152-I191 VanDerWaalsContact CD2-CD1 3.44Å; L152-V356 HydrophobicContact CD2-CG2 4.31Å; L152-L390 HydrophobicContact CD1-CD1 4.39Å; L152-V393 HydrophobicContact CD1-CB 4.24Å; L152-V393 HydrophobicContact CD1-CG1 3.56Å; L152-V393 HydrophobicContact CG-CG1 4.09Å; L152-V397 HydrophobicContact CB-CG1 4.4Å; L152-V397 HydrophobicContact CB-CG2 3.9Å |
| 153 | F | 94.6 | Very high | 92.4 | Very high | 14 Ų | 14 | 11.6 Ų | 11.6 | 6% | 0.061 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -63.2 | -45.9 | 172.2 | -169.2 | -78.8 | 0 | 0 | 0 | 111.2 | S149 S150 Y151 I155 K156 S157 V397 I403 I406 | S149-F153 WeakPolarHBondContact O-CB 3.47Å; S149-F153 PolarHBondContact O-N 3.02Å; S150-F153 PolarHBondContact O-N 3.4Å; Y151-F153 VanDerWaalsContact C-N 3.28Å; Y151-F153 PolarHBondContact O-N 3.2Å; F153-I155 VanDerWaalsContact C-N 3.27Å; F153-I155 PolarHBondContact O-N 2.92Å; F153-K156 CarbonylContact O-C 3.45Å; F153-K156 WeakPolarHBondContact O-CA 3.44Å; F153-K156 WeakPolarHBondContact O-CB 3.46Å; F153-K156 PolarHBondContact O-N 3.16Å; F153-S157 PolarHBondContact O-N 3.25Å; F153-S157 PolarHBondContact O-OG 3.34Å; F153-S157 VanDerWaalsContact O-OG 3.12Å; F153-V397 HydrophobicContact CB-CG1 4.2Å; F153-V397 HydrophobicContact CD2-CG1 4.37Å; F153-I403 HydrophobicContact CB-CD1 4.45Å; F153-I403 HydrophobicContact CB-CG1 4.49Å; F153-I403 HydrophobicContact CD1-CB 3.71Å; F153-I403 HydrophobicContact CD1-CD1 4.03Å; F153-I403 HydrophobicContact CD1-CG1 4.09Å; F153-I403 HydrophobicContact CE1-CB 3.82Å; F153-I403 HydrophobicContact CE1-CG2 4.49Å; F153-I403 HydrophobicContact CG-CB 4.18Å; F153-I403 HydrophobicContact CG-CG1 4.33Å; F153-I403 HydrophobicContact CZ-CB 4.38Å; F153-I406 HydrophobicContact CB-CD1 4.43Å; F153-I406 HydrophobicContact CD2-CD1 4.42Å |
| 154 | I | 93.3 | Very high | 92 | Very high | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -58.7 | -40.8 | 175.1 | -64.6 | 160.2 | 0 | 0 | 0 | 110.8 | L76 S150 Y151 K156 S157 E158 V348 V352 I403 | L76-I154 HydrophobicContact CD1-CD1 3.49Å; L76-I154 VanDerWaalsContact CD1-CD1 3.49Å; L76-I154 HydrophobicContact CD1-CG1 3.87Å; L76-I154 HydrophobicContact CD1-CG2 4.37Å; S150-I154 WeakPolarHBondContact O-CG1 3.26Å; S150-I154 PolarHBondContact O-N 2.87Å; S150-I154 VanDerWaalsContact O-N 3.14Å; Y151-I154 PolarHBondContact O-N 2.99Å; I154-K156 VanDerWaalsContact C-N 3.32Å; I154-K156 PolarHBondContact O-N 3.42Å; I154-S157 WeakPolarHBondContact CA-OG 3.48Å; I154-S157 PolarHBondContact O-N 3.33Å; I154-S157 PolarHBondContact O-OG 3.45Å; I154-E158 HydrophobicContact CG2-CG 4.17Å; I154-E158 VanDerWaalsContact O-CB 3.32Å; I154-E158 WeakPolarHBondContact O-CB 3.39Å; I154-E158 PolarHBondContact O-N 3.02Å; I154-V348 HydrophobicContact CG2-CG1 4.15Å; I154-V352 HydrophobicContact CD1-CG1 4.09Å; I154-V352 HydrophobicContact CG2-CG2 4.45Å; I154-I403 HydrophobicContact CD1-CD1 4.47Å; I154-I403 HydrophobicContact CG1-CD1 4Å |
| 155 | I | 93.9 | Very high | 91.6 | Very high | 1 Ų | 1 | 13 Ų | 13 | 1% | 0.005 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -63 | -41 | 174.6 | -66.4 | 164.6 | 0 | 0 | 0 | 110.8 | Y151 L152 F153 L159 V183 V186 I191 L349 V352 | Y151-I155 PolarHBondContact O-N 2.68Å; Y151-I155 VanDerWaalsContact O-N 3.14Å; L152-I155 HydrophobicContact CD2-CD1 3.93Å; L152-I155 PolarHBondContact O-N 3.2Å; F153-I155 VanDerWaalsContact C-N 3.27Å; F153-I155 PolarHBondContact O-N 2.92Å; I155-L159 HydrophobicContact CG2-CB 4.35Å; I155-L159 HydrophobicContact CG2-CD2 4Å; I155-L159 WeakPolarHBondContact O-CB 3.07Å; I155-L159 PolarHBondContact O-N 3.48Å; I155-V183 HydrophobicContact CG2-CG2 4.39Å; I155-V186 HydrophobicContact CD1-CG1 4.26Å; I155-V186 HydrophobicContact CG2-CB 4.27Å; I155-V186 HydrophobicContact CG2-CG1 4.26Å; I155-V186 HydrophobicContact CG2-CG2 4.33Å; I155-I191 HydrophobicContact CD1-CD1 4.17Å; I155-L349 HydrophobicContact CB-CD2 4.34Å; I155-L349 HydrophobicContact CG1-CD2 4Å; I155-V352 HydrophobicContact CD1-CG2 4.19Å; I155-V352 HydrophobicContact CG1-CG2 3.88Å |
| 156 | K | 92.6 | Very high | 91.2 | Very high | 38 Ų | 38 | 17.9 Ų | 17.9 | 17% | 0.165 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.8 | -39 | 178.4 | 168.5 | -178.3 | 160.5 | 178.5 | 0 | 112.6 | L152 F153 I154 P160 G179 N180 V183 V397 | L152-K156 WeakPolarHBondContact O-CB 3.33Å; L152-K156 PolarHBondContact O-N 3.4Å; F153-K156 CarbonylContact O-C 3.45Å; F153-K156 WeakPolarHBondContact O-CA 3.44Å; F153-K156 WeakPolarHBondContact O-CB 3.46Å; F153-K156 PolarHBondContact O-N 3.16Å; I154-K156 VanDerWaalsContact C-N 3.32Å; I154-K156 PolarHBondContact O-N 3.42Å; K156-P160 WeakPolarHBondContact O-CD 3.19Å; K156-P160 WeakPolarHBondContact O-CG 3.45Å; K156-G179 WeakPolarHBondContact O-CA 3.15Å; K156-N180 WeakPolarHBondContact CD-OD1 3.24Å; K156-N180 WeakPolarHBondContact CE-OD1 3.14Å; K156-N180 PolarHBondContact NZ-OD1 2.99Å; K156-V183 HydrophobicContact CB-CB 4.14Å; K156-V183 HydrophobicContact CB-CG1 4.39Å; K156-V183 HydrophobicContact CB-CG2 4.46Å; K156-V397 HydrophobicContact CB-CG1 4.28Å; K156-V397 HydrophobicContact CD-CG1 3.79Å; K156-V397 PolarHBondContact NZ-O 3.34Å |
| 157 | S | 90.5 | Very high | 90.8 | Very high | 25 Ų | 25 | 21.9 Ų | 21.9 | 18% | 0.175 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -80.3 | -45.9 | -178.9 | 48.8 | 0 | 0 | 0 | 0 | 112.4 | F153 I154 E329 | F153-S157 PolarHBondContact O-N 3.25Å; F153-S157 PolarHBondContact O-OG 3.34Å; F153-S157 VanDerWaalsContact O-OG 3.12Å; I154-S157 WeakPolarHBondContact CA-OG 3.48Å; I154-S157 PolarHBondContact O-N 3.33Å; I154-S157 PolarHBondContact O-OG 3.45Å; S157-E329 PolarHBondContact OG-OE2 3.03Å |
| 158 | E | 91.4 | Very high | 90.2 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -93.2 | -32 | -167.5 | -63 | -65.6 | 141.1 | 0 | 0 | 114.2 | I154 L161 V162 E329 L331 R345 L349 | I154-E158 HydrophobicContact CG2-CG 4.17Å; I154-E158 VanDerWaalsContact O-CB 3.32Å; I154-E158 WeakPolarHBondContact O-CB 3.39Å; I154-E158 PolarHBondContact O-N 3.02Å; E158-L161 WeakPolarHBondContact O-CB 3.04Å; E158-L161 PolarHBondContact O-N 3.01Å; E158-V162 WeakPolarHBondContact O-CG2 3.34Å; E158-V162 PolarHBondContact O-N 3.15Å; E158-V162 VanDerWaalsContact O-N 3.15Å; E158-E329 WeakPolarHBondContact CG-OE1 3.44Å; E158-L331 HydrophobicContact CG-CB 4.48Å; E158-L331 HydrophobicContact CG-CD2 4.22Å; E158-R345 VanDerWaalsContact OE2-CD 3.23Å; E158-R345 WeakPolarHBondContact OE2-CD 3.41Å; E158-R345 WeakPolarHBondContact OE2-CG 3.32Å; E158-R345 IonicContact OE2-CZ 3.47Å; E158-R345 IonicContact OE2-NE 3.99Å; E158-R345 PolarHBondContact OE2-NE 3.39Å; E158-R345 IonicContact OE2-NH2 3.6Å; E158-L349 HydrophobicContact CB-CD1 4.43Å; E158-L349 HydrophobicContact CB-CD2 4.12Å; E158-L349 HydrophobicContact CB-CG 4.36Å |
| 159 | L | 91.7 | Very high | 89.4 | Confident | 29 Ų | 29 | 34.4 Ų | 34.4 | 15% | 0.152 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.6 | -41.6 | -177.4 | -176.3 | 60.1 | 0 | 0 | 0 | 113.7 | I155 L161 V162 I163 L182 V186 L349 | I155-L159 HydrophobicContact CG2-CB 4.35Å; I155-L159 HydrophobicContact CG2-CD2 4Å; I155-L159 WeakPolarHBondContact O-CB 3.07Å; I155-L159 PolarHBondContact O-N 3.48Å; L159-L161 VanDerWaalsContact C-N 3.27Å; L159-L161 PolarHBondContact O-N 3.31Å; L159-V162 PolarHBondContact O-N 3.44Å; L159-I163 HydrophobicContact CD1-CD1 3.89Å; L159-I163 HydrophobicContact CD1-CG1 4.09Å; L159-I163 HydrophobicContact CG-CD1 3.84Å; L159-I163 HydrophobicContact CG-CG1 4.42Å; L159-I163 WeakPolarHBondContact O-CG1 3.38Å; L159-I163 PolarHBondContact O-N 3.36Å; L159-L182 HydrophobicContact CD2-CB 4.1Å; L159-L182 HydrophobicContact CD2-CD2 4.32Å; L159-L182 HydrophobicContact CG-CD1 4.47Å; L159-V186 HydrophobicContact CD2-CG2 3.5Å; L159-V186 VanDerWaalsContact CD2-CG2 3.5Å; L159-L349 HydrophobicContact CB-CD1 4.26Å; L159-L349 HydrophobicContact CB-CD2 4.27Å; L159-L349 HydrophobicContact CD1-CD1 4.09Å |
| 160 | P | 90.2 | Very high | 88.3 | Confident | 11 Ų | 11 | 40.6 Ų | 40.6 | 7% | 0.071 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -55.7 | -42.4 | 173.1 | -27.1 | 36.1 | 0 | 0 | 0 | 113.1 | K156 I163 G164 L177 L182 | K156-P160 WeakPolarHBondContact O-CD 3.19Å; K156-P160 WeakPolarHBondContact O-CG 3.45Å; P160-I163 PolarHBondContact O-N 3.01Å; P160-G164 PolarHBondContact O-N 3.03Å; P160-L177 VanDerWaalsContact CB-O 3.31Å; P160-L177 WeakPolarHBondContact CB-O 3.14Å; P160-L177 WeakPolarHBondContact CG-O 3.47Å; P160-L177 VanDerWaalsContact O-CD2 3.28Å; P160-L177 WeakPolarHBondContact O-CD2 3.31Å; P160-L182 HydrophobicContact CB-CD1 4.27Å; P160-L182 HydrophobicContact CG-CD1 3.87Å |
| 161 | L | 86.9 | Confident | 86.8 | Confident | 29 Ų | 29 | 42.2 Ų | 42.2 | 15% | 0.152 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.4 | -46.2 | -178.1 | -57.6 | -179.6 | 0 | 0 | 0 | 110.5 | E158 L159 G164 T165 P171 Q336 | E158-L161 WeakPolarHBondContact O-CB 3.04Å; E158-L161 PolarHBondContact O-N 3.01Å; L159-L161 VanDerWaalsContact C-N 3.27Å; L159-L161 PolarHBondContact O-N 3.31Å; L161-G164 PolarHBondContact O-N 3.22Å; L161-T165 PolarHBondContact O-N 3.26Å; L161-T165 PolarHBondContact O-OG1 3.47Å; L161-P171 HydrophobicContact CD2-CG 4.4Å; L161-Q336 VanDerWaalsContact CD2-NE2 3.32Å |
| 162 | V | 89.4 | Confident | 85.3 | Confident | 3 Ų | 3 | 51.2 Ų | 51.2 | 2% | 0.018 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.6 | -48.8 | 177.8 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | E158 L159 T165 F166 L342 R345 L346 L349 | E158-V162 WeakPolarHBondContact O-CG2 3.34Å; E158-V162 PolarHBondContact O-N 3.15Å; E158-V162 VanDerWaalsContact O-N 3.15Å; L159-V162 PolarHBondContact O-N 3.44Å; V162-T165 PolarHBondContact O-N 3.42Å; V162-F166 HydrophobicContact CG1-CD2 3.77Å; V162-F166 HydrophobicContact CG1-CE2 3.62Å; V162-F166 WeakPolarHBondContact O-CD2 3.35Å; V162-F166 PolarHBondContact O-N 2.94Å; V162-F166 VanDerWaalsContact O-N 3.08Å; V162-L342 HydrophobicContact CB-CD1 4.22Å; V162-L342 HydrophobicContact CG1-CD1 4Å; V162-L342 HydrophobicContact CG2-CD1 4.12Å; V162-R345 HydrophobicContact CG2-CB 3.56Å; V162-R345 HydrophobicContact CG2-CG 4.42Å; V162-L346 HydrophobicContact CG1-CD2 3.55Å; V162-L346 HydrophobicContact CG1-CG 3.88Å; V162-L349 HydrophobicContact CB-CD1 4.45Å; V162-L349 HydrophobicContact CG2-CD1 3.84Å |
| 163 | I | 88.2 | Confident | 83.8 | Confident | 44 Ų | 44 | 54.2 Ų | 54.2 | 23% | 0.226 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.4 | -42.2 | -179.2 | -64.7 | 172.2 | 0 | 0 | 0 | 110.9 | L159 P160 T165 F166 L167 F176 L177 L182 | L159-I163 HydrophobicContact CD1-CD1 3.89Å; L159-I163 HydrophobicContact CD1-CG1 4.09Å; L159-I163 HydrophobicContact CG-CD1 3.84Å; L159-I163 HydrophobicContact CG-CG1 4.42Å; L159-I163 WeakPolarHBondContact O-CG1 3.38Å; L159-I163 PolarHBondContact O-N 3.36Å; P160-I163 PolarHBondContact O-N 3.01Å; I163-T165 PolarHBondContact O-N 3.34Å; I163-F166 PolarHBondContact O-N 3.35Å; I163-L167 HydrophobicContact CG2-CD1 3.61Å; I163-L167 HydrophobicContact CG2-CG 4.21Å; I163-L167 WeakPolarHBondContact O-CB 3.43Å; I163-L167 WeakPolarHBondContact O-CG 3.34Å; I163-L167 PolarHBondContact O-N 2.88Å; I163-F176 HydrophobicContact CG2-CE2 4.45Å; I163-L177 HydrophobicContact CB-CD2 3.92Å; I163-L177 HydrophobicContact CG2-CD2 3.84Å; I163-L182 HydrophobicContact CD1-CD1 4.04Å; I163-L182 HydrophobicContact CD1-CD2 3.7Å |
| 164 | G | 85.1 | Confident | 82.7 | Confident | 4 Ų | 4 | 56.3 Ų | 56.3 | 4% | 0.041 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.6 | -44.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | P160 L161 F166 L167 H168 M169 | P160-G164 PolarHBondContact O-N 3.03Å; L161-G164 PolarHBondContact O-N 3.22Å; G164-F166 PolarHBondContact O-N 3.46Å; G164-L167 PolarHBondContact O-N 3.11Å; G164-H168 WeakPolarHBondContact O-CA 3.2Å; G164-H168 PolarHBondContact O-N 3.1Å; G164-M169 CarbonylContact C-O 3.57Å; G164-M169 WeakPolarHBondContact CA-O 3.22Å; G164-M169 PolarHBondContact O-N 2.68Å |
| 165 | T | 85.1 | Confident | 81.9 | Confident | 40 Ų | 40 | 64.8 Ų | 64.8 | 25% | 0.245 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 175.5 | -51.4 | 0 | 0 | 0 | 0 | 112.2 | L161 V162 I163 H168 L342 | L161-T165 PolarHBondContact O-N 3.26Å; L161-T165 PolarHBondContact O-OG1 3.47Å; V162-T165 PolarHBondContact O-N 3.42Å; I163-T165 PolarHBondContact O-N 3.34Å; T165-H168 PolarHBondContact O-N 3.28Å; T165-L342 HydrophobicContact CG2-CD1 4.35Å; T165-L342 HydrophobicContact CG2-CD2 4.13Å |
| 166 | F | 84.8 | Confident | 81 | Confident | 117 Ų | 117 | 67.9 Ų | 67.9 | 51% | 0.513 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -66.7 | -39 | 177.4 | -84.4 | -65.9 | 0 | 0 | 0 | 113.2 | V162 I163 G164 H168 L342 L346 | V162-F166 HydrophobicContact CG1-CD2 3.77Å; V162-F166 HydrophobicContact CG1-CE2 3.62Å; V162-F166 WeakPolarHBondContact O-CD2 3.35Å; V162-F166 PolarHBondContact O-N 2.94Å; V162-F166 VanDerWaalsContact O-N 3.08Å; I163-F166 PolarHBondContact O-N 3.35Å; G164-F166 PolarHBondContact O-N 3.46Å; F166-H168 VanDerWaalsContact C-N 3.34Å; F166-H168 PolarHBondContact O-ND1 3.47Å; F166-L342 HydrophobicContact CE1-CD2 4.27Å; F166-L342 HydrophobicContact CE2-CD1 4.21Å; F166-L342 HydrophobicContact CE2-CD2 4.1Å; F166-L342 HydrophobicContact CE2-CG 4.26Å; F166-L342 HydrophobicContact CZ-CD2 3.89Å; F166-L342 HydrophobicContact CZ-CG 4.34Å; F166-L346 HydrophobicContact CE2-CD1 3.84Å; F166-L346 HydrophobicContact CE2-CD2 4.42Å; F166-L346 HydrophobicContact CE2-CG 4.41Å; F166-L346 HydrophobicContact CZ-CD1 3.86Å |
| 167 | L | 84.3 | Confident | 80.3 | Confident | 88 Ų | 88 | 66.1 Ų | 66.1 | 46% | 0.461 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -85.8 | -6.4 | -178.3 | -64.3 | 178.6 | 0 | 0 | 0 | 113.3 | I163 G164 M169 F176 | I163-L167 HydrophobicContact CG2-CD1 3.61Å; I163-L167 HydrophobicContact CG2-CG 4.21Å; I163-L167 WeakPolarHBondContact O-CB 3.43Å; I163-L167 WeakPolarHBondContact O-CG 3.34Å; I163-L167 PolarHBondContact O-N 2.88Å; G164-L167 PolarHBondContact O-N 3.11Å; L167-M169 HydrophobicContact CB-CB 4.34Å; L167-M169 HydrophobicContact CB-CG 4.15Å; L167-M169 WeakPolarHBondContact O-CG 3.41Å; L167-M169 PolarHBondContact O-N 2.93Å; L167-F176 HydrophobicContact CD1-CE2 3.81Å; L167-F176 HydrophobicContact CD1-CZ 4.07Å |
| 168 | H | 80.4 | Confident | 80 | Confident | 175 Ų | 175 | 71.3 Ų | 71.3 | 81% | 0.81 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 41.8 | -171.3 | -57.3 | 70.8 | 0 | 0 | 0 | 111.7 | G164 T165 F166 | G164-H168 WeakPolarHBondContact O-CA 3.2Å; G164-H168 PolarHBondContact O-N 3.1Å; T165-H168 PolarHBondContact O-N 3.28Å; F166-H168 VanDerWaalsContact C-N 3.34Å; F166-H168 PolarHBondContact O-ND1 3.47Å |
| 169 | M | 77.6 | Confident | 79.7 | Confident | 96 Ų | 96 | 71.9 Ų | 71.9 | 47% | 0.473 | 37% | 0.365 | S | S | . | . | trans | -125.1 | 145.7 | -178.3 | -67 | -161.8 | 170.9 | 0 | 0 | 111.2 | G164 L167 P171 L177 | G164-M169 CarbonylContact C-O 3.57Å; G164-M169 WeakPolarHBondContact CA-O 3.22Å; G164-M169 PolarHBondContact O-N 2.68Å; L167-M169 HydrophobicContact CB-CB 4.34Å; L167-M169 HydrophobicContact CB-CG 4.15Å; L167-M169 WeakPolarHBondContact O-CG 3.41Å; L167-M169 PolarHBondContact O-N 2.93Å; M169-P171 WeakPolarHBondContact O-CD 3.46Å; M169-L177 HydrophobicContact CB-CD1 4.38Å | ||
| 170 | D | 70.6 | Confident | 79.5 | Confident | 131 Ų | 131 | 73.7 Ų | 73.7 | 70% | 0.701 | 38% | 0.375 | S | S | * | . | trans | -68.8 | 122 | 177.9 | -74.7 | -32.5 | 0 | 0 | 0 | 110.6 | E172 G173 | D170-E172 PolarHBondContact O-N 3.08Å; D170-G173 PolarHBondContact O-N 2.97Å | ||
| 171 | P | 64.2 | Low | 79.5 | Confident | 33 Ų | 33 | 76.3 Ų | 76.3 | 21% | 0.214 | 39% | 0.387 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | -21.3 | 179.6 | -23.3 | 32.3 | 0 | 0 | 0 | 114.2 | L161 M169 L177 | L161-P171 HydrophobicContact CD2-CG 4.4Å; M169-P171 WeakPolarHBondContact O-CD 3.46Å; P171-L177 WeakPolarHBondContact O-CB 3.39Å |
| 172 | E | 61.9 | Low | 79.6 | Confident | 195 Ų | 195 | 75.7 Ų | 75.7 | 91% | 0.911 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | -21.9 | -176.6 | -61.8 | -165.9 | 163.7 | 0 | 0 | 113.8 | D170 | D170-E172 PolarHBondContact O-N 3.08Š|
| 173 | G | 63.2 | Low | 79.8 | Confident | 65 Ų | 65 | 75.5 Ų | 75.5 | 67% | 0.67 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | -33.6 | -173 | 0 | 0 | 0 | 0 | 0 | 114.1 | D170 | D170-G173 PolarHBondContact O-N 2.97Š|
| 174 | D | 72.6 | Confident | 80.1 | Confident | 57 Ų | 57 | 76.9 Ų | 76.9 | 31% | 0.305 | 39% | 0.39 | S | S | . | . | trans | -109.7 | 137.1 | -166.1 | -77.5 | -37.2 | 0 | 0 | 0 | 114.3 | F176 L177 | D174-F176 HydrophobicContact CB-CD1 3.71Å; D174-F176 HydrophobicContact CB-CE1 3.42Å; D174-F176 VanDerWaalsContact CB-CE1 3.42Å; D174-F176 HydrophobicContact CB-CZ 4.09Å; D174-F176 PolarHBondContact O-N 2.93Å; D174-F176 VanDerWaalsContact O-N 3.16Å; D174-F176 WeakPolarHBondContact OD2-CE1 3.32Å; D174-L177 HydrophobicContact CB-CD1 4.04Å; D174-L177 PolarHBondContact O-N 2.84Å; D174-L177 VanDerWaalsContact O-N 3.14Å | ||
| 175 | W | 75.3 | Confident | 80.4 | Confident | 179 Ų | 179 | 80.8 Ų | 80.8 | 68% | 0.678 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -61.5 | -28.1 | -177.1 | 71.8 | -87 | 0 | 0 | 0 | 113.5 | L181 | W175-L181 HydrophobicContact CE3-CD2 3.61Å; W175-L181 HydrophobicContact CZ3-CD2 3.48Å; W175-L181 VanDerWaalsContact CZ3-CD2 3.48Å |
| 176 | F | 76.1 | Confident | 80.8 | Confident | 65 Ų | 65 | 79.5 Ų | 79.5 | 29% | 0.285 | 40% | 0.402 | S | S | . | . | G | 310 helix | trans | -81 | -19.3 | -178.5 | 72.2 | -93.4 | 0 | 0 | 0 | 113.3 | I163 L167 D174 K178 L182 | I163-F176 HydrophobicContact CG2-CE2 4.45Å; L167-F176 HydrophobicContact CD1-CE2 3.81Å; L167-F176 HydrophobicContact CD1-CZ 4.07Å; D174-F176 HydrophobicContact CB-CD1 3.71Å; D174-F176 HydrophobicContact CB-CE1 3.42Å; D174-F176 VanDerWaalsContact CB-CE1 3.42Å; D174-F176 HydrophobicContact CB-CZ 4.09Å; D174-F176 PolarHBondContact O-N 2.93Å; D174-F176 VanDerWaalsContact O-N 3.16Å; D174-F176 WeakPolarHBondContact OD2-CE1 3.32Å; F176-K178 VanDerWaalsContact C-N 3.33Å; F176-L182 WeakPolarHBondContact O-CG 3.44Å |
| 177 | L | 77.8 | Confident | 81.2 | Confident | 2 Ų | 2 | 73.9 Ų | 73.9 | 1% | 0.01 | 38% | 0.377 | C | S | . | . | G | 310 helix | trans | -86.2 | -3.7 | 176.7 | -84.9 | 151.4 | 0 | 0 | 0 | 112.8 | P160 I163 M169 P171 D174 G179 | P160-L177 VanDerWaalsContact CB-O 3.31Å; P160-L177 WeakPolarHBondContact CB-O 3.14Å; P160-L177 WeakPolarHBondContact CG-O 3.47Å; P160-L177 VanDerWaalsContact O-CD2 3.28Å; P160-L177 WeakPolarHBondContact O-CD2 3.31Å; I163-L177 HydrophobicContact CB-CD2 3.92Å; I163-L177 HydrophobicContact CG2-CD2 3.84Å; M169-L177 HydrophobicContact CB-CD1 4.38Å; P171-L177 WeakPolarHBondContact O-CB 3.39Å; D174-L177 HydrophobicContact CB-CD1 4.04Å; D174-L177 PolarHBondContact O-N 2.84Å; D174-L177 VanDerWaalsContact O-N 3.14Å; L177-G179 PolarHBondContact O-N 3.12Å; L177-G179 VanDerWaalsContact O-N 3.09Å |
| 178 | K | 84.2 | Confident | 81.6 | Confident | 133 Ų | 133 | 73.5 Ų | 73.5 | 58% | 0.578 | 37% | 0.374 | S | S | * | . | trans | -60.6 | 116.2 | 174.1 | -69.4 | -179.6 | 177.8 | 176 | 0 | 110.4 | F176 N180 L181 L182 | F176-K178 VanDerWaalsContact C-N 3.33Å; K178-N180 PolarHBondContact O-N 3.48Å; K178-N180 VanDerWaalsContact O-N 3.07Å; K178-L181 HydrophobicContact CB-CB 4.43Å; K178-L181 WeakPolarHBondContact O-CB 3.36Å; K178-L181 PolarHBondContact O-N 3.45Å; K178-L182 PolarHBondContact O-N 2.93Å; K178-L182 VanDerWaalsContact O-N 3.14Å | ||
| 179 | G | 83.5 | Confident | 82.2 | Confident | 14 Ų | 14 | 70.8 Ų | 70.8 | 14% | 0.144 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -52.2 | -35.3 | -180 | 0 | 0 | 0 | 0 | 0 | 114.2 | K156 L177 L181 L182 V183 | K156-G179 WeakPolarHBondContact O-CA 3.15Å; L177-G179 PolarHBondContact O-N 3.12Å; L177-G179 VanDerWaalsContact O-N 3.09Å; G179-L181 VanDerWaalsContact C-N 3.32Å; G179-L181 PolarHBondContact O-N 2.86Å; G179-L182 PolarHBondContact O-N 3.37Å; G179-V183 WeakPolarHBondContact O-CG1 3.36Å; G179-V183 PolarHBondContact O-N 2.91Å |
| 180 | N | 89.2 | Confident | 82.9 | Confident | 67 Ų | 67 | 69.9 Ų | 69.9 | 36% | 0.358 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63 | -34 | 175.6 | -67.7 | -20 | 0 | 0 | 0 | 113.4 | K156 K178 V183 I184 I398 | K156-N180 WeakPolarHBondContact CD-OD1 3.24Å; K156-N180 WeakPolarHBondContact CE-OD1 3.14Å; K156-N180 PolarHBondContact NZ-OD1 2.99Å; K178-N180 PolarHBondContact O-N 3.48Å; K178-N180 VanDerWaalsContact O-N 3.07Å; N180-V183 WeakPolarHBondContact O-CG1 3.48Å; N180-I184 VanDerWaalsContact O-CD1 3.32Å; N180-I184 WeakPolarHBondContact O-CD1 3.17Å; N180-I184 VanDerWaalsContact O-CG1 3.31Å; N180-I184 WeakPolarHBondContact O-CG1 3.23Å; N180-I398 HydrophobicContact CB-CG1 4.36Å |
| 181 | L | 89.5 | Confident | 83.9 | Confident | 65 Ų | 65 | 63.7 Ų | 63.7 | 34% | 0.34 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -78.1 | -44.5 | 176.7 | 177.9 | 68.5 | 0 | 0 | 0 | 110.6 | W175 K178 G179 V183 I184 L185 | W175-L181 HydrophobicContact CE3-CD2 3.61Å; W175-L181 HydrophobicContact CZ3-CD2 3.48Å; W175-L181 VanDerWaalsContact CZ3-CD2 3.48Å; K178-L181 HydrophobicContact CB-CB 4.43Å; K178-L181 WeakPolarHBondContact O-CB 3.36Å; K178-L181 PolarHBondContact O-N 3.45Å; G179-L181 VanDerWaalsContact C-N 3.32Å; G179-L181 PolarHBondContact O-N 2.86Å; L181-V183 PolarHBondContact O-N 3.4Å; L181-I184 PolarHBondContact O-N 3.25Å; L181-L185 PolarHBondContact O-N 3.49Å |
| 182 | L | 89.9 | Confident | 85.2 | Confident | 16 Ų | 16 | 63 Ų | 63 | 8% | 0.084 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.5 | -41.5 | -178.7 | -78.7 | 166.6 | 0 | 0 | 0 | 112.3 | L159 P160 I163 F176 K178 G179 I184 L185 V186 | L159-L182 HydrophobicContact CD2-CB 4.1Å; L159-L182 HydrophobicContact CD2-CD2 4.32Å; L159-L182 HydrophobicContact CG-CD1 4.47Å; P160-L182 HydrophobicContact CB-CD1 4.27Å; P160-L182 HydrophobicContact CG-CD1 3.87Å; I163-L182 HydrophobicContact CD1-CD1 4.04Å; I163-L182 HydrophobicContact CD1-CD2 3.7Å; F176-L182 WeakPolarHBondContact O-CG 3.44Å; K178-L182 PolarHBondContact O-N 2.93Å; K178-L182 VanDerWaalsContact O-N 3.14Å; G179-L182 PolarHBondContact O-N 3.37Å; L182-I184 VanDerWaalsContact C-N 3.31Å; L182-I184 PolarHBondContact O-N 3.41Å; L182-L185 PolarHBondContact O-N 3.44Å; L182-V186 WeakPolarHBondContact O-CG2 3.21Å; L182-V186 PolarHBondContact O-N 3.37Å |
| 183 | V | 93.1 | Very high | 86.5 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.7 | -37.8 | 176.7 | 69.6 | 0 | 0 | 0 | 0 | 112.2 | L152 I155 K156 G179 N180 L181 S187 | L152-V183 HydrophobicContact CB-CG2 3.89Å; L152-V183 HydrophobicContact CD1-CG2 4.38Å; L152-V183 HydrophobicContact CD2-CG2 4.33Å; L152-V183 HydrophobicContact CG-CG2 4.42Å; L152-V183 WeakPolarHBondContact O-CG2 3.21Å; I155-V183 HydrophobicContact CG2-CG2 4.39Å; K156-V183 HydrophobicContact CB-CB 4.14Å; K156-V183 HydrophobicContact CB-CG1 4.39Å; K156-V183 HydrophobicContact CB-CG2 4.46Å; G179-V183 WeakPolarHBondContact O-CG1 3.36Å; G179-V183 PolarHBondContact O-N 2.91Å; N180-V183 WeakPolarHBondContact O-CG1 3.48Å; L181-V183 PolarHBondContact O-N 3.4Å; V183-S187 WeakPolarHBondContact O-CB 3.45Å; V183-S187 PolarHBondContact O-N 2.93Å; V183-S187 PolarHBondContact O-OG 3.33Å |
| 184 | I | 93.4 | Very high | 87.7 | Confident | 73 Ų | 73 | 56.3 Ų | 56.3 | 37% | 0.374 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66 | -44.7 | 175.3 | -65.8 | 169 | 0 | 0 | 0 | 109.9 | N180 L181 L182 S187 M188 I398 | N180-I184 VanDerWaalsContact O-CD1 3.32Å; N180-I184 WeakPolarHBondContact O-CD1 3.17Å; N180-I184 VanDerWaalsContact O-CG1 3.31Å; N180-I184 WeakPolarHBondContact O-CG1 3.23Å; L181-I184 PolarHBondContact O-N 3.25Å; L182-I184 VanDerWaalsContact C-N 3.31Å; L182-I184 PolarHBondContact O-N 3.41Å; I184-S187 WeakPolarHBondContact O-CB 3.29Å; I184-S187 PolarHBondContact O-N 3.12Å; I184-M188 HydrophobicContact CG2-CG 4.41Å; I184-M188 WeakPolarHBondContact O-CB 3.29Å; I184-M188 WeakPolarHBondContact O-CG 3.46Å; I184-M188 PolarHBondContact O-N 3.48Å; I184-I398 HydrophobicContact CD1-CD1 4.04Å; I184-I398 HydrophobicContact CG1-CD1 4.37Å |
| 185 | L | 92.8 | Very high | 88.3 | Confident | 86 Ų | 86 | 53.8 Ų | 53.8 | 45% | 0.45 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.9 | -49.2 | -179.2 | -174.5 | 146.7 | 0 | 0 | 0 | 111.6 | L181 L182 S187 M188 L189 | L181-L185 PolarHBondContact O-N 3.49Å; L182-L185 PolarHBondContact O-N 3.44Å; L185-S187 VanDerWaalsContact C-N 3.32Å; L185-S187 PolarHBondContact O-N 2.65Å; L185-M188 PolarHBondContact O-N 2.92Å; L185-L189 HydrophobicContact CD1-CD1 4.4Å; L185-L189 HydrophobicContact CD2-CD1 3.71Å; L185-L189 HydrophobicContact CG-CD1 3.72Å; L185-L189 HydrophobicContact CG-CG 4.42Å; L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.32Å; L185-L189 WeakPolarHBondContact O-CG 3.36Å; L185-L189 PolarHBondContact O-N 3.14Å |
| 186 | V | 93.1 | Very high | 88.8 | Confident | 12 Ų | 12 | 47 Ų | 47 | 7% | 0.073 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.9 | -41.9 | 175.8 | 170.8 | 0 | 0 | 0 | 0 | 111 | I155 L159 L182 M188 I190 I191 T353 | I155-V186 HydrophobicContact CD1-CG1 4.26Å; I155-V186 HydrophobicContact CG2-CB 4.27Å; I155-V186 HydrophobicContact CG2-CG1 4.26Å; I155-V186 HydrophobicContact CG2-CG2 4.33Å; L159-V186 HydrophobicContact CD2-CG2 3.5Å; L159-V186 VanDerWaalsContact CD2-CG2 3.5Å; L182-V186 WeakPolarHBondContact O-CG2 3.21Å; L182-V186 PolarHBondContact O-N 3.37Å; V186-M188 PolarHBondContact O-N 3.47Å; V186-I190 HydrophobicContact CG1-CB 4.48Å; V186-I190 HydrophobicContact CG1-CD1 4.36Å; V186-I190 WeakPolarHBondContact O-CA 3.49Å; V186-I190 WeakPolarHBondContact O-CB 3.39Å; V186-I190 PolarHBondContact O-N 3.34Å; V186-I191 HydrophobicContact CG1-CD1 4.2Å; V186-I191 HydrophobicContact CG1-CG1 4.32Å; V186-I191 PolarHBondContact O-N 2.9Å; V186-I191 VanDerWaalsContact O-N 3.07Å; V186-T353 HydrophobicContact CG1-CG2 4.47Å |
| 187 | S | 92.8 | Very high | 89.1 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.252 | C | S | . | . | I | π-helix | trans | -57.7 | -49.9 | 176.9 | -69.7 | 0 | 0 | 0 | 0 | 111.6 | V183 I184 L185 I191 L192 L390 N394 | V183-S187 WeakPolarHBondContact O-CB 3.45Å; V183-S187 PolarHBondContact O-N 2.93Å; V183-S187 PolarHBondContact O-OG 3.33Å; I184-S187 WeakPolarHBondContact O-CB 3.29Å; I184-S187 PolarHBondContact O-N 3.12Å; L185-S187 VanDerWaalsContact C-N 3.32Å; L185-S187 PolarHBondContact O-N 2.65Å; S187-I191 PolarHBondContact O-N 3.32Å; S187-L192 WeakPolarHBondContact O-CB 3.41Å; S187-L192 PolarHBondContact O-N 3.06Å; S187-L390 WeakPolarHBondContact O-CD2 3.45Å; S187-N394 WeakPolarHBondContact CB-ND2 3.33Å; S187-N394 PolarHBondContact OG-ND2 2.86Å; S187-N394 PolarHBondContact OG-OD1 2.94Å |
| 188 | M | 92.6 | Very high | 88.5 | Confident | 80 Ų | 80 | 52 Ų | 52 | 39% | 0.394 | 27% | 0.268 | S | S | . | . | I | π-helix | trans | -77.7 | -37.1 | -174.6 | -67.4 | -58.5 | -66.4 | 0 | 0 | 113.5 | I184 L185 V186 L192 P193 L387 L390 | I184-M188 HydrophobicContact CG2-CG 4.41Å; I184-M188 WeakPolarHBondContact O-CB 3.29Å; I184-M188 WeakPolarHBondContact O-CG 3.46Å; I184-M188 PolarHBondContact O-N 3.48Å; L185-M188 PolarHBondContact O-N 2.92Å; V186-M188 PolarHBondContact O-N 3.47Å; M188-L192 HydrophobicContact CE-CD2 3.78Å; M188-L192 HydrophobicContact SD-CD2 4.15Å; M188-P193 WeakPolarHBondContact O-CD 3.33Å; M188-L387 HydrophobicContact CE-CD1 3.88Å; M188-L387 HydrophobicContact SD-CD1 4.11Å; M188-L390 HydrophobicContact SD-CD2 4.44Å |
| 189 | L | 92.6 | Very high | 87.4 | Confident | 117 Ų | 117 | 52.8 Ų | 52.8 | 61% | 0.613 | 27% | 0.274 | S | S | * | . | I | π-helix | trans | -90.4 | -27.8 | -174.1 | -63.7 | -177.5 | 0 | 0 | 0 | 113.9 | L185 P193 | L185-L189 HydrophobicContact CD1-CD1 4.4Å; L185-L189 HydrophobicContact CD2-CD1 3.71Å; L185-L189 HydrophobicContact CG-CD1 3.72Å; L185-L189 HydrophobicContact CG-CG 4.42Å; L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.32Å; L185-L189 WeakPolarHBondContact O-CG 3.36Å; L185-L189 PolarHBondContact O-N 3.14Å; L189-P193 WeakPolarHBondContact O-CG 3.47Å |
| 190 | I | 91.9 | Very high | 86.3 | Confident | 78 Ų | 78 | 53.5 Ų | 53.5 | 40% | 0.4 | 27% | 0.274 | S | S | . | . | I | π-helix | trans | -115.7 | -57.6 | -174.7 | -53.4 | -179.7 | 0 | 0 | 0 | 110.1 | V186 P193 L194 T353 | V186-I190 HydrophobicContact CG1-CB 4.48Å; V186-I190 HydrophobicContact CG1-CD1 4.36Å; V186-I190 WeakPolarHBondContact O-CA 3.49Å; V186-I190 WeakPolarHBondContact O-CB 3.39Å; V186-I190 PolarHBondContact O-N 3.34Å; I190-P193 WeakPolarHBondContact O-CD 3.33Å; I190-L194 VanDerWaalsContact O-CD1 3.3Å; I190-L194 WeakPolarHBondContact O-CD1 3.43Å; I190-L194 PolarHBondContact O-N 3.15Å; I190-T353 HydrophobicContact CG2-CG2 3.73Å |
| 191 | I | 92.3 | Very high | 84.8 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | I | π-helix | trans | -68.7 | -44.6 | -171.4 | -61.3 | 176.7 | 0 | 0 | 0 | 111.3 | L152 I155 V186 S187 L194 A195 T353 V356 P357 L390 | L152-I191 HydrophobicContact CD2-CD1 3.44Å; L152-I191 VanDerWaalsContact CD2-CD1 3.44Å; I155-I191 HydrophobicContact CD1-CD1 4.17Å; V186-I191 HydrophobicContact CG1-CD1 4.2Å; V186-I191 HydrophobicContact CG1-CG1 4.32Å; V186-I191 PolarHBondContact O-N 2.9Å; V186-I191 VanDerWaalsContact O-N 3.07Å; S187-I191 PolarHBondContact O-N 3.32Å; I191-L194 PolarHBondContact O-N 3.31Å; I191-A195 WeakPolarHBondContact O-CB 3.25Å; I191-A195 PolarHBondContact O-N 2.96Å; I191-T353 HydrophobicContact CG1-CG2 4.07Å; I191-V356 HydrophobicContact CD1-CB 4.29Å; I191-V356 HydrophobicContact CD1-CG1 4.27Å; I191-V356 HydrophobicContact CD1-CG2 4.35Å; I191-V356 HydrophobicContact CG2-CB 4.09Å; I191-V356 HydrophobicContact CG2-CG1 3.48Å; I191-V356 VanDerWaalsContact CG2-CG1 3.48Å; I191-P357 HydrophobicContact CG2-CG 4.44Å; I191-L390 HydrophobicContact CG2-CD1 4.15Å |
| 192 | L | 91.2 | Very high | 83.6 | Confident | 20 Ų | 20 | 58 Ų | 58 | 11% | 0.105 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.4 | -51.5 | -178.2 | 178.2 | 67 | 0 | 0 | 0 | 112.1 | S187 M188 L194 A195 L196 A386 L387 L390 | S187-L192 WeakPolarHBondContact O-CB 3.41Å; S187-L192 PolarHBondContact O-N 3.06Å; M188-L192 HydrophobicContact CE-CD2 3.78Å; M188-L192 HydrophobicContact SD-CD2 4.15Å; L192-L194 VanDerWaalsContact C-N 3.28Å; L192-L194 PolarHBondContact O-N 2.73Å; L192-A195 PolarHBondContact O-N 3.4Å; L192-A195 VanDerWaalsContact O-N 3.15Å; L192-L196 HydrophobicContact CD1-CD1 4.17Å; L192-L196 HydrophobicContact CD1-CD2 4.32Å; L192-L196 HydrophobicContact CD1-CG 4.07Å; L192-L196 HydrophobicContact CG-CD1 4.12Å; L192-L196 HydrophobicContact CG-CG 4.4Å; L192-L196 VanDerWaalsContact O-CG 3.25Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.31Å; L192-A386 HydrophobicContact CD1-CB 4.37Å; L192-L387 HydrophobicContact CD2-CD1 4.12Å; L192-L390 HydrophobicContact CB-CD2 3.76Å; L192-L390 HydrophobicContact CD1-CD2 4.27Å |
| 193 | P | 90.2 | Very high | 82.5 | Confident | 67 Ų | 67 | 58.6 Ų | 58.6 | 44% | 0.435 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -55 | -42.9 | 174.7 | -28 | 35.7 | 0 | 0 | 0 | 113.2 | M188 L189 I190 L196 | M188-P193 WeakPolarHBondContact O-CD 3.33Å; L189-P193 WeakPolarHBondContact O-CG 3.47Å; I190-P193 WeakPolarHBondContact O-CD 3.33Å; P193-L196 PolarHBondContact O-N 3.44Å |
| 194 | L | 87.7 | Confident | 81.5 | Confident | 51 Ų | 51 | 58.8 Ų | 58.8 | 27% | 0.267 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 177.8 | -92.1 | 61.2 | 0 | 0 | 0 | 111.7 | I190 I191 L192 L196 M197 L354 P357 | I190-L194 VanDerWaalsContact O-CD1 3.3Å; I190-L194 WeakPolarHBondContact O-CD1 3.43Å; I190-L194 PolarHBondContact O-N 3.15Å; I191-L194 PolarHBondContact O-N 3.31Å; L192-L194 VanDerWaalsContact C-N 3.28Å; L192-L194 PolarHBondContact O-N 2.73Å; L194-L196 VanDerWaalsContact C-N 3.31Å; L194-L196 PolarHBondContact O-N 3.35Å; L194-M197 HydrophobicContact CB-CE 4.37Å; L194-M197 HydrophobicContact CG-CE 4.24Å; L194-M197 WeakPolarHBondContact O-CB 3.31Å; L194-M197 WeakPolarHBondContact O-CE 3.15Å; L194-M197 WeakPolarHBondContact O-CG 3.39Å; L194-M197 PolarHBondContact O-N 3.32Å; L194-L354 HydrophobicContact CD2-CD2 4.22Å; L194-P357 HydrophobicContact CB-CB 4.2Å; L194-P357 HydrophobicContact CB-CG 3.66Å; L194-P357 HydrophobicContact CD2-CG 4.24Å |
| 195 | A | 85.4 | Confident | 80.9 | Confident | 4 Ų | 4 | 62.4 Ų | 62.4 | 3% | 0.033 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -67.6 | -28.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | I191 L192 M197 P357 L360 R364 | I191-A195 WeakPolarHBondContact O-CB 3.25Å; I191-A195 PolarHBondContact O-N 2.96Å; L192-A195 PolarHBondContact O-N 3.4Å; L192-A195 VanDerWaalsContact O-N 3.15Å; A195-M197 PolarHBondContact O-N 3.22Å; A195-P357 HydrophobicContact CB-CB 4.47Å; A195-L360 HydrophobicContact CB-CD1 4.07Å; A195-L360 HydrophobicContact CB-CD2 4.05Å; A195-R364 PolarHBondContact O-NH1 3.15Å |
| 196 | L | 86.4 | Confident | 80.6 | Confident | 38 Ų | 38 | 60.4 Ų | 60.4 | 20% | 0.199 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | -6.2 | 178 | -67.6 | 179.5 | 0 | 0 | 0 | 113.9 | L192 P193 L194 K198 V383 A386 | L192-L196 HydrophobicContact CD1-CD1 4.17Å; L192-L196 HydrophobicContact CD1-CD2 4.32Å; L192-L196 HydrophobicContact CD1-CG 4.07Å; L192-L196 HydrophobicContact CG-CD1 4.12Å; L192-L196 HydrophobicContact CG-CG 4.4Å; L192-L196 VanDerWaalsContact O-CG 3.25Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.31Å; P193-L196 PolarHBondContact O-N 3.44Å; L194-L196 VanDerWaalsContact C-N 3.31Å; L194-L196 PolarHBondContact O-N 3.35Å; L196-K198 PolarHBondContact O-N 3.01Å; L196-V383 HydrophobicContact CD1-CG1 4.38Å; L196-V383 HydrophobicContact CD1-CG2 4.25Å; L196-V383 HydrophobicContact CD2-CB 4.12Å; L196-V383 HydrophobicContact CD2-CG1 4.28Å; L196-V383 HydrophobicContact CD2-CG2 3.81Å; L196-A386 HydrophobicContact CD2-CB 3.87Å |
| 197 | M | 80.7 | Confident | 80.3 | Confident | 86 Ų | 86 | 59.9 Ų | 59.9 | 42% | 0.424 | 30% | 0.304 | S | S | . | . | trans | -62.5 | 128.1 | 175.2 | -66.2 | -165 | -69.2 | 0 | 0 | 111 | L194 A195 L200 | L194-M197 HydrophobicContact CB-CE 4.37Å; L194-M197 HydrophobicContact CG-CE 4.24Å; L194-M197 WeakPolarHBondContact O-CB 3.31Å; L194-M197 WeakPolarHBondContact O-CE 3.15Å; L194-M197 WeakPolarHBondContact O-CG 3.39Å; L194-M197 PolarHBondContact O-N 3.32Å; A195-M197 PolarHBondContact O-N 3.22Å; M197-L200 HydrophobicContact CE-CD2 4.3Å | ||
| 198 | K | 65.9 | Low | 80.2 | Confident | 84 Ų | 84 | 61.4 Ų | 61.4 | 37% | 0.365 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -70.2 | -37.5 | -178.1 | -85.2 | -179.5 | 165.9 | 173 | 0 | 113.5 | L196 F377 W379 | L196-K198 PolarHBondContact O-N 3.01Å; K198-F377 HydrophobicContact CD-CZ 4.4Å; K198-F377 HydrophobicContact CG-CZ 4.38Å; K198-W379 HydrophobicContact CD-CH2 3.89Å; K198-W379 HydrophobicContact CD-CZ2 3.64Å; K198-W379 HydrophobicContact CG-CH2 3.88Å; K198-W379 HydrophobicContact CG-CZ2 4.15Å; K198-W379 HydrophobicContact CG-CZ3 4.45Å; K198-W379 VanDerWaalsContact NZ-CZ2 3.27Å |
| 199 | H | 61.2 | Low | 80.1 | Confident | 151 Ų | 151 | 61.4 Ų | 61.4 | 70% | 0.699 | 32% | 0.317 | S | S | * | . | trans | -122.8 | 107.8 | -176.4 | -60.3 | -67.8 | 0 | 0 | 0 | 107.8 | G201 | H199-G201 PolarHBondContact O-N 2.73Š| ||
| 200 | L | 60.1 | Low | 80.1 | Confident | 28 Ų | 28 | 55.9 Ų | 55.9 | 15% | 0.147 | 29% | 0.288 | C | S | . | . | trans | -77.5 | 40.2 | 167.6 | -68.4 | 170 | 0 | 0 | 0 | 110 | M197 Y202 L203 F361 | M197-L200 HydrophobicContact CE-CD2 4.3Å; L200-Y202 PolarHBondContact O-N 3.45Å; L200-L203 HydrophobicContact CB-CB 4.1Å; L200-L203 HydrophobicContact CB-CD1 4.17Å; L200-L203 HydrophobicContact CB-CD2 4.44Å; L200-L203 HydrophobicContact CD1-CD1 4.08Å; L200-L203 HydrophobicContact CD2-CD1 4.28Å; L200-L203 HydrophobicContact CG-CD1 4.42Å; L200-L203 WeakPolarHBondContact O-CB 3.47Å; L200-L203 PolarHBondContact O-N 3.41Å; L200-F361 HydrophobicContact CD1-CB 3.79Å; L200-F361 HydrophobicContact CD1-CD2 3.73Å; L200-F361 HydrophobicContact CD1-CG 3.88Å | ||
| 201 | G | 57.4 | Low | 80.1 | Confident | 59 Ų | 59 | 52.8 Ų | 52.8 | 61% | 0.608 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -5.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | H199 | H199-G201 PolarHBondContact O-N 2.73Š|
| 202 | Y | 64.7 | Low | 80.1 | Confident | 169 Ų | 169 | 56.9 Ų | 56.9 | 66% | 0.663 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.4 | 5.1 | 174.3 | -58.7 | -80.1 | 0 | 0 | 0 | 113.6 | L200 G204 Y205 T206 | L200-Y202 PolarHBondContact O-N 3.45Å; Y202-G204 PolarHBondContact O-N 3.02Å; Y202-G204 VanDerWaalsContact O-N 3.17Å; Y202-Y205 HydrophobicContact CD1-CD2 4.2Å; Y202-Y205 PolarHBondContact O-N 2.88Å; Y202-T206 PolarHBondContact O-N 3.21Å |
| 203 | L | 66.3 | Low | 80.3 | Confident | 28 Ų | 28 | 56.6 Ų | 56.6 | 15% | 0.147 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -55.7 | -37.5 | -174.3 | -161 | 59.6 | 0 | 0 | 0 | 112.9 | N65 L200 Y205 T206 S207 V358 | N65-L203 PolarHBondContact OD1-O 3.32Å; L200-L203 HydrophobicContact CB-CB 4.1Å; L200-L203 HydrophobicContact CB-CD1 4.17Å; L200-L203 HydrophobicContact CB-CD2 4.44Å; L200-L203 HydrophobicContact CD1-CD1 4.08Å; L200-L203 HydrophobicContact CD2-CD1 4.28Å; L200-L203 HydrophobicContact CG-CD1 4.42Å; L200-L203 WeakPolarHBondContact O-CB 3.47Å; L200-L203 PolarHBondContact O-N 3.41Å; L203-Y205 VanDerWaalsContact C-N 3.31Å; L203-Y205 PolarHBondContact O-N 3.5Å; L203-T206 PolarHBondContact O-OG1 3.3Å; L203-S207 WeakPolarHBondContact O-CB 3.26Å; L203-S207 PolarHBondContact O-N 2.97Å; L203-S207 PolarHBondContact O-OG 2.64Å; L203-V358 HydrophobicContact CD1-CB 3.94Å; L203-V358 HydrophobicContact CD1-CG1 3.76Å; L203-V358 HydrophobicContact CD1-CG2 3.26Å; L203-V358 HydrophobicContact CD2-CG1 4Å; L203-V358 HydrophobicContact CG-CG1 4.21Å; L203-V358 HydrophobicContact CG-CG2 4.39Å |
| 204 | G | 72.4 | Confident | 80.4 | Confident | 4 Ų | 4 | 53.6 Ų | 53.6 | 4% | 0.041 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.5 | -33.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | M61 N65 Y202 S208 | M61-G204 VanDerWaalsContact CE-C 3.48Å; M61-G204 VanDerWaalsContact CE-CA 3.41Å; N65-G204 WeakPolarHBondContact OD1-CA 3.37Å; N65-G204 PolarHBondContact OD1-N 3.32Å; N65-G204 VanDerWaalsContact OD1-N 3.14Å; Y202-G204 PolarHBondContact O-N 3.02Å; Y202-G204 VanDerWaalsContact O-N 3.17Å; G204-S208 WeakPolarHBondContact O-CB 3.11Å; G204-S208 PolarHBondContact O-N 3.25Å; G204-S208 PolarHBondContact O-OG 2.64Å |
| 205 | Y | 81.9 | Confident | 80.7 | Confident | 149 Ų | 149 | 55.1 Ų | 55.1 | 58% | 0.584 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -75 | -43.9 | 178.9 | -63.4 | -73.1 | 0 | 0 | 0 | 111.3 | M61 Y202 L203 S207 S208 L209 | M61-Y205 HydrophobicContact CE-CD1 4.07Å; M61-Y205 HydrophobicContact CE-CD2 3.79Å; M61-Y205 HydrophobicContact CE-CE1 4.04Å; M61-Y205 HydrophobicContact CE-CE2 3.74Å; M61-Y205 HydrophobicContact CE-CG 3.96Å; Y202-Y205 HydrophobicContact CD1-CD2 4.2Å; Y202-Y205 PolarHBondContact O-N 2.88Å; L203-Y205 VanDerWaalsContact C-N 3.31Å; L203-Y205 PolarHBondContact O-N 3.5Å; Y205-S207 VanDerWaalsContact C-N 3.31Å; Y205-S207 PolarHBondContact O-N 3.27Å; Y205-S208 WeakPolarHBondContact CA-OG 3.39Å; Y205-S208 PolarHBondContact O-N 3.42Å; Y205-S208 PolarHBondContact O-OG 3.01Å; Y205-L209 PolarHBondContact O-N 3.24Å |
| 206 | T | 85.6 | Confident | 81.2 | Confident | 44 Ų | 44 | 58.6 Ų | 58.6 | 27% | 0.27 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65.4 | -37.6 | 175.2 | 58 | 0 | 0 | 0 | 0 | 111.2 | Y202 L203 L209 S210 | Y202-T206 PolarHBondContact O-N 3.21Å; L203-T206 PolarHBondContact O-OG1 3.3Å; T206-L209 PolarHBondContact O-N 3.17Å; T206-S210 WeakPolarHBondContact O-CB 3.28Å; T206-S210 PolarHBondContact O-N 3.46Å |
| 207 | S | 87.7 | Confident | 81.5 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.3 | -41.3 | 174.5 | -61.6 | 0 | 0 | 0 | 0 | 111.8 | N65 L203 Y205 L209 S210 L211 | N65-S207 PolarHBondContact OD1-OG 3.12Å; L203-S207 WeakPolarHBondContact O-CB 3.26Å; L203-S207 PolarHBondContact O-N 2.97Å; L203-S207 PolarHBondContact O-OG 2.64Å; Y205-S207 VanDerWaalsContact C-N 3.31Å; Y205-S207 PolarHBondContact O-N 3.27Å; S207-L209 VanDerWaalsContact C-N 3.34Å; S207-L209 PolarHBondContact O-N 2.89Å; S207-S210 PolarHBondContact O-N 2.88Å; S207-L211 WeakPolarHBondContact O-CB 3.05Å; S207-L211 VanDerWaalsContact O-CG 3.31Å; S207-L211 WeakPolarHBondContact O-CG 3.44Å; S207-L211 PolarHBondContact O-N 3.36Å |
| 208 | S | 89.4 | Confident | 82.2 | Confident | 33 Ų | 33 | 53.4 Ų | 53.4 | 23% | 0.231 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.9 | -40.7 | 174.7 | 60.3 | 0 | 0 | 0 | 0 | 112.2 | G204 Y205 L211 T212 | G204-S208 WeakPolarHBondContact O-CB 3.11Å; G204-S208 PolarHBondContact O-N 3.25Å; G204-S208 PolarHBondContact O-OG 2.64Å; Y205-S208 WeakPolarHBondContact CA-OG 3.39Å; Y205-S208 PolarHBondContact O-N 3.42Å; Y205-S208 PolarHBondContact O-OG 3.01Å; S208-L211 PolarHBondContact O-N 3.04Å; S208-T212 PolarHBondContact O-N 3.41Å; S208-T212 PolarHBondContact O-OG1 2.92Å; S208-T212 VanDerWaalsContact O-OG1 3.06Å |
| 209 | L | 91.7 | Very high | 83.6 | Confident | 80 Ų | 80 | 53.7 Ų | 53.7 | 42% | 0.419 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.7 | -46.2 | 176.9 | 179.3 | 59.9 | 0 | 0 | 0 | 111.4 | Y205 T206 S207 L211 T212 C213 L350 L354 | Y205-L209 PolarHBondContact O-N 3.24Å; T206-L209 PolarHBondContact O-N 3.17Å; S207-L209 VanDerWaalsContact C-N 3.34Å; S207-L209 PolarHBondContact O-N 2.89Å; L209-L211 PolarHBondContact O-N 3.45Å; L209-T212 PolarHBondContact O-N 3.34Å; L209-C213 PolarHBondContact O-N 3.39Å; L209-C213 PolarHBondContact O-SG 2.87Å; L209-C213 VanDerWaalsContact O-SG 3.4Å; L209-L350 HydrophobicContact CD2-CD2 4.44Å; L209-L354 HydrophobicContact CD2-CD1 3.75Å; L209-L354 HydrophobicContact CG-CD1 4.17Å |
| 210 | S | 91.5 | Very high | 85.2 | Confident | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.007 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.1 | -46.2 | 175.2 | -179.6 | 0 | 0 | 0 | 0 | 112.1 | N68 T206 S207 T212 C213 M214 A351 T355 | N68-S210 WeakPolarHBondContact OD1-CB 3.45Å; N68-S210 PolarHBondContact OD1-OG 3.34Å; T206-S210 WeakPolarHBondContact O-CB 3.28Å; T206-S210 PolarHBondContact O-N 3.46Å; S207-S210 PolarHBondContact O-N 2.88Å; S210-T212 PolarHBondContact O-N 3.39Å; S210-C213 WeakPolarHBondContact O-CB 3.44Å; S210-C213 PolarHBondContact O-N 3.46Å; S210-M214 WeakPolarHBondContact O-CG 2.85Å; S210-M214 PolarHBondContact O-N 2.91Å; S210-M214 VanDerWaalsContact O-N 3.08Å; S210-A351 WeakPolarHBondContact OG-CB 3.24Å; S210-A351 PolarHBondContact OG-O 2.98Å; S210-T355 PolarHBondContact OG-OG1 3.42Å |
| 211 | L | 91.4 | Very high | 86.7 | Confident | 12 Ų | 12 | 45.6 Ų | 45.6 | 6% | 0.063 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.1 | -40.7 | 176 | -72.5 | 172.6 | 0 | 0 | 0 | 112.4 | F64 N68 M71 S207 S208 L209 M214 L215 M307 | F64-L211 HydrophobicContact CB-CD1 3.91Å; F64-L211 HydrophobicContact CD1-CD1 3.43Å; F64-L211 VanDerWaalsContact CD1-CD1 3.43Å; F64-L211 HydrophobicContact CE1-CD1 4.35Å; F64-L211 HydrophobicContact CG-CD1 4.08Å; N68-L211 HydrophobicContact CB-CG 4.49Å; M71-L211 HydrophobicContact CB-CD2 4.45Å; M71-L211 HydrophobicContact CE-CD2 3.32Å; M71-L211 HydrophobicContact CE-CG 4.48Å; M71-L211 HydrophobicContact SD-CD2 3.66Å; S207-L211 WeakPolarHBondContact O-CB 3.05Å; S207-L211 VanDerWaalsContact O-CG 3.31Å; S207-L211 WeakPolarHBondContact O-CG 3.44Å; S207-L211 PolarHBondContact O-N 3.36Å; S208-L211 PolarHBondContact O-N 3.04Å; L209-L211 PolarHBondContact O-N 3.45Å; L211-M214 PolarHBondContact O-N 3.49Å; L211-L215 WeakPolarHBondContact O-CG 3.37Å; L211-L215 PolarHBondContact O-N 2.95Å; L211-M307 HydrophobicContact CD2-CE 4.25Å; L211-M307 HydrophobicContact CD2-SD 4.48Å |
| 212 | T | 93.7 | Very high | 88.4 | Confident | 87 Ų | 87 | 45 Ų | 45 | 53% | 0.534 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.2 | -43.3 | 175.9 | -61.1 | 0 | 0 | 0 | 0 | 111.7 | S208 L209 S210 M214 L215 F216 | S208-T212 PolarHBondContact O-N 3.41Å; S208-T212 PolarHBondContact O-OG1 2.92Å; S208-T212 VanDerWaalsContact O-OG1 3.06Å; L209-T212 PolarHBondContact O-N 3.34Å; S210-T212 PolarHBondContact O-N 3.39Å; T212-M214 VanDerWaalsContact C-N 3.26Å; T212-M214 PolarHBondContact O-N 3.29Å; T212-L215 PolarHBondContact O-N 3.05Å; T212-F216 PolarHBondContact O-N 3.21Å |
| 213 | C | 93.9 | Very high | 89.7 | Confident | 14 Ų | 14 | 42.7 Ų | 42.7 | 10% | 0.095 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.9 | -38.7 | 175 | -72.1 | 0 | 0 | 0 | 0 | 112.3 | L209 S210 F216 F217 A347 A351 | L209-C213 PolarHBondContact O-N 3.39Å; L209-C213 PolarHBondContact O-SG 2.87Å; L209-C213 VanDerWaalsContact O-SG 3.4Å; S210-C213 WeakPolarHBondContact O-CB 3.44Å; S210-C213 PolarHBondContact O-N 3.46Å; C213-F216 WeakPolarHBondContact O-CB 3.37Å; C213-F216 PolarHBondContact O-N 3.5Å; C213-F217 PolarHBondContact O-N 3.12Å; C213-A347 HydrophobicContact CB-CB 3.96Å; C213-A347 WeakPolarHBondContact CB-O 3.12Å; C213-A351 HydrophobicContact CB-CB 3.96Å |
| 214 | M | 92.6 | Very high | 90.8 | Very high | 4 Ų | 4 | 41.8 Ų | 41.8 | 2% | 0.02 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -80 | -28.3 | -179.4 | -70.5 | -78.6 | -163.2 | 0 | 0 | 113.1 | M71 I75 S210 L211 T212 F216 F217 L218 V348 A351 V352 | M71-M214 HydrophobicContact CE-CB 3.32Å; M71-M214 HydrophobicContact CE-CG 4.14Å; M71-M214 HydrophobicContact CG-CB 4.36Å; M71-M214 HydrophobicContact CG-CG 4.27Å; M71-M214 HydrophobicContact SD-CB 3.16Å; M71-M214 WeakPolarHBondContact SD-CB 3.19Å; M71-M214 HydrophobicContact SD-CG 3.26Å; M71-M214 WeakPolarHBondContact SD-CG 3.41Å; M71-M214 HydrophobicContact SD-SD 4.38Å; I75-M214 HydrophobicContact CG2-SD 4.34Å; S210-M214 WeakPolarHBondContact O-CG 2.85Å; S210-M214 PolarHBondContact O-N 2.91Å; S210-M214 VanDerWaalsContact O-N 3.08Å; L211-M214 PolarHBondContact O-N 3.49Å; T212-M214 VanDerWaalsContact C-N 3.26Å; T212-M214 PolarHBondContact O-N 3.29Å; M214-F216 VanDerWaalsContact C-N 3.34Å; M214-F217 WeakPolarHBondContact O-CB 3.42Å; M214-F217 PolarHBondContact O-N 3.45Å; M214-F217 HydrophobicContact SD-CD1 4.34Å; M214-L218 PolarHBondContact O-N 3.07Å; M214-V348 HydrophobicContact CE-CG1 4.24Å; M214-V348 HydrophobicContact SD-CG2 4.25Å; M214-A351 HydrophobicContact CE-CB 3.94Å; M214-A351 HydrophobicContact CG-CB 4.08Å; M214-V352 HydrophobicContact CE-CG1 4.23Å |
| 215 | L | 94.7 | Very high | 91.5 | Very high | 82 Ų | 82 | 43.1 Ų | 43.1 | 43% | 0.429 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.8 | -40.9 | 165.1 | -77.5 | 169 | 0 | 0 | 0 | 111.3 | L211 T212 F217 L218 V219 M310 | L211-L215 WeakPolarHBondContact O-CG 3.37Å; L211-L215 PolarHBondContact O-N 2.95Å; T212-L215 PolarHBondContact O-N 3.05Å; L215-F217 VanDerWaalsContact C-N 3.33Å; L215-L218 WeakPolarHBondContact O-CB 3.33Å; L215-L218 PolarHBondContact O-N 3.28Å; L215-V219 WeakPolarHBondContact O-CG2 3.17Å; L215-V219 PolarHBondContact O-N 3.36Å; L215-M310 HydrophobicContact CD2-CG 4.26Å; L215-M310 HydrophobicContact CD2-SD 3.37Å; L215-M310 WeakPolarHBondContact CD2-SD 3.01Å; L215-M310 HydrophobicContact CG-SD 3.93Å |
| 216 | F | 95.4 | Very high | 91.8 | Very high | 78 Ų | 78 | 43.3 Ų | 43.3 | 34% | 0.342 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.2 | -41 | 173.9 | 171.5 | -110.7 | 0 | 0 | 0 | 111.8 | T212 C213 M214 V219 S220 L340 C343 V344 A347 | T212-F216 PolarHBondContact O-N 3.21Å; C213-F216 WeakPolarHBondContact O-CB 3.37Å; C213-F216 PolarHBondContact O-N 3.5Å; M214-F216 VanDerWaalsContact C-N 3.34Å; F216-V219 PolarHBondContact O-N 2.74Å; F216-S220 WeakPolarHBondContact O-CB 3.45Å; F216-S220 PolarHBondContact O-N 3.46Å; F216-S220 PolarHBondContact O-OG 3.46Å; F216-L340 HydrophobicContact CE2-CD1 4.27Å; F216-L340 HydrophobicContact CZ-CD1 3.96Å; F216-C343 HydrophobicContact CE1-CB 4.11Å; F216-C343 HydrophobicContact CZ-CB 4.12Å; F216-V344 HydrophobicContact CD1-CG2 4.23Å; F216-V344 HydrophobicContact CE1-CB 4.41Å; F216-V344 HydrophobicContact CE1-CG2 3.66Å; F216-V344 HydrophobicContact CZ-CG2 4.13Å; F216-A347 HydrophobicContact CD1-CB 3.87Å; F216-A347 HydrophobicContact CE1-CB 4.37Å |
| 217 | F | 94.2 | Very high | 91.7 | Very high | 1 Ų | 1 | 46 Ų | 46 | 0% | 0.004 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56.7 | -51.8 | 170.2 | 164.3 | -119.3 | 0 | 0 | 0 | 111.8 | I75 L76 C213 M214 L215 V219 S220 V221 T314 M330 L331 V344 V348 | I75-F217 HydrophobicContact CD1-CD1 4.48Å; I75-F217 HydrophobicContact CD1-CE1 4.33Å; I75-F217 HydrophobicContact CG1-CE1 4.38Å; L76-F217 HydrophobicContact CD2-CE1 3.7Å; L76-F217 HydrophobicContact CD2-CE2 4.29Å; L76-F217 HydrophobicContact CD2-CZ 3.49Å; L76-F217 VanDerWaalsContact CD2-CZ 3.49Å; C213-F217 PolarHBondContact O-N 3.12Å; M214-F217 WeakPolarHBondContact O-CB 3.42Å; M214-F217 PolarHBondContact O-N 3.45Å; M214-F217 HydrophobicContact SD-CD1 4.34Å; L215-F217 VanDerWaalsContact C-N 3.33Å; F217-V219 PolarHBondContact O-N 2.93Å; F217-S220 PolarHBondContact O-N 3.35Å; F217-S220 VanDerWaalsContact O-N 3.14Å; F217-V221 HydrophobicContact CD2-CG2 3.71Å; F217-V221 HydrophobicContact CE2-CG2 3.43Å; F217-V221 VanDerWaalsContact CE2-CG2 3.43Å; F217-V221 HydrophobicContact CG-CG2 4.46Å; F217-V221 HydrophobicContact CZ-CG2 3.97Å; F217-V221 VanDerWaalsContact O-CG2 3.27Å; F217-V221 WeakPolarHBondContact O-CG2 3.36Å; F217-V221 PolarHBondContact O-N 3.26Å; F217-T314 HydrophobicContact CD1-CG2 4.34Å; F217-T314 HydrophobicContact CE1-CG2 3.54Å; F217-T314 HydrophobicContact CZ-CG2 3.95Å; F217-M330 HydrophobicContact CE1-CE 4.4Å; F217-M330 HydrophobicContact CE2-CE 3.45Å; F217-M330 VanDerWaalsContact CE2-CE 3.45Å; F217-M330 HydrophobicContact CZ-CE 3.26Å; F217-L331 HydrophobicContact CD2-CD1 4.27Å; F217-L331 HydrophobicContact CE2-CD1 3.48Å; F217-L331 VanDerWaalsContact CE2-CD1 3.48Å; F217-L331 HydrophobicContact CZ-CD1 3.87Å; F217-V344 HydrophobicContact CB-CG1 4.29Å; F217-V344 HydrophobicContact CD2-CG1 3.55Å; F217-V344 HydrophobicContact CE2-CG1 4.37Å; F217-V344 HydrophobicContact CG-CG1 4.38Å; F217-V348 HydrophobicContact CB-CG2 4.18Å; F217-V348 HydrophobicContact CD2-CG2 4.38Å; F217-V348 HydrophobicContact CG-CG2 4.23Å |
| 218 | L | 95.1 | Very high | 91.2 | Very high | 13 Ų | 13 | 50.2 Ų | 50.2 | 7% | 0.068 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -54.3 | -49.8 | 177.1 | 166.9 | 62.4 | 0 | 0 | 0 | 112.2 | M214 L215 S220 V221 I222 M310 L313 T314 | M214-L218 PolarHBondContact O-N 3.07Å; L215-L218 WeakPolarHBondContact O-CB 3.33Å; L215-L218 PolarHBondContact O-N 3.28Å; L218-S220 VanDerWaalsContact C-N 3.29Å; L218-S220 PolarHBondContact O-N 2.97Å; L218-V221 PolarHBondContact O-N 3.12Å; L218-I222 HydrophobicContact CD1-CD1 3.82Å; L218-I222 HydrophobicContact CD1-CG1 4.17Å; L218-I222 HydrophobicContact CG-CD1 4.12Å; L218-I222 WeakPolarHBondContact O-CG1 3.43Å; L218-I222 PolarHBondContact O-N 3.33Å; L218-M310 HydrophobicContact CD2-CB 4.42Å; L218-M310 HydrophobicContact CD2-CG 4.07Å; L218-L313 HydrophobicContact CD1-CB 3.67Å; L218-L313 HydrophobicContact CD2-CD1 4.39Å; L218-T314 WeakPolarHBondContact CD1-OG1 3.11Å |
| 219 | V | 95.6 | Very high | 90 | Very high | 91 Ų | 91 | 50.6 Ų | 50.6 | 55% | 0.552 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -60.6 | -41.2 | 179.5 | 172.1 | 0 | 0 | 0 | 0 | 111 | L215 F216 F217 I222 Y223 | L215-V219 WeakPolarHBondContact O-CG2 3.17Å; L215-V219 PolarHBondContact O-N 3.36Å; F216-V219 PolarHBondContact O-N 2.74Å; F217-V219 PolarHBondContact O-N 2.93Å; V219-I222 PolarHBondContact O-N 3.46Å; V219-Y223 WeakPolarHBondContact O-CB 3.17Å; V219-Y223 PolarHBondContact O-N 3.32Å |
| 220 | S | 93.3 | Very high | 88.8 | Confident | 5 Ų | 5 | 49.3 Ų | 49.3 | 4% | 0.035 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67 | -37.7 | 179.2 | -57.6 | 0 | 0 | 0 | 0 | 112.4 | F216 F217 L218 Y223 K224 V344 | F216-S220 WeakPolarHBondContact O-CB 3.45Å; F216-S220 PolarHBondContact O-N 3.46Å; F216-S220 PolarHBondContact O-OG 3.46Å; F217-S220 PolarHBondContact O-N 3.35Å; F217-S220 VanDerWaalsContact O-N 3.14Å; L218-S220 VanDerWaalsContact C-N 3.29Å; L218-S220 PolarHBondContact O-N 2.97Å; S220-Y223 PolarHBondContact O-N 3.09Å; S220-K224 VanDerWaalsContact O-CB 3.32Å; S220-K224 WeakPolarHBondContact O-CB 3.3Å; S220-K224 VanDerWaalsContact O-CG 3.3Å; S220-K224 WeakPolarHBondContact O-CG 3.24Å; S220-K224 PolarHBondContact O-N 2.81Å; S220-V344 VanDerWaalsContact OG-CG2 3.29Å; S220-V344 WeakPolarHBondContact OG-CG2 3.29Å |
| 221 | V | 92.1 | Very high | 87 | Confident | 4 Ų | 4 | 55.9 Ų | 55.9 | 2% | 0.024 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.4 | -44.4 | 175.1 | 172.1 | 0 | 0 | 0 | 0 | 111 | F217 L218 K224 K225 F317 M330 | F217-V221 HydrophobicContact CD2-CG2 3.71Å; F217-V221 HydrophobicContact CE2-CG2 3.43Å; F217-V221 VanDerWaalsContact CE2-CG2 3.43Å; F217-V221 HydrophobicContact CG-CG2 4.46Å; F217-V221 HydrophobicContact CZ-CG2 3.97Å; F217-V221 VanDerWaalsContact O-CG2 3.27Å; F217-V221 WeakPolarHBondContact O-CG2 3.36Å; F217-V221 PolarHBondContact O-N 3.26Å; L218-V221 PolarHBondContact O-N 3.12Å; V221-K224 PolarHBondContact O-N 2.87Å; V221-K225 PolarHBondContact O-N 2.71Å; V221-F317 HydrophobicContact CG1-CB 4Å; V221-M330 HydrophobicContact CB-CE 4.32Å; V221-M330 HydrophobicContact CG1-CE 3.95Å; V221-M330 HydrophobicContact CG2-CE 3.34Å |
| 222 | I | 93.6 | Very high | 85.2 | Confident | 45 Ų | 45 | 59 Ų | 59 | 23% | 0.231 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.6 | -49.3 | 174.5 | -65.8 | 169.2 | 0 | 0 | 0 | 109.9 | L218 V219 K224 K225 F226 F317 | L218-I222 HydrophobicContact CD1-CD1 3.82Å; L218-I222 HydrophobicContact CD1-CG1 4.17Å; L218-I222 HydrophobicContact CG-CD1 4.12Å; L218-I222 WeakPolarHBondContact O-CG1 3.43Å; L218-I222 PolarHBondContact O-N 3.33Å; V219-I222 PolarHBondContact O-N 3.46Å; I222-K224 VanDerWaalsContact C-N 3.34Å; I222-K224 PolarHBondContact O-N 2.83Å; I222-K225 WeakPolarHBondContact O-CB 3.39Å; I222-K225 PolarHBondContact O-N 3.42Å; I222-F226 HydrophobicContact CG2-CD2 4.18Å; I222-F226 HydrophobicContact CG2-CE2 3.78Å; I222-F226 WeakPolarHBondContact O-CD2 3.32Å; I222-F226 PolarHBondContact O-N 3.36Å; I222-F317 HydrophobicContact CB-CD1 4.49Å; I222-F317 HydrophobicContact CB-CG 4.41Å; I222-F317 HydrophobicContact CD1-CD2 4.21Å; I222-F317 HydrophobicContact CD1-CE2 4.25Å; I222-F317 HydrophobicContact CG1-CB 4.19Å; I222-F317 HydrophobicContact CG1-CD1 4.23Å; I222-F317 HydrophobicContact CG1-CD2 3.57Å; I222-F317 HydrophobicContact CG1-CE2 3.95Å; I222-F317 HydrophobicContact CG1-CG 3.73Å; I222-F317 HydrophobicContact CG1-CZ 4.45Å; I222-F317 HydrophobicContact CG2-CD1 4.32Å; I222-F317 HydrophobicContact CG2-CE1 4.19Å; I222-F317 HydrophobicContact CG2-CZ 4.39Å |
| 223 | Y | 92.4 | Very high | 82.7 | Confident | 121 Ų | 121 | 58 Ų | 58 | 48% | 0.475 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58.5 | -46.1 | 178.9 | 179.4 | -103.4 | 0 | 0 | 0 | 112 | V219 S220 K225 F226 Q227 L340 | V219-Y223 WeakPolarHBondContact O-CB 3.17Å; V219-Y223 PolarHBondContact O-N 3.32Å; S220-Y223 PolarHBondContact O-N 3.09Å; Y223-K225 VanDerWaalsContact C-N 3.34Å; Y223-K225 PolarHBondContact O-N 3.21Å; Y223-F226 PolarHBondContact O-N 2.77Å; Y223-F226 VanDerWaalsContact O-N 3.13Å; Y223-Q227 HydrophobicContact CD1-CG 4.22Å; Y223-Q227 HydrophobicContact CE1-CG 3.78Å; Y223-Q227 VanDerWaalsContact CE1-NE2 3.26Å; Y223-Q227 HydrophobicContact CE2-CG 4.5Å; Y223-Q227 PolarHBondContact O-N 3.3Å; Y223-Q227 VanDerWaalsContact O-N 3.12Å; Y223-Q227 PolarHBondContact OH-NE2 2.92Å; Y223-L340 HydrophobicContact CD1-CD2 3.51Å; Y223-L340 HydrophobicContact CE1-CD2 3.92Å |
| 224 | K | 88.4 | Confident | 80.2 | Confident | 10 Ų | 10 | 65.2 Ų | 65.2 | 4% | 0.043 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64 | -36.2 | 180 | -79.8 | -75 | 170.6 | -150.7 | 0 | 113 | S220 V221 I222 F226 Q227 L228 Y334 D338 I341 | S220-K224 VanDerWaalsContact O-CB 3.32Å; S220-K224 WeakPolarHBondContact O-CB 3.3Å; S220-K224 VanDerWaalsContact O-CG 3.3Å; S220-K224 WeakPolarHBondContact O-CG 3.24Å; S220-K224 PolarHBondContact O-N 2.81Å; V221-K224 PolarHBondContact O-N 2.87Å; I222-K224 VanDerWaalsContact C-N 3.34Å; I222-K224 PolarHBondContact O-N 2.83Å; K224-F226 PolarHBondContact O-N 3.43Å; K224-Q227 PolarHBondContact O-N 3.26Å; K224-Q227 VanDerWaalsContact O-N 3.14Å; K224-L228 HydrophobicContact CB-CD1 4.09Å; K224-L228 HydrophobicContact CD-CD1 4.09Å; K224-L228 WeakPolarHBondContact O-CB 3.42Å; K224-L228 PolarHBondContact O-N 3.4Å; K224-Y334 HydrophobicContact CB-CE1 3.87Å; K224-Y334 HydrophobicContact CG-CE1 4.13Å; K224-D338 VanDerWaalsContact CE-OD2 3.3Å; K224-D338 WeakPolarHBondContact CE-OD2 3.37Å; K224-D338 IonicContact NZ-OD1 3.71Å; K224-D338 IonicContact NZ-OD2 2.51Å; K224-D338 PolarHBondContact NZ-OD2 3.4Å; K224-I341 HydrophobicContact CD-CD1 4.18Å; K224-I341 HydrophobicContact CG-CD1 3.96Å |
| 225 | K | 87.4 | Confident | 78 | Confident | 32 Ų | 32 | 71.8 Ų | 71.8 | 14% | 0.139 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -56.1 | -39.1 | 173.3 | 171.7 | 64.9 | -156.6 | 95.3 | 0 | 112.5 | V221 I222 Y223 F317 L320 T321 | V221-K225 PolarHBondContact O-N 2.71Å; I222-K225 WeakPolarHBondContact O-CB 3.39Å; I222-K225 PolarHBondContact O-N 3.42Å; Y223-K225 VanDerWaalsContact C-N 3.34Å; Y223-K225 PolarHBondContact O-N 3.21Å; K225-F317 HydrophobicContact CB-CD1 4.13Å; K225-F317 HydrophobicContact CG-CD1 4.01Å; K225-L320 HydrophobicContact CD-CB 3.7Å; K225-L320 WeakPolarHBondContact CD-O 3.39Å; K225-L320 WeakPolarHBondContact CE-O 3.37Å; K225-T321 WeakPolarHBondContact CB-OG1 3.47Å |
| 226 | F | 88.1 | Confident | 75.3 | Confident | 153 Ų | 153 | 74.8 Ų | 74.8 | 67% | 0.671 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -80 | -26 | 179.8 | -69.1 | -70.4 | 0 | 0 | 0 | 112.8 | I222 Y223 K224 F317 | I222-F226 HydrophobicContact CG2-CD2 4.18Å; I222-F226 HydrophobicContact CG2-CE2 3.78Å; I222-F226 WeakPolarHBondContact O-CD2 3.32Å; I222-F226 PolarHBondContact O-N 3.36Å; Y223-F226 PolarHBondContact O-N 2.77Å; Y223-F226 VanDerWaalsContact O-N 3.13Å; K224-F226 PolarHBondContact O-N 3.43Å; F226-F317 HydrophobicContact CE2-CE1 4.08Å; F226-F317 HydrophobicContact CZ-CE1 4.18Å |
| 227 | Q | 84.1 | Confident | 72.8 | Confident | 100 Ų | 100 | 77 Ų | 77 | 47% | 0.467 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -79.1 | -45.1 | 175.3 | -76.6 | -156.8 | -33.7 | 0 | 0 | 114 | Y223 K224 G229 | Y223-Q227 HydrophobicContact CD1-CG 4.22Å; Y223-Q227 HydrophobicContact CE1-CG 3.78Å; Y223-Q227 VanDerWaalsContact CE1-NE2 3.26Å; Y223-Q227 HydrophobicContact CE2-CG 4.5Å; Y223-Q227 PolarHBondContact O-N 3.3Å; Y223-Q227 VanDerWaalsContact O-N 3.12Å; Y223-Q227 PolarHBondContact OH-NE2 2.92Å; K224-Q227 PolarHBondContact O-N 3.26Å; K224-Q227 VanDerWaalsContact O-N 3.14Å; Q227-G229 PolarHBondContact O-N 3.34Å; Q227-G229 VanDerWaalsContact O-N 3.1Å |
| 228 | L | 77.5 | Confident | 70.4 | Confident | 89 Ų | 89 | 83.4 Ų | 83.4 | 47% | 0.466 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -72.7 | -1.8 | -171.2 | -77.8 | 154.3 | 0 | 0 | 0 | 113.7 | K224 T321 Y334 | K224-L228 HydrophobicContact CB-CD1 4.09Å; K224-L228 HydrophobicContact CD-CD1 4.09Å; K224-L228 WeakPolarHBondContact O-CB 3.42Å; K224-L228 PolarHBondContact O-N 3.4Å; L228-T321 HydrophobicContact CD1-CG2 3.76Å; L228-Y334 HydrophobicContact CD1-CD1 4.35Å; L228-Y334 HydrophobicContact CD1-CE1 4.06Å |
| 229 | G | 64.1 | Low | 67.7 | Low | 40 Ų | 40 | 89.2 Ų | 89.2 | 41% | 0.412 | 49% | 0.489 | S | S | . | . | trans | 52.7 | -161.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q227 | Q227-G229 PolarHBondContact O-N 3.34Å; Q227-G229 VanDerWaalsContact O-N 3.1Å | ||
| 230 | C | 66.7 | Low | 65.1 | Low | 54 Ų | 54 | 94.4 Ų | 94.4 | 37% | 0.365 | 51% | 0.507 | S | S | . | . | trans | -137.4 | 88.5 | 159.4 | -132.5 | 0 | 0 | 0 | 0 | 104 | V232 C253 Y323 | C230-V232 VanDerWaalsContact C-N 3.29Å; C230-V232 PolarHBondContact O-N 2.83Å; C230-C253 HydrophobicContact CB-CB 3.81Å; C230-C253 WeakPolarHBondContact CB-SG 3.38Å; C230-C253 WeakPolarHBondContact SG-CB 3.25Å; C230-C253 CovalentContact SG-SG 2.03Å; C230-C253 PolarHBondContact SG-SG 3.13Å; C230-Y323 WeakPolarHBondContact SG-CE2 3.33Å | ||
| 231 | D | 52.6 | Low | 62.3 | Low | 138 Ų | 138 | 97.2 Ų | 97.2 | 74% | 0.738 | 54% | 0.536 | S | S | * | . | trans | -82 | 86.5 | -176.6 | -146.9 | 4.4 | 0 | 0 | 0 | 107.7 | S233 | D231-S233 PolarHBondContact O-N 3.11Š| ||
| 232 | V | 52.8 | Low | 59.7 | Low | 78 Ų | 78 | 106.8 Ų | 106.8 | 47% | 0.473 | 58% | 0.581 | S | S | . | * | trans | -68.1 | 103.8 | 170.8 | 179.1 | 0 | 0 | 0 | 0 | 105 | C230 H234 C253 | C230-V232 VanDerWaalsContact C-N 3.29Å; C230-V232 PolarHBondContact O-N 2.83Å; V232-H234 PolarHBondContact O-N 3.44Å; V232-C253 HydrophobicContact CG2-CB 4.07Å | ||
| 233 | S | 42.8 | Very low | 56.8 | Low | 67 Ų | 67 | 112.9 Ų | 112.9 | 47% | 0.469 | 61% | 0.608 | S | S | . | * | trans | -59.3 | 88.3 | 170.6 | -55.2 | 0 | 0 | 0 | 0 | 108.7 | D231 N235 | D231-S233 PolarHBondContact O-N 3.11Å; S233-N235 PolarHBondContact O-N 3.36Å; S233-N235 VanDerWaalsContact O-N 3.12Å | ||
| 234 | H | 40.3 | Very low | 54.1 | Low | 164 Ų | 164 | 112.1 Ų | 112.1 | 76% | 0.759 | 62% | 0.619 | S | S | * | * | trans | -67.2 | 103.9 | 158.7 | -96.7 | -85.1 | 0 | 0 | 0 | 105.3 | V232 D236 | V232-H234 PolarHBondContact O-N 3.44Å; H234-D236 PolarHBondContact O-N 3.02Å | ||
| 235 | N | 46.6 | Very low | 51.6 | Low | 143 Ų | 143 | 117.8 Ų | 117.8 | 77% | 0.765 | 66% | 0.656 | S | S | * | * | trans | -55 | 129.4 | 160.5 | -81.5 | -16.3 | 0 | 0 | 0 | 107.8 | S233 | S233-N235 PolarHBondContact O-N 3.36Å; S233-N235 VanDerWaalsContact O-N 3.12Å | ||
| 236 | D | 39.1 | Very low | 49.5 | Very low | 145 Ų | 145 | 122.3 Ų | 122.3 | 78% | 0.775 | 69% | 0.686 | S | S | * | * | trans | 99.9 | 112.8 | 174.7 | -52 | -23.1 | 0 | 0 | 0 | 113.7 | H234 | H234-D236 PolarHBondContact O-N 3.02Š| ||
| 237 | T | 41.7 | Very low | 47.1 | Very low | 124 Ų | 124 | 123.4 Ų | 123.4 | 76% | 0.761 | 69% | 0.694 | S | S | * | * | cis | -163.1 | 144.1 | 12.5 | 23.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 238 | V | 44.4 | Very low | 44.8 | Very low | 136 Ų | 136 | 121.5 Ų | 121.5 | 82% | 0.824 | 70% | 0.701 | S | S | * | * | trans | 41.6 | 116 | 148.9 | -169.5 | 0 | 0 | 0 | 0 | 119 | ||||
| 239 | V | 38.1 | Very low | 43.3 | Very low | 135 Ų | 135 | 121.3 Ų | 121.3 | 82% | 0.818 | 70% | 0.696 | S | S | * | * | -172.5 | 135.4 | 115.7 | 154.5 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 240 | E | 41.2 | Very low | 42.2 | Very low | 199 Ų | 199 | 127 Ų | 127 | 93% | 0.93 | 72% | 0.717 | S | S | * | * | trans | -52.9 | 129.7 | 177.5 | -68.9 | 172.8 | 137.8 | 0 | 0 | 113 | ||||
| 241 | G | 33.3 | Very low | 41.6 | Very low | 64 Ų | 64 | 125.6 Ų | 125.6 | 66% | 0.66 | 71% | 0.708 | S | S | * | * | trans | -171.4 | 113.9 | 166.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | Q243 | G241-Q243 PolarHBondContact O-N 3.13Š| ||
| 242 | E | 38 | Very low | 41.9 | Very low | 206 Ų | 206 | 122.7 Ų | 122.7 | 96% | 0.963 | 70% | 0.698 | S | S | * | * | trans | -49.5 | 107.6 | 179.1 | -80.3 | 157.3 | 105 | 0 | 0 | 112.5 | ||||
| 243 | Q | 33 | Very low | 42.7 | Very low | 172 Ų | 172 | 121 Ų | 121 | 80% | 0.804 | 69% | 0.689 | S | S | * | * | trans | -132.6 | 142.7 | 159.2 | -73.2 | -173 | -16.9 | 0 | 0 | 108.7 | G241 | G241-Q243 PolarHBondContact O-N 3.13Š| ||
| 244 | P | 36.7 | Very low | 44.4 | Very low | 106 Ų | 106 | 124.3 Ų | 124.3 | 69% | 0.688 | 70% | 0.698 | S | S | * | * | trans | -65 | 153.1 | -177.2 | 27.8 | -33 | 0 | 0 | 0 | 110.7 | V246 | P244-V246 PolarHBondContact O-N 2.74Š| ||
| 245 | P | 35.1 | Very low | 46.3 | Very low | 128 Ų | 128 | 118.4 Ų | 118.4 | 83% | 0.831 | 68% | 0.677 | S | S | * | * | trans | -71.4 | 99.3 | -172.5 | 29.5 | -32.8 | 0 | 0 | 0 | 110 | Q247 | P245-Q247 PolarHBondContact O-N 2.98Š| ||
| 246 | V | 44.1 | Very low | 48.2 | Very low | 127 Ų | 127 | 116.4 Ų | 116.4 | 77% | 0.77 | 66% | 0.662 | S | S | * | * | trans | -75.3 | 110.3 | 166.8 | -177.7 | 0 | 0 | 0 | 0 | 106.8 | P244 G248 | P244-V246 PolarHBondContact O-N 2.74Å; V246-G248 PolarHBondContact O-N 2.99Å; V246-G248 VanDerWaalsContact O-N 3.11Å | ||
| 247 | Q | 37.5 | Very low | 50.3 | Low | 177 Ų | 177 | 114.4 Ų | 114.4 | 83% | 0.827 | 65% | 0.65 | S | S | * | * | trans | -53.5 | 117.8 | 177.2 | -79.2 | 178.8 | -17.9 | 0 | 0 | 110.1 | P245 F249 | P245-Q247 PolarHBondContact O-N 2.98Å; Q247-F249 PolarHBondContact O-N 3.02Å | ||
| 248 | G | 36 | Very low | 52.4 | Low | 60 Ų | 60 | 115 Ų | 115 | 62% | 0.619 | 64% | 0.643 | S | S | * | * | trans | -58.4 | 125.4 | -169.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | V246 N250 | V246-G248 PolarHBondContact O-N 2.99Å; V246-G248 VanDerWaalsContact O-N 3.11Å; G248-N250 PolarHBondContact O-N 3.17Å | ||
| 249 | F | 44.8 | Very low | 54.1 | Low | 84 Ų | 84 | 109.7 Ų | 109.7 | 37% | 0.368 | 61% | 0.611 | S | S | . | * | trans | -85.8 | 88.5 | 164.6 | -86 | -112.3 | 0 | 0 | 0 | 109.2 | Q247 S251 F322 T325 M333 | Q247-F249 PolarHBondContact O-N 3.02Å; F249-S251 PolarHBondContact O-N 3.03Å; F249-F322 HydrophobicContact CE1-CB 4.19Å; F249-F322 HydrophobicContact CE1-CD1 4.13Å; F249-F322 AromaticContact CZ-CD1 3.72Å; F249-F322 HydrophobicContact CZ-CD1 3.72Å; F249-F322 HydrophobicContact CZ-CE1 4.49Å; F249-T325 HydrophobicContact CD1-CG2 4.47Å; F249-T325 HydrophobicContact CE1-CG2 4.48Å; F249-T325 WeakPolarHBondContact CE1-OG1 3.29Å; F249-M333 HydrophobicContact CZ-CE 4.11Å | ||
| 250 | N | 41.8 | Very low | 55.9 | Low | 159 Ų | 159 | 107.7 Ų | 107.7 | 85% | 0.85 | 60% | 0.598 | S | S | * | * | trans | -76.8 | 58.2 | 166.2 | -91 | -15.3 | 0 | 0 | 0 | 111.2 | G248 | G248-N250 PolarHBondContact O-N 3.17Š| ||
| 251 | S | 53.8 | Low | 57.6 | Low | 26 Ų | 26 | 101 Ų | 101 | 18% | 0.182 | 57% | 0.569 | C | S | . | * | S | Bend | trans | -137.3 | 131.1 | 172.1 | 59.4 | 0 | 0 | 0 | 0 | 108.8 | F249 C253 | F249-S251 PolarHBondContact O-N 3.03Å; S251-C253 PolarHBondContact O-N 3.42Å; S251-C253 VanDerWaalsContact O-N 3.15Å |
| 252 | S | 58.9 | Low | 59.4 | Low | 76 Ų | 76 | 101.1 Ų | 101.1 | 53% | 0.531 | 56% | 0.56 | S | S | . | * | trans | -49.5 | 124.7 | 178.8 | 50.5 | 0 | 0 | 0 | 0 | 110.3 | E254 | S252-E254 PolarHBondContact O-N 2.9Š| ||
| 253 | C | 70.1 | Confident | 61 | Low | 42 Ų | 42 | 92.7 Ų | 92.7 | 28% | 0.284 | 52% | 0.52 | S | S | . | . | trans | -69 | 41.1 | 173.2 | -79.2 | 0 | 0 | 0 | 0 | 111.8 | C230 V232 S251 Y323 | C230-C253 HydrophobicContact CB-CB 3.81Å; C230-C253 WeakPolarHBondContact CB-SG 3.38Å; C230-C253 WeakPolarHBondContact SG-CB 3.25Å; C230-C253 CovalentContact SG-SG 2.03Å; C230-C253 PolarHBondContact SG-SG 3.13Å; V232-C253 HydrophobicContact CG2-CB 4.07Å; S251-C253 PolarHBondContact O-N 3.42Å; S251-C253 VanDerWaalsContact O-N 3.15Å; C253-Y323 VanDerWaalsContact C-CE1 3.49Å; C253-Y323 HydrophobicContact CB-CE2 4.31Å | ||
| 254 | E | 78.4 | Confident | 63 | Low | 138 Ų | 138 | 87.2 Ų | 87.2 | 65% | 0.645 | 50% | 0.496 | S | S | * | . | trans | -108.6 | 116.7 | -175 | -166.9 | -178.7 | 174.1 | 0 | 0 | 109 | S252 K256 | S252-E254 PolarHBondContact O-N 2.9Å; E254-K256 PolarHBondContact O-N 3.06Å | ||
| 255 | A | 80.6 | Confident | 64.9 | Low | 39 Ų | 39 | 83.1 Ų | 83.1 | 32% | 0.322 | 47% | 0.469 | S | S | . | . | trans | -69.4 | 114.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | L257 Y319 L320 Y323 | A255-L257 PolarHBondContact O-N 3.33Å; A255-Y319 HydrophobicContact CB-CE1 4.27Å; A255-L320 HydrophobicContact CB-CD2 3.81Å; A255-Y323 HydrophobicContact CB-CE1 4.34Å | ||
| 256 | K | 84.6 | Confident | 67.1 | Low | 102 Ų | 102 | 77.3 Ų | 77.3 | 44% | 0.443 | 43% | 0.431 | S | S | . | . | trans | -76.8 | 120.7 | 175.2 | -63.2 | -176.6 | -178.5 | 176.1 | 0 | 109 | G86 V87 E254 T259 Y319 | G86-K256 CarbonylContact C-O 3.55Å; G86-K256 WeakPolarHBondContact CA-O 3.36Å; V87-K256 PolarHBondContact N-O 3.25Å; E254-K256 PolarHBondContact O-N 3.06Å; K256-T259 VanDerWaalsContact CB-OG1 3.3Å; K256-T259 WeakPolarHBondContact CB-OG1 3.24Å; K256-T259 WeakPolarHBondContact CD-OG1 3.45Å; K256-Y319 PolarHBondContact N-OH 3.07Å | ||
| 257 | L | 84.5 | Confident | 69.1 | Low | 103 Ų | 103 | 71.2 Ų | 71.2 | 54% | 0.539 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -75.6 | -34.7 | 179.6 | -63.3 | 176.6 | 0 | 0 | 0 | 112.3 | G86 V87 I88 A255 | G86-L257 CarbonylContact C-O 3.51Å; V87-L257 PolarHBondContact N-O 3.36Å; I88-L257 HydrophobicContact CD1-CB 3.98Å; I88-L257 HydrophobicContact CD1-CD1 4.19Å; I88-L257 HydrophobicContact CD1-CD2 3.99Å; I88-L257 HydrophobicContact CD1-CG 4.28Å; I88-L257 HydrophobicContact CG1-CB 4.23Å; I88-L257 HydrophobicContact CG1-CD2 4.03Å; I88-L257 PolarHBondContact N-O 2.86Å; I88-L257 VanDerWaalsContact N-O 3.16Å; A255-L257 PolarHBondContact O-N 3.33Å |
| 258 | F | 85.6 | Confident | 71.6 | Confident | 136 Ų | 136 | 64.7 Ų | 64.7 | 60% | 0.596 | 37% | 0.366 | S | S | * | . | trans | -139 | 126.2 | 178.3 | -173.1 | -98.6 | 0 | 0 | 0 | 109 | F89 V260 | F89-F258 HydrophobicContact CB-CD2 3.92Å; F89-F258 HydrophobicContact CB-CE2 4.24Å; F89-F258 HydrophobicContact CD1-CE2 4.31Å; F89-F258 HydrophobicContact CD2-CE2 4.1Å; F89-F258 HydrophobicContact CG-CD2 4.17Å; F89-F258 AromaticContact CG-CE2 3.98Å; F89-F258 HydrophobicContact CG-CE2 3.98Å; F258-V260 HydrophobicContact CD1-CG2 4.35Å; F258-V260 HydrophobicContact CE1-CG2 3.45Å; F258-V260 VanDerWaalsContact CE1-CG2 3.45Å; F258-V260 HydrophobicContact CE2-CG2 4.42Å; F258-V260 HydrophobicContact CZ-CG2 3.48Å; F258-V260 VanDerWaalsContact CZ-CG2 3.48Å | ||
| 259 | T | 80.6 | Confident | 74.3 | Confident | 25 Ų | 25 | 62 Ų | 62 | 15% | 0.153 | 34% | 0.338 | C | S | . | . | trans | -140.4 | 135.3 | 173.9 | -59.8 | 0 | 0 | 0 | 0 | 108.6 | T85 K256 D261 | T85-T259 CarbonylContact C-O 3.58Å; T85-T259 WeakPolarHBondContact CA-O 3.19Å; T85-T259 PolarHBondContact O-N 3.2Å; K256-T259 VanDerWaalsContact CB-OG1 3.3Å; K256-T259 WeakPolarHBondContact CB-OG1 3.24Å; K256-T259 WeakPolarHBondContact CD-OG1 3.45Å; T259-D261 HydrophobicContact CG2-CB 4.36Å | ||
| 260 | V | 75.9 | Confident | 76.5 | Confident | 92 Ų | 92 | 58.1 Ų | 58.1 | 56% | 0.558 | 32% | 0.321 | S | S | * | . | trans | -120.9 | 98.3 | 171.8 | 179.3 | 0 | 0 | 0 | 0 | 106.5 | F258 M264 | F258-V260 HydrophobicContact CD1-CG2 4.35Å; F258-V260 HydrophobicContact CE1-CG2 3.45Å; F258-V260 VanDerWaalsContact CE1-CG2 3.45Å; F258-V260 HydrophobicContact CE2-CG2 4.42Å; F258-V260 HydrophobicContact CZ-CG2 3.48Å; F258-V260 VanDerWaalsContact CZ-CG2 3.48Å; V260-M264 HydrophobicContact CG1-CE 3.92Å; V260-M264 HydrophobicContact CG1-SD 4.24Å | ||
| 261 | D | 75.3 | Confident | 78.9 | Confident | 60 Ų | 60 | 50.5 Ų | 50.5 | 32% | 0.321 | 28% | 0.28 | S | S | . | . | trans | -105.7 | 155.2 | 176.7 | -172.1 | 6.9 | 0 | 0 | 0 | 110.2 | H84 T259 Q263 M264 | H84-D261 HydrophobicContact CB-CB 4.49Å; H84-D261 IonicContact CE1-OD2 2.85Å; H84-D261 PolarHBondContact CE1-OD2 3.27Å; H84-D261 IonicContact ND1-OD2 2.73Å; H84-D261 PolarHBondContact ND1-OD2 3.44Å; T259-D261 HydrophobicContact CG2-CB 4.36Å; D261-Q263 PolarHBondContact O-N 2.89Å; D261-Q263 VanDerWaalsContact O-N 3.16Å; D261-M264 WeakPolarHBondContact O-CB 3.38Å; D261-M264 PolarHBondContact O-N 3.21Å | ||
| 262 | S | 71.1 | Confident | 80.8 | Confident | 66 Ų | 66 | 49.3 Ų | 49.3 | 46% | 0.462 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.3 | -33.1 | 169.8 | 60 | 0 | 0 | 0 | 0 | 113.2 | M264 S265 | S262-M264 PolarHBondContact O-N 2.98Å; S262-S265 PolarHBondContact O-OG 2.89Å |
| 263 | Q | 72.4 | Confident | 82.4 | Confident | 28 Ų | 28 | 46.3 Ų | 46.3 | 13% | 0.131 | 25% | 0.249 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -10.2 | 177.6 | -58.5 | -56.1 | -45.3 | 0 | 0 | 113.9 | H84 D261 S265 Y266 | H84-Q263 HydrophobicContact CB-CB 4.4Å; D261-Q263 PolarHBondContact O-N 2.89Å; D261-Q263 VanDerWaalsContact O-N 3.16Å; Q263-S265 PolarHBondContact O-N 3.45Å; Q263-S265 VanDerWaalsContact O-N 3.08Å; Q263-Y266 PolarHBondContact O-N 2.96Å |
| 264 | M | 74.3 | Confident | 83.5 | Confident | 58 Ų | 58 | 44.4 Ų | 44.4 | 29% | 0.286 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -57.6 | -23.2 | 173.2 | -174.7 | 179.9 | 70.4 | 0 | 0 | 112.4 | T85 F89 V260 D261 S262 Y266 T267 | T85-M264 HydrophobicContact CG2-CG 3.98Å; T85-M264 HydrophobicContact CG2-SD 4.48Å; F89-M264 HydrophobicContact CE1-SD 3.97Å; V260-M264 HydrophobicContact CG1-CE 3.92Å; V260-M264 HydrophobicContact CG1-SD 4.24Å; D261-M264 WeakPolarHBondContact O-CB 3.38Å; D261-M264 PolarHBondContact O-N 3.21Å; S262-M264 PolarHBondContact O-N 2.98Å; M264-Y266 PolarHBondContact O-N 2.83Å; M264-Y266 VanDerWaalsContact O-N 3.17Å; M264-T267 WeakPolarHBondContact O-CB 3.3Å; M264-T267 PolarHBondContact O-N 3.4Å |
| 265 | S | 77.5 | Confident | 84.3 | Confident | 19 Ų | 19 | 37.9 Ų | 37.9 | 13% | 0.133 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -52.9 | -30.7 | 172.6 | 50.4 | 0 | 0 | 0 | 0 | 113.5 | S262 Q263 P269 N467 | S262-S265 PolarHBondContact O-OG 2.89Å; Q263-S265 PolarHBondContact O-N 3.45Å; Q263-S265 VanDerWaalsContact O-N 3.08Å; S265-P269 VanDerWaalsContact O-CD 3.24Å; S265-P269 WeakPolarHBondContact O-CD 3.35Å; S265-P269 WeakPolarHBondContact O-CG 3.28Å; S265-N467 PolarHBondContact OG-ND2 3.28Å |
| 266 | Y | 82 | Confident | 84.9 | Confident | 6 Ų | 6 | 36.3 Ų | 36.3 | 2% | 0.024 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -91.3 | -23.1 | 176.4 | -65.3 | -82.9 | 0 | 0 | 0 | 113.2 | Q263 M264 P269 I270 R404 M464 N467 | Q263-Y266 PolarHBondContact O-N 2.96Å; M264-Y266 PolarHBondContact O-N 2.83Å; M264-Y266 VanDerWaalsContact O-N 3.17Å; Y266-P269 WeakPolarHBondContact O-CD 3.48Å; Y266-I270 WeakPolarHBondContact O-CB 3.3Å; Y266-I270 VanDerWaalsContact O-CD1 3.25Å; Y266-I270 WeakPolarHBondContact O-CD1 3.3Å; Y266-I270 WeakPolarHBondContact O-CG1 3.31Å; Y266-I270 PolarHBondContact O-N 3.29Å; Y266-R404 HydrophobicContact CD1-CG 4.16Å; Y266-R404 HydrophobicContact CG-CG 4.22Å; Y266-M464 HydrophobicContact CE1-CG 4.14Å; Y266-N467 WeakPolarHBondContact CE2-ND2 2.95Å |
| 267 | T | 85.9 | Confident | 85.3 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.4 | -55 | -175.8 | -63.4 | 0 | 0 | 0 | 0 | 113.1 | A81 T85 M264 I270 M271 | A81-T267 HydrophobicContact CB-CG2 3.56Å; T85-T267 HydrophobicContact CG2-CG2 3.38Å; M264-T267 WeakPolarHBondContact O-CB 3.3Å; M264-T267 PolarHBondContact O-N 3.4Å; T267-I270 PolarHBondContact O-N 3.3Å; T267-I270 VanDerWaalsContact O-N 3.15Å; T267-M271 HydrophobicContact CG2-CG 4.44Å; T267-M271 HydrophobicContact CG2-SD 3.79Å; T267-M271 VanDerWaalsContact O-CG 3.32Å; T267-M271 WeakPolarHBondContact O-CG 3.28Å; T267-M271 PolarHBondContact O-N 2.93Å |
| 268 | V | 89.1 | Confident | 85.7 | Confident | 40 Ų | 40 | 26.6 Ų | 26.6 | 24% | 0.242 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63 | -42 | -177.1 | -171.4 | 0 | 0 | 0 | 0 | 111.3 | L93 I97 M271 A272 F456 | L93-V268 HydrophobicContact CD1-CG2 4.45Å; I97-V268 HydrophobicContact CD1-CG1 4.36Å; V268-M271 PolarHBondContact O-N 2.96Å; V268-A272 WeakPolarHBondContact O-CB 3.39Å; V268-A272 PolarHBondContact O-N 3.4Å; V268-F456 HydrophobicContact CB-CE2 3.91Å; V268-F456 HydrophobicContact CB-CZ 4.4Å; V268-F456 HydrophobicContact CG1-CD2 4.17Å; V268-F456 HydrophobicContact CG1-CE2 3.32Å; V268-F456 HydrophobicContact CG1-CZ 3.71Å |
| 269 | P | 92.2 | Very high | 85.9 | Confident | 3 Ų | 3 | 20.4 Ų | 20.4 | 2% | 0.019 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -55.7 | -46.3 | 168.6 | -31.9 | 39.5 | 0 | 0 | 0 | 114.8 | S265 Y266 M271 A272 F273 G411 | S265-P269 VanDerWaalsContact O-CD 3.24Å; S265-P269 WeakPolarHBondContact O-CD 3.35Å; S265-P269 WeakPolarHBondContact O-CG 3.28Å; Y266-P269 WeakPolarHBondContact O-CD 3.48Å; P269-M271 VanDerWaalsContact C-N 3.3Å; P269-M271 PolarHBondContact O-N 3.07Å; P269-A272 PolarHBondContact O-N 2.8Å; P269-F273 WeakPolarHBondContact O-CB 3.45Å; P269-F273 PolarHBondContact O-N 3.14Å; P269-G411 VanDerWaalsContact O-CA 3.28Å; P269-G411 WeakPolarHBondContact O-CA 3.16Å |
| 270 | I | 92.3 | Very high | 86.4 | Confident | 2 Ų | 2 | 19.9 Ų | 19.9 | 1% | 0.01 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -58.4 | -45 | 177.8 | -69.9 | 159.5 | 0 | 0 | 0 | 110.4 | L78 Y80 Y266 T267 F273 A274 F407 | L78-I270 HydrophobicContact CD2-CG2 4.33Å; Y80-I270 HydrophobicContact CD1-CD1 3.88Å; Y80-I270 HydrophobicContact CE1-CD1 4.13Å; Y266-I270 WeakPolarHBondContact O-CB 3.3Å; Y266-I270 VanDerWaalsContact O-CD1 3.25Å; Y266-I270 WeakPolarHBondContact O-CD1 3.3Å; Y266-I270 WeakPolarHBondContact O-CG1 3.31Å; Y266-I270 PolarHBondContact O-N 3.29Å; T267-I270 PolarHBondContact O-N 3.3Å; T267-I270 VanDerWaalsContact O-N 3.15Å; I270-F273 PolarHBondContact O-N 3.4Å; I270-A274 WeakPolarHBondContact O-CB 3.39Å; I270-A274 PolarHBondContact O-N 2.98Å; I270-F407 HydrophobicContact CB-CB 4.43Å; I270-F407 HydrophobicContact CG1-CB 3.58Å; I270-F407 HydrophobicContact CG1-CD2 4.34Å; I270-F407 HydrophobicContact CG1-CG 4.4Å |
| 271 | M | 92.8 | Very high | 87.1 | Confident | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -67.1 | -41.2 | 178.8 | -63 | 172.2 | 75.4 | 0 | 0 | 112.1 | L78 A81 F90 L93 L94 I97 T267 V268 P269 A274 F275 | L78-M271 HydrophobicContact CD2-CG 4.09Å; A81-M271 HydrophobicContact CB-CG 4.46Å; F90-M271 HydrophobicContact CD2-CE 4.09Å; F90-M271 HydrophobicContact CD2-SD 4.05Å; F90-M271 HydrophobicContact CE2-CE 3.97Å; F90-M271 HydrophobicContact CE2-CG 4.18Å; F90-M271 HydrophobicContact CE2-SD 3.98Å; F90-M271 HydrophobicContact CZ-CE 4.42Å; L93-M271 HydrophobicContact CB-CE 3.6Å; L93-M271 HydrophobicContact CB-SD 4.11Å; L94-M271 HydrophobicContact CB-CE 3.62Å; L94-M271 HydrophobicContact CD1-CE 3.76Å; L94-M271 HydrophobicContact CG-CE 4.33Å; I97-M271 HydrophobicContact CD1-CB 3.56Å; I97-M271 HydrophobicContact CD1-CE 4.42Å; T267-M271 HydrophobicContact CG2-CG 4.44Å; T267-M271 HydrophobicContact CG2-SD 3.79Å; T267-M271 VanDerWaalsContact O-CG 3.32Å; T267-M271 WeakPolarHBondContact O-CG 3.28Å; T267-M271 PolarHBondContact O-N 2.93Å; V268-M271 PolarHBondContact O-N 2.96Å; P269-M271 VanDerWaalsContact C-N 3.3Å; P269-M271 PolarHBondContact O-N 3.07Å; M271-A274 PolarHBondContact O-N 3.41Å; M271-F275 PolarHBondContact O-N 3.09Å |
| 272 | A | 92.9 | Very high | 87.8 | Confident | 1 Ų | 1 | 12.6 Ų | 12.6 | 1% | 0.008 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -61.8 | -46.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | V268 P269 A274 F275 V276 A415 I419 F456 | V268-A272 WeakPolarHBondContact O-CB 3.39Å; V268-A272 PolarHBondContact O-N 3.4Å; P269-A272 PolarHBondContact O-N 2.8Å; A272-A274 VanDerWaalsContact C-N 3.33Å; A272-A274 PolarHBondContact O-N 3.34Å; A272-F275 PolarHBondContact O-N 3.47Å; A272-V276 VanDerWaalsContact O-CG2 3.3Å; A272-V276 WeakPolarHBondContact O-CG2 3.38Å; A272-V276 PolarHBondContact O-N 2.85Å; A272-A415 HydrophobicContact CB-CB 3.9Å; A272-I419 HydrophobicContact CB-CD1 4.5Å; A272-I419 WeakPolarHBondContact O-CD1 3.23Å; A272-F456 HydrophobicContact CB-CE1 3.77Å; A272-F456 HydrophobicContact CB-CZ 3.87Å |
| 273 | F | 92.9 | Very high | 88.5 | Confident | 13 Ų | 13 | 10.3 Ų | 10.3 | 6% | 0.057 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -54.9 | -45.9 | 174.1 | 170.6 | -102.2 | 0 | 0 | 0 | 111.9 | H143 A147 P269 I270 F275 V276 F407 I410 | H143-F273 AromaticContact CE1-CD2 3.91Å; A147-F273 HydrophobicContact CB-CE2 4.1Å; A147-F273 HydrophobicContact CB-CZ 4.13Å; P269-F273 WeakPolarHBondContact O-CB 3.45Å; P269-F273 PolarHBondContact O-N 3.14Å; I270-F273 PolarHBondContact O-N 3.4Å; F273-F275 PolarHBondContact O-N 2.86Å; F273-V276 PolarHBondContact O-N 3.07Å; F273-F407 AromaticContact CD1-CD1 3.61Å; F273-F407 HydrophobicContact CD1-CD1 3.61Å; F273-F407 HydrophobicContact CD1-CE1 4.01Å; F273-F407 HydrophobicContact CD1-CG 4.31Å; F273-F407 AromaticContact CE1-CD1 3.39Å; F273-F407 HydrophobicContact CE1-CD1 3.39Å; F273-F407 AromaticContact CE1-CE1 3.38Å; F273-F407 HydrophobicContact CE1-CE1 3.38Å; F273-F407 HydrophobicContact CE1-CG 4.46Å; F273-F407 HydrophobicContact CE1-CZ 4.44Å; F273-F407 HydrophobicContact CG-CD1 4.43Å; F273-F407 HydrophobicContact CZ-CD1 4.05Å; F273-F407 HydrophobicContact CZ-CE1 4.05Å; F273-I410 HydrophobicContact CD2-CB 4.27Å; F273-I410 HydrophobicContact CD2-CG2 3.68Å; F273-I410 HydrophobicContact CE2-CG2 3.87Å |
| 274 | A | 93.4 | Very high | 89.3 | Confident | 2 Ų | 2 | 9.6 Ų | 9.6 | 2% | 0.017 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -63.8 | -19.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | I70 L78 I270 M271 A272 Y311 | I70-A274 WeakPolarHBondContact CG2-O 3.42Å; I70-A274 VanDerWaalsContact O-O 3.08Å; L78-A274 HydrophobicContact CD2-CB 4.26Å; I270-A274 WeakPolarHBondContact O-CB 3.39Å; I270-A274 PolarHBondContact O-N 2.98Å; M271-A274 PolarHBondContact O-N 3.41Å; A272-A274 VanDerWaalsContact C-N 3.33Å; A272-A274 PolarHBondContact O-N 3.34Å; A274-Y311 HydrophobicContact CB-CE2 3.92Å; A274-Y311 WeakPolarHBondContact O-CE2 3.29Å; A274-Y311 PolarHBondContact O-OH 3.4Å |
| 275 | F | 93.8 | Very high | 90 | Very high | 0 Ų | 0 | 7.3 Ų | 7.3 | 0% | 0 | 4% | 0.042 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.7 | 5 | 179.8 | -82.2 | -69.8 | 0 | 0 | 0 | 114.5 | I70 L94 I97 A98 S101 M271 A272 F273 C277 I304 F308 Y311 | I70-F275 HydrophobicContact CG2-CD1 4.11Å; L94-F275 HydrophobicContact CD1-CE2 3.54Å; L94-F275 HydrophobicContact CD1-CZ 4.21Å; L94-F275 HydrophobicContact CG-CE2 3.93Å; L94-F275 HydrophobicContact CG-CZ 4.26Å; I97-F275 HydrophobicContact CB-CD2 4.38Å; I97-F275 HydrophobicContact CG2-CB 3.9Å; I97-F275 HydrophobicContact CG2-CD2 3.71Å; I97-F275 HydrophobicContact CG2-CG 4.12Å; A98-F275 HydrophobicContact CB-CE1 3.98Å; A98-F275 HydrophobicContact CB-CE2 4.39Å; A98-F275 HydrophobicContact CB-CZ 3.88Å; S101-F275 PolarHBondContact OG-O 2.9Å; M271-F275 PolarHBondContact O-N 3.09Å; A272-F275 PolarHBondContact O-N 3.47Å; F273-F275 PolarHBondContact O-N 2.86Å; F275-C277 PolarHBondContact O-N 3.44Å; F275-I304 HydrophobicContact CD1-CG2 4.46Å; F275-I304 HydrophobicContact CE1-CG2 4.21Å; F275-F308 HydrophobicContact CZ-CB 4.38Å; F275-Y311 HydrophobicContact CD1-CE2 4.44Å; F275-Y311 HydrophobicContact CE1-CD2 4.12Å; F275-Y311 HydrophobicContact CE1-CE2 4.15Å; F275-Y311 AromaticContact CE2-CD2 3.93Å; F275-Y311 HydrophobicContact CE2-CD2 3.93Å; F275-Y311 HydrophobicContact CE2-CE2 4.29Å; F275-Y311 AromaticContact CZ-CD2 3.65Å; F275-Y311 HydrophobicContact CZ-CD2 3.65Å; F275-Y311 HydrophobicContact CZ-CE2 4.07Å |
| 276 | V | 93.5 | Very high | 90.4 | Very high | 6 Ų | 6 | 7.7 Ų | 7.7 | 4% | 0.036 | 4% | 0.043 | C | C | . | . | trans | -75.2 | 115.6 | 173.2 | -173.1 | 0 | 0 | 0 | 0 | 109.5 | H143 A272 F273 A415 L418 I419 | H143-V276 WeakPolarHBondContact CE1-CB 3.46Å; H143-V276 VanDerWaalsContact CE1-CG1 3.45Å; H143-V276 WeakPolarHBondContact CE1-CG1 3.43Å; H143-V276 WeakPolarHBondContact NE2-CB 3.24Å; H143-V276 WeakPolarHBondContact NE2-CG1 3.33Å; A272-V276 VanDerWaalsContact O-CG2 3.3Å; A272-V276 WeakPolarHBondContact O-CG2 3.38Å; A272-V276 PolarHBondContact O-N 2.85Å; F273-V276 PolarHBondContact O-N 3.07Å; V276-A415 HydrophobicContact CG2-CB 3.37Å; V276-L418 HydrophobicContact CG1-CB 4.1Å; V276-L418 HydrophobicContact CG1-CD1 3.75Å; V276-I419 HydrophobicContact CG2-CD1 3.77Å; V276-I419 HydrophobicContact CG2-CG1 4.09Å | ||
| 277 | C | 93.3 | Very high | 90.5 | Very high | 2 Ų | 2 | 10.8 Ų | 10.8 | 1% | 0.014 | 6% | 0.058 | C | C | . | . | trans | -131.5 | 2.5 | 167.2 | 58.2 | 0 | 0 | 0 | 0 | 113 | L66 I70 F275 P279 E280 V281 | L66-C277 HydrophobicContact CD1-CB 3.77Å; I70-C277 HydrophobicContact CD1-CB 4.35Å; I70-C277 HydrophobicContact CG1-CB 3.48Å; I70-C277 VanDerWaalsContact CG1-CB 3.48Å; F275-C277 PolarHBondContact O-N 3.44Å; C277-P279 VanDerWaalsContact C-N 3.34Å; C277-E280 WeakPolarHBondContact O-CB 3.36Å; C277-E280 PolarHBondContact O-N 3.47Å; C277-V281 PolarHBondContact O-N 2.89Å | ||
| 278 | H | 93.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 10.8 Ų | 10.8 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -51.3 | -39.6 | -174.2 | -63.5 | 77.5 | 0 | 0 | 0 | 114.6 | S101 S104 Y120 E280 V281 L418 | S101-H278 PolarHBondContact OG-CE1 2.99Å; S104-H278 VanDerWaalsContact CB-NE2 3.31Å; S104-H278 WeakPolarHBondContact CB-NE2 3.35Å; S104-H278 PolarHBondContact OG-CD2 3.13Å; S104-H278 PolarHBondContact OG-NE2 2.93Å; Y120-H278 HydrophobicContact CE2-CB 4Å; H278-E280 VanDerWaalsContact C-N 3.25Å; H278-E280 PolarHBondContact O-N 3.35Å; H278-V281 PolarHBondContact O-N 3.4Å; H278-L418 HydrophobicContact CB-CB 4.28Å; H278-L418 PolarHBondContact CD2-O 3.39Å |
| 279 | P | 90.4 | Very high | 90.5 | Very high | 5 Ų | 5 | 9.4 Ų | 9.4 | 3% | 0.032 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -62.1 | -30 | 175.5 | -24.1 | 36.2 | 0 | 0 | 0 | 114 | I140 C277 P283 L418 | I140-P279 HydrophobicContact CG1-CB 4.44Å; I140-P279 HydrophobicContact CG1-CG 4.37Å; I140-P279 HydrophobicContact CG2-CB 4.09Å; I140-P279 HydrophobicContact CG2-CG 4.47Å; C277-P279 VanDerWaalsContact C-N 3.34Å; P279-P283 WeakPolarHBondContact O-CD 3.05Å; P279-P283 WeakPolarHBondContact O-CG 3.14Å; P279-L418 HydrophobicContact CG-CD1 3.83Å; P279-L418 HydrophobicContact CG-CD2 4.26Å |
| 280 | E | 89.4 | Confident | 90.2 | Very high | 14 Ų | 14 | 14.9 Ų | 14.9 | 7% | 0.065 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -88.5 | -22.6 | -175.8 | -55.8 | -53.4 | 143.8 | 0 | 0 | 113.3 | A69 C277 H278 L282 P283 I284 P362 | A69-E280 HydrophobicContact CB-CB 4.15Å; A69-E280 HydrophobicContact CB-CG 3.73Å; C277-E280 WeakPolarHBondContact O-CB 3.36Å; C277-E280 PolarHBondContact O-N 3.47Å; H278-E280 VanDerWaalsContact C-N 3.25Å; H278-E280 PolarHBondContact O-N 3.35Å; E280-L282 PolarHBondContact O-N 3.35Å; E280-P283 WeakPolarHBondContact O-CD 3.3Å; E280-I284 HydrophobicContact CB-CD1 4.04Å; E280-I284 WeakPolarHBondContact O-CB 3.3Å; E280-I284 VanDerWaalsContact O-CG1 3.24Å; E280-I284 WeakPolarHBondContact O-CG1 3.44Å; E280-I284 PolarHBondContact O-N 3.12Å; E280-P362 VanDerWaalsContact CD-CG 3.48Å; E280-P362 WeakPolarHBondContact OE1-CG 3.32Å; E280-P362 WeakPolarHBondContact OE2-CG 3.47Å |
| 281 | V | 91.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -56.8 | -50.3 | -176.2 | 171.4 | 0 | 0 | 0 | 0 | 111.7 | L66 I105 L109 C277 H278 I284 Y285 M296 | L66-V281 HydrophobicContact CD1-CG2 4.04Å; I105-V281 HydrophobicContact CD1-CG2 4Å; I105-V281 HydrophobicContact CG1-CG2 4.17Å; I105-V281 HydrophobicContact CG2-CG1 4.08Å; I105-V281 HydrophobicContact CG2-CG2 4.48Å; L109-V281 HydrophobicContact CD2-CG1 3.87Å; L109-V281 HydrophobicContact CG-CG1 4.34Å; C277-V281 PolarHBondContact O-N 2.89Å; H278-V281 PolarHBondContact O-N 3.4Å; V281-I284 PolarHBondContact O-N 2.84Å; V281-Y285 VanDerWaalsContact O-CB 3.3Å; V281-Y285 WeakPolarHBondContact O-CB 3.4Å; V281-Y285 PolarHBondContact O-N 3.47Å; V281-M296 HydrophobicContact CB-CE 4.39Å; V281-M296 HydrophobicContact CG1-CE 3.86Å; V281-M296 VanDerWaalsContact O-CE 3.32Å; V281-M296 WeakPolarHBondContact O-CE 3.44Å |
| 282 | L | 89.4 | Confident | 89.8 | Confident | 0 Ų | 0 | 19.1 Ų | 19.1 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -70.6 | -43.4 | -176.5 | -63.1 | 179.2 | 0 | 0 | 0 | 113.2 | L108 L109 A112 Y120 E280 I284 Y285 T286 | L108-L282 HydrophobicContact CD1-CD1 4.43Å; L108-L282 HydrophobicContact CD2-CG 4.4Å; L109-L282 HydrophobicContact CD2-CD2 4.3Å; A112-L282 HydrophobicContact CB-CD2 3.78Å; Y120-L282 HydrophobicContact CD2-CD1 4.3Å; Y120-L282 HydrophobicContact CG-CD1 4.35Å; E280-L282 PolarHBondContact O-N 3.35Å; L282-I284 PolarHBondContact O-N 3.38Å; L282-Y285 HydrophobicContact CD2-CD1 4.45Å; L282-Y285 WeakPolarHBondContact O-CB 3.45Å; L282-Y285 PolarHBondContact O-N 3.14Å; L282-T286 PolarHBondContact O-N 3.04Å |
| 283 | P | 86.2 | Confident | 89.7 | Confident | 18 Ų | 18 | 21.6 Ų | 21.6 | 12% | 0.117 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -54.7 | -47.7 | 168.6 | -28.1 | 35 | 0 | 0 | 0 | 113.6 | P279 E280 Y285 T286 E287 | P279-P283 WeakPolarHBondContact O-CD 3.05Å; P279-P283 WeakPolarHBondContact O-CG 3.14Å; E280-P283 WeakPolarHBondContact O-CD 3.3Å; P283-Y285 VanDerWaalsContact C-N 3.27Å; P283-Y285 PolarHBondContact O-N 3.32Å; P283-T286 PolarHBondContact O-N 3.26Å; P283-T286 VanDerWaalsContact O-N 3.12Å; P283-T286 PolarHBondContact O-OG1 3.27Å; P283-E287 PolarHBondContact O-N 3.08Å |
| 284 | I | 88.3 | Confident | 89.7 | Confident | 12 Ų | 12 | 31.5 Ų | 31.5 | 6% | 0.062 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63 | -37.3 | 177.4 | -67.4 | 169.2 | 0 | 0 | 0 | 110.7 | N65 L66 E280 V281 L282 T286 E287 L288 M296 | N65-I284 HydrophobicContact CB-CD1 3.97Å; N65-I284 HydrophobicContact CB-CG1 4.4Å; L66-I284 HydrophobicContact CB-CD1 3.91Å; L66-I284 HydrophobicContact CD1-CD1 3.98Å; E280-I284 HydrophobicContact CB-CD1 4.04Å; E280-I284 WeakPolarHBondContact O-CB 3.3Å; E280-I284 VanDerWaalsContact O-CG1 3.24Å; E280-I284 WeakPolarHBondContact O-CG1 3.44Å; E280-I284 PolarHBondContact O-N 3.12Å; V281-I284 PolarHBondContact O-N 2.84Å; L282-I284 PolarHBondContact O-N 3.38Å; I284-T286 VanDerWaalsContact C-N 3.29Å; I284-T286 PolarHBondContact O-N 3.06Å; I284-E287 PolarHBondContact O-N 3.5Å; I284-E287 VanDerWaalsContact O-N 3.11Å; I284-L288 PolarHBondContact O-N 3.14Å; I284-M296 HydrophobicContact CB-CE 4.08Å; I284-M296 HydrophobicContact CG2-CE 3.86Å; I284-M296 HydrophobicContact CG2-SD 4.28Å |
| 285 | Y | 89 | Confident | 89.8 | Confident | 11 Ų | 11 | 35.3 Ų | 35.3 | 4% | 0.043 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.7 | -34.4 | 175.9 | -171.2 | -164.2 | 0 | 0 | 0 | 112.7 | L109 V281 L282 P283 E287 P291 S292 Q293 M296 | L109-Y285 HydrophobicContact CD2-CD1 3.72Å; L109-Y285 HydrophobicContact CD2-CE1 4.04Å; L109-Y285 HydrophobicContact CD2-CG 4.45Å; V281-Y285 VanDerWaalsContact O-CB 3.3Å; V281-Y285 WeakPolarHBondContact O-CB 3.4Å; V281-Y285 PolarHBondContact O-N 3.47Å; L282-Y285 HydrophobicContact CD2-CD1 4.45Å; L282-Y285 WeakPolarHBondContact O-CB 3.45Å; L282-Y285 PolarHBondContact O-N 3.14Å; P283-Y285 VanDerWaalsContact C-N 3.27Å; P283-Y285 PolarHBondContact O-N 3.32Å; Y285-E287 VanDerWaalsContact C-N 3.31Å; Y285-P291 HydrophobicContact CD2-CB 3.82Å; Y285-P291 HydrophobicContact CE2-CB 3.52Å; Y285-S292 VanDerWaalsContact OH-C 3.27Å; Y285-Q293 PolarHBondContact OH-N 3.18Å; Y285-Q293 VanDerWaalsContact OH-N 3.12Å; Y285-M296 HydrophobicContact CD1-CG 4.34Å; Y285-M296 HydrophobicContact CD2-CB 3.77Å; Y285-M296 HydrophobicContact CD2-CG 3.94Å; Y285-M296 HydrophobicContact CD2-SD 4.31Å; Y285-M296 HydrophobicContact CE2-CB 4.01Å; Y285-M296 HydrophobicContact CG-CB 4.09Å; Y285-M296 HydrophobicContact CG-CG 3.8Å; Y285-M296 HydrophobicContact CG-SD 4.28Å |
| 286 | T | 85.9 | Confident | 89.8 | Confident | 26 Ų | 26 | 35.3 Ų | 35.3 | 16% | 0.16 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -69.4 | -28.4 | 174.3 | 56.6 | 0 | 0 | 0 | 0 | 113.6 | R118 L282 P283 I284 | R118-T286 HydrophobicContact CB-CG2 3.36Å; R118-T286 HydrophobicContact CG-CG2 4.18Å; L282-T286 PolarHBondContact O-N 3.04Å; P283-T286 PolarHBondContact O-N 3.26Å; P283-T286 VanDerWaalsContact O-N 3.12Å; P283-T286 PolarHBondContact O-OG1 3.27Å; I284-T286 VanDerWaalsContact C-N 3.29Å; I284-T286 PolarHBondContact O-N 3.06Å |
| 287 | E | 84.9 | Confident | 89.9 | Confident | 71 Ų | 71 | 36.1 Ų | 36.1 | 33% | 0.332 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -88.7 | -17 | -177.6 | -70.8 | -105.3 | 154.6 | 0 | 0 | 113.1 | G55 K56 T57 P283 I284 Y285 | G55-E287 CarbonylContact C-O 3.34Å; G55-E287 WeakPolarHBondContact CA-O 3.46Å; K56-E287 PolarHBondContact N-O 2.79Å; K56-E287 VanDerWaalsContact N-O 3.13Å; T57-E287 VanDerWaalsContact CB-O 3.28Å; T57-E287 WeakPolarHBondContact CB-O 3.48Å; T57-E287 PolarHBondContact N-O 2.94Å; T57-E287 PolarHBondContact OG1-O 3.11Å; T57-E287 PolarHBondContact OG1-OE2 3.39Å; P283-E287 PolarHBondContact O-N 3.08Å; I284-E287 PolarHBondContact O-N 3.5Å; I284-E287 VanDerWaalsContact O-N 3.11Å; Y285-E287 VanDerWaalsContact C-N 3.31Å |
| 288 | L | 87.8 | Confident | 90.1 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | B | Isolated β-bridge | trans | -66.6 | 128 | -176.1 | -179.4 | 64.9 | 0 | 0 | 0 | 112.5 | S62 I284 R290 P291 R295 M296 | S62-L288 VanDerWaalsContact OG-CD1 3.25Å; S62-L288 WeakPolarHBondContact OG-CD1 3.41Å; I284-L288 PolarHBondContact O-N 3.14Å; L288-R290 PolarHBondContact O-N 3.18Å; L288-P291 WeakPolarHBondContact O-CD 3.38Å; L288-R295 HydrophobicContact CD2-CB 4.24Å; L288-M296 HydrophobicContact CD2-CB 4.41Å; L288-M296 HydrophobicContact CD2-SD 4.25Å |
| 289 | C | 86.9 | Confident | 90.3 | Very high | 11 Ų | 11 | 37.8 Ų | 37.8 | 7% | 0.074 | 18% | 0.178 | C | C | . | . | S | Bend | trans | -64.7 | 127 | 175.6 | -161.4 | 0 | 0 | 0 | 0 | 110.7 | C5 G55 T57 R295 | C5-C289 WeakPolarHBondContact CB-SG 3.43Å; C5-C289 WeakPolarHBondContact SG-CB 3.3Å; C5-C289 CovalentContact SG-SG 2.07Å; C5-C289 PolarHBondContact SG-SG 2.66Å; G55-C289 WeakPolarHBondContact O-CA 3.22Å; G55-C289 WeakPolarHBondContact O-CB 3.43Å; T57-C289 WeakPolarHBondContact O-CB 3.4Å; T57-C289 PolarHBondContact O-N 2.92Å; C289-R295 PolarHBondContact O-NH1 2.94Å; C289-R295 PolarHBondContact O-NH2 3.16Å |
| 290 | R | 86.4 | Confident | 90.6 | Very high | 119 Ų | 119 | 37.5 Ų | 37.5 | 45% | 0.449 | 18% | 0.177 | S | C | . | . | S | Bend | trans | 50.6 | 70.1 | -171.7 | -58.3 | 176.2 | -172.9 | 169.6 | 4.4 | 111.7 | L288 S292 R295 | L288-R290 PolarHBondContact O-N 3.18Å; R290-S292 PolarHBondContact O-N 2.82Å; R290-R295 PolarHBondContact O-NH1 3.34Å |
| 291 | P | 85.7 | Confident | 90.9 | Very high | 44 Ų | 44 | 40.3 Ų | 40.3 | 29% | 0.286 | 19% | 0.192 | S | C | . | . | trans | -70.3 | 124.1 | -171.9 | 28 | -32.6 | 0 | 0 | 0 | 111 | R118 Y285 L288 | R118-P291 VanDerWaalsContact NH1-CG 3.31Å; Y285-P291 HydrophobicContact CD2-CB 3.82Å; Y285-P291 HydrophobicContact CE2-CB 3.52Å; L288-P291 WeakPolarHBondContact O-CD 3.38Å | ||
| 292 | S | 91 | Very high | 91.2 | Very high | 47 Ų | 47 | 45.3 Ų | 45.3 | 33% | 0.329 | 22% | 0.217 | S | C | . | . | trans | -137.8 | 154.5 | 168.4 | 75.6 | 0 | 0 | 0 | 0 | 111.1 | Y285 R290 R294 R295 M296 | Y285-S292 VanDerWaalsContact OH-C 3.27Å; R290-S292 PolarHBondContact O-N 2.82Å; S292-R294 VanDerWaalsContact C-N 3.31Å; S292-R294 PolarHBondContact O-N 3.26Å; S292-R295 PolarHBondContact O-N 3.17Å; S292-R295 VanDerWaalsContact O-N 3.16Å; S292-R295 WeakPolarHBondContact OG-CB 3.41Å; S292-R295 VanDerWaalsContact OG-CG 3.31Å; S292-R295 WeakPolarHBondContact OG-CG 3.38Å; S292-R295 PolarHBondContact OG-N 3.28Å; S292-M296 PolarHBondContact O-N 3.34Å | ||
| 293 | Q | 91 | Very high | 91.5 | Very high | 52 Ų | 52 | 45.3 Ų | 45.3 | 24% | 0.243 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -56.3 | -45.5 | -179.8 | 177.1 | 177.7 | -3.5 | 0 | 0 | 111.5 | L109 T110 Y285 R295 M296 Q297 | L109-Q293 HydrophobicContact CB-CG 4.15Å; T110-Q293 PolarHBondContact OG1-NE2 3.29Å; Y285-Q293 PolarHBondContact OH-N 3.18Å; Y285-Q293 VanDerWaalsContact OH-N 3.12Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 2.95Å; Q293-M296 PolarHBondContact O-N 3.05Å; Q293-Q297 WeakPolarHBondContact O-CB 3.13Å; Q293-Q297 PolarHBondContact O-N 3.31Å |
| 294 | R | 93.1 | Very high | 92.1 | Very high | 222 Ų | 222 | 44.8 Ų | 44.8 | 84% | 0.838 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -60.5 | -42.7 | 178.9 | -67.6 | -176.9 | -177 | 170.6 | 1 | 112.1 | S292 A298 | S292-R294 VanDerWaalsContact C-N 3.31Å; S292-R294 PolarHBondContact O-N 3.26Å; R294-A298 WeakPolarHBondContact O-CB 3.17Å; R294-A298 PolarHBondContact O-N 3.38Å |
| 295 | R | 94.3 | Very high | 92.5 | Very high | 82 Ų | 82 | 45.7 Ų | 45.7 | 31% | 0.309 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -68.5 | -43.6 | 179.2 | -72.3 | -176.6 | 69.6 | 176.7 | -0.2 | 111.5 | L288 C289 R290 S292 Q293 Q297 A298 V299 | L288-R295 HydrophobicContact CD2-CB 4.24Å; C289-R295 PolarHBondContact O-NH1 2.94Å; C289-R295 PolarHBondContact O-NH2 3.16Å; R290-R295 PolarHBondContact O-NH1 3.34Å; S292-R295 PolarHBondContact O-N 3.17Å; S292-R295 VanDerWaalsContact O-N 3.16Å; S292-R295 WeakPolarHBondContact OG-CB 3.41Å; S292-R295 VanDerWaalsContact OG-CG 3.31Å; S292-R295 WeakPolarHBondContact OG-CG 3.38Å; S292-R295 PolarHBondContact OG-N 3.28Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 2.95Å; R295-Q297 VanDerWaalsContact C-N 3.34Å; R295-A298 WeakPolarHBondContact O-CB 3.4Å; R295-A298 PolarHBondContact O-N 3.35Å; R295-V299 WeakPolarHBondContact O-CG2 3.42Å; R295-V299 PolarHBondContact O-N 3.15Å |
| 296 | M | 94.5 | Very high | 92.8 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.2 | -37.2 | 177.5 | -169.5 | 62.5 | -156.1 | 0 | 0 | 112 | L66 L109 V281 I284 Y285 L288 S292 Q293 A298 V299 A300 | L66-M296 HydrophobicContact CD2-CE 4.33Å; L109-M296 HydrophobicContact CD1-CB 4Å; L109-M296 HydrophobicContact CD1-CG 3.92Å; L109-M296 HydrophobicContact CD2-CB 4.27Å; L109-M296 HydrophobicContact CD2-CG 3.78Å; V281-M296 HydrophobicContact CB-CE 4.39Å; V281-M296 HydrophobicContact CG1-CE 3.86Å; V281-M296 VanDerWaalsContact O-CE 3.32Å; V281-M296 WeakPolarHBondContact O-CE 3.44Å; I284-M296 HydrophobicContact CB-CE 4.08Å; I284-M296 HydrophobicContact CG2-CE 3.86Å; I284-M296 HydrophobicContact CG2-SD 4.28Å; Y285-M296 HydrophobicContact CD1-CG 4.34Å; Y285-M296 HydrophobicContact CD2-CB 3.77Å; Y285-M296 HydrophobicContact CD2-CG 3.94Å; Y285-M296 HydrophobicContact CD2-SD 4.31Å; Y285-M296 HydrophobicContact CE2-CB 4.01Å; Y285-M296 HydrophobicContact CG-CB 4.09Å; Y285-M296 HydrophobicContact CG-CG 3.8Å; Y285-M296 HydrophobicContact CG-SD 4.28Å; L288-M296 HydrophobicContact CD2-CB 4.41Å; L288-M296 HydrophobicContact CD2-SD 4.25Å; S292-M296 PolarHBondContact O-N 3.34Å; Q293-M296 PolarHBondContact O-N 3.05Å; M296-A298 VanDerWaalsContact C-N 3.35Å; M296-V299 HydrophobicContact CE-CG1 4.39Å; M296-V299 WeakPolarHBondContact O-CB 3.38Å; M296-V299 PolarHBondContact O-N 3.15Å; M296-V299 HydrophobicContact SD-CB 4.41Å; M296-A300 PolarHBondContact O-N 2.99Å |
| 297 | Q | 96.3 | Very high | 93.3 | Very high | 22 Ų | 22 | 46.1 Ų | 46.1 | 10% | 0.103 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.6 | -40.1 | 172.2 | -170.8 | 67.8 | 47.6 | 0 | 0 | 111.8 | S102 L109 Q293 R295 A300 N301 | S102-Q297 PolarHBondContact O-NE2 3Å; L109-Q297 HydrophobicContact CD1-CB 4.22Å; Q293-Q297 WeakPolarHBondContact O-CB 3.13Å; Q293-Q297 PolarHBondContact O-N 3.31Å; R295-Q297 VanDerWaalsContact C-N 3.34Å; Q297-A300 PolarHBondContact O-N 3.21Å; Q297-N301 PolarHBondContact NE2-OD1 3.41Å; Q297-N301 WeakPolarHBondContact O-CB 3.42Å; Q297-N301 VanDerWaalsContact O-CG 3.26Å; Q297-N301 PolarHBondContact O-N 2.92Å; Q297-N301 PolarHBondContact O-OD1 2.99Å |
| 298 | A | 96.8 | Very high | 93.8 | Very high | 37 Ų | 37 | 45.4 Ų | 45.4 | 31% | 0.306 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63.4 | -41.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | F59 R294 R295 M296 A300 N301 M302 | F59-A298 HydrophobicContact CE2-CB 4.04Å; F59-A298 HydrophobicContact CZ-CB 4.07Å; R294-A298 WeakPolarHBondContact O-CB 3.17Å; R294-A298 PolarHBondContact O-N 3.38Å; R295-A298 WeakPolarHBondContact O-CB 3.4Å; R295-A298 PolarHBondContact O-N 3.35Å; M296-A298 VanDerWaalsContact C-N 3.35Å; A298-A300 VanDerWaalsContact C-N 3.32Å; A298-A300 PolarHBondContact O-N 3.48Å; A298-N301 PolarHBondContact O-N 3.26Å; A298-M302 WeakPolarHBondContact O-CB 3.35Å; A298-M302 VanDerWaalsContact O-CG 3.28Å; A298-M302 WeakPolarHBondContact O-CG 3.46Å; A298-M302 PolarHBondContact O-N 3.36Å |
| 299 | V | 96.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -56.5 | -48 | 172.1 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | F59 V63 L66 R295 M296 S303 | F59-V299 HydrophobicContact CD2-CG2 3.55Å; F59-V299 HydrophobicContact CE2-CB 4.45Å; F59-V299 HydrophobicContact CE2-CG2 3.39Å; F59-V299 HydrophobicContact CG-CG2 4.37Å; F59-V299 HydrophobicContact CZ-CG2 4.09Å; V63-V299 HydrophobicContact CG2-CB 4.3Å; V63-V299 HydrophobicContact CG2-CG1 4.04Å; V63-V299 HydrophobicContact CG2-CG2 4.22Å; L66-V299 HydrophobicContact CB-CG1 4.35Å; L66-V299 HydrophobicContact CD2-CG1 3.99Å; R295-V299 WeakPolarHBondContact O-CG2 3.42Å; R295-V299 PolarHBondContact O-N 3.15Å; M296-V299 HydrophobicContact CE-CG1 4.39Å; M296-V299 WeakPolarHBondContact O-CB 3.38Å; M296-V299 PolarHBondContact O-N 3.15Å; M296-V299 HydrophobicContact SD-CB 4.41Å; V299-S303 WeakPolarHBondContact O-CB 3.28Å; V299-S303 PolarHBondContact O-N 3.03Å; V299-S303 PolarHBondContact O-OG 3.32Å |
| 300 | A | 96.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.9 | -49.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | L66 I105 M296 Q297 A298 M302 S303 I304 | L66-A300 HydrophobicContact CD2-CB 4.03Å; I105-A300 HydrophobicContact CD1-CB 3.85Å; I105-A300 HydrophobicContact CG2-CB 3.77Å; M296-A300 PolarHBondContact O-N 2.99Å; Q297-A300 PolarHBondContact O-N 3.21Å; A298-A300 VanDerWaalsContact C-N 3.32Å; A298-A300 PolarHBondContact O-N 3.48Å; A300-M302 PolarHBondContact O-N 3.33Å; A300-S303 PolarHBondContact O-N 2.88Å; A300-I304 WeakPolarHBondContact O-CB 3.12Å; A300-I304 WeakPolarHBondContact O-CG1 3.34Å; A300-I304 PolarHBondContact O-N 3.41Å |
| 301 | N | 97.3 | Very high | 95.1 | Very high | 73 Ų | 73 | 44.9 Ų | 44.9 | 39% | 0.39 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64.8 | -41.4 | -178.3 | -69.7 | -1 | 0 | 0 | 0 | 112 | S102 Q297 A298 G305 | S102-N301 PolarHBondContact OG-OD1 3.08Å; Q297-N301 PolarHBondContact NE2-OD1 3.41Å; Q297-N301 WeakPolarHBondContact O-CB 3.42Å; Q297-N301 VanDerWaalsContact O-CG 3.26Å; Q297-N301 PolarHBondContact O-N 2.92Å; Q297-N301 PolarHBondContact O-OD1 2.99Å; A298-N301 PolarHBondContact O-N 3.26Å; N301-G305 PolarHBondContact O-N 2.87Å |
| 302 | M | 97.1 | Very high | 95.6 | Very high | 105 Ų | 105 | 43.1 Ų | 43.1 | 52% | 0.517 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -64.8 | -42.1 | 175 | -71.4 | -177.4 | 69.6 | 0 | 0 | 111.6 | F59 V63 A298 A300 A306 | F59-M302 HydrophobicContact CE1-CE 4.36Å; F59-M302 HydrophobicContact CE1-SD 3.56Å; F59-M302 VanDerWaalsContact CE1-SD 3.56Å; F59-M302 HydrophobicContact CZ-SD 3.61Å; V63-M302 HydrophobicContact CG1-CB 4.44Å; V63-M302 HydrophobicContact CG2-CB 4.36Å; A298-M302 WeakPolarHBondContact O-CB 3.35Å; A298-M302 VanDerWaalsContact O-CG 3.28Å; A298-M302 WeakPolarHBondContact O-CG 3.46Å; A298-M302 PolarHBondContact O-N 3.36Å; A300-M302 PolarHBondContact O-N 3.33Å; M302-A306 WeakPolarHBondContact O-CB 3.49Å; M302-A306 PolarHBondContact O-N 3.31Å |
| 303 | S | 96.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.9 | -47.5 | 179.8 | -53.9 | 0 | 0 | 0 | 0 | 111.6 | V63 S67 V299 A300 A306 M307 | V63-S303 PolarHBondContact O-OG 3.37Å; S67-S303 WeakPolarHBondContact OG-CA 3.25Å; S67-S303 WeakPolarHBondContact OG-CB 3.43Å; V299-S303 WeakPolarHBondContact O-CB 3.28Å; V299-S303 PolarHBondContact O-N 3.03Å; V299-S303 PolarHBondContact O-OG 3.32Å; A300-S303 PolarHBondContact O-N 2.88Å; S303-A306 PolarHBondContact O-N 3.34Å; S303-M307 WeakPolarHBondContact O-CG 3.05Å; S303-M307 PolarHBondContact O-N 2.99Å |
| 304 | I | 96.9 | Very high | 96.1 | Very high | 7 Ų | 7 | 41.7 Ų | 41.7 | 4% | 0.036 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.4 | -44.1 | 177.4 | -69.9 | 171.2 | 0 | 0 | 0 | 110.8 | I70 A98 I105 F275 A300 M307 F308 | I70-I304 HydrophobicContact CD1-CG1 3.82Å; A98-I304 HydrophobicContact CB-CG2 3.83Å; I105-I304 HydrophobicContact CD1-CD1 3.77Å; F275-I304 HydrophobicContact CD1-CG2 4.46Å; F275-I304 HydrophobicContact CE1-CG2 4.21Å; A300-I304 WeakPolarHBondContact O-CB 3.12Å; A300-I304 WeakPolarHBondContact O-CG1 3.34Å; A300-I304 PolarHBondContact O-N 3.41Å; I304-M307 PolarHBondContact O-N 2.84Å; I304-F308 WeakPolarHBondContact O-CB 3.34Å; I304-F308 PolarHBondContact O-N 3.41Å |
| 305 | G | 97 | Very high | 96.2 | Very high | 31 Ų | 31 | 31.1 Ų | 31.1 | 32% | 0.32 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -61.9 | -43.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | N301 F308 I309 | N301-G305 PolarHBondContact O-N 2.87Å; G305-F308 PolarHBondContact O-N 3Å; G305-I309 WeakPolarHBondContact O-CG1 3.21Å; G305-I309 PolarHBondContact O-N 3.48Å |
| 306 | A | 95.7 | Very high | 96.2 | Very high | 41 Ų | 41 | 28.5 Ų | 28.5 | 34% | 0.339 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.4 | -43.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | M302 S303 I309 M310 | M302-A306 WeakPolarHBondContact O-CB 3.49Å; M302-A306 PolarHBondContact O-N 3.31Å; S303-A306 PolarHBondContact O-N 3.34Å; A306-I309 PolarHBondContact O-N 3.42Å; A306-M310 PolarHBondContact O-N 2.85Å; A306-M310 VanDerWaalsContact O-N 3.13Å |
| 307 | M | 96 | Very high | 96.1 | Very high | 4 Ų | 4 | 30.6 Ų | 30.6 | 2% | 0.02 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -69.5 | -37.9 | 178.5 | -66.2 | -43.6 | 96.1 | 0 | 0 | 112.1 | S67 I70 M71 L211 S303 I304 I309 M310 Y311 | S67-M307 VanDerWaalsContact CB-CE 3.48Å; S67-M307 WeakPolarHBondContact OG-CE 3.36Å; I70-M307 HydrophobicContact CB-CB 4.47Å; I70-M307 HydrophobicContact CB-CG 3.67Å; I70-M307 HydrophobicContact CD1-CG 4.24Å; I70-M307 HydrophobicContact CG2-CB 3.74Å; I70-M307 HydrophobicContact CG2-CG 3.47Å; I70-M307 VanDerWaalsContact CG2-CG 3.47Å; M71-M307 HydrophobicContact CB-SD 3.8Å; M71-M307 HydrophobicContact CE-SD 4.26Å; L211-M307 HydrophobicContact CD2-CE 4.25Å; L211-M307 HydrophobicContact CD2-SD 4.48Å; S303-M307 WeakPolarHBondContact O-CG 3.05Å; S303-M307 PolarHBondContact O-N 2.99Å; I304-M307 PolarHBondContact O-N 2.84Å; M307-I309 VanDerWaalsContact C-N 3.28Å; M307-I309 PolarHBondContact O-N 2.93Å; M307-M310 HydrophobicContact CE-CE 3.11Å; M307-M310 PolarHBondContact O-N 2.93Å; M307-M310 HydrophobicContact SD-CE 3.23Å; M307-M310 WeakPolarHBondContact SD-CE 3.48Å; M307-Y311 HydrophobicContact CB-CD2 4.43Å; M307-Y311 HydrophobicContact CB-CE2 4.21Å; M307-Y311 WeakPolarHBondContact O-CB 3.44Å; M307-Y311 PolarHBondContact O-N 3.16Å |
| 308 | F | 96.7 | Very high | 95.9 | Very high | 56 Ų | 56 | 29.6 Ų | 29.6 | 25% | 0.246 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -54.9 | -44.9 | 174.2 | 168.8 | -99.8 | 0 | 0 | 0 | 111.7 | L94 L95 A98 F275 I304 G305 G312 | L94-F308 HydrophobicContact CB-CD2 4.48Å; L94-F308 HydrophobicContact CB-CE2 4.21Å; L94-F308 HydrophobicContact CD2-CD2 3.77Å; L94-F308 HydrophobicContact CD2-CE2 3.88Å; L94-F308 HydrophobicContact CG-CD2 3.93Å; L94-F308 HydrophobicContact CG-CE2 4.11Å; L95-F308 HydrophobicContact CB-CE2 3.76Å; L95-F308 HydrophobicContact CB-CZ 4.1Å; L95-F308 HydrophobicContact CD1-CE1 4.48Å; L95-F308 HydrophobicContact CD1-CE2 4.14Å; L95-F308 HydrophobicContact CD1-CZ 4.04Å; A98-F308 HydrophobicContact CB-CD2 4.31Å; F275-F308 HydrophobicContact CZ-CB 4.38Å; I304-F308 WeakPolarHBondContact O-CB 3.34Å; I304-F308 PolarHBondContact O-N 3.41Å; G305-F308 PolarHBondContact O-N 3Å; F308-G312 PolarHBondContact O-N 3.39Å |
| 309 | I | 96.4 | Very high | 95.6 | Very high | 101 Ų | 101 | 27.9 Ų | 27.9 | 52% | 0.518 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -64.5 | -50.9 | 177.3 | -65.3 | 169 | 0 | 0 | 0 | 110.6 | G305 A306 M307 Y311 G312 L313 | G305-I309 WeakPolarHBondContact O-CG1 3.21Å; G305-I309 PolarHBondContact O-N 3.48Å; A306-I309 PolarHBondContact O-N 3.42Å; M307-I309 VanDerWaalsContact C-N 3.28Å; M307-I309 PolarHBondContact O-N 2.93Å; I309-Y311 PolarHBondContact O-N 3.18Å; I309-G312 PolarHBondContact O-N 2.97Å; I309-L313 HydrophobicContact CG2-CD1 3.77Å; I309-L313 HydrophobicContact CG2-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CB 3.31Å; I309-L313 VanDerWaalsContact O-CG 3.28Å; I309-L313 WeakPolarHBondContact O-CG 3.24Å; I309-L313 PolarHBondContact O-N 3.16Å |
| 310 | M | 95.4 | Very high | 95.3 | Very high | 18 Ų | 18 | 29.9 Ų | 29.9 | 9% | 0.089 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -63.4 | -41.2 | -178.9 | -72.2 | -164.3 | -56.1 | 0 | 0 | 112.7 | M71 L215 L218 A306 M307 T314 | M71-M310 HydrophobicContact CE-CE 3.13Å; M71-M310 HydrophobicContact CE-SD 3.87Å; L215-M310 HydrophobicContact CD2-CG 4.26Å; L215-M310 HydrophobicContact CD2-SD 3.37Å; L215-M310 WeakPolarHBondContact CD2-SD 3.01Å; L215-M310 HydrophobicContact CG-SD 3.93Å; L218-M310 HydrophobicContact CD2-CB 4.42Å; L218-M310 HydrophobicContact CD2-CG 4.07Å; A306-M310 PolarHBondContact O-N 2.85Å; A306-M310 VanDerWaalsContact O-N 3.13Å; M307-M310 HydrophobicContact CE-CE 3.11Å; M307-M310 PolarHBondContact O-N 2.93Å; M307-M310 HydrophobicContact SD-CE 3.23Å; M307-M310 WeakPolarHBondContact SD-CE 3.48Å; M310-T314 VanDerWaalsContact O-CB 3.25Å; M310-T314 WeakPolarHBondContact O-CB 3.25Å; M310-T314 PolarHBondContact O-N 2.92Å; M310-T314 PolarHBondContact O-OG1 3.14Å |
| 311 | Y | 96.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64.2 | -47.2 | 176.1 | -74.2 | -2.5 | 0 | 0 | 0 | 111.9 | I70 M71 I75 L78 A274 F275 M307 I309 A315 | I70-Y311 HydrophobicContact CG2-CE2 4.17Å; I70-Y311 PolarHBondContact O-OH 3.03Å; M71-Y311 WeakPolarHBondContact CA-OH 3.45Å; M71-Y311 PolarHBondContact N-OH 2.69Å; M71-Y311 PolarHBondContact O-OH 2.99Å; I75-Y311 HydrophobicContact CB-CD1 4.11Å; I75-Y311 HydrophobicContact CB-CE1 3.79Å; I75-Y311 HydrophobicContact CD1-CD1 3.97Å; I75-Y311 HydrophobicContact CD1-CE1 4.12Å; I75-Y311 HydrophobicContact CG1-CD1 3.83Å; I75-Y311 HydrophobicContact CG1-CE1 4Å; L78-Y311 VanDerWaalsContact CD1-CB 3.44Å; L78-Y311 HydrophobicContact CD1-CD1 3.77Å; L78-Y311 HydrophobicContact CD1-CD2 3.68Å; L78-Y311 HydrophobicContact CD1-CE1 4.39Å; L78-Y311 HydrophobicContact CD1-CE2 4.31Å; L78-Y311 HydrophobicContact CD1-CG 3.35Å; A274-Y311 HydrophobicContact CB-CE2 3.92Å; A274-Y311 WeakPolarHBondContact O-CE2 3.29Å; A274-Y311 PolarHBondContact O-OH 3.4Å; F275-Y311 HydrophobicContact CD1-CE2 4.44Å; F275-Y311 HydrophobicContact CE1-CD2 4.12Å; F275-Y311 HydrophobicContact CE1-CE2 4.15Å; F275-Y311 AromaticContact CE2-CD2 3.93Å; F275-Y311 HydrophobicContact CE2-CD2 3.93Å; F275-Y311 HydrophobicContact CE2-CE2 4.29Å; F275-Y311 AromaticContact CZ-CD2 3.65Å; F275-Y311 HydrophobicContact CZ-CD2 3.65Å; F275-Y311 HydrophobicContact CZ-CE2 4.07Å; M307-Y311 HydrophobicContact CB-CD2 4.43Å; M307-Y311 HydrophobicContact CB-CE2 4.21Å; M307-Y311 WeakPolarHBondContact O-CB 3.44Å; M307-Y311 PolarHBondContact O-N 3.16Å; I309-Y311 PolarHBondContact O-N 3.18Å; Y311-A315 WeakPolarHBondContact O-CB 3.39Å; Y311-A315 PolarHBondContact O-N 3.18Å |
| 312 | G | 96.4 | Very high | 94.3 | Very high | 8 Ų | 8 | 27.6 Ų | 27.6 | 8% | 0.082 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -59.6 | -47.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | F308 I309 T316 | F308-G312 PolarHBondContact O-N 3.39Å; I309-G312 PolarHBondContact O-N 2.97Å; G312-T316 VanDerWaalsContact O-CB 3.26Å; G312-T316 WeakPolarHBondContact O-CB 3.48Å; G312-T316 PolarHBondContact O-N 2.91Å; G312-T316 PolarHBondContact O-OG1 3.44Å |
| 313 | L | 96.4 | Very high | 93.8 | Very high | 68 Ų | 68 | 23.8 Ų | 23.8 | 36% | 0.356 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -66.1 | -50.7 | 178.1 | -65.2 | 172.4 | 0 | 0 | 0 | 111.5 | L218 I309 A315 T316 F317 | L218-L313 HydrophobicContact CD1-CB 3.67Å; L218-L313 HydrophobicContact CD2-CD1 4.39Å; I309-L313 HydrophobicContact CG2-CD1 3.77Å; I309-L313 HydrophobicContact CG2-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CB 3.31Å; I309-L313 VanDerWaalsContact O-CG 3.28Å; I309-L313 WeakPolarHBondContact O-CG 3.24Å; I309-L313 PolarHBondContact O-N 3.16Å; L313-A315 VanDerWaalsContact C-N 3.33Å; L313-A315 PolarHBondContact O-N 2.94Å; L313-T316 PolarHBondContact O-N 3.5Å; L313-F317 HydrophobicContact CB-CD2 4.43Å; L313-F317 HydrophobicContact CD2-CE2 3.99Å; L313-F317 VanDerWaalsContact O-CD2 3.24Å; L313-F317 WeakPolarHBondContact O-CD2 3.47Å; L313-F317 PolarHBondContact O-N 3.02Å |
| 314 | T | 95.2 | Very high | 93 | Very high | 1 Ų | 1 | 26.6 Ų | 26.6 | 1% | 0.006 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59 | -45.7 | -179.1 | -52.6 | 0 | 0 | 0 | 0 | 111.2 | I75 F217 L218 M310 G318 M330 | I75-T314 HydrophobicContact CD1-CG2 4.3Å; I75-T314 HydrophobicContact CG1-CG2 4.05Å; F217-T314 HydrophobicContact CD1-CG2 4.34Å; F217-T314 HydrophobicContact CE1-CG2 3.54Å; F217-T314 HydrophobicContact CZ-CG2 3.95Å; L218-T314 WeakPolarHBondContact CD1-OG1 3.11Å; M310-T314 VanDerWaalsContact O-CB 3.25Å; M310-T314 WeakPolarHBondContact O-CB 3.25Å; M310-T314 PolarHBondContact O-N 2.92Å; M310-T314 PolarHBondContact O-OG1 3.14Å; T314-G318 WeakPolarHBondContact O-CA 3.49Å; T314-G318 PolarHBondContact O-N 3.24Å; T314-M330 HydrophobicContact CG2-CE 4.43Å |
| 315 | A | 95.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65 | -41.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L78 M82 F90 Y311 L313 Y319 | L78-A315 HydrophobicContact CB-CB 3.89Å; M82-A315 HydrophobicContact CE-CB 3.77Å; F90-A315 HydrophobicContact CD1-CB 4.49Å; F90-A315 HydrophobicContact CE1-CB 3.56Å; F90-A315 HydrophobicContact CZ-CB 3.62Å; Y311-A315 WeakPolarHBondContact O-CB 3.39Å; Y311-A315 PolarHBondContact O-N 3.18Å; L313-A315 VanDerWaalsContact C-N 3.33Å; L313-A315 PolarHBondContact O-N 2.94Å; A315-Y319 WeakPolarHBondContact O-CB 3.42Å; A315-Y319 PolarHBondContact O-N 3.17Å |
| 316 | T | 93.9 | Very high | 91.7 | Very high | 27 Ų | 27 | 28.1 Ų | 28.1 | 17% | 0.166 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.1 | -53.9 | 179.3 | -56.1 | 0 | 0 | 0 | 0 | 111.2 | G312 L313 Y319 L320 | G312-T316 VanDerWaalsContact O-CB 3.26Å; G312-T316 WeakPolarHBondContact O-CB 3.48Å; G312-T316 PolarHBondContact O-N 2.91Å; G312-T316 PolarHBondContact O-OG1 3.44Å; L313-T316 PolarHBondContact O-N 3.5Å; T316-Y319 PolarHBondContact O-N 3.07Å; T316-L320 HydrophobicContact CG2-CD1 3.85Å; T316-L320 HydrophobicContact CG2-CG 4.42Å; T316-L320 WeakPolarHBondContact O-CB 3.42Å; T316-L320 WeakPolarHBondContact O-CG 3.26Å; T316-L320 PolarHBondContact O-N 2.9Å |
| 317 | F | 93.2 | Very high | 91.2 | Very high | 44 Ų | 44 | 31.2 Ų | 31.2 | 19% | 0.193 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -70.8 | -34.2 | -178.2 | -72.9 | -80 | 0 | 0 | 0 | 112.1 | V221 I222 K225 F226 L313 T321 | V221-F317 HydrophobicContact CG1-CB 4Å; I222-F317 HydrophobicContact CB-CD1 4.49Å; I222-F317 HydrophobicContact CB-CG 4.41Å; I222-F317 HydrophobicContact CD1-CD2 4.21Å; I222-F317 HydrophobicContact CD1-CE2 4.25Å; I222-F317 HydrophobicContact CG1-CB 4.19Å; I222-F317 HydrophobicContact CG1-CD1 4.23Å; I222-F317 HydrophobicContact CG1-CD2 3.57Å; I222-F317 HydrophobicContact CG1-CE2 3.95Å; I222-F317 HydrophobicContact CG1-CG 3.73Å; I222-F317 HydrophobicContact CG1-CZ 4.45Å; I222-F317 HydrophobicContact CG2-CD1 4.32Å; I222-F317 HydrophobicContact CG2-CE1 4.19Å; I222-F317 HydrophobicContact CG2-CZ 4.39Å; K225-F317 HydrophobicContact CB-CD1 4.13Å; K225-F317 HydrophobicContact CG-CD1 4.01Å; F226-F317 HydrophobicContact CE2-CE1 4.08Å; F226-F317 HydrophobicContact CZ-CE1 4.18Å; L313-F317 HydrophobicContact CB-CD2 4.43Å; L313-F317 HydrophobicContact CD2-CE2 3.99Å; L313-F317 VanDerWaalsContact O-CD2 3.24Å; L313-F317 WeakPolarHBondContact O-CD2 3.47Å; L313-F317 PolarHBondContact O-N 3.02Å; F317-T321 PolarHBondContact O-N 3.2Å; F317-T321 VanDerWaalsContact O-N 3.1Å; F317-T321 PolarHBondContact O-OG1 2.77Å |
| 318 | G | 91.7 | Very high | 90.5 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.4 | -48.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T314 T321 M330 | T314-G318 WeakPolarHBondContact O-CA 3.49Å; T314-G318 PolarHBondContact O-N 3.24Å; G318-T321 WeakPolarHBondContact O-CB 3.32Å; G318-T321 PolarHBondContact O-N 3.03Å; G318-M330 WeakPolarHBondContact CA-SD 3.43Å |
| 319 | Y | 91.8 | Very high | 90 | Very high | 2 Ų | 2 | 29.4 Ų | 29.4 | 1% | 0.008 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.5 | -47.8 | 174.7 | 169.4 | -110.9 | 0 | 0 | 0 | 111.7 | M82 A83 V87 A255 K256 A315 T316 T321 F322 Y323 V326 | M82-Y319 HydrophobicContact CB-CG 4.39Å; M82-Y319 HydrophobicContact CG-CD1 4.03Å; M82-Y319 HydrophobicContact CG-CD2 4.48Å; M82-Y319 HydrophobicContact CG-CG 3.88Å; M82-Y319 VanDerWaalsContact SD-CB 3.54Å; M82-Y319 HydrophobicContact SD-CD1 3.69Å; M82-Y319 HydrophobicContact SD-CG 3.81Å; A83-Y319 HydrophobicContact CB-CD2 3.79Å; A83-Y319 HydrophobicContact CB-CE2 3.97Å; V87-Y319 HydrophobicContact CG2-CD1 3.76Å; V87-Y319 HydrophobicContact CG2-CE1 3.53Å; A255-Y319 HydrophobicContact CB-CE1 4.27Å; K256-Y319 PolarHBondContact N-OH 3.07Å; A315-Y319 WeakPolarHBondContact O-CB 3.42Å; A315-Y319 PolarHBondContact O-N 3.17Å; T316-Y319 PolarHBondContact O-N 3.07Å; Y319-T321 PolarHBondContact O-N 3.43Å; Y319-T321 VanDerWaalsContact O-N 3.1Å; Y319-F322 PolarHBondContact O-N 3.23Å; Y319-Y323 WeakPolarHBondContact CD2-O 3.26Å; Y319-Y323 VanDerWaalsContact CE2-O 3.3Å; Y319-Y323 WeakPolarHBondContact CE2-O 3.02Å; Y319-Y323 WeakPolarHBondContact O-CA 3.43Å; Y319-Y323 PolarHBondContact O-N 3.33Å; Y319-V326 HydrophobicContact CD2-CG2 4.48Å |
| 320 | L | 89.7 | Confident | 89.5 | Confident | 41 Ų | 41 | 24.7 Ų | 24.7 | 22% | 0.215 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.3 | -14 | -179.9 | -68.7 | 175.7 | 0 | 0 | 0 | 113.2 | K225 A255 T316 Y323 | K225-L320 HydrophobicContact CD-CB 3.7Å; K225-L320 WeakPolarHBondContact CD-O 3.39Å; K225-L320 WeakPolarHBondContact CE-O 3.37Å; A255-L320 HydrophobicContact CB-CD2 3.81Å; T316-L320 HydrophobicContact CG2-CD1 3.85Å; T316-L320 HydrophobicContact CG2-CG 4.42Å; T316-L320 WeakPolarHBondContact O-CB 3.42Å; T316-L320 WeakPolarHBondContact O-CG 3.26Å; T316-L320 PolarHBondContact O-N 2.9Å; L320-Y323 HydrophobicContact CD2-CE1 4.27Å; L320-Y323 WeakPolarHBondContact O-CE2 3.46Å |
| 321 | T | 87.5 | Confident | 89.1 | Confident | 15 Ų | 15 | 24 Ų | 24 | 9% | 0.092 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -79.1 | -39.5 | 175.7 | -57.7 | 0 | 0 | 0 | 0 | 111.4 | K225 L228 F317 G318 Y319 Y334 | K225-T321 WeakPolarHBondContact CB-OG1 3.47Å; L228-T321 HydrophobicContact CD1-CG2 3.76Å; F317-T321 PolarHBondContact O-N 3.2Å; F317-T321 VanDerWaalsContact O-N 3.1Å; F317-T321 PolarHBondContact O-OG1 2.77Å; G318-T321 WeakPolarHBondContact O-CB 3.32Å; G318-T321 PolarHBondContact O-N 3.03Å; Y319-T321 PolarHBondContact O-N 3.43Å; Y319-T321 VanDerWaalsContact O-N 3.1Å; T321-Y334 HydrophobicContact CG2-CE1 4.38Å |
| 322 | F | 85 | Confident | 88.4 | Confident | 11 Ų | 11 | 27.7 Ų | 27.7 | 5% | 0.048 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -122.8 | -4.8 | -171.8 | -54 | -69.9 | 0 | 0 | 0 | 114.5 | F249 Y319 S324 T325 V326 M330 M333 Y334 | F249-F322 HydrophobicContact CE1-CB 4.19Å; F249-F322 HydrophobicContact CE1-CD1 4.13Å; F249-F322 AromaticContact CZ-CD1 3.72Å; F249-F322 HydrophobicContact CZ-CD1 3.72Å; F249-F322 HydrophobicContact CZ-CE1 4.49Å; Y319-F322 PolarHBondContact O-N 3.23Å; F322-S324 PolarHBondContact O-N 3.32Å; F322-T325 PolarHBondContact O-N 2.69Å; F322-T325 PolarHBondContact O-OG1 3.14Å; F322-V326 HydrophobicContact CB-CG2 3.8Å; F322-M330 HydrophobicContact CE2-CG 4.41Å; F322-M333 HydrophobicContact CB-CE 4.04Å; F322-M333 HydrophobicContact CD1-CB 4.14Å; F322-M333 HydrophobicContact CD1-CE 3.87Å; F322-M333 HydrophobicContact CD2-CB 3.9Å; F322-M333 HydrophobicContact CD2-CG 4.27Å; F322-M333 HydrophobicContact CE1-CB 3.77Å; F322-M333 HydrophobicContact CE1-CE 4.46Å; F322-M333 HydrophobicContact CE2-CB 3.51Å; F322-M333 HydrophobicContact CE2-CG 4.32Å; F322-M333 HydrophobicContact CG-CB 4.19Å; F322-M333 HydrophobicContact CG-CE 3.95Å; F322-M333 HydrophobicContact CG-CG 4.48Å; F322-M333 HydrophobicContact CZ-CB 3.42Å; F322-M333 VanDerWaalsContact CZ-CB 3.42Å; F322-Y334 HydrophobicContact CE2-CD2 4.45Å; F322-Y334 HydrophobicContact CE2-CE1 4.01Å; F322-Y334 AromaticContact CE2-CE2 3.95Å; F322-Y334 HydrophobicContact CE2-CE2 3.95Å; F322-Y334 AromaticContact CE2-CZ 3.7Å; F322-Y334 AromaticContact CZ-CD1 3.82Å; F322-Y334 HydrophobicContact CZ-CD1 3.82Å; F322-Y334 HydrophobicContact CZ-CD2 4.32Å; F322-Y334 AromaticContact CZ-CE1 3.63Å; F322-Y334 HydrophobicContact CZ-CE1 3.63Å; F322-Y334 HydrophobicContact CZ-CE2 4.16Å; F322-Y334 HydrophobicContact CZ-CG 4.17Å; F322-Y334 AromaticContact CZ-CZ 3.82Å |
| 323 | Y | 86.8 | Confident | 87.8 | Confident | 25 Ų | 25 | 29 Ų | 29 | 10% | 0.098 | 15% | 0.154 | C | C | . | . | G | 310 helix | trans | 49.6 | -121 | -179.2 | -62.9 | -94.9 | 0 | 0 | 0 | 113.1 | C230 C253 A255 Y319 L320 T325 V326 | C230-Y323 WeakPolarHBondContact SG-CE2 3.33Å; C253-Y323 VanDerWaalsContact C-CE1 3.49Å; C253-Y323 HydrophobicContact CB-CE2 4.31Å; A255-Y323 HydrophobicContact CB-CE1 4.34Å; Y319-Y323 WeakPolarHBondContact CD2-O 3.26Å; Y319-Y323 VanDerWaalsContact CE2-O 3.3Å; Y319-Y323 WeakPolarHBondContact CE2-O 3.02Å; Y319-Y323 WeakPolarHBondContact O-CA 3.43Å; Y319-Y323 PolarHBondContact O-N 3.33Å; L320-Y323 HydrophobicContact CD2-CE1 4.27Å; L320-Y323 WeakPolarHBondContact O-CE2 3.46Å; Y323-T325 VanDerWaalsContact C-N 3.27Å; Y323-T325 PolarHBondContact O-N 3.14Å; Y323-V326 VanDerWaalsContact O-CG2 3.23Å; Y323-V326 WeakPolarHBondContact O-CG2 3.42Å |
| 324 | S | 79.4 | Confident | 87.2 | Confident | 59 Ų | 59 | 26.5 Ų | 26.5 | 41% | 0.413 | 14% | 0.139 | S | C | . | . | G | 310 helix | trans | -76.9 | -7 | -173.5 | 47.2 | 0 | 0 | 0 | 0 | 114.7 | F322 | F322-S324 PolarHBondContact O-N 3.32Š|
| 325 | T | 82.3 | Confident | 86.4 | Confident | 61 Ų | 61 | 31 Ų | 31 | 37% | 0.374 | 17% | 0.167 | S | C | . | . | G | 310 helix | trans | -104 | 13.6 | -176.2 | 66.2 | 0 | 0 | 0 | 0 | 113 | F249 F322 Y323 K327 M333 | F249-T325 HydrophobicContact CD1-CG2 4.47Å; F249-T325 HydrophobicContact CE1-CG2 4.48Å; F249-T325 WeakPolarHBondContact CE1-OG1 3.29Å; F322-T325 PolarHBondContact O-N 2.69Å; F322-T325 PolarHBondContact O-OG1 3.14Å; Y323-T325 VanDerWaalsContact C-N 3.27Å; Y323-T325 PolarHBondContact O-N 3.14Å; T325-K327 PolarHBondContact O-N 3.17Å; T325-M333 WeakPolarHBondContact O-CE 3.49Å |
| 326 | V | 84.4 | Confident | 85.3 | Confident | 8 Ų | 8 | 35.1 Ų | 35.1 | 5% | 0.048 | 19% | 0.187 | C | C | . | . | trans | -58.7 | 121.6 | 177 | 179.9 | 0 | 0 | 0 | 0 | 109.9 | A79 Y80 A83 Y319 F322 Y323 | A79-V326 HydrophobicContact CB-CG1 3.87Å; Y80-V326 WeakPolarHBondContact CD2-O 3.18Å; A83-V326 HydrophobicContact CB-CB 4.11Å; A83-V326 HydrophobicContact CB-CG2 4.26Å; Y319-V326 HydrophobicContact CD2-CG2 4.48Å; F322-V326 HydrophobicContact CB-CG2 3.8Å; Y323-V326 VanDerWaalsContact O-CG2 3.23Å; Y323-V326 WeakPolarHBondContact O-CG2 3.42Å | ||
| 327 | K | 86.3 | Confident | 84.3 | Confident | 106 Ų | 106 | 42.7 Ų | 42.7 | 46% | 0.461 | 22% | 0.22 | S | C | . | . | trans | -73.8 | 161.6 | 170.6 | -74.6 | 177.1 | -175.7 | 179.7 | 0 | 111.9 | T325 E329 E332 M333 | T325-K327 PolarHBondContact O-N 3.17Å; K327-E329 PolarHBondContact O-N 2.84Å; K327-E332 HydrophobicContact CD-CB 4.29Å; K327-M333 HydrophobicContact CB-CG 4.14Å; K327-M333 HydrophobicContact CB-SD 3.82Å; K327-M333 HydrophobicContact CD-SD 3.57Å; K327-M333 VanDerWaalsContact CD-SD 3.57Å; K327-M333 HydrophobicContact CG-CG 4.42Å; K327-M333 HydrophobicContact CG-SD 3.46Å; K327-M333 WeakPolarHBondContact CG-SD 3.47Å | ||
| 328 | A | 81.3 | Confident | 83.8 | Confident | 21 Ų | 21 | 42.6 Ų | 42.6 | 17% | 0.174 | 22% | 0.222 | C | C | . | . | S | Bend | trans | -60 | -26 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | G77 Y80 I403 R404 | G77-A328 WeakPolarHBondContact CA-O 3.31Å; Y80-A328 HydrophobicContact CD2-CB 4.34Å; Y80-A328 HydrophobicContact CG-CB 4.44Å; A328-I403 HydrophobicContact CB-CG2 4.14Å; A328-R404 HydrophobicContact CB-CB 3.84Å |
| 329 | E | 85.9 | Confident | 83.7 | Confident | 2 Ų | 2 | 47.7 Ų | 47.7 | 1% | 0.009 | 25% | 0.252 | C | S | . | . | S | Bend | trans | -113.1 | 115.8 | 167 | -179.6 | 165.7 | -169 | 0 | 0 | 109 | S157 E158 K327 L331 E332 I403 | S157-E329 PolarHBondContact OG-OE2 3.03Å; E158-E329 WeakPolarHBondContact CG-OE1 3.44Å; K327-E329 PolarHBondContact O-N 2.84Å; E329-L331 VanDerWaalsContact C-N 3.31Å; E329-L331 HydrophobicContact CG-CB 4.38Å; E329-L331 PolarHBondContact O-N 2.82Å; E329-E332 HydrophobicContact CB-CG 4.1Å; E329-E332 HydrophobicContact CG-CG 4.11Å; E329-E332 PolarHBondContact O-N 2.07Å; E329-I403 HydrophobicContact CB-CG2 4.32Å |
| 330 | M | 86.3 | Confident | 83.6 | Confident | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.01 | 26% | 0.264 | C | S | . | . | G | 310 helix | trans | -69.5 | -26.2 | -175.1 | -167.5 | -176.3 | 81.5 | 0 | 0 | 113.5 | L76 A79 F217 V221 T314 G318 F322 E332 M333 Y334 | L76-M330 PolarHBondContact O-N 3.43Å; A79-M330 HydrophobicContact CB-CG 4.34Å; A79-M330 HydrophobicContact CB-SD 3.74Å; F217-M330 HydrophobicContact CE1-CE 4.4Å; F217-M330 HydrophobicContact CE2-CE 3.45Å; F217-M330 VanDerWaalsContact CE2-CE 3.45Å; F217-M330 HydrophobicContact CZ-CE 3.26Å; V221-M330 HydrophobicContact CB-CE 4.32Å; V221-M330 HydrophobicContact CG1-CE 3.95Å; V221-M330 HydrophobicContact CG2-CE 3.34Å; T314-M330 HydrophobicContact CG2-CE 4.43Å; G318-M330 WeakPolarHBondContact CA-SD 3.43Å; F322-M330 HydrophobicContact CE2-CG 4.41Å; M330-E332 VanDerWaalsContact C-N 3.27Å; M330-E332 PolarHBondContact O-N 3.07Å; M330-M333 WeakPolarHBondContact O-CB 3.44Å; M330-M333 PolarHBondContact O-N 3.39Å; M330-Y334 HydrophobicContact CE-CE2 4.04Å; M330-Y334 HydrophobicContact CG-CE2 4.3Å; M330-Y334 WeakPolarHBondContact O-CD2 3.42Å |
| 331 | L | 85.6 | Confident | 83.6 | Confident | 2 Ų | 2 | 48.1 Ų | 48.1 | 1% | 0.01 | 26% | 0.255 | C | S | . | . | G | 310 helix | trans | -66.9 | -29.1 | -179.6 | -93.3 | 67.8 | 0 | 0 | 0 | 112.7 | L76 E158 F217 E329 M333 Y334 R345 V348 | L76-L331 HydrophobicContact CD1-CD1 4.38Å; L76-L331 HydrophobicContact CD2-CD1 3.49Å; L76-L331 VanDerWaalsContact CD2-CD1 3.49Å; E158-L331 HydrophobicContact CG-CB 4.48Å; E158-L331 HydrophobicContact CG-CD2 4.22Å; F217-L331 HydrophobicContact CD2-CD1 4.27Å; F217-L331 HydrophobicContact CE2-CD1 3.48Å; F217-L331 VanDerWaalsContact CE2-CD1 3.48Å; F217-L331 HydrophobicContact CZ-CD1 3.87Å; E329-L331 VanDerWaalsContact C-N 3.31Å; E329-L331 HydrophobicContact CG-CB 4.38Å; E329-L331 PolarHBondContact O-N 2.82Å; L331-M333 PolarHBondContact O-N 3.46Å; L331-Y334 PolarHBondContact O-N 3.26Å; L331-R345 HydrophobicContact CD2-CG 4.12Å; L331-R345 PolarHBondContact O-NH2 3.47Å; L331-V348 HydrophobicContact CD2-CB 4.11Å; L331-V348 HydrophobicContact CD2-CG1 4.12Å; L331-V348 HydrophobicContact CD2-CG2 4.16Å |
| 332 | E | 82.9 | Confident | 83.8 | Confident | 79 Ų | 79 | 48.3 Ų | 48.3 | 37% | 0.369 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -66.5 | -17.6 | 176.5 | -64.8 | -174.4 | 173.2 | 0 | 0 | 112.9 | K327 E329 M330 | K327-E332 HydrophobicContact CD-CB 4.29Å; E329-E332 HydrophobicContact CB-CG 4.1Å; E329-E332 HydrophobicContact CG-CG 4.11Å; E329-E332 PolarHBondContact O-N 2.07Å; M330-E332 VanDerWaalsContact C-N 3.27Å; M330-E332 PolarHBondContact O-N 3.07Å |
| 333 | M | 83.3 | Confident | 84.2 | Confident | 36 Ų | 36 | 50.5 Ų | 50.5 | 18% | 0.177 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -82.2 | -16.3 | -179.4 | -64.2 | -63.3 | -67.1 | 0 | 0 | 113.2 | F249 F322 T325 K327 M330 L331 | F249-M333 HydrophobicContact CZ-CE 4.11Å; F322-M333 HydrophobicContact CB-CE 4.04Å; F322-M333 HydrophobicContact CD1-CB 4.14Å; F322-M333 HydrophobicContact CD1-CE 3.87Å; F322-M333 HydrophobicContact CD2-CB 3.9Å; F322-M333 HydrophobicContact CD2-CG 4.27Å; F322-M333 HydrophobicContact CE1-CB 3.77Å; F322-M333 HydrophobicContact CE1-CE 4.46Å; F322-M333 HydrophobicContact CE2-CB 3.51Å; F322-M333 HydrophobicContact CE2-CG 4.32Å; F322-M333 HydrophobicContact CG-CB 4.19Å; F322-M333 HydrophobicContact CG-CE 3.95Å; F322-M333 HydrophobicContact CG-CG 4.48Å; F322-M333 HydrophobicContact CZ-CB 3.42Å; F322-M333 VanDerWaalsContact CZ-CB 3.42Å; T325-M333 WeakPolarHBondContact O-CE 3.49Å; K327-M333 HydrophobicContact CB-CG 4.14Å; K327-M333 HydrophobicContact CB-SD 3.82Å; K327-M333 HydrophobicContact CD-SD 3.57Å; K327-M333 VanDerWaalsContact CD-SD 3.57Å; K327-M333 HydrophobicContact CG-CG 4.42Å; K327-M333 HydrophobicContact CG-SD 3.46Å; K327-M333 WeakPolarHBondContact CG-SD 3.47Å; M330-M333 WeakPolarHBondContact O-CB 3.44Å; M330-M333 PolarHBondContact O-N 3.39Å; L331-M333 PolarHBondContact O-N 3.46Å |
| 334 | Y | 83.9 | Confident | 84.5 | Confident | 14 Ų | 14 | 49.5 Ų | 49.5 | 6% | 0.055 | 27% | 0.267 | C | S | . | . | S | Bend | trans | -90.2 | 143.8 | -179.3 | -67.3 | -77.3 | 0 | 0 | 0 | 112 | K224 L228 T321 F322 M330 L331 I341 R345 | K224-Y334 HydrophobicContact CB-CE1 3.87Å; K224-Y334 HydrophobicContact CG-CE1 4.13Å; L228-Y334 HydrophobicContact CD1-CD1 4.35Å; L228-Y334 HydrophobicContact CD1-CE1 4.06Å; T321-Y334 HydrophobicContact CG2-CE1 4.38Å; F322-Y334 HydrophobicContact CE2-CD2 4.45Å; F322-Y334 HydrophobicContact CE2-CE1 4.01Å; F322-Y334 AromaticContact CE2-CE2 3.95Å; F322-Y334 HydrophobicContact CE2-CE2 3.95Å; F322-Y334 AromaticContact CE2-CZ 3.7Å; F322-Y334 AromaticContact CZ-CD1 3.82Å; F322-Y334 HydrophobicContact CZ-CD1 3.82Å; F322-Y334 HydrophobicContact CZ-CD2 4.32Å; F322-Y334 AromaticContact CZ-CE1 3.63Å; F322-Y334 HydrophobicContact CZ-CE1 3.63Å; F322-Y334 HydrophobicContact CZ-CE2 4.16Å; F322-Y334 HydrophobicContact CZ-CG 4.17Å; F322-Y334 AromaticContact CZ-CZ 3.82Å; M330-Y334 HydrophobicContact CE-CE2 4.04Å; M330-Y334 HydrophobicContact CG-CE2 4.3Å; M330-Y334 WeakPolarHBondContact O-CD2 3.42Å; L331-Y334 PolarHBondContact O-N 3.26Å; Y334-I341 HydrophobicContact CD1-CD1 3.59Å; Y334-I341 HydrophobicContact CD1-CG1 4.26Å; Y334-I341 HydrophobicContact CD2-CD1 4.25Å; Y334-I341 HydrophobicContact CE1-CD1 4.16Å; Y334-I341 HydrophobicContact CG-CD1 3.65Å; Y334-I341 HydrophobicContact CG-CG1 4.24Å; Y334-I341 HydrophobicContact CG-CG2 4.4Å; Y334-R345 PolarHBondContact O-NH2 3.4Å |
| 335 | T | 78.8 | Confident | 85.1 | Confident | 97 Ų | 97 | 46.9 Ų | 46.9 | 60% | 0.595 | 25% | 0.248 | S | C | * | . | trans | -63.5 | 149.8 | 178.5 | 54.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 336 | Q | 70.8 | Confident | 85.7 | Confident | 86 Ų | 86 | 47.4 Ų | 47.4 | 40% | 0.402 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -82.4 | -21.8 | -173.7 | -52.7 | -170.6 | 0.4 | 0 | 0 | 113.5 | L161 D338 | L161-Q336 VanDerWaalsContact CD2-NE2 3.32Å; Q336-D338 VanDerWaalsContact C-N 3.31Å; Q336-D338 PolarHBondContact O-N 2.89Å |
| 337 | E | 73.9 | Confident | 86.2 | Confident | 185 Ų | 185 | 47.6 Ų | 47.6 | 86% | 0.864 | 25% | 0.251 | S | S | * | . | S | Bend | trans | -81.3 | -10.8 | -174.3 | -61.1 | -176.8 | 175.6 | 0 | 0 | 113.5 | V339 | E337-V339 PolarHBondContact O-N 2.9Š|
| 338 | D | 83.5 | Confident | 86.5 | Confident | 43 Ų | 43 | 42.6 Ų | 42.6 | 23% | 0.23 | 23% | 0.229 | C | C | . | . | trans | -82.4 | 116.1 | -176.6 | -163.3 | -54.8 | 0 | 0 | 0 | 112.1 | K224 Q336 L340 I341 L342 | K224-D338 VanDerWaalsContact CE-OD2 3.3Å; K224-D338 WeakPolarHBondContact CE-OD2 3.37Å; K224-D338 IonicContact NZ-OD1 3.71Å; K224-D338 IonicContact NZ-OD2 2.51Å; K224-D338 PolarHBondContact NZ-OD2 3.4Å; Q336-D338 VanDerWaalsContact C-N 3.31Å; Q336-D338 PolarHBondContact O-N 2.89Å; D338-L340 PolarHBondContact O-N 3.27Å; D338-L340 VanDerWaalsContact OD1-CB 3.28Å; D338-L340 WeakPolarHBondContact OD1-CB 3.31Å; D338-L340 PolarHBondContact OD1-N 3.06Å; D338-I341 HydrophobicContact CB-CB 4.08Å; D338-I341 HydrophobicContact CB-CG1 3.85Å; D338-I341 PolarHBondContact O-N 3Å; D338-L342 PolarHBondContact O-N 2.77Å | ||
| 339 | V | 88.3 | Confident | 87.2 | Confident | 106 Ų | 106 | 42.2 Ų | 42.2 | 64% | 0.642 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -57.6 | -34.7 | -179.7 | -177.6 | 0 | 0 | 0 | 0 | 112.2 | E337 L342 C343 | E337-V339 PolarHBondContact O-N 2.9Å; V339-L342 PolarHBondContact O-N 3.31Å; V339-C343 PolarHBondContact O-N 3.18Å; V339-C343 PolarHBondContact O-SG 3.17Å; V339-C343 VanDerWaalsContact O-SG 3.33Å |
| 340 | L | 90.4 | Very high | 87.5 | Confident | 47 Ų | 47 | 45.9 Ų | 45.9 | 25% | 0.246 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.2 | -44 | 177.2 | -177.7 | 66.2 | 0 | 0 | 0 | 110.5 | F216 Y223 D338 L342 C343 V344 | F216-L340 HydrophobicContact CE2-CD1 4.27Å; F216-L340 HydrophobicContact CZ-CD1 3.96Å; Y223-L340 HydrophobicContact CD1-CD2 3.51Å; Y223-L340 HydrophobicContact CE1-CD2 3.92Å; D338-L340 PolarHBondContact O-N 3.27Å; D338-L340 VanDerWaalsContact OD1-CB 3.28Å; D338-L340 WeakPolarHBondContact OD1-CB 3.31Å; D338-L340 PolarHBondContact OD1-N 3.06Å; L340-L342 VanDerWaalsContact C-N 3.35Å; L340-C343 WeakPolarHBondContact O-CB 3.4Å; L340-C343 PolarHBondContact O-N 3.01Å; L340-V344 VanDerWaalsContact O-CG2 3.31Å; L340-V344 WeakPolarHBondContact O-CG2 3.5Å; L340-V344 PolarHBondContact O-N 2.99Å |
| 341 | I | 89.4 | Confident | 87.9 | Confident | 5 Ų | 5 | 45.8 Ų | 45.8 | 3% | 0.026 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67 | -38.6 | 178.5 | -61 | -59.3 | 0 | 0 | 0 | 110.7 | K224 Y334 D338 C343 V344 R345 | K224-I341 HydrophobicContact CD-CD1 4.18Å; K224-I341 HydrophobicContact CG-CD1 3.96Å; Y334-I341 HydrophobicContact CD1-CD1 3.59Å; Y334-I341 HydrophobicContact CD1-CG1 4.26Å; Y334-I341 HydrophobicContact CD2-CD1 4.25Å; Y334-I341 HydrophobicContact CE1-CD1 4.16Å; Y334-I341 HydrophobicContact CG-CD1 3.65Å; Y334-I341 HydrophobicContact CG-CG1 4.24Å; Y334-I341 HydrophobicContact CG-CG2 4.4Å; D338-I341 HydrophobicContact CB-CB 4.08Å; D338-I341 HydrophobicContact CB-CG1 3.85Å; D338-I341 PolarHBondContact O-N 3Å; I341-C343 VanDerWaalsContact C-N 3.34Å; I341-C343 PolarHBondContact O-N 3.37Å; I341-V344 WeakPolarHBondContact O-CB 3.03Å; I341-V344 PolarHBondContact O-N 3.38Å; I341-V344 VanDerWaalsContact O-N 3.14Å; I341-R345 HydrophobicContact CG2-CG 4.47Å; I341-R345 WeakPolarHBondContact O-CG 3.36Å; I341-R345 PolarHBondContact O-N 3.49Å |
| 342 | L | 91.4 | Very high | 88.2 | Confident | 19 Ų | 19 | 45.8 Ų | 45.8 | 10% | 0.099 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.2 | -45.4 | 173.9 | -175.6 | 65.4 | 0 | 0 | 0 | 111.6 | V162 T165 F166 D338 V339 L340 V344 R345 L346 | V162-L342 HydrophobicContact CB-CD1 4.22Å; V162-L342 HydrophobicContact CG1-CD1 4Å; V162-L342 HydrophobicContact CG2-CD1 4.12Å; T165-L342 HydrophobicContact CG2-CD1 4.35Å; T165-L342 HydrophobicContact CG2-CD2 4.13Å; F166-L342 HydrophobicContact CE1-CD2 4.27Å; F166-L342 HydrophobicContact CE2-CD1 4.21Å; F166-L342 HydrophobicContact CE2-CD2 4.1Å; F166-L342 HydrophobicContact CE2-CG 4.26Å; F166-L342 HydrophobicContact CZ-CD2 3.89Å; F166-L342 HydrophobicContact CZ-CG 4.34Å; D338-L342 PolarHBondContact O-N 2.77Å; V339-L342 PolarHBondContact O-N 3.31Å; L340-L342 VanDerWaalsContact C-N 3.35Å; L342-V344 VanDerWaalsContact C-N 3.32Å; L342-V344 PolarHBondContact O-N 2.82Å; L342-R345 PolarHBondContact O-N 3.4Å; L342-L346 PolarHBondContact O-N 3.19Å |
| 343 | C | 92.9 | Very high | 88.7 | Confident | 57 Ų | 57 | 42.9 Ų | 42.9 | 39% | 0.385 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61 | -40 | 173.7 | -73.6 | 0 | 0 | 0 | 0 | 112.2 | F216 V339 L340 I341 L346 A347 | F216-C343 HydrophobicContact CE1-CB 4.11Å; F216-C343 HydrophobicContact CZ-CB 4.12Å; V339-C343 PolarHBondContact O-N 3.18Å; V339-C343 PolarHBondContact O-SG 3.17Å; V339-C343 VanDerWaalsContact O-SG 3.33Å; L340-C343 WeakPolarHBondContact O-CB 3.4Å; L340-C343 PolarHBondContact O-N 3.01Å; I341-C343 VanDerWaalsContact C-N 3.34Å; I341-C343 PolarHBondContact O-N 3.37Å; C343-L346 PolarHBondContact O-N 3.4Å; C343-A347 WeakPolarHBondContact O-CB 3.4Å; C343-A347 PolarHBondContact O-N 3.04Å |
| 344 | V | 93.4 | Very high | 89 | Confident | 4 Ų | 4 | 42.5 Ų | 42.5 | 2% | 0.024 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.9 | -45.7 | 176.2 | 166.4 | 0 | 0 | 0 | 0 | 111.2 | F216 F217 S220 L340 I341 L342 L346 A347 V348 | F216-V344 HydrophobicContact CD1-CG2 4.23Å; F216-V344 HydrophobicContact CE1-CB 4.41Å; F216-V344 HydrophobicContact CE1-CG2 3.66Å; F216-V344 HydrophobicContact CZ-CG2 4.13Å; F217-V344 HydrophobicContact CB-CG1 4.29Å; F217-V344 HydrophobicContact CD2-CG1 3.55Å; F217-V344 HydrophobicContact CE2-CG1 4.37Å; F217-V344 HydrophobicContact CG-CG1 4.38Å; S220-V344 VanDerWaalsContact OG-CG2 3.29Å; S220-V344 WeakPolarHBondContact OG-CG2 3.29Å; L340-V344 VanDerWaalsContact O-CG2 3.31Å; L340-V344 WeakPolarHBondContact O-CG2 3.5Å; L340-V344 PolarHBondContact O-N 2.99Å; I341-V344 WeakPolarHBondContact O-CB 3.03Å; I341-V344 PolarHBondContact O-N 3.38Å; I341-V344 VanDerWaalsContact O-N 3.14Å; L342-V344 VanDerWaalsContact C-N 3.32Å; L342-V344 PolarHBondContact O-N 2.82Å; V344-L346 VanDerWaalsContact C-N 3.34Å; V344-L346 PolarHBondContact O-N 3.42Å; V344-A347 PolarHBondContact O-N 3.23Å; V344-A347 VanDerWaalsContact O-N 3.15Å; V344-V348 HydrophobicContact CG1-CG2 4.37Å; V344-V348 WeakPolarHBondContact O-CG2 3.25Å; V344-V348 PolarHBondContact O-N 3.27Å |
| 345 | R | 93.1 | Very high | 89.3 | Confident | 4 Ų | 4 | 42 Ų | 42 | 2% | 0.015 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.3 | -47.9 | 176.2 | -74.2 | -179.1 | 166.3 | 154.2 | 12.1 | 111.1 | E158 V162 L331 Y334 I341 L342 A347 V348 L349 | E158-R345 VanDerWaalsContact OE2-CD 3.23Å; E158-R345 WeakPolarHBondContact OE2-CD 3.41Å; E158-R345 WeakPolarHBondContact OE2-CG 3.32Å; E158-R345 IonicContact OE2-CZ 3.47Å; E158-R345 IonicContact OE2-NE 3.99Å; E158-R345 PolarHBondContact OE2-NE 3.39Å; E158-R345 IonicContact OE2-NH2 3.6Å; V162-R345 HydrophobicContact CG2-CB 3.56Å; V162-R345 HydrophobicContact CG2-CG 4.42Å; L331-R345 HydrophobicContact CD2-CG 4.12Å; L331-R345 PolarHBondContact O-NH2 3.47Å; Y334-R345 PolarHBondContact O-NH2 3.4Å; I341-R345 HydrophobicContact CG2-CG 4.47Å; I341-R345 WeakPolarHBondContact O-CG 3.36Å; I341-R345 PolarHBondContact O-N 3.49Å; L342-R345 PolarHBondContact O-N 3.4Å; R345-A347 VanDerWaalsContact C-N 3.34Å; R345-A347 PolarHBondContact O-N 3.42Å; R345-V348 PolarHBondContact O-N 3.31Å; R345-L349 VanDerWaalsContact O-CB 3.32Å; R345-L349 WeakPolarHBondContact O-CB 3.42Å; R345-L349 WeakPolarHBondContact O-CG 3.32Å; R345-L349 PolarHBondContact O-N 3.17Å |
| 346 | L | 93.7 | Very high | 89.9 | Confident | 72 Ų | 72 | 37.4 Ų | 37.4 | 38% | 0.377 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -58.5 | -44.2 | 174.8 | -78.4 | 172 | 0 | 0 | 0 | 112.6 | V162 F166 L342 C343 V344 L349 L350 | V162-L346 HydrophobicContact CG1-CD2 3.55Å; V162-L346 HydrophobicContact CG1-CG 3.88Å; F166-L346 HydrophobicContact CE2-CD1 3.84Å; F166-L346 HydrophobicContact CE2-CD2 4.42Å; F166-L346 HydrophobicContact CE2-CG 4.41Å; F166-L346 HydrophobicContact CZ-CD1 3.86Å; L342-L346 PolarHBondContact O-N 3.19Å; C343-L346 PolarHBondContact O-N 3.4Å; V344-L346 VanDerWaalsContact C-N 3.34Å; V344-L346 PolarHBondContact O-N 3.42Å; L346-L349 PolarHBondContact O-N 3.02Å; L346-L350 WeakPolarHBondContact O-CB 3.45Å; L346-L350 PolarHBondContact O-N 2.66Å |
| 347 | A | 94.3 | Very high | 90.7 | Very high | 13 Ų | 13 | 33.6 Ų | 33.6 | 11% | 0.107 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.2 | -44 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | C213 F216 C343 V344 R345 L350 A351 | C213-A347 HydrophobicContact CB-CB 3.96Å; C213-A347 WeakPolarHBondContact CB-O 3.12Å; F216-A347 HydrophobicContact CD1-CB 3.87Å; F216-A347 HydrophobicContact CE1-CB 4.37Å; C343-A347 WeakPolarHBondContact O-CB 3.4Å; C343-A347 PolarHBondContact O-N 3.04Å; V344-A347 PolarHBondContact O-N 3.23Å; V344-A347 VanDerWaalsContact O-N 3.15Å; R345-A347 VanDerWaalsContact C-N 3.34Å; R345-A347 PolarHBondContact O-N 3.42Å; A347-L350 PolarHBondContact O-N 3.19Å; A347-A351 WeakPolarHBondContact O-CB 3.08Å; A347-A351 PolarHBondContact O-N 3.17Å |
| 348 | V | 94.1 | Very high | 91.2 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.8 | -45.4 | 176.2 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | L76 I154 M214 F217 L331 V344 R345 L350 A351 V352 | L76-V348 HydrophobicContact CD1-CG1 4.29Å; I154-V348 HydrophobicContact CG2-CG1 4.15Å; M214-V348 HydrophobicContact CE-CG1 4.24Å; M214-V348 HydrophobicContact SD-CG2 4.25Å; F217-V348 HydrophobicContact CB-CG2 4.18Å; F217-V348 HydrophobicContact CD2-CG2 4.38Å; F217-V348 HydrophobicContact CG-CG2 4.23Å; L331-V348 HydrophobicContact CD2-CB 4.11Å; L331-V348 HydrophobicContact CD2-CG1 4.12Å; L331-V348 HydrophobicContact CD2-CG2 4.16Å; V344-V348 HydrophobicContact CG1-CG2 4.37Å; V344-V348 WeakPolarHBondContact O-CG2 3.25Å; V344-V348 PolarHBondContact O-N 3.27Å; R345-V348 PolarHBondContact O-N 3.31Å; V348-L350 VanDerWaalsContact C-N 3.32Å; V348-L350 PolarHBondContact O-N 2.84Å; V348-A351 WeakPolarHBondContact O-CB 3.5Å; V348-A351 PolarHBondContact O-N 2.89Å; V348-V352 HydrophobicContact CG1-CG1 4.34Å; V348-V352 WeakPolarHBondContact O-CG1 3.4Å; V348-V352 WeakPolarHBondContact O-CG2 3.2Å; V348-V352 PolarHBondContact O-N 2.98Å |
| 349 | L | 94.6 | Very high | 91.4 | Very high | 13 Ų | 13 | 23.6 Ų | 23.6 | 7% | 0.068 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -58.3 | -43 | 176.1 | -75.7 | 170.3 | 0 | 0 | 0 | 112.1 | I155 E158 L159 V162 R345 L346 V352 T353 | I155-L349 HydrophobicContact CB-CD2 4.34Å; I155-L349 HydrophobicContact CG1-CD2 4Å; E158-L349 HydrophobicContact CB-CD1 4.43Å; E158-L349 HydrophobicContact CB-CD2 4.12Å; E158-L349 HydrophobicContact CB-CG 4.36Å; L159-L349 HydrophobicContact CB-CD1 4.26Å; L159-L349 HydrophobicContact CB-CD2 4.27Å; L159-L349 HydrophobicContact CD1-CD1 4.09Å; V162-L349 HydrophobicContact CB-CD1 4.45Å; V162-L349 HydrophobicContact CG2-CD1 3.84Å; R345-L349 VanDerWaalsContact O-CB 3.32Å; R345-L349 WeakPolarHBondContact O-CB 3.42Å; R345-L349 WeakPolarHBondContact O-CG 3.32Å; R345-L349 PolarHBondContact O-N 3.17Å; L346-L349 PolarHBondContact O-N 3.02Å; L349-V352 WeakPolarHBondContact O-CG2 3.48Å; L349-T353 VanDerWaalsContact O-CB 3.25Å; L349-T353 WeakPolarHBondContact O-CB 3.46Å; L349-T353 PolarHBondContact O-N 3.34Å; L349-T353 PolarHBondContact O-OG1 3.45Å |
| 350 | L | 93.7 | Very high | 91.3 | Very high | 80 Ų | 80 | 18.6 Ų | 18.6 | 42% | 0.419 | 11% | 0.105 | S | C | . | . | H | α-helix | trans | -62.9 | -48.1 | 174.6 | 179.3 | 62.3 | 0 | 0 | 0 | 111.2 | L209 L346 A347 V348 T353 L354 | L209-L350 HydrophobicContact CD2-CD2 4.44Å; L346-L350 WeakPolarHBondContact O-CB 3.45Å; L346-L350 PolarHBondContact O-N 2.66Å; A347-L350 PolarHBondContact O-N 3.19Å; V348-L350 VanDerWaalsContact C-N 3.32Å; V348-L350 PolarHBondContact O-N 2.84Å; L350-T353 PolarHBondContact O-N 3.22Å; L350-L354 HydrophobicContact CD1-CD1 3.99Å; L350-L354 HydrophobicContact CD1-CG 4.2Å; L350-L354 HydrophobicContact CG-CD1 4.05Å; L350-L354 WeakPolarHBondContact O-CB 3.34Å; L350-L354 VanDerWaalsContact O-CG 3.29Å; L350-L354 WeakPolarHBondContact O-CG 3.47Å; L350-L354 PolarHBondContact O-N 3.25Å |
| 351 | A | 93.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -59.6 | -47.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S210 C213 M214 A347 V348 L354 T355 | S210-A351 WeakPolarHBondContact OG-CB 3.24Å; S210-A351 PolarHBondContact OG-O 2.98Å; C213-A351 HydrophobicContact CB-CB 3.96Å; M214-A351 HydrophobicContact CE-CB 3.94Å; M214-A351 HydrophobicContact CG-CB 4.08Å; A347-A351 WeakPolarHBondContact O-CB 3.08Å; A347-A351 PolarHBondContact O-N 3.17Å; V348-A351 WeakPolarHBondContact O-CB 3.5Å; V348-A351 PolarHBondContact O-N 2.89Å; A351-L354 PolarHBondContact O-N 2.93Å; A351-T355 WeakPolarHBondContact O-CB 3.39Å; A351-T355 PolarHBondContact O-N 3.42Å; A351-T355 PolarHBondContact O-OG1 2.65Å |
| 352 | V | 93.4 | Very high | 90.3 | Very high | 1 Ų | 1 | 19.2 Ų | 19.2 | 1% | 0.006 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -67.8 | -39.2 | 179.1 | -59 | 0 | 0 | 0 | 0 | 111.7 | Y151 I154 I155 M214 V348 L349 L354 T355 V356 | Y151-V352 HydrophobicContact CD1-CB 3.82Å; Y151-V352 HydrophobicContact CD1-CG1 3.75Å; Y151-V352 HydrophobicContact CE1-CG1 4.39Å; Y151-V352 HydrophobicContact CG-CB 4.26Å; I154-V352 HydrophobicContact CD1-CG1 4.09Å; I154-V352 HydrophobicContact CG2-CG2 4.45Å; I155-V352 HydrophobicContact CD1-CG2 4.19Å; I155-V352 HydrophobicContact CG1-CG2 3.88Å; M214-V352 HydrophobicContact CE-CG1 4.23Å; V348-V352 HydrophobicContact CG1-CG1 4.34Å; V348-V352 WeakPolarHBondContact O-CG1 3.4Å; V348-V352 WeakPolarHBondContact O-CG2 3.2Å; V348-V352 PolarHBondContact O-N 2.98Å; L349-V352 WeakPolarHBondContact O-CG2 3.48Å; V352-L354 VanDerWaalsContact C-N 3.32Å; V352-L354 PolarHBondContact O-N 3.22Å; V352-T355 PolarHBondContact O-N 3.2Å; V352-T355 VanDerWaalsContact O-N 3.07Å; V352-V356 WeakPolarHBondContact O-CG2 3.41Å; V352-V356 PolarHBondContact O-N 3.1Å; V352-V356 VanDerWaalsContact O-N 3.08Å |
| 353 | T | 92.5 | Very high | 90 | Very high | 18 Ų | 18 | 18.3 Ų | 18.3 | 11% | 0.11 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -61.9 | -40.2 | 176.8 | -59.5 | 0 | 0 | 0 | 0 | 111.6 | V186 I190 I191 L349 L350 T355 P357 | V186-T353 HydrophobicContact CG1-CG2 4.47Å; I190-T353 HydrophobicContact CG2-CG2 3.73Å; I191-T353 HydrophobicContact CG1-CG2 4.07Å; L349-T353 VanDerWaalsContact O-CB 3.25Å; L349-T353 WeakPolarHBondContact O-CB 3.46Å; L349-T353 PolarHBondContact O-N 3.34Å; L349-T353 PolarHBondContact O-OG1 3.45Å; L350-T353 PolarHBondContact O-N 3.22Å; T353-T355 VanDerWaalsContact C-N 3.3Å; T353-T355 PolarHBondContact O-N 3.25Å; T353-P357 WeakPolarHBondContact O-CD 3.39Å |
| 354 | L | 90 | Very high | 89.6 | Confident | 28 Ų | 28 | 16.1 Ų | 16.1 | 15% | 0.147 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -72.1 | -23.3 | 175.8 | -68.6 | 174.7 | 0 | 0 | 0 | 113.1 | L194 L209 L350 A351 V352 V358 | L194-L354 HydrophobicContact CD2-CD2 4.22Å; L209-L354 HydrophobicContact CD2-CD1 3.75Å; L209-L354 HydrophobicContact CG-CD1 4.17Å; L350-L354 HydrophobicContact CD1-CD1 3.99Å; L350-L354 HydrophobicContact CD1-CG 4.2Å; L350-L354 HydrophobicContact CG-CD1 4.05Å; L350-L354 WeakPolarHBondContact O-CB 3.34Å; L350-L354 VanDerWaalsContact O-CG 3.29Å; L350-L354 WeakPolarHBondContact O-CG 3.47Å; L350-L354 PolarHBondContact O-N 3.25Å; A351-L354 PolarHBondContact O-N 2.93Å; V352-L354 VanDerWaalsContact C-N 3.32Å; V352-L354 PolarHBondContact O-N 3.22Å; L354-V358 WeakPolarHBondContact O-CG2 3.21Å |
| 355 | T | 90.3 | Very high | 88.9 | Confident | 3 Ų | 3 | 18.8 Ų | 18.8 | 2% | 0.018 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -85.2 | -31.9 | -177.6 | -59.8 | 0 | 0 | 0 | 0 | 112.8 | N68 Y151 S210 A351 V352 T353 V358 V359 | N68-T355 PolarHBondContact ND2-OG1 3.47Å; N68-T355 PolarHBondContact OD1-OG1 3.36Å; Y151-T355 HydrophobicContact CE1-CG2 4.19Å; Y151-T355 HydrophobicContact CE2-CG2 3.83Å; Y151-T355 WeakPolarHBondContact OH-CG2 3.25Å; S210-T355 PolarHBondContact OG-OG1 3.42Å; A351-T355 WeakPolarHBondContact O-CB 3.39Å; A351-T355 PolarHBondContact O-N 3.42Å; A351-T355 PolarHBondContact O-OG1 2.65Å; V352-T355 PolarHBondContact O-N 3.2Å; V352-T355 VanDerWaalsContact O-N 3.07Å; T353-T355 VanDerWaalsContact C-N 3.3Å; T353-T355 PolarHBondContact O-N 3.25Å; T355-V358 VanDerWaalsContact O-CB 3.25Å; T355-V358 WeakPolarHBondContact O-CB 3.03Å; T355-V358 PolarHBondContact O-N 2.99Å; T355-V359 HydrophobicContact CG2-CG2 4.25Å; T355-V359 PolarHBondContact O-N 3.43Å |
| 356 | V | 90.9 | Very high | 88.3 | Confident | 1 Ų | 1 | 18.9 Ų | 18.9 | 1% | 0.006 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -55.2 | -47.2 | 179.2 | 174.6 | 0 | 0 | 0 | 0 | 113.4 | M148 Y151 L152 I191 V352 V358 V359 L360 | M148-V356 HydrophobicContact CG-CG1 4.25Å; M148-V356 HydrophobicContact SD-CG1 4.42Å; Y151-V356 VanDerWaalsContact CB-CG2 3.48Å; Y151-V356 HydrophobicContact CD2-CG2 3.72Å; Y151-V356 HydrophobicContact CG-CG2 3.95Å; L152-V356 HydrophobicContact CD2-CG2 4.31Å; I191-V356 HydrophobicContact CD1-CB 4.29Å; I191-V356 HydrophobicContact CD1-CG1 4.27Å; I191-V356 HydrophobicContact CD1-CG2 4.35Å; I191-V356 HydrophobicContact CG2-CB 4.09Å; I191-V356 HydrophobicContact CG2-CG1 3.48Å; I191-V356 VanDerWaalsContact CG2-CG1 3.48Å; V352-V356 WeakPolarHBondContact O-CG2 3.41Å; V352-V356 PolarHBondContact O-N 3.1Å; V352-V356 VanDerWaalsContact O-N 3.08Å; V356-V358 PolarHBondContact O-N 3.31Å; V356-V359 PolarHBondContact O-N 2.82Å; V356-L360 WeakPolarHBondContact O-CB 3.4Å; V356-L360 PolarHBondContact O-N 3.4Å |
| 357 | P | 86.8 | Confident | 87.9 | Confident | 6 Ų | 6 | 17.1 Ų | 17.1 | 4% | 0.039 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -59.9 | -32.2 | 176.4 | -24.9 | 34.7 | 0 | 0 | 0 | 113.7 | I191 L194 A195 T353 F361 | I191-P357 HydrophobicContact CG2-CG 4.44Å; L194-P357 HydrophobicContact CB-CB 4.2Å; L194-P357 HydrophobicContact CB-CG 3.66Å; L194-P357 HydrophobicContact CD2-CG 4.24Å; A195-P357 HydrophobicContact CB-CB 4.47Å; T353-P357 WeakPolarHBondContact O-CD 3.39Å; P357-F361 PolarHBondContact O-N 2.87Å |
| 358 | V | 84.8 | Confident | 87.3 | Confident | 9 Ų | 9 | 18.3 Ų | 18.3 | 6% | 0.055 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -64.9 | -49.6 | 177.9 | -173.8 | 0 | 0 | 0 | 0 | 110.1 | L203 L354 T355 V356 L360 F361 P362 | L203-V358 HydrophobicContact CD1-CB 3.94Å; L203-V358 HydrophobicContact CD1-CG1 3.76Å; L203-V358 HydrophobicContact CD1-CG2 3.26Å; L203-V358 HydrophobicContact CD2-CG1 4Å; L203-V358 HydrophobicContact CG-CG1 4.21Å; L203-V358 HydrophobicContact CG-CG2 4.39Å; L354-V358 WeakPolarHBondContact O-CG2 3.21Å; T355-V358 VanDerWaalsContact O-CB 3.25Å; T355-V358 WeakPolarHBondContact O-CB 3.03Å; T355-V358 PolarHBondContact O-N 2.99Å; V356-V358 PolarHBondContact O-N 3.31Å; V358-L360 VanDerWaalsContact C-N 3.3Å; V358-L360 PolarHBondContact O-N 2.91Å; V358-F361 WeakPolarHBondContact O-CB 3.46Å; V358-F361 PolarHBondContact O-N 3.41Å; V358-P362 WeakPolarHBondContact O-CD 3.33Å |
| 359 | V | 87.2 | Confident | 86.5 | Confident | 9 Ų | 9 | 20.7 Ų | 20.7 | 6% | 0.055 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -69.5 | -28.5 | -179.2 | 177.2 | 0 | 0 | 0 | 0 | 112.4 | N144 A147 M148 Y151 T355 V356 F361 P362 I363 | N144-V359 HydrophobicContact CB-CG1 3.68Å; N144-V359 PolarHBondContact ND2-O 2.7Å; A147-V359 HydrophobicContact CB-CG1 4.27Å; M148-V359 HydrophobicContact CG-CB 4.13Å; M148-V359 HydrophobicContact CG-CG1 3.76Å; Y151-V359 HydrophobicContact CE2-CG2 3.97Å; T355-V359 HydrophobicContact CG2-CG2 4.25Å; T355-V359 PolarHBondContact O-N 3.43Å; V356-V359 PolarHBondContact O-N 2.82Å; V359-F361 VanDerWaalsContact C-N 3.33Å; V359-F361 PolarHBondContact O-N 2.84Å; V359-P362 WeakPolarHBondContact O-CD 3.28Å; V359-I363 WeakPolarHBondContact O-CG1 3.31Å |
| 360 | L | 86.2 | Confident | 85.8 | Confident | 1 Ų | 1 | 22.6 Ų | 22.6 | 1% | 0.005 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -68.9 | -30.9 | 176.1 | -170.1 | 146.3 | 0 | 0 | 0 | 112.4 | M148 A195 V356 V358 I363 R364 A386 | M148-L360 HydrophobicContact SD-CB 3.91Å; M148-L360 HydrophobicContact SD-CD1 4.29Å; M148-L360 HydrophobicContact SD-CG 4.35Å; A195-L360 HydrophobicContact CB-CD1 4.07Å; A195-L360 HydrophobicContact CB-CD2 4.05Å; V356-L360 WeakPolarHBondContact O-CB 3.4Å; V356-L360 PolarHBondContact O-N 3.4Å; V358-L360 VanDerWaalsContact C-N 3.3Å; V358-L360 PolarHBondContact O-N 2.91Å; L360-I363 PolarHBondContact O-N 3.47Å; L360-R364 HydrophobicContact CD2-CB 4.34Å; L360-R364 WeakPolarHBondContact O-CB 3.4Å; L360-R364 PolarHBondContact O-N 3.47Å; L360-A386 HydrophobicContact CD2-CB 4.25Å |
| 361 | F | 81.4 | Confident | 85.3 | Confident | 56 Ų | 56 | 23.7 Ų | 23.7 | 25% | 0.246 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -56.4 | -52.5 | -176 | 177.9 | -91.6 | 0 | 0 | 0 | 114.1 | L200 P357 V358 V359 R364 R365 | L200-F361 HydrophobicContact CD1-CB 3.79Å; L200-F361 HydrophobicContact CD1-CD2 3.73Å; L200-F361 HydrophobicContact CD1-CG 3.88Å; P357-F361 PolarHBondContact O-N 2.87Å; V358-F361 WeakPolarHBondContact O-CB 3.46Å; V358-F361 PolarHBondContact O-N 3.41Å; V359-F361 VanDerWaalsContact C-N 3.33Å; V359-F361 PolarHBondContact O-N 2.84Å; F361-R364 PolarHBondContact O-N 3.34Å; F361-R365 PolarHBondContact O-N 2.98Å |
| 362 | P | 78.9 | Confident | 84.9 | Confident | 9 Ų | 9 | 27.4 Ų | 27.4 | 6% | 0.058 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -68.1 | -32.5 | 177.9 | 9 | -11.6 | 0 | 0 | 0 | 113.6 | E280 V358 V359 R364 R365 A366 | E280-P362 VanDerWaalsContact CD-CG 3.48Å; E280-P362 WeakPolarHBondContact OE1-CG 3.32Å; E280-P362 WeakPolarHBondContact OE2-CG 3.47Å; V358-P362 WeakPolarHBondContact O-CD 3.33Å; V359-P362 WeakPolarHBondContact O-CD 3.28Å; P362-R364 VanDerWaalsContact C-N 3.34Å; P362-R365 PolarHBondContact O-N 3.27Å; P362-A366 VanDerWaalsContact O-CB 3.31Å; P362-A366 WeakPolarHBondContact O-CB 3.38Å; P362-A366 PolarHBondContact O-N 3.44Å |
| 363 | I | 84.8 | Confident | 83.8 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.6 | -47.5 | 175.6 | -52 | 172.9 | 0 | 0 | 0 | 109.7 | N144 V145 M148 V359 L360 R365 A366 L367 L389 | N144-I363 HydrophobicContact CB-CD1 3.25Å; N144-I363 HydrophobicContact CB-CG1 3.28Å; V145-I363 HydrophobicContact CG2-CD1 4.5Å; M148-I363 HydrophobicContact CE-CD1 3.12Å; M148-I363 HydrophobicContact SD-CD1 3.85Å; V359-I363 WeakPolarHBondContact O-CG1 3.31Å; L360-I363 PolarHBondContact O-N 3.47Å; I363-R365 VanDerWaalsContact C-N 3.28Å; I363-R365 PolarHBondContact O-N 2.94Å; I363-A366 PolarHBondContact O-N 2.96Å; I363-L367 HydrophobicContact CG2-CD1 4.08Å; I363-L367 HydrophobicContact CG2-CG 4.27Å; I363-L367 WeakPolarHBondContact O-CB 3.45Å; I363-L367 WeakPolarHBondContact O-CG 3.44Å; I363-L367 PolarHBondContact O-N 2.7Å; I363-L389 HydrophobicContact CB-CD1 4.08Å; I363-L389 HydrophobicContact CG2-CD1 3.6Å; I363-L389 HydrophobicContact CG2-CD2 3.79Å; I363-L389 HydrophobicContact CG2-CG 4.35Å |
| 364 | R | 84.8 | Confident | 82.8 | Confident | 12 Ų | 12 | 35.6 Ų | 35.6 | 5% | 0.045 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60.1 | -42 | 177.8 | -178.3 | 179.2 | 65.1 | -167.3 | -1.9 | 111 | A195 L360 F361 P362 Q368 H382 I385 | A195-R364 PolarHBondContact O-NH1 3.15Å; L360-R364 HydrophobicContact CD2-CB 4.34Å; L360-R364 WeakPolarHBondContact O-CB 3.4Å; L360-R364 PolarHBondContact O-N 3.47Å; F361-R364 PolarHBondContact O-N 3.34Å; P362-R364 VanDerWaalsContact C-N 3.34Å; R364-Q368 VanDerWaalsContact O-CB 3.24Å; R364-Q368 WeakPolarHBondContact O-CB 3.35Å; R364-Q368 PolarHBondContact O-N 2.98Å; R364-H382 PolarHBondContact NE-CE1 3.48Å; R364-H382 VanDerWaalsContact NE-CE1 3.29Å; R364-H382 PolarHBondContact NH1-CE1 3.08Å; R364-H382 PolarHBondContact NH1-NE2 3.42Å; R364-I385 HydrophobicContact CB-CG2 4.38Å; R364-I385 HydrophobicContact CG-CG2 4.04Å |
| 365 | R | 78.3 | Confident | 82.1 | Confident | 60 Ų | 60 | 40.6 Ų | 40.6 | 23% | 0.226 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.2 | -48 | 175.1 | -176.2 | 176.8 | 174.3 | 171.9 | -0.7 | 111.2 | F361 P362 I363 Q368 Q369 | F361-R365 PolarHBondContact O-N 2.98Å; P362-R365 PolarHBondContact O-N 3.27Å; I363-R365 VanDerWaalsContact C-N 3.28Å; I363-R365 PolarHBondContact O-N 2.94Å; R365-Q368 PolarHBondContact O-N 3.25Å; R365-Q369 WeakPolarHBondContact O-CB 3.48Å; R365-Q369 VanDerWaalsContact O-CG 3.3Å; R365-Q369 WeakPolarHBondContact O-CG 3.46Å; R365-Q369 PolarHBondContact O-N 3.28Å |
| 366 | A | 80 | Confident | 81.5 | Confident | 5 Ų | 5 | 44.5 Ų | 44.5 | 4% | 0.041 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.9 | -47.9 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | P362 I363 Q368 Q369 L370 | P362-A366 VanDerWaalsContact O-CB 3.31Å; P362-A366 WeakPolarHBondContact O-CB 3.38Å; P362-A366 PolarHBondContact O-N 3.44Å; I363-A366 PolarHBondContact O-N 2.96Å; A366-Q368 PolarHBondContact O-N 2.95Å; A366-Q369 PolarHBondContact O-N 2.83Å; A366-L370 VanDerWaalsContact O-CB 3.27Å; A366-L370 WeakPolarHBondContact O-CB 3.43Å; A366-L370 PolarHBondContact O-N 3.21Å |
| 367 | L | 85 | Confident | 81 | Confident | 35 Ų | 35 | 49 Ų | 49 | 18% | 0.183 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 177.3 | -74 | -178.8 | 0 | 0 | 0 | 112.5 | I363 Q369 L370 L371 I385 L389 | I363-L367 HydrophobicContact CG2-CD1 4.08Å; I363-L367 HydrophobicContact CG2-CG 4.27Å; I363-L367 WeakPolarHBondContact O-CB 3.45Å; I363-L367 WeakPolarHBondContact O-CG 3.44Å; I363-L367 PolarHBondContact O-N 2.7Å; L367-Q369 VanDerWaalsContact C-N 3.33Å; L367-Q369 PolarHBondContact O-N 3.34Å; L367-L370 PolarHBondContact O-N 3.38Å; L367-L371 WeakPolarHBondContact O-CB 3.44Å; L367-L371 WeakPolarHBondContact O-CG 3.28Å; L367-L371 PolarHBondContact O-N 3.35Å; L367-I385 HydrophobicContact CB-CG2 4.31Å; L367-I385 HydrophobicContact CD1-CG2 3.95Å; L367-L389 HydrophobicContact CD1-CD1 3.96Å; L367-L389 HydrophobicContact CD1-CD2 3.84Å; L367-L389 HydrophobicContact CD1-CG 4.02Å |
| 368 | Q | 83.3 | Confident | 80.9 | Confident | 39 Ų | 39 | 50.5 Ų | 50.5 | 18% | 0.182 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.6 | -40.2 | 176 | -173.7 | 173.5 | -45.1 | 0 | 0 | 111.4 | R364 R365 A366 L370 F372 | R364-Q368 VanDerWaalsContact O-CB 3.24Å; R364-Q368 WeakPolarHBondContact O-CB 3.35Å; R364-Q368 PolarHBondContact O-N 2.98Å; R365-Q368 PolarHBondContact O-N 3.25Å; A366-Q368 PolarHBondContact O-N 2.95Å; Q368-L370 VanDerWaalsContact C-N 3.33Å; Q368-F372 CarbonylContact O-C 3.12Å; Q368-F372 VanDerWaalsContact O-CA 3.3Å; Q368-F372 WeakPolarHBondContact O-CA 3.36Å; Q368-F372 PolarHBondContact O-N 2.95Å |
| 369 | Q | 76.4 | Confident | 81 | Confident | 50 Ų | 50 | 56.1 Ų | 56.1 | 23% | 0.234 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -69.8 | -29.5 | 175.5 | -73.2 | -65.7 | -36.4 | 0 | 0 | 113.1 | E121 K133 R365 A366 L367 P373 | E121-Q369 HydrophobicContact CG-CB 4.4Å; K133-Q369 WeakPolarHBondContact CE-O 3.37Å; K133-Q369 PolarHBondContact NZ-O 3.19Å; R365-Q369 WeakPolarHBondContact O-CB 3.48Å; R365-Q369 VanDerWaalsContact O-CG 3.3Å; R365-Q369 WeakPolarHBondContact O-CG 3.46Å; R365-Q369 PolarHBondContact O-N 3.28Å; A366-Q369 PolarHBondContact O-N 2.83Å; L367-Q369 VanDerWaalsContact C-N 3.33Å; L367-Q369 PolarHBondContact O-N 3.34Å; Q369-P373 WeakPolarHBondContact O-CB 3.45Å |
| 370 | L | 80.5 | Confident | 81.1 | Confident | 52 Ų | 52 | 60.5 Ų | 60.5 | 27% | 0.272 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -79.2 | -52.2 | 180 | -172.7 | 67.1 | 0 | 0 | 0 | 111.9 | V134 A137 A366 L367 Q368 | V134-L370 HydrophobicContact CB-CD1 4.26Å; V134-L370 HydrophobicContact CG1-CD1 4.48Å; V134-L370 HydrophobicContact CG2-CD1 3.81Å; A137-L370 HydrophobicContact CB-CD1 4.27Å; A137-L370 HydrophobicContact CB-CD2 4.09Å; A366-L370 VanDerWaalsContact O-CB 3.27Å; A366-L370 WeakPolarHBondContact O-CB 3.43Å; A366-L370 PolarHBondContact O-N 3.21Å; L367-L370 PolarHBondContact O-N 3.38Å; Q368-L370 VanDerWaalsContact C-N 3.33Å |
| 371 | L | 83.1 | Confident | 81.2 | Confident | 103 Ų | 103 | 62.2 Ų | 62.2 | 54% | 0.539 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -84.7 | -30.6 | -174.3 | -62.2 | 172.5 | 0 | 0 | 0 | 112.7 | L367 | L367-L371 WeakPolarHBondContact O-CB 3.44Å; L367-L371 WeakPolarHBondContact O-CG 3.28Å; L367-L371 PolarHBondContact O-N 3.35Å |
| 372 | F | 83.6 | Confident | 81.5 | Confident | 79 Ų | 79 | 60 Ų | 60 | 35% | 0.346 | 32% | 0.319 | S | S | . | . | trans | -137.9 | 55.2 | -171.6 | -53.4 | -78.5 | 0 | 0 | 0 | 113.4 | Q368 S374 K375 R381 | Q368-F372 CarbonylContact O-C 3.12Å; Q368-F372 VanDerWaalsContact O-CA 3.3Å; Q368-F372 WeakPolarHBondContact O-CA 3.36Å; Q368-F372 PolarHBondContact O-N 2.95Å; F372-S374 PolarHBondContact O-N 2.81Å; F372-S374 VanDerWaalsContact O-N 3.11Å; F372-K375 HydrophobicContact CB-CB 4.18Å; F372-K375 HydrophobicContact CB-CG 4.27Å; F372-K375 HydrophobicContact CD1-CG 4.42Å; F372-K375 PolarHBondContact O-N 3.4Å; F372-R381 VanDerWaalsContact CD2-CD 3.46Å; F372-R381 HydrophobicContact CD2-CG 4.27Å; F372-R381 HydrophobicContact CE2-CG 4.09Å | ||
| 373 | P | 71.1 | Confident | 82 | Confident | 79 Ų | 79 | 62 Ų | 62 | 51% | 0.513 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -27.1 | -171.8 | 21 | -32.3 | 0 | 0 | 0 | 115.1 | Q369 | Q369-P373 WeakPolarHBondContact O-CB 3.45Š|
| 374 | S | 71.1 | Confident | 82.4 | Confident | 111 Ų | 111 | 63.9 Ų | 63.9 | 78% | 0.776 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.5 | 8.1 | -173.1 | 55.9 | 0 | 0 | 0 | 0 | 114.3 | F372 | F372-S374 PolarHBondContact O-N 2.81Å; F372-S374 VanDerWaalsContact O-N 3.11Å |
| 375 | K | 76.1 | Confident | 82.6 | Confident | 133 Ų | 133 | 64 Ų | 64 | 58% | 0.578 | 35% | 0.349 | S | S | * | . | P | Polyproline II helix | trans | -97.7 | 131.8 | -177.4 | -63.2 | -68.8 | -174.2 | 176.8 | 0 | 111.1 | F372 | F372-K375 HydrophobicContact CB-CB 4.18Å; F372-K375 HydrophobicContact CB-CG 4.27Å; F372-K375 HydrophobicContact CD1-CG 4.42Å; F372-K375 PolarHBondContact O-N 3.4Å |
| 376 | A | 77.9 | Confident | 83.2 | Confident | 86 Ų | 86 | 61.2 Ų | 61.2 | 71% | 0.711 | 34% | 0.338 | S | S | * | . | P | Polyproline II helix | trans | -57.8 | 156.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | S378 R381 | A376-S378 PolarHBondContact O-N 3.23Å; A376-R381 PolarHBondContact O-NH1 3.26Å; A376-R381 PolarHBondContact O-NH2 2.94Å |
| 377 | F | 79.4 | Confident | 83.8 | Confident | 94 Ų | 94 | 63.7 Ų | 63.7 | 41% | 0.412 | 35% | 0.35 | S | S | . | . | P | Polyproline II helix | trans | -53.7 | 134.4 | 178.9 | 178.2 | -89.5 | 0 | 0 | 0 | 111.5 | K198 W379 H382 | K198-F377 HydrophobicContact CD-CZ 4.4Å; K198-F377 HydrophobicContact CG-CZ 4.38Å; F377-W379 AromaticContact CE1-CD1 3.98Å; F377-W379 HydrophobicContact CE1-CD2 4.08Å; F377-W379 AromaticContact CE1-CG 3.94Å; F377-W379 HydrophobicContact CE1-CG 3.94Å; F377-W379 HydrophobicContact CZ-CD2 4.19Å; F377-W379 HydrophobicContact CZ-CE3 4.41Å; F377-W379 HydrophobicContact CZ-CG 4.42Å; F377-H382 HydrophobicContact CE2-CB 4.05Å; F377-H382 AromaticContact CE2-CE1 3.92Å; F377-H382 AromaticContact CE2-CG 3.82Å; F377-H382 AromaticContact CE2-ND1 3.5Å; F377-H382 WeakPolarHBondContact CE2-ND1 3.36Å; F377-H382 HydrophobicContact CZ-CB 4.03Å; F377-H382 AromaticContact CZ-CG 3.97Å |
| 378 | S | 86 | Confident | 84.2 | Confident | 38 Ų | 38 | 67.5 Ų | 67.5 | 27% | 0.266 | 37% | 0.37 | S | S | . | . | trans | -137.9 | 128.8 | 172.8 | 66.1 | 0 | 0 | 0 | 0 | 110 | A376 R381 H382 | A376-S378 PolarHBondContact O-N 3.23Å; S378-R381 PolarHBondContact O-N 2.97Å; S378-R381 WeakPolarHBondContact OG-CB 3.44Å; S378-R381 PolarHBondContact OG-NH1 3.4Å; S378-H382 WeakPolarHBondContact O-CB 3.46Å; S378-H382 PolarHBondContact O-N 2.92Å | ||
| 379 | W | 86.5 | Confident | 84.6 | Confident | 128 Ų | 128 | 65.9 Ų | 65.9 | 49% | 0.485 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -56.3 | -45.9 | 178.6 | -85.9 | 115 | 0 | 0 | 0 | 114.2 | K198 F377 R381 H382 V383 | K198-W379 HydrophobicContact CD-CH2 3.89Å; K198-W379 HydrophobicContact CD-CZ2 3.64Å; K198-W379 HydrophobicContact CG-CH2 3.88Å; K198-W379 HydrophobicContact CG-CZ2 4.15Å; K198-W379 HydrophobicContact CG-CZ3 4.45Å; K198-W379 VanDerWaalsContact NZ-CZ2 3.27Å; F377-W379 AromaticContact CE1-CD1 3.98Å; F377-W379 HydrophobicContact CE1-CD2 4.08Å; F377-W379 AromaticContact CE1-CG 3.94Å; F377-W379 HydrophobicContact CE1-CG 3.94Å; F377-W379 HydrophobicContact CZ-CD2 4.19Å; F377-W379 HydrophobicContact CZ-CE3 4.41Å; F377-W379 HydrophobicContact CZ-CG 4.42Å; W379-R381 VanDerWaalsContact C-N 3.33Å; W379-R381 PolarHBondContact O-N 2.98Å; W379-H382 WeakPolarHBondContact O-CB 3.45Å; W379-H382 PolarHBondContact O-N 3.4Å; W379-H382 VanDerWaalsContact O-N 3.1Å; W379-V383 HydrophobicContact CE3-CG2 4.45Å; W379-V383 WeakPolarHBondContact O-CG2 3.48Å; W379-V383 PolarHBondContact O-N 3.02Å |
| 380 | P | 89.3 | Confident | 85.4 | Confident | 101 Ų | 101 | 63.8 Ų | 63.8 | 66% | 0.656 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -59.9 | -42.9 | -179.1 | -25.9 | 35.4 | 0 | 0 | 0 | 112.6 | H382 V383 A384 | P380-H382 PolarHBondContact O-N 3.29Å; P380-V383 PolarHBondContact O-N 2.93Å; P380-A384 WeakPolarHBondContact O-CB 3.32Å; P380-A384 PolarHBondContact O-N 3.47Å |
| 381 | R | 88.4 | Confident | 86 | Confident | 37 Ų | 37 | 65.5 Ų | 65.5 | 14% | 0.14 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -64.9 | -40.1 | 175.8 | -171.5 | 177.4 | 66.8 | -126.9 | 4.4 | 112.3 | F372 A376 S378 W379 A384 I385 | F372-R381 VanDerWaalsContact CD2-CD 3.46Å; F372-R381 HydrophobicContact CD2-CG 4.27Å; F372-R381 HydrophobicContact CE2-CG 4.09Å; A376-R381 PolarHBondContact O-NH1 3.26Å; A376-R381 PolarHBondContact O-NH2 2.94Å; S378-R381 PolarHBondContact O-N 2.97Å; S378-R381 WeakPolarHBondContact OG-CB 3.44Å; S378-R381 PolarHBondContact OG-NH1 3.4Å; W379-R381 VanDerWaalsContact C-N 3.33Å; W379-R381 PolarHBondContact O-N 2.98Å; R381-A384 PolarHBondContact O-N 3.38Å; R381-I385 HydrophobicContact CG-CD1 3.9Å; R381-I385 HydrophobicContact CG-CG1 4.44Å; R381-I385 VanDerWaalsContact O-CG1 3.26Å; R381-I385 WeakPolarHBondContact O-CG1 3.31Å; R381-I385 PolarHBondContact O-N 2.92Å |
| 382 | H | 86.5 | Confident | 86.6 | Confident | 8 Ų | 8 | 65 Ų | 65 | 4% | 0.037 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.2 | -44.6 | 178.8 | -171.9 | 84.4 | 0 | 0 | 0 | 111.6 | R364 F377 S378 W379 P380 A386 | R364-H382 PolarHBondContact NE-CE1 3.48Å; R364-H382 VanDerWaalsContact NE-CE1 3.29Å; R364-H382 PolarHBondContact NH1-CE1 3.08Å; R364-H382 PolarHBondContact NH1-NE2 3.42Å; F377-H382 HydrophobicContact CE2-CB 4.05Å; F377-H382 AromaticContact CE2-CE1 3.92Å; F377-H382 AromaticContact CE2-CG 3.82Å; F377-H382 AromaticContact CE2-ND1 3.5Å; F377-H382 WeakPolarHBondContact CE2-ND1 3.36Å; F377-H382 HydrophobicContact CZ-CB 4.03Å; F377-H382 AromaticContact CZ-CG 3.97Å; S378-H382 WeakPolarHBondContact O-CB 3.46Å; S378-H382 PolarHBondContact O-N 2.92Å; W379-H382 WeakPolarHBondContact O-CB 3.45Å; W379-H382 PolarHBondContact O-N 3.4Å; W379-H382 VanDerWaalsContact O-N 3.1Å; P380-H382 PolarHBondContact O-N 3.29Å; H382-A386 PolarHBondContact O-N 3.38Å |
| 383 | V | 90.8 | Very high | 87.1 | Confident | 51 Ų | 51 | 61.3 Ų | 61.3 | 31% | 0.309 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -68.6 | -45.6 | 175.9 | 177.1 | 0 | 0 | 0 | 0 | 111 | L196 W379 P380 I385 A386 L387 | L196-V383 HydrophobicContact CD1-CG1 4.38Å; L196-V383 HydrophobicContact CD1-CG2 4.25Å; L196-V383 HydrophobicContact CD2-CB 4.12Å; L196-V383 HydrophobicContact CD2-CG1 4.28Å; L196-V383 HydrophobicContact CD2-CG2 3.81Å; W379-V383 HydrophobicContact CE3-CG2 4.45Å; W379-V383 WeakPolarHBondContact O-CG2 3.48Å; W379-V383 PolarHBondContact O-N 3.02Å; P380-V383 PolarHBondContact O-N 2.93Å; V383-I385 PolarHBondContact O-N 3.35Å; V383-A386 PolarHBondContact O-N 2.85Å; V383-L387 WeakPolarHBondContact O-CB 3.41Å; V383-L387 PolarHBondContact O-N 3.37Å |
| 384 | A | 91.8 | Very high | 88.2 | Confident | 41 Ų | 41 | 58.1 Ų | 58.1 | 34% | 0.339 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.2 | -44.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P380 R381 L387 I388 | P380-A384 WeakPolarHBondContact O-CB 3.32Å; P380-A384 PolarHBondContact O-N 3.47Å; R381-A384 PolarHBondContact O-N 3.38Å; A384-L387 PolarHBondContact O-N 3.05Å; A384-I388 WeakPolarHBondContact O-CB 3.46Å; A384-I388 WeakPolarHBondContact O-CD1 3.35Å; A384-I388 WeakPolarHBondContact O-CG1 3.3Å; A384-I388 PolarHBondContact O-N 3Å |
| 385 | I | 90.6 | Very high | 89.2 | Confident | 15 Ų | 15 | 56.7 Ų | 56.7 | 8% | 0.077 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.2 | -46 | 177.5 | -68 | 167.8 | 0 | 0 | 0 | 110.7 | R364 L367 R381 V383 L389 | R364-I385 HydrophobicContact CB-CG2 4.38Å; R364-I385 HydrophobicContact CG-CG2 4.04Å; L367-I385 HydrophobicContact CB-CG2 4.31Å; L367-I385 HydrophobicContact CD1-CG2 3.95Å; R381-I385 HydrophobicContact CG-CD1 3.9Å; R381-I385 HydrophobicContact CG-CG1 4.44Å; R381-I385 VanDerWaalsContact O-CG1 3.26Å; R381-I385 WeakPolarHBondContact O-CG1 3.31Å; R381-I385 PolarHBondContact O-N 2.92Å; V383-I385 PolarHBondContact O-N 3.35Å; I385-L389 HydrophobicContact CG2-CD1 3.95Å; I385-L389 HydrophobicContact CG2-CG 4.47Å; I385-L389 WeakPolarHBondContact O-CB 3.48Å; I385-L389 VanDerWaalsContact O-CG 3.28Å; I385-L389 WeakPolarHBondContact O-CG 3.39Å; I385-L389 PolarHBondContact O-N 3.34Å |
| 386 | A | 90.8 | Very high | 90 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L192 L196 L360 H382 V383 L390 | L192-A386 HydrophobicContact CD1-CB 4.37Å; L196-A386 HydrophobicContact CD2-CB 3.87Å; L360-A386 HydrophobicContact CD2-CB 4.25Å; H382-A386 PolarHBondContact O-N 3.38Å; V383-A386 PolarHBondContact O-N 2.85Å; A386-L390 VanDerWaalsContact O-CB 3.28Å; A386-L390 WeakPolarHBondContact O-CB 3.16Å; A386-L390 PolarHBondContact O-N 3.15Å |
| 387 | L | 92.8 | Very high | 90.7 | Very high | 57 Ų | 57 | 49.2 Ų | 49.2 | 30% | 0.298 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.9 | -47.6 | 178.9 | -176.2 | 66.1 | 0 | 0 | 0 | 111.9 | M188 L192 V383 A384 L389 L390 I391 | M188-L387 HydrophobicContact CE-CD1 3.88Å; M188-L387 HydrophobicContact SD-CD1 4.11Å; L192-L387 HydrophobicContact CD2-CD1 4.12Å; V383-L387 WeakPolarHBondContact O-CB 3.41Å; V383-L387 PolarHBondContact O-N 3.37Å; A384-L387 PolarHBondContact O-N 3.05Å; L387-L389 VanDerWaalsContact C-N 3.35Å; L387-L389 PolarHBondContact O-N 2.75Å; L387-L390 PolarHBondContact O-N 3.32Å; L387-I391 HydrophobicContact CD1-CD1 4.08Å; L387-I391 HydrophobicContact CD1-CG1 4.41Å; L387-I391 HydrophobicContact CG-CD1 3.84Å; L387-I391 WeakPolarHBondContact O-CB 3.29Å; L387-I391 VanDerWaalsContact O-CG1 3.25Å; L387-I391 WeakPolarHBondContact O-CG1 3.39Å; L387-I391 PolarHBondContact O-N 3.48Å |
| 388 | I | 93 | Very high | 91.3 | Very high | 115 Ų | 115 | 47.8 Ų | 47.8 | 59% | 0.59 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -61.2 | -45 | 178.7 | -69.8 | 165.2 | 0 | 0 | 0 | 110.6 | A384 I391 L392 | A384-I388 WeakPolarHBondContact O-CB 3.46Å; A384-I388 WeakPolarHBondContact O-CD1 3.35Å; A384-I388 WeakPolarHBondContact O-CG1 3.3Å; A384-I388 PolarHBondContact O-N 3Å; I388-I391 PolarHBondContact O-N 3Å; I388-L392 WeakPolarHBondContact O-CB 3.41Å; I388-L392 PolarHBondContact O-N 3.44Å |
| 389 | L | 92 | Very high | 91.4 | Very high | 6 Ų | 6 | 50.5 Ų | 50.5 | 3% | 0.031 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.3 | -46.8 | 176.1 | -78.4 | 173.7 | 0 | 0 | 0 | 111.5 | V145 I363 L367 I385 L387 I391 L392 V393 | V145-L389 HydrophobicContact CG2-CD2 4.48Å; I363-L389 HydrophobicContact CB-CD1 4.08Å; I363-L389 HydrophobicContact CG2-CD1 3.6Å; I363-L389 HydrophobicContact CG2-CD2 3.79Å; I363-L389 HydrophobicContact CG2-CG 4.35Å; L367-L389 HydrophobicContact CD1-CD1 3.96Å; L367-L389 HydrophobicContact CD1-CD2 3.84Å; L367-L389 HydrophobicContact CD1-CG 4.02Å; I385-L389 HydrophobicContact CG2-CD1 3.95Å; I385-L389 HydrophobicContact CG2-CG 4.47Å; I385-L389 WeakPolarHBondContact O-CB 3.48Å; I385-L389 VanDerWaalsContact O-CG 3.28Å; I385-L389 WeakPolarHBondContact O-CG 3.39Å; I385-L389 PolarHBondContact O-N 3.34Å; L387-L389 VanDerWaalsContact C-N 3.35Å; L387-L389 PolarHBondContact O-N 2.75Å; L389-I391 PolarHBondContact O-N 3.34Å; L389-L392 WeakPolarHBondContact O-CB 3.43Å; L389-L392 PolarHBondContact O-N 3.44Å; L389-V393 WeakPolarHBondContact O-CG2 3.48Å; L389-V393 PolarHBondContact O-N 3.48Å |
| 390 | L | 92.9 | Very high | 91.4 | Very high | 5 Ų | 5 | 45.8 Ų | 45.8 | 3% | 0.026 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.6 | -40.2 | -178.3 | -171.3 | 63 | 0 | 0 | 0 | 111.9 | L152 S187 M188 I191 L192 A386 L387 V393 N394 | L152-L390 HydrophobicContact CD1-CD1 4.39Å; S187-L390 WeakPolarHBondContact O-CD2 3.45Å; M188-L390 HydrophobicContact SD-CD2 4.44Å; I191-L390 HydrophobicContact CG2-CD1 4.15Å; L192-L390 HydrophobicContact CB-CD2 3.76Å; L192-L390 HydrophobicContact CD1-CD2 4.27Å; A386-L390 VanDerWaalsContact O-CB 3.28Å; A386-L390 WeakPolarHBondContact O-CB 3.16Å; A386-L390 PolarHBondContact O-N 3.15Å; L387-L390 PolarHBondContact O-N 3.32Å; L390-V393 PolarHBondContact O-N 3.2Å; L390-N394 WeakPolarHBondContact O-CB 3.42Å; L390-N394 PolarHBondContact O-N 3.43Å; L390-N394 PolarHBondContact O-ND2 2.85Å |
| 391 | I | 93.4 | Very high | 91.1 | Very high | 88 Ų | 88 | 45.9 Ų | 45.9 | 45% | 0.451 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.3 | -47.2 | 173.6 | -69.8 | 167.7 | 0 | 0 | 0 | 110.3 | L387 I388 L389 V393 N394 V395 | L387-I391 HydrophobicContact CD1-CD1 4.08Å; L387-I391 HydrophobicContact CD1-CG1 4.41Å; L387-I391 HydrophobicContact CG-CD1 3.84Å; L387-I391 WeakPolarHBondContact O-CB 3.29Å; L387-I391 VanDerWaalsContact O-CG1 3.25Å; L387-I391 WeakPolarHBondContact O-CG1 3.39Å; L387-I391 PolarHBondContact O-N 3.48Å; I388-I391 PolarHBondContact O-N 3Å; L389-I391 PolarHBondContact O-N 3.34Å; I391-V393 VanDerWaalsContact C-N 3.33Å; I391-V393 PolarHBondContact O-N 3.4Å; I391-N394 PolarHBondContact O-N 3.43Å; I391-V395 HydrophobicContact CG2-CG2 4.39Å; I391-V395 WeakPolarHBondContact O-CG2 3.36Å; I391-V395 PolarHBondContact O-N 2.91Å |
| 392 | L | 94.1 | Very high | 91 | Very high | 93 Ų | 93 | 46.2 Ų | 46.2 | 49% | 0.487 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -57.4 | -45.4 | 179 | 178.4 | 67 | 0 | 0 | 0 | 111.8 | I388 L389 V395 L396 | I388-L392 WeakPolarHBondContact O-CB 3.41Å; I388-L392 PolarHBondContact O-N 3.44Å; L389-L392 WeakPolarHBondContact O-CB 3.43Å; L389-L392 PolarHBondContact O-N 3.44Å; L392-V395 PolarHBondContact O-N 2.71Å; L392-L396 PolarHBondContact O-N 3.39Å |
| 393 | V | 94.4 | Very high | 91.1 | Very high | 2 Ų | 2 | 46 Ų | 46 | 1% | 0.012 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.7 | -42.8 | 179.3 | -179.7 | 0 | 0 | 0 | 0 | 110.8 | V145 M148 L152 L389 L390 I391 V395 L396 V397 | V145-V393 HydrophobicContact CG1-CG2 4.26Å; M148-V393 HydrophobicContact CB-CG1 3.91Å; M148-V393 HydrophobicContact CB-CG2 4.21Å; M148-V393 HydrophobicContact CE-CG2 3.58Å; L152-V393 HydrophobicContact CD1-CB 4.24Å; L152-V393 HydrophobicContact CD1-CG1 3.56Å; L152-V393 HydrophobicContact CG-CG1 4.09Å; L389-V393 WeakPolarHBondContact O-CG2 3.48Å; L389-V393 PolarHBondContact O-N 3.48Å; L390-V393 PolarHBondContact O-N 3.2Å; I391-V393 VanDerWaalsContact C-N 3.33Å; I391-V393 PolarHBondContact O-N 3.4Å; V393-V395 PolarHBondContact O-N 3.4Å; V393-L396 PolarHBondContact O-N 2.96Å; V393-V397 WeakPolarHBondContact O-CG2 3.28Å; V393-V397 PolarHBondContact O-N 3.18Å |
| 394 | N | 93.8 | Very high | 91 | Very high | 12 Ų | 12 | 44.3 Ų | 44.3 | 6% | 0.064 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.1 | -45 | 177.1 | -87.4 | -88.4 | 0 | 0 | 0 | 111.6 | S187 L390 I391 L396 V397 I398 | S187-N394 WeakPolarHBondContact CB-ND2 3.33Å; S187-N394 PolarHBondContact OG-ND2 2.86Å; S187-N394 PolarHBondContact OG-OD1 2.94Å; L390-N394 WeakPolarHBondContact O-CB 3.42Å; L390-N394 PolarHBondContact O-N 3.43Å; L390-N394 PolarHBondContact O-ND2 2.85Å; I391-N394 PolarHBondContact O-N 3.43Å; N394-L396 VanDerWaalsContact C-N 3.32Å; N394-L396 PolarHBondContact O-N 3.24Å; N394-V397 PolarHBondContact O-N 2.88Å; N394-I398 WeakPolarHBondContact O-CD1 3.45Å; N394-I398 VanDerWaalsContact O-CG1 3.26Å; N394-I398 WeakPolarHBondContact O-CG1 3.23Å; N394-I398 PolarHBondContact O-N 2.97Å |
| 395 | V | 93.8 | Very high | 90.8 | Very high | 80 Ų | 80 | 43.8 Ų | 43.8 | 49% | 0.485 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.2 | -45.5 | 175.7 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | I391 L392 V393 V397 I398 C399 | I391-V395 HydrophobicContact CG2-CG2 4.39Å; I391-V395 WeakPolarHBondContact O-CG2 3.36Å; I391-V395 PolarHBondContact O-N 2.91Å; L392-V395 PolarHBondContact O-N 2.71Å; V393-V395 PolarHBondContact O-N 3.4Å; V395-V397 PolarHBondContact O-N 2.98Å; V395-I398 PolarHBondContact O-N 3.48Å; V395-C399 PolarHBondContact O-N 3.18Å; V395-C399 VanDerWaalsContact O-N 3.1Å; V395-C399 PolarHBondContact O-SG 3.3Å |
| 396 | L | 92.7 | Very high | 90.9 | Very high | 62 Ų | 62 | 43.5 Ų | 43.5 | 33% | 0.325 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -58.6 | -47.3 | 178.5 | -168 | 153.7 | 0 | 0 | 0 | 111.4 | V145 L392 V393 N394 I398 C399 V400 | V145-L396 HydrophobicContact CG1-CD1 4.39Å; L392-L396 PolarHBondContact O-N 3.39Å; V393-L396 PolarHBondContact O-N 2.96Å; N394-L396 VanDerWaalsContact C-N 3.32Å; N394-L396 PolarHBondContact O-N 3.24Å; L396-I398 VanDerWaalsContact C-N 3.32Å; L396-I398 PolarHBondContact O-N 3.23Å; L396-C399 PolarHBondContact O-N 2.73Å; L396-V400 HydrophobicContact CD2-CG2 3.67Å; L396-V400 HydrophobicContact CG-CG2 4.34Å; L396-V400 VanDerWaalsContact O-CG2 3.29Å; L396-V400 WeakPolarHBondContact O-CG2 3.22Å; L396-V400 PolarHBondContact O-N 3.23Å |
| 397 | V | 92.5 | Very high | 90.9 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.7 | -31.8 | -179 | 170.3 | 0 | 0 | 0 | 0 | 113.1 | S149 L152 F153 K156 V393 N394 V395 | S149-V397 WeakPolarHBondContact O-CG2 3.4Å; L152-V397 HydrophobicContact CB-CG1 4.4Å; L152-V397 HydrophobicContact CB-CG2 3.9Å; F153-V397 HydrophobicContact CB-CG1 4.2Å; F153-V397 HydrophobicContact CD2-CG1 4.37Å; K156-V397 HydrophobicContact CB-CG1 4.28Å; K156-V397 HydrophobicContact CD-CG1 3.79Å; K156-V397 PolarHBondContact NZ-O 3.34Å; V393-V397 WeakPolarHBondContact O-CG2 3.28Å; V393-V397 PolarHBondContact O-N 3.18Å; N394-V397 PolarHBondContact O-N 2.88Å; V395-V397 PolarHBondContact O-N 2.98Å |
| 398 | I | 90.6 | Very high | 90.8 | Very high | 64 Ų | 64 | 40.9 Ų | 40.9 | 33% | 0.328 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -68.9 | -38.8 | 174.6 | -68.5 | 165.2 | 0 | 0 | 0 | 110.4 | N180 I184 N394 V395 L396 | N180-I398 HydrophobicContact CB-CG1 4.36Å; I184-I398 HydrophobicContact CD1-CD1 4.04Å; I184-I398 HydrophobicContact CG1-CD1 4.37Å; N394-I398 WeakPolarHBondContact O-CD1 3.45Å; N394-I398 VanDerWaalsContact O-CG1 3.26Å; N394-I398 WeakPolarHBondContact O-CG1 3.23Å; N394-I398 PolarHBondContact O-N 2.97Å; V395-I398 PolarHBondContact O-N 3.48Å; L396-I398 VanDerWaalsContact C-N 3.32Å; L396-I398 PolarHBondContact O-N 3.23Å |
| 399 | C | 89.5 | Confident | 90.7 | Very high | 96 Ų | 96 | 38.7 Ų | 38.7 | 65% | 0.649 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -79.4 | -26.7 | -178.6 | -66.1 | 0 | 0 | 0 | 0 | 114.3 | V395 L396 | V395-C399 PolarHBondContact O-N 3.18Å; V395-C399 VanDerWaalsContact O-N 3.1Å; V395-C399 PolarHBondContact O-SG 3.3Å; L396-C399 PolarHBondContact O-N 2.73Å |
| 400 | V | 86.8 | Confident | 90.8 | Very high | 28 Ų | 28 | 38.9 Ų | 38.9 | 17% | 0.17 | 22% | 0.219 | C | C | . | . | trans | -81.8 | 126.8 | -177.7 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | L396 T402 I406 | L396-V400 HydrophobicContact CD2-CG2 3.67Å; L396-V400 HydrophobicContact CG-CG2 4.34Å; L396-V400 VanDerWaalsContact O-CG2 3.29Å; L396-V400 WeakPolarHBondContact O-CG2 3.22Å; L396-V400 PolarHBondContact O-N 3.23Å; V400-T402 WeakPolarHBondContact CG1-O 3.45Å; V400-I406 HydrophobicContact CB-CD1 4.44Å; V400-I406 HydrophobicContact CB-CG1 4.47Å; V400-I406 HydrophobicContact CG1-CD1 4Å; V400-I406 HydrophobicContact CG1-CG1 3.73Å; V400-I406 HydrophobicContact CG2-CG1 4.46Å | ||
| 401 | P | 82.3 | Confident | 90.8 | Very high | 103 Ų | 103 | 38.7 Ų | 38.7 | 67% | 0.669 | 22% | 0.217 | S | C | * | . | S | Bend | trans | -81.3 | -33.8 | -179.1 | 30.4 | -34 | 0 | 0 | 0 | 113.3 | ||
| 402 | T | 86.1 | Confident | 90.8 | Very high | 44 Ų | 44 | 34.5 Ų | 34.5 | 27% | 0.27 | 20% | 0.196 | S | C | . | . | trans | -131.7 | 137.9 | -175.8 | 79.1 | 0 | 0 | 0 | 0 | 112.2 | V400 R404 D405 | V400-T402 WeakPolarHBondContact CG1-O 3.45Å; T402-R404 PolarHBondContact O-N 3.08Å; T402-D405 PolarHBondContact O-N 3.41Å; T402-D405 VanDerWaalsContact OG1-CG 3.23Å; T402-D405 PolarHBondContact OG1-N 3.45Å; T402-D405 PolarHBondContact OG1-OD2 3.44Å | ||
| 403 | I | 88.4 | Confident | 90.8 | Very high | 5 Ų | 5 | 31 Ų | 31 | 3% | 0.026 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.9 | -27.8 | 175.5 | -161.7 | 171.3 | 0 | 0 | 0 | 112.4 | F153 I154 A328 E329 D405 I406 F407 | F153-I403 HydrophobicContact CB-CD1 4.45Å; F153-I403 HydrophobicContact CB-CG1 4.49Å; F153-I403 HydrophobicContact CD1-CB 3.71Å; F153-I403 HydrophobicContact CD1-CD1 4.03Å; F153-I403 HydrophobicContact CD1-CG1 4.09Å; F153-I403 HydrophobicContact CE1-CB 3.82Å; F153-I403 HydrophobicContact CE1-CG2 4.49Å; F153-I403 HydrophobicContact CG-CB 4.18Å; F153-I403 HydrophobicContact CG-CG1 4.33Å; F153-I403 HydrophobicContact CZ-CB 4.38Å; I154-I403 HydrophobicContact CD1-CD1 4.47Å; I154-I403 HydrophobicContact CG1-CD1 4Å; A328-I403 HydrophobicContact CB-CG2 4.14Å; E329-I403 HydrophobicContact CB-CG2 4.32Å; I403-D405 VanDerWaalsContact C-N 3.29Å; I403-D405 PolarHBondContact O-N 3.37Å; I403-I406 WeakPolarHBondContact O-CB 3.32Å; I403-I406 PolarHBondContact O-N 2.78Å; I403-I406 VanDerWaalsContact O-N 3.12Å; I403-F407 HydrophobicContact CD1-CE1 4.26Å; I403-F407 HydrophobicContact CD1-CE2 3.9Å; I403-F407 HydrophobicContact CD1-CZ 3.51Å; I403-F407 HydrophobicContact CG1-CD2 4.36Å; I403-F407 HydrophobicContact CG1-CE1 4.08Å; I403-F407 HydrophobicContact CG1-CE2 3.78Å; I403-F407 HydrophobicContact CG1-CZ 3.63Å; I403-F407 HydrophobicContact CG2-CE2 4.29Å; I403-F407 PolarHBondContact O-N 2.93Å; I403-F407 VanDerWaalsContact O-N 3.07Å |
| 404 | R | 88.8 | Confident | 90.8 | Very high | 15 Ų | 15 | 31 Ų | 31 | 6% | 0.057 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -56.7 | -41.4 | 176.2 | -178.6 | 179 | 60.9 | -163.4 | -6 | 112 | Y80 Y266 A328 T402 I406 F407 G408 | Y80-R404 HydrophobicContact CE1-CG 4.43Å; Y80-R404 VanDerWaalsContact OH-CD 3.24Å; Y80-R404 WeakPolarHBondContact OH-CD 3.41Å; Y80-R404 PolarHBondContact OH-NH1 3.21Å; Y266-R404 HydrophobicContact CD1-CG 4.16Å; Y266-R404 HydrophobicContact CG-CG 4.22Å; A328-R404 HydrophobicContact CB-CB 3.84Å; T402-R404 PolarHBondContact O-N 3.08Å; R404-I406 VanDerWaalsContact C-N 3.29Å; R404-I406 PolarHBondContact O-N 2.67Å; R404-F407 PolarHBondContact O-N 3.34Å; R404-G408 PolarHBondContact O-N 3.48Å |
| 405 | D | 88.4 | Confident | 90.8 | Very high | 29 Ų | 29 | 30.4 Ų | 30.4 | 16% | 0.155 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.9 | -35.8 | 179.9 | -65.6 | -43.9 | 0 | 0 | 0 | 111.2 | T402 I403 F409 | T402-D405 PolarHBondContact O-N 3.41Å; T402-D405 VanDerWaalsContact OG1-CG 3.23Å; T402-D405 PolarHBondContact OG1-N 3.45Å; T402-D405 PolarHBondContact OG1-OD2 3.44Å; I403-D405 VanDerWaalsContact C-N 3.29Å; I403-D405 PolarHBondContact O-N 3.37Å; D405-F409 VanDerWaalsContact O-CB 3.25Å; D405-F409 WeakPolarHBondContact O-CB 3.39Å; D405-F409 PolarHBondContact O-N 2.88Å |
| 406 | I | 91.4 | Very high | 90.9 | Very high | 9 Ų | 9 | 26.6 Ų | 26.6 | 5% | 0.046 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.8 | -52.5 | 174 | -52.2 | -178.2 | 0 | 0 | 0 | 109.6 | F153 V400 I403 R404 G408 F409 I410 | F153-I406 HydrophobicContact CB-CD1 4.43Å; F153-I406 HydrophobicContact CD2-CD1 4.42Å; V400-I406 HydrophobicContact CB-CD1 4.44Å; V400-I406 HydrophobicContact CB-CG1 4.47Å; V400-I406 HydrophobicContact CG1-CD1 4Å; V400-I406 HydrophobicContact CG1-CG1 3.73Å; V400-I406 HydrophobicContact CG2-CG1 4.46Å; I403-I406 WeakPolarHBondContact O-CB 3.32Å; I403-I406 PolarHBondContact O-N 2.78Å; I403-I406 VanDerWaalsContact O-N 3.12Å; R404-I406 VanDerWaalsContact C-N 3.29Å; R404-I406 PolarHBondContact O-N 2.67Å; I406-G408 PolarHBondContact O-N 2.86Å; I406-F409 PolarHBondContact O-N 3.25Å; I406-I410 HydrophobicContact CG2-CG1 4.2Å; I406-I410 VanDerWaalsContact O-CB 3.29Å; I406-I410 WeakPolarHBondContact O-CB 3.47Å; I406-I410 WeakPolarHBondContact O-CG1 3.47Å; I406-I410 PolarHBondContact O-N 3.13Å |
| 407 | F | 91.1 | Very high | 91.1 | Very high | 1 Ų | 1 | 24.3 Ų | 24.3 | 0% | 0.004 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.6 | -41.1 | -179.4 | -62.3 | -27.9 | 0 | 0 | 0 | 112.6 | S73 I270 F273 I403 R404 G411 | S73-F407 WeakPolarHBondContact O-CZ 3.5Å; S73-F407 WeakPolarHBondContact OG-CE1 3.42Å; I270-F407 HydrophobicContact CB-CB 4.43Å; I270-F407 HydrophobicContact CG1-CB 3.58Å; I270-F407 HydrophobicContact CG1-CD2 4.34Å; I270-F407 HydrophobicContact CG1-CG 4.4Å; F273-F407 AromaticContact CD1-CD1 3.61Å; F273-F407 HydrophobicContact CD1-CD1 3.61Å; F273-F407 HydrophobicContact CD1-CE1 4.01Å; F273-F407 HydrophobicContact CD1-CG 4.31Å; F273-F407 AromaticContact CE1-CD1 3.39Å; F273-F407 HydrophobicContact CE1-CD1 3.39Å; F273-F407 AromaticContact CE1-CE1 3.38Å; F273-F407 HydrophobicContact CE1-CE1 3.38Å; F273-F407 HydrophobicContact CE1-CG 4.46Å; F273-F407 HydrophobicContact CE1-CZ 4.44Å; F273-F407 HydrophobicContact CG-CD1 4.43Å; F273-F407 HydrophobicContact CZ-CD1 4.05Å; F273-F407 HydrophobicContact CZ-CE1 4.05Å; I403-F407 HydrophobicContact CD1-CE1 4.26Å; I403-F407 HydrophobicContact CD1-CE2 3.9Å; I403-F407 HydrophobicContact CD1-CZ 3.51Å; I403-F407 HydrophobicContact CG1-CD2 4.36Å; I403-F407 HydrophobicContact CG1-CE1 4.08Å; I403-F407 HydrophobicContact CG1-CE2 3.78Å; I403-F407 HydrophobicContact CG1-CZ 3.63Å; I403-F407 HydrophobicContact CG2-CE2 4.29Å; I403-F407 PolarHBondContact O-N 2.93Å; I403-F407 VanDerWaalsContact O-N 3.07Å; R404-F407 PolarHBondContact O-N 3.34Å; F407-G411 VanDerWaalsContact O-CA 3.28Å; F407-G411 WeakPolarHBondContact O-CA 3.46Å; F407-G411 PolarHBondContact O-N 3.41Å |
| 408 | G | 90.3 | Very high | 91.2 | Very high | 1 Ų | 1 | 24.3 Ų | 24.3 | 1% | 0.01 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.2 | -51.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | R404 I406 S412 | R404-G408 PolarHBondContact O-N 3.48Å; I406-G408 PolarHBondContact O-N 2.86Å; G408-S412 WeakPolarHBondContact O-CB 3.36Å; G408-S412 PolarHBondContact O-N 2.95Å; G408-S412 PolarHBondContact O-OG 3.36Å |
| 409 | F | 92.2 | Very high | 91.5 | Very high | 70 Ų | 70 | 21.3 Ų | 21.3 | 31% | 0.307 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -68.4 | -47.9 | -176.9 | -178 | -102.3 | 0 | 0 | 0 | 112.3 | L142 D405 I406 S412 T413 M464 W468 | L142-F409 HydrophobicContact CD1-CE1 4.17Å; D405-F409 VanDerWaalsContact O-CB 3.25Å; D405-F409 WeakPolarHBondContact O-CB 3.39Å; D405-F409 PolarHBondContact O-N 2.88Å; I406-F409 PolarHBondContact O-N 3.25Å; F409-S412 PolarHBondContact O-N 2.99Å; F409-S412 PolarHBondContact O-OG 3.24Å; F409-S412 VanDerWaalsContact O-OG 3.08Å; F409-T413 HydrophobicContact CD2-CG2 4.45Å; F409-T413 HydrophobicContact CE2-CG2 4.17Å; F409-T413 HydrophobicContact CZ-CG2 4.33Å; F409-T413 WeakPolarHBondContact O-CB 3.37Å; F409-T413 WeakPolarHBondContact O-CG2 3.31Å; F409-T413 PolarHBondContact O-N 3.42Å; F409-T413 VanDerWaalsContact O-N 3.17Å; F409-T413 PolarHBondContact O-OG1 3.22Å; F409-M464 VanDerWaalsContact CA-SD 3.59Å; F409-M464 HydrophobicContact CB-CE 4.41Å; F409-M464 HydrophobicContact CB-SD 4.05Å; F409-M464 HydrophobicContact CD2-CE 3.85Å; F409-M464 HydrophobicContact CD2-SD 4.36Å; F409-W468 HydrophobicContact CD2-CH2 4.06Å |
| 410 | I | 93.8 | Very high | 91.8 | Very high | 10 Ų | 10 | 17.2 Ų | 17.2 | 5% | 0.051 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -71.3 | -37.5 | -178 | -59.1 | -66.8 | 0 | 0 | 0 | 110.6 | L142 F273 I406 S414 A415 | L142-I410 HydrophobicContact CD1-CD1 4.01Å; L142-I410 HydrophobicContact CG-CD1 4.23Å; F273-I410 HydrophobicContact CD2-CB 4.27Å; F273-I410 HydrophobicContact CD2-CG2 3.68Å; F273-I410 HydrophobicContact CE2-CG2 3.87Å; I406-I410 HydrophobicContact CG2-CG1 4.2Å; I406-I410 VanDerWaalsContact O-CB 3.29Å; I406-I410 WeakPolarHBondContact O-CB 3.47Å; I406-I410 WeakPolarHBondContact O-CG1 3.47Å; I406-I410 PolarHBondContact O-N 3.13Å; I410-S414 WeakPolarHBondContact CG2-OG 3.5Å; I410-S414 PolarHBondContact O-N 2.84Å; I410-S414 PolarHBondContact O-OG 3.02Å; I410-A415 PolarHBondContact O-N 3.09Å |
| 411 | G | 92.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -72 | -22.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | P269 F407 P416 | P269-G411 VanDerWaalsContact O-CA 3.28Å; P269-G411 WeakPolarHBondContact O-CA 3.16Å; F407-G411 VanDerWaalsContact O-CA 3.28Å; F407-G411 WeakPolarHBondContact O-CA 3.46Å; F407-G411 PolarHBondContact O-N 3.41Å; G411-P416 WeakPolarHBondContact O-CD 3.26Å |
| 412 | S | 93.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -94.1 | -18.1 | 176.7 | 57.6 | 0 | 0 | 0 | 0 | 113.5 | G408 F409 P416 M457 M464 | G408-S412 WeakPolarHBondContact O-CB 3.36Å; G408-S412 PolarHBondContact O-N 2.95Å; G408-S412 PolarHBondContact O-OG 3.36Å; F409-S412 PolarHBondContact O-N 2.99Å; F409-S412 PolarHBondContact O-OG 3.24Å; F409-S412 VanDerWaalsContact O-OG 3.08Å; S412-P416 WeakPolarHBondContact O-CG 3.41Å; S412-M457 WeakPolarHBondContact O-CG 3.02Å; S412-M464 WeakPolarHBondContact OG-CE 3.43Å |
| 413 | T | 94.6 | Very high | 93.3 | Very high | 20 Ų | 20 | 11 Ų | 11 | 12% | 0.123 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -106.4 | -69.7 | -178.8 | 55.4 | 0 | 0 | 0 | 0 | 111.8 | F409 S417 L461 | F409-T413 HydrophobicContact CD2-CG2 4.45Å; F409-T413 HydrophobicContact CE2-CG2 4.17Å; F409-T413 HydrophobicContact CZ-CG2 4.33Å; F409-T413 WeakPolarHBondContact O-CB 3.37Å; F409-T413 WeakPolarHBondContact O-CG2 3.31Å; F409-T413 PolarHBondContact O-N 3.42Å; F409-T413 VanDerWaalsContact O-N 3.17Å; F409-T413 PolarHBondContact O-OG1 3.22Å; T413-S417 WeakPolarHBondContact O-CB 3.16Å; T413-S417 PolarHBondContact O-N 3.29Å; T413-S417 PolarHBondContact O-OG 3.16Å; T413-L461 HydrophobicContact CG2-CD1 4.08Å; T413-L461 HydrophobicContact CG2-CD2 3.45Å; T413-L461 VanDerWaalsContact CG2-CD2 3.45Å; T413-L461 HydrophobicContact CG2-CG 4.14Å |
| 414 | S | 95 | Very high | 93.6 | Very high | 1 Ų | 1 | 10.9 Ų | 10.9 | 1% | 0.007 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -75.6 | -36.4 | -170.1 | 74.4 | 0 | 0 | 0 | 0 | 112.6 | H143 I410 S417 L418 | H143-S414 PolarHBondContact ND1-OG 2.87Å; I410-S414 WeakPolarHBondContact CG2-OG 3.5Å; I410-S414 PolarHBondContact O-N 2.84Å; I410-S414 PolarHBondContact O-OG 3.02Å; S414-S417 WeakPolarHBondContact O-CB 3.34Å; S414-S417 PolarHBondContact O-N 3.37Å; S414-L418 WeakPolarHBondContact O-CB 3.43Å; S414-L418 WeakPolarHBondContact O-CG 3.41Å; S414-L418 PolarHBondContact O-N 3.48Å |
| 415 | A | 94.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 12.4 Ų | 12.4 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -65.8 | -51.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A272 V276 I410 S417 L418 I419 | A272-A415 HydrophobicContact CB-CB 3.9Å; V276-A415 HydrophobicContact CG2-CB 3.37Å; I410-A415 PolarHBondContact O-N 3.09Å; A415-S417 PolarHBondContact O-N 3.39Å; A415-L418 PolarHBondContact O-N 2.92Å; A415-I419 HydrophobicContact CB-CD1 4.34Å; A415-I419 WeakPolarHBondContact O-CB 3.41Å; A415-I419 WeakPolarHBondContact O-CG1 3.22Å; A415-I419 PolarHBondContact O-N 3.44Å |
| 416 | P | 95.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 11 Ų | 11 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -55.3 | -39.6 | 172.9 | -4.9 | -4.9 | 0 | 0 | 0 | 112.7 | G411 S412 F420 I421 F456 M457 | G411-P416 WeakPolarHBondContact O-CD 3.26Å; S412-P416 WeakPolarHBondContact O-CG 3.41Å; P416-F420 WeakPolarHBondContact O-CA 3.44Å; P416-F420 WeakPolarHBondContact O-CB 3.47Å; P416-F420 PolarHBondContact O-N 3.04Å; P416-I421 PolarHBondContact O-N 3.47Å; P416-I421 VanDerWaalsContact O-N 3.11Å; P416-F456 HydrophobicContact CB-CD1 3.64Å; P416-F456 HydrophobicContact CB-CE1 4.08Å; P416-F456 HydrophobicContact CG-CD1 3.7Å; P416-F456 HydrophobicContact CG-CE1 3.72Å; P416-M457 HydrophobicContact CB-CB 3.96Å; P416-M457 HydrophobicContact CG-CB 4.01Å; P416-M457 HydrophobicContact CG-CG 4.45Å |
| 417 | S | 96.4 | Very high | 94.1 | Very high | 15 Ų | 15 | 11.1 Ų | 11.1 | 11% | 0.105 | 6% | 0.058 | C | C | . | . | I | π-helix | trans | -62.8 | -45.1 | 179.2 | -62 | 0 | 0 | 0 | 0 | 112.4 | T413 S414 A415 L422 | T413-S417 WeakPolarHBondContact O-CB 3.16Å; T413-S417 PolarHBondContact O-N 3.29Å; T413-S417 PolarHBondContact O-OG 3.16Å; S414-S417 WeakPolarHBondContact O-CB 3.34Å; S414-S417 PolarHBondContact O-N 3.37Å; A415-S417 PolarHBondContact O-N 3.39Å; S417-L422 WeakPolarHBondContact O-CB 3.22Å; S417-L422 VanDerWaalsContact O-CG 3.29Å; S417-L422 WeakPolarHBondContact O-CG 3.44Å; S417-L422 PolarHBondContact O-N 3.08Å |
| 418 | L | 95.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.07 | C | C | . | . | I | π-helix | trans | -81.2 | -34.6 | -176.6 | -73.5 | 167.8 | 0 | 0 | 0 | 114 | Y120 I139 I140 H143 V276 H278 P279 S414 A415 L422 P423 | Y120-L418 HydrophobicContact CE2-CD2 4.44Å; Y120-L418 PolarHBondContact OH-O 3.41Å; I139-L418 HydrophobicContact CG2-CD1 4.25Å; I139-L418 HydrophobicContact CG2-CD2 3.92Å; I139-L418 HydrophobicContact CG2-CG 3.69Å; I140-L418 HydrophobicContact CG1-CD2 4.05Å; H143-L418 HydrophobicContact CB-CD1 3.56Å; V276-L418 HydrophobicContact CG1-CB 4.1Å; V276-L418 HydrophobicContact CG1-CD1 3.75Å; H278-L418 HydrophobicContact CB-CB 4.28Å; H278-L418 PolarHBondContact CD2-O 3.39Å; P279-L418 HydrophobicContact CG-CD1 3.83Å; P279-L418 HydrophobicContact CG-CD2 4.26Å; S414-L418 WeakPolarHBondContact O-CB 3.43Å; S414-L418 WeakPolarHBondContact O-CG 3.41Å; S414-L418 PolarHBondContact O-N 3.48Å; A415-L418 PolarHBondContact O-N 2.92Å; L418-L422 HydrophobicContact CD2-CD1 4.07Å; L418-P423 WeakPolarHBondContact O-CD 3.48Å; L418-P423 WeakPolarHBondContact O-CG 3.13Å |
| 419 | I | 95.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 10% | 0.103 | C | C | . | . | I | π-helix | trans | -83.8 | -41.7 | -178.6 | -60.9 | 168.7 | 0 | 0 | 0 | 110.8 | S104 A272 V276 A415 F449 | S104-I419 WeakPolarHBondContact CB-O 3.49Å; S104-I419 PolarHBondContact OG-O 3.25Å; A272-I419 HydrophobicContact CB-CD1 4.5Å; A272-I419 WeakPolarHBondContact O-CD1 3.23Å; V276-I419 HydrophobicContact CG2-CD1 3.77Å; V276-I419 HydrophobicContact CG2-CG1 4.09Å; A415-I419 HydrophobicContact CB-CD1 4.34Å; A415-I419 WeakPolarHBondContact O-CB 3.41Å; A415-I419 WeakPolarHBondContact O-CG1 3.22Å; A415-I419 PolarHBondContact O-N 3.44Å; I419-F449 HydrophobicContact CG2-CZ 4.36Å; I419-F449 WeakPolarHBondContact O-CE1 3.24Å; I419-F449 WeakPolarHBondContact O-CZ 3.4Å |
| 420 | F | 95.8 | Very high | 93.9 | Very high | 10 Ų | 10 | 19.5 Ų | 19.5 | 4% | 0.044 | 9% | 0.092 | C | C | . | . | I | π-helix | trans | -110.8 | -58.8 | -169.3 | -58.9 | -96.5 | 0 | 0 | 0 | 111.7 | L100 P416 S424 F449 L452 F456 | L100-F420 HydrophobicContact CB-CE1 4.22Å; L100-F420 HydrophobicContact CB-CZ 4.41Å; L100-F420 HydrophobicContact CD1-CE1 3.94Å; L100-F420 HydrophobicContact CD1-CZ 4.15Å; L100-F420 HydrophobicContact CG-CE1 4.46Å; P416-F420 WeakPolarHBondContact O-CA 3.44Å; P416-F420 WeakPolarHBondContact O-CB 3.47Å; P416-F420 PolarHBondContact O-N 3.04Å; F420-S424 VanDerWaalsContact O-CB 3.24Å; F420-S424 WeakPolarHBondContact O-CB 3.45Å; F420-S424 PolarHBondContact O-N 3.4Å; F420-S424 PolarHBondContact O-OG 3.04Å; F420-S424 VanDerWaalsContact O-OG 3.1Å; F420-F449 HydrophobicContact CB-CE1 4.43Å; F420-F449 HydrophobicContact CB-CZ 4.45Å; F420-F449 AromaticContact CD1-CD2 3.71Å; F420-F449 HydrophobicContact CD1-CD2 3.71Å; F420-F449 HydrophobicContact CD1-CE1 4.21Å; F420-F449 AromaticContact CD1-CE2 3.23Å; F420-F449 HydrophobicContact CD1-CE2 3.23Å; F420-F449 HydrophobicContact CD1-CG 4.35Å; F420-F449 AromaticContact CD1-CZ 3.51Å; F420-F449 HydrophobicContact CD1-CZ 3.51Å; F420-F449 HydrophobicContact CE1-CD2 4.16Å; F420-F449 AromaticContact CE1-CE2 3.46Å; F420-F449 HydrophobicContact CE1-CE2 3.46Å; F420-F449 VanDerWaalsContact CE1-CE2 3.46Å; F420-F449 AromaticContact CE1-CZ 3.95Å; F420-F449 HydrophobicContact CE1-CZ 3.95Å; F420-F449 HydrophobicContact CG-CE2 4.24Å; F420-F449 HydrophobicContact CG-CZ 4.09Å; F420-L452 HydrophobicContact CD1-CD2 4.43Å; F420-L452 HydrophobicContact CE1-CD2 4.08Å; F420-F456 HydrophobicContact CE2-CD1 4.23Å |
| 421 | I | 96.4 | Very high | 93.4 | Very high | 30 Ų | 30 | 19.3 Ų | 19.3 | 15% | 0.154 | 9% | 0.091 | C | C | . | . | I | π-helix | trans | -69.7 | -56.1 | -164.8 | -56.7 | 174.5 | 0 | 0 | 0 | 111.5 | P416 S424 V425 V454 M457 | P416-I421 PolarHBondContact O-N 3.47Å; P416-I421 VanDerWaalsContact O-N 3.11Å; I421-S424 PolarHBondContact O-N 3.43Å; I421-V425 HydrophobicContact CG2-CG2 4.21Å; I421-V425 VanDerWaalsContact O-CB 3.3Å; I421-V425 WeakPolarHBondContact O-CB 3.32Å; I421-V425 WeakPolarHBondContact O-CG2 3.35Å; I421-V425 PolarHBondContact O-N 3.5Å; I421-V454 HydrophobicContact CD1-CG2 3.93Å; I421-V454 HydrophobicContact CG1-CG2 4.13Å; I421-M457 HydrophobicContact CD1-CE 3.79Å; I421-M457 HydrophobicContact CD1-SD 4.15Å |
| 422 | L | 95.6 | Very high | 92.6 | Very high | 16 Ų | 16 | 22 Ų | 22 | 8% | 0.084 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -63.8 | -48.3 | -174.5 | -67.7 | 172.8 | 0 | 0 | 0 | 112.7 | Y120 V136 I139 S417 L418 S424 V425 F426 | Y120-L422 HydrophobicContact CE1-CB 4.2Å; Y120-L422 HydrophobicContact CE1-CD1 3.98Å; V136-L422 HydrophobicContact CG2-CD1 4.32Å; V136-L422 HydrophobicContact CG2-CD2 3.99Å; I139-L422 HydrophobicContact CB-CD1 4.47Å; I139-L422 HydrophobicContact CD1-CD1 3.9Å; I139-L422 HydrophobicContact CD1-CD2 4.33Å; I139-L422 HydrophobicContact CD1-CG 4.35Å; I139-L422 HydrophobicContact CG2-CD1 4.15Å; S417-L422 WeakPolarHBondContact O-CB 3.22Å; S417-L422 VanDerWaalsContact O-CG 3.29Å; S417-L422 WeakPolarHBondContact O-CG 3.44Å; S417-L422 PolarHBondContact O-N 3.08Å; L418-L422 HydrophobicContact CD2-CD1 4.07Å; L422-S424 PolarHBondContact O-N 3.46Å; L422-V425 PolarHBondContact O-N 3.03Å; L422-F426 HydrophobicContact CB-CE2 4.22Å; L422-F426 HydrophobicContact CB-CZ 4.27Å; L422-F426 HydrophobicContact CD2-CE1 4.26Å; L422-F426 HydrophobicContact CD2-CZ 4.07Å; L422-F426 VanDerWaalsContact O-CB 3.32Å; L422-F426 WeakPolarHBondContact O-CB 3.12Å; L422-F426 WeakPolarHBondContact O-CD2 3.36Å; L422-F426 WeakPolarHBondContact O-CG 3.07Å; L422-F426 PolarHBondContact O-N 3.45Å |
| 423 | P | 94.9 | Very high | 91.4 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -60.8 | -43 | 178.7 | -25.3 | 38.3 | 0 | 0 | 0 | 112.8 | S104 L107 L418 Y427 | S104-P423 VanDerWaalsContact OG-CG 3.22Å; S104-P423 WeakPolarHBondContact OG-CG 3.13Å; L107-P423 HydrophobicContact CB-CB 4.25Å; L418-P423 WeakPolarHBondContact O-CD 3.48Å; L418-P423 WeakPolarHBondContact O-CG 3.13Å; P423-Y427 WeakPolarHBondContact O-CB 3.25Å; P423-Y427 PolarHBondContact O-N 3.46Å |
| 424 | S | 94.6 | Very high | 89.7 | Confident | 1 Ų | 1 | 33.3 Ų | 33.3 | 1% | 0.007 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.8 | -51 | 174.9 | -79.2 | 0 | 0 | 0 | 0 | 112.8 | F420 I421 L422 F426 Y427 L428 A446 F449 G450 | F420-S424 VanDerWaalsContact O-CB 3.24Å; F420-S424 WeakPolarHBondContact O-CB 3.45Å; F420-S424 PolarHBondContact O-N 3.4Å; F420-S424 PolarHBondContact O-OG 3.04Å; F420-S424 VanDerWaalsContact O-OG 3.1Å; I421-S424 PolarHBondContact O-N 3.43Å; L422-S424 PolarHBondContact O-N 3.46Å; S424-F426 VanDerWaalsContact C-N 3.33Å; S424-F426 PolarHBondContact O-N 3.14Å; S424-Y427 PolarHBondContact O-N 3.47Å; S424-L428 WeakPolarHBondContact O-CG 3.3Å; S424-L428 PolarHBondContact O-N 3.33Å; S424-A446 WeakPolarHBondContact CB-O 3.23Å; S424-A446 PolarHBondContact OG-O 2.83Å; S424-F449 VanDerWaalsContact OG-CD1 3.23Å; S424-F449 WeakPolarHBondContact OG-CD1 3.41Å; S424-G450 PolarHBondContact OG-N 3.45Å; S424-G450 VanDerWaalsContact OG-N 3.08Å |
| 425 | V | 94.1 | Very high | 88.3 | Confident | 47 Ų | 47 | 38.5 Ų | 38.5 | 29% | 0.285 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -67.7 | -38.2 | -175 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | F128 I421 L422 R429 | F128-V425 HydrophobicContact CE1-CG1 4.47Å; F128-V425 HydrophobicContact CE2-CG1 3.36Å; F128-V425 HydrophobicContact CZ-CG1 3.19Å; I421-V425 HydrophobicContact CG2-CG2 4.21Å; I421-V425 VanDerWaalsContact O-CB 3.3Å; I421-V425 WeakPolarHBondContact O-CB 3.32Å; I421-V425 WeakPolarHBondContact O-CG2 3.35Å; I421-V425 PolarHBondContact O-N 3.5Å; L422-V425 PolarHBondContact O-N 3.03Å; V425-R429 WeakPolarHBondContact O-CB 3.4Å; V425-R429 WeakPolarHBondContact O-CG 3.4Å; V425-R429 PolarHBondContact O-N 2.96Å; V425-R429 VanDerWaalsContact O-N 3.13Å |
| 426 | F | 93.9 | Very high | 87.2 | Confident | 1 Ų | 1 | 40.8 Ų | 40.8 | 0% | 0.004 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.9 | -45.6 | 172.7 | -67.2 | -13.4 | 0 | 0 | 0 | 111.7 | L108 Y120 L123 A127 F128 V136 L422 S424 L428 R429 I430 | L108-F426 HydrophobicContact CD1-CD2 4.49Å; Y120-F426 AromaticContact CD1-CE2 3.9Å; Y120-F426 HydrophobicContact CD1-CE2 3.9Å; Y120-F426 HydrophobicContact CE1-CD2 4.41Å; Y120-F426 AromaticContact CE1-CE2 3.47Å; Y120-F426 HydrophobicContact CE1-CE2 3.47Å; Y120-F426 VanDerWaalsContact CE1-CE2 3.47Å; Y120-F426 HydrophobicContact CE1-CZ 4.16Å; L123-F426 HydrophobicContact CB-CD2 4.4Å; L123-F426 HydrophobicContact CB-CE2 4.19Å; L123-F426 HydrophobicContact CD2-CB 4.41Å; L123-F426 HydrophobicContact CD2-CD2 3.44Å; L123-F426 VanDerWaalsContact CD2-CD2 3.44Å; L123-F426 HydrophobicContact CD2-CE2 3.92Å; L123-F426 HydrophobicContact CD2-CG 4.2Å; L123-F426 HydrophobicContact CG-CD2 3.84Å; L123-F426 HydrophobicContact CG-CE2 4.14Å; L123-F426 HydrophobicContact CG-CG 4.29Å; A127-F426 HydrophobicContact CB-CD1 3.87Å; A127-F426 HydrophobicContact CB-CE1 4.22Å; F128-F426 HydrophobicContact CE2-CD1 4.46Å; F128-F426 HydrophobicContact CE2-CE1 4.49Å; V136-F426 HydrophobicContact CG2-CE1 4.32Å; V136-F426 HydrophobicContact CG2-CZ 3.61Å; L422-F426 HydrophobicContact CB-CE2 4.22Å; L422-F426 HydrophobicContact CB-CZ 4.27Å; L422-F426 HydrophobicContact CD2-CE1 4.26Å; L422-F426 HydrophobicContact CD2-CZ 4.07Å; L422-F426 VanDerWaalsContact O-CB 3.32Å; L422-F426 WeakPolarHBondContact O-CB 3.12Å; L422-F426 WeakPolarHBondContact O-CD2 3.36Å; L422-F426 WeakPolarHBondContact O-CG 3.07Å; L422-F426 PolarHBondContact O-N 3.45Å; S424-F426 VanDerWaalsContact C-N 3.33Å; S424-F426 PolarHBondContact O-N 3.14Å; F426-L428 PolarHBondContact O-N 3.15Å; F426-R429 PolarHBondContact O-N 2.96Å; F426-I430 HydrophobicContact CB-CD1 4.1Å; F426-I430 WeakPolarHBondContact O-CB 3.46Å; F426-I430 VanDerWaalsContact O-CG1 3.32Å; F426-I430 WeakPolarHBondContact O-CG1 3.29Å; F426-I430 PolarHBondContact O-N 3.28Å |
| 427 | Y | 91.9 | Very high | 86.1 | Confident | 11 Ų | 11 | 44.7 Ų | 44.7 | 4% | 0.043 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58 | -48.4 | 178.4 | -169.7 | -90.3 | 0 | 0 | 0 | 111.8 | L107 T110 C111 P423 S424 R429 V431 E436 P442 K443 A446 | L107-Y427 HydrophobicContact CB-CD2 4.29Å; L107-Y427 HydrophobicContact CD2-CD1 4.29Å; L107-Y427 HydrophobicContact CD2-CD2 3.51Å; L107-Y427 HydrophobicContact CD2-CE2 3.79Å; L107-Y427 HydrophobicContact CD2-CG 3.77Å; L107-Y427 HydrophobicContact CG-CD2 4.49Å; T110-Y427 HydrophobicContact CG2-CE2 3.93Å; C111-Y427 WeakPolarHBondContact SG-CA 3.43Å; C111-Y427 PolarHBondContact SG-N 3.15Å; C111-Y427 VanDerWaalsContact SG-N 3.42Å; P423-Y427 WeakPolarHBondContact O-CB 3.25Å; P423-Y427 PolarHBondContact O-N 3.46Å; S424-Y427 PolarHBondContact O-N 3.47Å; Y427-R429 VanDerWaalsContact C-N 3.29Å; Y427-R429 PolarHBondContact O-N 3.4Å; Y427-V431 HydrophobicContact CD1-CG2 4.47Å; Y427-V431 HydrophobicContact CD2-CG2 3.77Å; Y427-V431 HydrophobicContact CE1-CG2 4.47Å; Y427-V431 HydrophobicContact CE2-CG2 3.8Å; Y427-V431 HydrophobicContact CG-CG2 4.13Å; Y427-V431 VanDerWaalsContact O-CB 3.31Å; Y427-V431 WeakPolarHBondContact O-CB 3.44Å; Y427-V431 WeakPolarHBondContact O-CG2 3.15Å; Y427-V431 PolarHBondContact O-N 2.91Å; Y427-V431 VanDerWaalsContact O-N 3.14Å; Y427-E436 PolarHBondContact OH-OE1 3.39Å; Y427-E436 PolarHBondContact OH-OE2 3.08Å; Y427-P442 HydrophobicContact CE1-CB 4.45Å; Y427-K443 HydrophobicContact CE1-CG 4.1Å; Y427-A446 HydrophobicContact CD1-CB 3.82Å; Y427-A446 HydrophobicContact CG-CB 4.4Å |
| 428 | L | 90.8 | Very high | 84.7 | Confident | 48 Ų | 48 | 49.8 Ų | 49.8 | 25% | 0.251 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.4 | -32.1 | -179.9 | -69.5 | 172.5 | 0 | 0 | 0 | 113.7 | S424 F426 K443 A446 L447 | S424-L428 WeakPolarHBondContact O-CG 3.3Å; S424-L428 PolarHBondContact O-N 3.33Å; F426-L428 PolarHBondContact O-N 3.15Å; L428-K443 HydrophobicContact CD2-CB 3.95Å; L428-K443 HydrophobicContact CD2-CG 4.15Å; L428-K443 WeakPolarHBondContact CD2-O 3.27Å; L428-A446 HydrophobicContact CD2-CB 4.28Å; L428-A446 HydrophobicContact CG-CB 4.3Å; L428-L447 HydrophobicContact CD1-CB 4.17Å; L428-L447 HydrophobicContact CD1-CD1 4.08Å |
| 429 | R | 89.7 | Confident | 83.7 | Confident | 184 Ų | 184 | 57.1 Ų | 57.1 | 69% | 0.694 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -92.4 | -34.9 | -176.9 | -74.5 | -66.1 | -170.6 | 172.8 | 0.5 | 114.3 | A127 F128 V425 F426 Y427 | A127-R429 HydrophobicContact CB-CB 4.43Å; F128-R429 HydrophobicContact CE1-CG 4.21Å; F128-R429 HydrophobicContact CZ-CG 3.85Å; V425-R429 WeakPolarHBondContact O-CB 3.4Å; V425-R429 WeakPolarHBondContact O-CG 3.4Å; V425-R429 PolarHBondContact O-N 2.96Å; V425-R429 VanDerWaalsContact O-N 3.13Å; F426-R429 PolarHBondContact O-N 2.96Å; Y427-R429 VanDerWaalsContact C-N 3.29Å; Y427-R429 PolarHBondContact O-N 3.4Å |
| 430 | I | 88.3 | Confident | 83 | Confident | 15 Ų | 15 | 58 Ų | 58 | 8% | 0.077 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -90 | -39.9 | -172 | -66.5 | 179.9 | 0 | 0 | 0 | 111.2 | C111 V115 L123 A127 F426 P432 | C111-I430 HydrophobicContact CB-CD1 4.38Å; V115-I430 HydrophobicContact CG2-CG2 3.15Å; L123-I430 HydrophobicContact CD1-CD1 3.36Å; L123-I430 HydrophobicContact CG-CD1 3.62Å; A127-I430 HydrophobicContact CB-CD1 4.19Å; A127-I430 HydrophobicContact CB-CG1 4.13Å; F426-I430 HydrophobicContact CB-CD1 4.1Å; F426-I430 WeakPolarHBondContact O-CB 3.46Å; F426-I430 VanDerWaalsContact O-CG1 3.32Å; F426-I430 WeakPolarHBondContact O-CG1 3.29Å; F426-I430 PolarHBondContact O-N 3.28Å; I430-P432 VanDerWaalsContact O-CD 3.23Å; I430-P432 WeakPolarHBondContact O-CD 3.41Å |
| 431 | V | 84.1 | Confident | 82.5 | Confident | 7 Ų | 7 | 66.2 Ų | 66.2 | 4% | 0.042 | 34% | 0.336 | C | S | . | . | S | Bend | trans | -74.1 | 112.6 | -177.9 | -178.6 | 0 | 0 | 0 | 0 | 109 | Y427 E436 K443 | Y427-V431 HydrophobicContact CD1-CG2 4.47Å; Y427-V431 HydrophobicContact CD2-CG2 3.77Å; Y427-V431 HydrophobicContact CE1-CG2 4.47Å; Y427-V431 HydrophobicContact CE2-CG2 3.8Å; Y427-V431 HydrophobicContact CG-CG2 4.13Å; Y427-V431 VanDerWaalsContact O-CB 3.31Å; Y427-V431 WeakPolarHBondContact O-CB 3.44Å; Y427-V431 WeakPolarHBondContact O-CG2 3.15Å; Y427-V431 PolarHBondContact O-N 2.91Å; Y427-V431 VanDerWaalsContact O-N 3.14Å; V431-E436 HydrophobicContact CG1-CG 4.46Å; V431-K443 PolarHBondContact O-NZ 2.98Å |
| 432 | P | 75.2 | Confident | 82 | Confident | 55 Ų | 55 | 66.8 Ų | 66.8 | 36% | 0.357 | 34% | 0.341 | S | S | . | . | trans | -59.1 | 141 | -172.7 | -21.7 | 32.2 | 0 | 0 | 0 | 111.8 | I430 E434 V435 E436 | I430-P432 VanDerWaalsContact O-CD 3.23Å; I430-P432 WeakPolarHBondContact O-CD 3.41Å; P432-E434 PolarHBondContact O-N 3.06Å; P432-V435 HydrophobicContact CB-CG2 4.33Å; P432-V435 HydrophobicContact CG-CG2 4.41Å; P432-V435 PolarHBondContact O-N 3.2Å; P432-V435 VanDerWaalsContact O-N 3.11Å; P432-E436 PolarHBondContact O-N 3.45Å; P432-E436 VanDerWaalsContact O-N 3.16Å | ||
| 433 | S | 66.5 | Low | 81.5 | Confident | 64 Ų | 64 | 66.1 Ų | 66.1 | 45% | 0.448 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.1 | -16.9 | 175.6 | -60.9 | 0 | 0 | 0 | 0 | 113.7 | E436 L438 K443 | S433-E436 CarbonylContact C-O 3.58Å; S433-E436 VanDerWaalsContact CA-O 3.27Å; S433-E436 WeakPolarHBondContact CA-O 3.31Å; S433-E436 CarbonylContact O-C 3.21Å; S433-L438 WeakPolarHBondContact OG-CD2 3.41Å; S433-K443 PolarHBondContact OG-NZ 2.96Å |
| 434 | E | 59.8 | Low | 81.2 | Confident | 194 Ų | 194 | 69.1 Ų | 69.1 | 91% | 0.907 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72 | -29.1 | 174.3 | -63.2 | 172.6 | -170.7 | 0 | 0 | 112.6 | P432 | P432-E434 PolarHBondContact O-N 3.06Š|
| 435 | V | 65.7 | Low | 81 | Confident | 110 Ų | 110 | 72.7 Ų | 72.7 | 67% | 0.667 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.7 | -39.6 | 176.8 | -177.5 | 0 | 0 | 0 | 0 | 110.5 | P432 | P432-V435 HydrophobicContact CB-CG2 4.33Å; P432-V435 HydrophobicContact CG-CG2 4.41Å; P432-V435 PolarHBondContact O-N 3.2Å; P432-V435 VanDerWaalsContact O-N 3.11Å |
| 436 | E | 71.4 | Confident | 80.9 | Confident | 48 Ų | 48 | 70.5 Ų | 70.5 | 22% | 0.224 | 36% | 0.356 | C | S | . | . | S | Bend | trans | -135.8 | 114 | 175.2 | -67.2 | -170.4 | 171.2 | 0 | 0 | 110.8 | Y427 V431 P432 S433 K443 | Y427-E436 PolarHBondContact OH-OE1 3.39Å; Y427-E436 PolarHBondContact OH-OE2 3.08Å; V431-E436 HydrophobicContact CG1-CG 4.46Å; P432-E436 PolarHBondContact O-N 3.45Å; P432-E436 VanDerWaalsContact O-N 3.16Å; S433-E436 CarbonylContact C-O 3.58Å; S433-E436 VanDerWaalsContact CA-O 3.27Å; S433-E436 WeakPolarHBondContact CA-O 3.31Å; S433-E436 CarbonylContact O-C 3.21Å; E436-K443 WeakPolarHBondContact O-CE 3.39Å; E436-K443 PolarHBondContact O-NZ 3.14Å |
| 437 | P | 71.8 | Confident | 80.8 | Confident | 83 Ų | 83 | 74.8 Ų | 74.8 | 54% | 0.539 | 38% | 0.379 | S | S | . | . | trans | -60.9 | 152.2 | -179.1 | 23.7 | -31.9 | 0 | 0 | 0 | 111.2 | L439 S440 | P437-L439 PolarHBondContact O-N 3.39Å; P437-L439 VanDerWaalsContact O-N 3.1Å; P437-S440 WeakPolarHBondContact O-CB 3.41Å; P437-S440 PolarHBondContact O-N 3.35Å; P437-S440 PolarHBondContact O-OG 2.99Å | ||
| 438 | L | 66.8 | Low | 80.9 | Confident | 122 Ų | 122 | 77.8 Ų | 77.8 | 64% | 0.639 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | -25.6 | -175.4 | -69.8 | 172 | 0 | 0 | 0 | 114.1 | S433 S440 K443 | S433-L438 WeakPolarHBondContact OG-CD2 3.41Å; L438-S440 VanDerWaalsContact C-N 3.32Å; L438-K443 HydrophobicContact CD2-CD 4.18Å |
| 439 | L | 74.3 | Confident | 81.1 | Confident | 153 Ų | 153 | 76 Ų | 76 | 80% | 0.801 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.4 | 11.1 | 176 | -152.5 | 70.8 | 0 | 0 | 0 | 112.9 | P437 | P437-L439 PolarHBondContact O-N 3.39Å; P437-L439 VanDerWaalsContact O-N 3.1Å |
| 440 | S | 81.9 | Confident | 81.4 | Confident | 20 Ų | 20 | 67.8 Ų | 67.8 | 14% | 0.14 | 36% | 0.363 | C | S | . | . | S | Bend | trans | -67.6 | 146.2 | 175.9 | 74.7 | 0 | 0 | 0 | 0 | 110.6 | P437 L438 P442 K443 I444 | P437-S440 WeakPolarHBondContact O-CB 3.41Å; P437-S440 PolarHBondContact O-N 3.35Å; P437-S440 PolarHBondContact O-OG 2.99Å; L438-S440 VanDerWaalsContact C-N 3.32Å; S440-P442 VanDerWaalsContact C-CD 3.46Å; S440-P442 VanDerWaalsContact C-N 3.33Å; S440-K443 PolarHBondContact O-N 3.31Å; S440-K443 VanDerWaalsContact O-N 3.12Å; S440-K443 PolarHBondContact OG-N 2.88Å; S440-I444 WeakPolarHBondContact O-CG1 3.37Å; S440-I444 PolarHBondContact O-N 3.38Å |
| 441 | W | 85.1 | Confident | 81.7 | Confident | 181 Ų | 181 | 71.3 Ų | 71.3 | 69% | 0.686 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -52.7 | -42.5 | 177.1 | -173.4 | -103.4 | 0 | 0 | 0 | 113.4 | K443 I444 Q445 | W441-K443 PolarHBondContact O-N 3.36Å; W441-I444 PolarHBondContact O-N 3.26Å; W441-Q445 VanDerWaalsContact NE1-CD 3.32Å; W441-Q445 WeakPolarHBondContact O-CG 3.39Å; W441-Q445 PolarHBondContact O-N 2.96Å |
| 442 | P | 84.8 | Confident | 82.2 | Confident | 42 Ų | 42 | 74.9 Ų | 74.9 | 27% | 0.273 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.6 | -38.6 | 176.3 | -24.6 | 35.2 | 0 | 0 | 0 | 114.2 | Y427 S440 Q445 A446 | Y427-P442 HydrophobicContact CE1-CB 4.45Å; S440-P442 VanDerWaalsContact C-CD 3.46Å; S440-P442 VanDerWaalsContact C-N 3.33Å; P442-Q445 PolarHBondContact O-N 2.94Å; P442-A446 WeakPolarHBondContact O-CB 2.95Å; P442-A446 PolarHBondContact O-N 3.11Å |
| 443 | K | 85.8 | Confident | 83.1 | Confident | 2 Ų | 2 | 72.2 Ų | 72.2 | 1% | 0.009 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -72.2 | -36.6 | 178.1 | -75.6 | -171.2 | 170.1 | 174.7 | 0 | 112 | Y427 L428 V431 S433 E436 L438 S440 W441 A446 L447 | Y427-K443 HydrophobicContact CE1-CG 4.1Å; L428-K443 HydrophobicContact CD2-CB 3.95Å; L428-K443 HydrophobicContact CD2-CG 4.15Å; L428-K443 WeakPolarHBondContact CD2-O 3.27Å; V431-K443 PolarHBondContact O-NZ 2.98Å; S433-K443 PolarHBondContact OG-NZ 2.96Å; E436-K443 WeakPolarHBondContact O-CE 3.39Å; E436-K443 PolarHBondContact O-NZ 3.14Å; L438-K443 HydrophobicContact CD2-CD 4.18Å; S440-K443 PolarHBondContact O-N 3.31Å; S440-K443 VanDerWaalsContact O-N 3.12Å; S440-K443 PolarHBondContact OG-N 2.88Å; W441-K443 PolarHBondContact O-N 3.36Å; K443-A446 PolarHBondContact O-N 3.29Å; K443-L447 WeakPolarHBondContact O-CB 3.49Å; K443-L447 PolarHBondContact O-N 2.92Å |
| 444 | I | 89.2 | Confident | 84.5 | Confident | 64 Ų | 64 | 72.7 Ų | 72.7 | 33% | 0.328 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 172.3 | -64.5 | 170.2 | 0 | 0 | 0 | 110.1 | S440 W441 A446 L447 C448 | S440-I444 WeakPolarHBondContact O-CG1 3.37Å; S440-I444 PolarHBondContact O-N 3.38Å; W441-I444 PolarHBondContact O-N 3.26Å; I444-A446 PolarHBondContact O-N 3.43Å; I444-L447 PolarHBondContact O-N 2.69Å; I444-C448 PolarHBondContact O-N 2.9Å; I444-C448 PolarHBondContact O-SG 3.19Å; I444-C448 VanDerWaalsContact O-SG 3.37Å |
| 445 | Q | 90.7 | Very high | 86.2 | Confident | 76 Ų | 76 | 67.9 Ų | 67.9 | 36% | 0.355 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.4 | -46.8 | 175.3 | -72.8 | -179.8 | -36.9 | 0 | 0 | 111.9 | Y103 W441 P442 L447 C448 F449 | Y103-Q445 WeakPolarHBondContact OH-CB 3.32Å; W441-Q445 VanDerWaalsContact NE1-CD 3.32Å; W441-Q445 WeakPolarHBondContact O-CG 3.39Å; W441-Q445 PolarHBondContact O-N 2.96Å; P442-Q445 PolarHBondContact O-N 2.94Å; Q445-L447 VanDerWaalsContact C-N 3.31Å; Q445-L447 PolarHBondContact O-N 3.23Å; Q445-C448 PolarHBondContact O-N 2.96Å; Q445-F449 WeakPolarHBondContact O-CB 3.49Å; Q445-F449 PolarHBondContact O-N 2.93Å |
| 446 | A | 90.8 | Very high | 87.5 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.1 | -39.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | L107 S424 Y427 L428 P442 K443 I444 F449 G450 | L107-A446 HydrophobicContact CD1-CB 4.47Å; S424-A446 WeakPolarHBondContact CB-O 3.23Å; S424-A446 PolarHBondContact OG-O 2.83Å; Y427-A446 HydrophobicContact CD1-CB 3.82Å; Y427-A446 HydrophobicContact CG-CB 4.4Å; L428-A446 HydrophobicContact CD2-CB 4.28Å; L428-A446 HydrophobicContact CG-CB 4.3Å; P442-A446 WeakPolarHBondContact O-CB 2.95Å; P442-A446 PolarHBondContact O-N 3.11Å; K443-A446 PolarHBondContact O-N 3.29Å; I444-A446 PolarHBondContact O-N 3.43Å; A446-F449 PolarHBondContact O-N 3.38Å; A446-G450 PolarHBondContact O-N 3.37Å |
| 447 | L | 93.3 | Very high | 88.5 | Confident | 92 Ų | 92 | 64.2 Ų | 64.2 | 48% | 0.482 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.3 | -50 | 176.1 | -179.7 | 62.5 | 0 | 0 | 0 | 111.9 | L428 K443 I444 Q445 F449 G450 I451 | L428-L447 HydrophobicContact CD1-CB 4.17Å; L428-L447 HydrophobicContact CD1-CD1 4.08Å; K443-L447 WeakPolarHBondContact O-CB 3.49Å; K443-L447 PolarHBondContact O-N 2.92Å; I444-L447 PolarHBondContact O-N 2.69Å; Q445-L447 VanDerWaalsContact C-N 3.31Å; Q445-L447 PolarHBondContact O-N 3.23Å; L447-F449 VanDerWaalsContact C-N 3.26Å; L447-F449 PolarHBondContact O-N 3.1Å; L447-G450 PolarHBondContact O-N 2.84Å; L447-G450 VanDerWaalsContact O-N 3.14Å; L447-I451 HydrophobicContact CD1-CD1 4.23Å; L447-I451 HydrophobicContact CD1-CG1 4.48Å; L447-I451 HydrophobicContact CG-CD1 4.03Å; L447-I451 WeakPolarHBondContact O-CG1 3.48Å; L447-I451 PolarHBondContact O-N 3.21Å |
| 448 | C | 93.6 | Very high | 89.6 | Confident | 74 Ų | 74 | 63.1 Ų | 63.1 | 50% | 0.5 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -57.9 | -40.9 | 175.6 | -70.3 | 0 | 0 | 0 | 0 | 111.5 | I444 Q445 G450 I451 L452 | I444-C448 PolarHBondContact O-N 2.9Å; I444-C448 PolarHBondContact O-SG 3.19Å; I444-C448 VanDerWaalsContact O-SG 3.37Å; Q445-C448 PolarHBondContact O-N 2.96Å; C448-G450 VanDerWaalsContact C-N 3.35Å; C448-G450 PolarHBondContact O-N 2.96Å; C448-I451 PolarHBondContact O-N 3.1Å; C448-L452 WeakPolarHBondContact O-CB 3.45Å; C448-L452 PolarHBondContact O-N 3.44Å |
| 449 | F | 94.5 | Very high | 90.8 | Very high | 11 Ų | 11 | 61.8 Ų | 61.8 | 5% | 0.048 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.7 | -40.2 | 177.1 | -170.6 | -120 | 0 | 0 | 0 | 112 | L100 Y103 L107 I419 F420 S424 Q445 A446 L447 G453 | L100-F449 HydrophobicContact CB-CE2 3.96Å; L100-F449 HydrophobicContact CB-CZ 4.43Å; L100-F449 HydrophobicContact CD2-CD2 4.04Å; L100-F449 HydrophobicContact CD2-CE2 3.6Å; L100-F449 HydrophobicContact CG-CE2 4.3Å; Y103-F449 HydrophobicContact CD1-CD1 4.22Å; Y103-F449 HydrophobicContact CD1-CD2 4.28Å; Y103-F449 HydrophobicContact CD1-CE1 4.25Å; Y103-F449 HydrophobicContact CD1-CE2 4.29Å; Y103-F449 HydrophobicContact CD1-CG 4.27Å; Y103-F449 HydrophobicContact CD1-CZ 4.3Å; Y103-F449 HydrophobicContact CE1-CB 4.37Å; Y103-F449 HydrophobicContact CE1-CD1 4.13Å; Y103-F449 HydrophobicContact CE1-CD2 4.45Å; Y103-F449 HydrophobicContact CE1-CG 4.08Å; L107-F449 HydrophobicContact CD1-CD1 4Å; L107-F449 HydrophobicContact CD1-CE1 4.38Å; I419-F449 HydrophobicContact CG2-CZ 4.36Å; I419-F449 WeakPolarHBondContact O-CE1 3.24Å; I419-F449 WeakPolarHBondContact O-CZ 3.4Å; F420-F449 HydrophobicContact CB-CE1 4.43Å; F420-F449 HydrophobicContact CB-CZ 4.45Å; F420-F449 AromaticContact CD1-CD2 3.71Å; F420-F449 HydrophobicContact CD1-CD2 3.71Å; F420-F449 HydrophobicContact CD1-CE1 4.21Å; F420-F449 AromaticContact CD1-CE2 3.23Å; F420-F449 HydrophobicContact CD1-CE2 3.23Å; F420-F449 HydrophobicContact CD1-CG 4.35Å; F420-F449 AromaticContact CD1-CZ 3.51Å; F420-F449 HydrophobicContact CD1-CZ 3.51Å; F420-F449 HydrophobicContact CE1-CD2 4.16Å; F420-F449 AromaticContact CE1-CE2 3.46Å; F420-F449 HydrophobicContact CE1-CE2 3.46Å; F420-F449 VanDerWaalsContact CE1-CE2 3.46Å; F420-F449 AromaticContact CE1-CZ 3.95Å; F420-F449 HydrophobicContact CE1-CZ 3.95Å; F420-F449 HydrophobicContact CG-CE2 4.24Å; F420-F449 HydrophobicContact CG-CZ 4.09Å; S424-F449 VanDerWaalsContact OG-CD1 3.23Å; S424-F449 WeakPolarHBondContact OG-CD1 3.41Å; Q445-F449 WeakPolarHBondContact O-CB 3.49Å; Q445-F449 PolarHBondContact O-N 2.93Å; A446-F449 PolarHBondContact O-N 3.38Å; L447-F449 VanDerWaalsContact C-N 3.26Å; L447-F449 PolarHBondContact O-N 3.1Å; F449-G453 PolarHBondContact O-N 2.96Å; F449-G453 VanDerWaalsContact O-N 3.12Å |
| 450 | G | 95 | Very high | 91.6 | Very high | 10 Ų | 10 | 55 Ų | 55 | 10% | 0.103 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.4 | -42.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | S424 A446 L447 C448 G453 V454 | S424-G450 PolarHBondContact OG-N 3.45Å; S424-G450 VanDerWaalsContact OG-N 3.08Å; A446-G450 PolarHBondContact O-N 3.37Å; L447-G450 PolarHBondContact O-N 2.84Å; L447-G450 VanDerWaalsContact O-N 3.14Å; C448-G450 VanDerWaalsContact C-N 3.35Å; C448-G450 PolarHBondContact O-N 2.96Å; G450-G453 PolarHBondContact O-N 2.69Å; G450-V454 PolarHBondContact O-N 3.15Å |
| 451 | I | 95.6 | Very high | 92 | Very high | 89 Ų | 89 | 55.7 Ų | 55.7 | 46% | 0.456 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 176.1 | -67.3 | 167.6 | 0 | 0 | 0 | 110.4 | L447 C448 G453 V454 L455 | L447-I451 HydrophobicContact CD1-CD1 4.23Å; L447-I451 HydrophobicContact CD1-CG1 4.48Å; L447-I451 HydrophobicContact CG-CD1 4.03Å; L447-I451 WeakPolarHBondContact O-CG1 3.48Å; L447-I451 PolarHBondContact O-N 3.21Å; C448-I451 PolarHBondContact O-N 3.1Å; I451-G453 PolarHBondContact O-N 2.87Å; I451-V454 PolarHBondContact O-N 3.19Å; I451-V454 VanDerWaalsContact O-N 3.15Å; I451-L455 HydrophobicContact CG2-CD1 4.02Å; I451-L455 HydrophobicContact CG2-CG 4.34Å; I451-L455 WeakPolarHBondContact O-CG 3.28Å; I451-L455 PolarHBondContact O-N 2.77Å |
| 452 | L | 94.6 | Very high | 92.2 | Very high | 82 Ų | 82 | 49 Ų | 49 | 43% | 0.429 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -56.1 | -41.9 | 174.4 | -179.8 | 65.7 | 0 | 0 | 0 | 111.3 | F420 C448 L455 F456 | F420-L452 HydrophobicContact CD1-CD2 4.43Å; F420-L452 HydrophobicContact CE1-CD2 4.08Å; C448-L452 WeakPolarHBondContact O-CB 3.45Å; C448-L452 PolarHBondContact O-N 3.44Å; L452-L455 PolarHBondContact O-N 3.4Å; L452-F456 VanDerWaalsContact O-CB 3.29Å; L452-F456 WeakPolarHBondContact O-CB 3.22Å; L452-F456 PolarHBondContact O-N 3.04Å |
| 453 | G | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.6 | -44.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | F449 G450 I451 F456 M457 | F449-G453 PolarHBondContact O-N 2.96Å; F449-G453 VanDerWaalsContact O-N 3.12Å; G450-G453 PolarHBondContact O-N 2.69Å; I451-G453 PolarHBondContact O-N 2.87Å; G453-F456 PolarHBondContact O-N 2.63Å; G453-M457 WeakPolarHBondContact O-CB 3.2Å; G453-M457 PolarHBondContact O-N 3.22Å |
| 454 | V | 95.8 | Very high | 92.2 | Very high | 73 Ų | 73 | 52.6 Ų | 52.6 | 44% | 0.442 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 177.3 | 174.5 | 0 | 0 | 0 | 0 | 111 | I421 G450 I451 M457 A458 | I421-V454 HydrophobicContact CD1-CG2 3.93Å; I421-V454 HydrophobicContact CG1-CG2 4.13Å; G450-V454 PolarHBondContact O-N 3.15Å; I451-V454 PolarHBondContact O-N 3.19Å; I451-V454 VanDerWaalsContact O-N 3.15Å; V454-M457 PolarHBondContact O-N 3.33Å; V454-A458 WeakPolarHBondContact O-CB 3.17Å; V454-A458 PolarHBondContact O-N 3.46Å |
| 455 | L | 94.6 | Very high | 92.1 | Very high | 94 Ų | 94 | 54.9 Ų | 54.9 | 49% | 0.492 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -62.4 | -46.8 | 175.6 | -70 | 173.7 | 0 | 0 | 0 | 111.1 | I451 L452 M457 A458 I459 | I451-L455 HydrophobicContact CG2-CD1 4.02Å; I451-L455 HydrophobicContact CG2-CG 4.34Å; I451-L455 WeakPolarHBondContact O-CG 3.28Å; I451-L455 PolarHBondContact O-N 2.77Å; L452-L455 PolarHBondContact O-N 3.4Å; L455-M457 PolarHBondContact O-N 3.03Å; L455-A458 PolarHBondContact O-N 2.87Å; L455-I459 HydrophobicContact CB-CD1 4.48Å; L455-I459 VanDerWaalsContact O-CB 3.29Å; L455-I459 WeakPolarHBondContact O-CB 3.35Å; L455-I459 WeakPolarHBondContact O-CD1 3.09Å; L455-I459 WeakPolarHBondContact O-CG1 3.24Å; L455-I459 PolarHBondContact O-N 2.51Å |
| 456 | F | 93 | Very high | 91.9 | Very high | 30 Ų | 30 | 53.4 Ų | 53.4 | 13% | 0.132 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -57.8 | -48.3 | 176.7 | 175 | -132.7 | 0 | 0 | 0 | 111.3 | V268 A272 P416 F420 L452 G453 I459 S460 | V268-F456 HydrophobicContact CB-CE2 3.91Å; V268-F456 HydrophobicContact CB-CZ 4.4Å; V268-F456 HydrophobicContact CG1-CD2 4.17Å; V268-F456 HydrophobicContact CG1-CE2 3.32Å; V268-F456 HydrophobicContact CG1-CZ 3.71Å; A272-F456 HydrophobicContact CB-CE1 3.77Å; A272-F456 HydrophobicContact CB-CZ 3.87Å; P416-F456 HydrophobicContact CB-CD1 3.64Å; P416-F456 HydrophobicContact CB-CE1 4.08Å; P416-F456 HydrophobicContact CG-CD1 3.7Å; P416-F456 HydrophobicContact CG-CE1 3.72Å; F420-F456 HydrophobicContact CE2-CD1 4.23Å; L452-F456 VanDerWaalsContact O-CB 3.29Å; L452-F456 WeakPolarHBondContact O-CB 3.22Å; L452-F456 PolarHBondContact O-N 3.04Å; G453-F456 PolarHBondContact O-N 2.63Å; F456-I459 PolarHBondContact O-N 2.79Å; F456-S460 WeakPolarHBondContact CD2-OG 3.46Å; F456-S460 WeakPolarHBondContact CE2-OG 3.3Å; F456-S460 VanDerWaalsContact O-CB 3.31Å; F456-S460 WeakPolarHBondContact O-CB 3.26Å; F456-S460 PolarHBondContact O-N 2.96Å; F456-S460 PolarHBondContact O-OG 3.43Å |
| 457 | M | 94.5 | Very high | 91.4 | Very high | 51 Ų | 51 | 54.1 Ų | 54.1 | 25% | 0.251 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.9 | -48.2 | 176.6 | -177.3 | 170.6 | 69 | 0 | 0 | 112.3 | S412 P416 I421 G453 V454 L455 L461 | S412-M457 WeakPolarHBondContact O-CG 3.02Å; P416-M457 HydrophobicContact CB-CB 3.96Å; P416-M457 HydrophobicContact CG-CB 4.01Å; P416-M457 HydrophobicContact CG-CG 4.45Å; I421-M457 HydrophobicContact CD1-CE 3.79Å; I421-M457 HydrophobicContact CD1-SD 4.15Å; G453-M457 WeakPolarHBondContact O-CB 3.2Å; G453-M457 PolarHBondContact O-N 3.22Å; V454-M457 PolarHBondContact O-N 3.33Å; L455-M457 PolarHBondContact O-N 3.03Å; M457-L461 HydrophobicContact CG-CD1 3.66Å; M457-L461 VanDerWaalsContact O-CB 3.23Å; M457-L461 WeakPolarHBondContact O-CB 3.28Å; M457-L461 WeakPolarHBondContact O-CG 3.38Å; M457-L461 PolarHBondContact O-N 3.32Å |
| 458 | A | 93.6 | Very high | 90.8 | Very high | 59 Ų | 59 | 54.3 Ų | 54.3 | 49% | 0.488 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.5 | -43.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V454 L455 G462 | V454-A458 WeakPolarHBondContact O-CB 3.17Å; V454-A458 PolarHBondContact O-N 3.46Å; L455-A458 PolarHBondContact O-N 2.87Å; A458-G462 PolarHBondContact O-N 3.42Å |
| 459 | I | 91.7 | Very high | 90.4 | Very high | 94 Ų | 94 | 55 Ų | 55 | 48% | 0.482 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.9 | -51.2 | 179.3 | -68.5 | 167.9 | 0 | 0 | 0 | 110.1 | L455 F456 G462 F463 | L455-I459 HydrophobicContact CB-CD1 4.48Å; L455-I459 VanDerWaalsContact O-CB 3.29Å; L455-I459 WeakPolarHBondContact O-CB 3.35Å; L455-I459 WeakPolarHBondContact O-CD1 3.09Å; L455-I459 WeakPolarHBondContact O-CG1 3.24Å; L455-I459 PolarHBondContact O-N 2.51Å; F456-I459 PolarHBondContact O-N 2.79Å; I459-G462 PolarHBondContact O-N 3.37Å; I459-F463 HydrophobicContact CG2-CD2 3.63Å; I459-F463 HydrophobicContact CG2-CE2 3.54Å; I459-F463 WeakPolarHBondContact O-CD2 3.3Å; I459-F463 PolarHBondContact O-N 2.85Å |
| 460 | S | 90.8 | Very high | 89.7 | Confident | 10 Ų | 10 | 59 Ų | 59 | 7% | 0.07 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.9 | -40.8 | -177.7 | -68.2 | 0 | 0 | 0 | 0 | 112.8 | F456 M464 | F456-S460 WeakPolarHBondContact CD2-OG 3.46Å; F456-S460 WeakPolarHBondContact CE2-OG 3.3Å; F456-S460 VanDerWaalsContact O-CB 3.31Å; F456-S460 WeakPolarHBondContact O-CB 3.26Å; F456-S460 PolarHBondContact O-N 2.96Å; F456-S460 PolarHBondContact O-OG 3.43Å; S460-M464 WeakPolarHBondContact O-CB 3.32Å; S460-M464 PolarHBondContact O-N 3.37Å |
| 461 | L | 90.4 | Very high | 88.2 | Confident | 35 Ų | 35 | 60 Ų | 60 | 18% | 0.183 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -64.7 | -44.3 | 173.4 | -77.9 | 167.8 | 0 | 0 | 0 | 111.5 | T413 M457 F463 M464 F465 | T413-L461 HydrophobicContact CG2-CD1 4.08Å; T413-L461 HydrophobicContact CG2-CD2 3.45Å; T413-L461 VanDerWaalsContact CG2-CD2 3.45Å; T413-L461 HydrophobicContact CG2-CG 4.14Å; M457-L461 HydrophobicContact CG-CD1 3.66Å; M457-L461 VanDerWaalsContact O-CB 3.23Å; M457-L461 WeakPolarHBondContact O-CB 3.28Å; M457-L461 WeakPolarHBondContact O-CG 3.38Å; M457-L461 PolarHBondContact O-N 3.32Å; L461-F463 PolarHBondContact O-N 2.95Å; L461-M464 HydrophobicContact CD2-CE 3.39Å; L461-M464 HydrophobicContact CG-CE 4.47Å; L461-M464 PolarHBondContact O-N 3.28Å; L461-F465 HydrophobicContact CB-CD2 4.28Å; L461-F465 HydrophobicContact CB-CE2 4.2Å; L461-F465 HydrophobicContact CD2-CE2 3.89Å; L461-F465 WeakPolarHBondContact O-CD2 3.35Å; L461-F465 PolarHBondContact O-N 2.93Å |
| 462 | G | 89.5 | Confident | 86.3 | Confident | 41 Ų | 41 | 60 Ų | 60 | 42% | 0.423 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -56.8 | -48.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A458 I459 A466 | A458-G462 PolarHBondContact O-N 3.42Å; I459-G462 PolarHBondContact O-N 3.37Å; G462-A466 VanDerWaalsContact O-CB 3.3Å; G462-A466 WeakPolarHBondContact O-CB 3.43Å; G462-A466 PolarHBondContact O-N 3.39Å |
| 463 | F | 87.3 | Confident | 84.2 | Confident | 115 Ų | 115 | 57.9 Ų | 57.9 | 50% | 0.504 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 176.2 | -80.9 | -63.3 | 0 | 0 | 0 | 113 | I459 L461 A466 N467 | I459-F463 HydrophobicContact CG2-CD2 3.63Å; I459-F463 HydrophobicContact CG2-CE2 3.54Å; I459-F463 WeakPolarHBondContact O-CD2 3.3Å; I459-F463 PolarHBondContact O-N 2.85Å; L461-F463 PolarHBondContact O-N 2.95Å; F463-A466 PolarHBondContact O-N 3.38Å; F463-N467 WeakPolarHBondContact O-CB 3.13Å; F463-N467 VanDerWaalsContact O-CG 3.25Å; F463-N467 PolarHBondContact O-N 3.3Å |
| 464 | M | 84.8 | Confident | 81.6 | Confident | 5 Ų | 5 | 68.1 Ų | 68.1 | 3% | 0.025 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -64.9 | -44.8 | 179.6 | -177.2 | 173.7 | 49.1 | 0 | 0 | 111.9 | Y266 F409 S412 S460 L461 A466 N467 W468 | Y266-M464 HydrophobicContact CE1-CG 4.14Å; F409-M464 VanDerWaalsContact CA-SD 3.59Å; F409-M464 HydrophobicContact CB-CE 4.41Å; F409-M464 HydrophobicContact CB-SD 4.05Å; F409-M464 HydrophobicContact CD2-CE 3.85Å; F409-M464 HydrophobicContact CD2-SD 4.36Å; S412-M464 WeakPolarHBondContact OG-CE 3.43Å; S460-M464 WeakPolarHBondContact O-CB 3.32Å; S460-M464 PolarHBondContact O-N 3.37Å; L461-M464 HydrophobicContact CD2-CE 3.39Å; L461-M464 HydrophobicContact CG-CE 4.47Å; L461-M464 PolarHBondContact O-N 3.28Å; M464-A466 VanDerWaalsContact C-N 3.34Å; M464-N467 PolarHBondContact O-N 3.01Å; M464-W468 HydrophobicContact CG-CD2 4.32Å; M464-W468 HydrophobicContact CG-CH2 4.33Å; M464-W468 HydrophobicContact CG-CZ2 3.96Å; M464-W468 PolarHBondContact O-N 2.88Å; M464-W468 HydrophobicContact SD-CH2 4.16Å; M464-W468 HydrophobicContact SD-CZ2 3.98Å |
| 465 | F | 86.8 | Confident | 78.8 | Confident | 111 Ų | 111 | 72.4 Ų | 72.4 | 49% | 0.487 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.2 | -38 | 175 | -74.7 | -60.1 | 0 | 0 | 0 | 112 | L461 W468 A469 | L461-F465 HydrophobicContact CB-CD2 4.28Å; L461-F465 HydrophobicContact CB-CE2 4.2Å; L461-F465 HydrophobicContact CD2-CE2 3.89Å; L461-F465 WeakPolarHBondContact O-CD2 3.35Å; L461-F465 PolarHBondContact O-N 2.93Å; F465-W468 AromaticContact CD1-CE3 3.9Å; F465-W468 HydrophobicContact CD1-CE3 3.9Å; F465-W468 HydrophobicContact CD1-CZ3 4.16Å; F465-W468 HydrophobicContact CE1-CE3 4.11Å; F465-W468 AromaticContact CE1-CZ3 3.9Å; F465-W468 HydrophobicContact CE1-CZ3 3.9Å; F465-W468 PolarHBondContact O-N 3.27Å; F465-A469 WeakPolarHBondContact O-CB 3.04Å; F465-A469 PolarHBondContact O-N 3.01Å |
| 466 | A | 85.8 | Confident | 76 | Confident | 45 Ų | 45 | 71.5 Ų | 71.5 | 37% | 0.372 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.7 | -46.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | G462 F463 M464 W468 A469 T470 | G462-A466 VanDerWaalsContact O-CB 3.3Å; G462-A466 WeakPolarHBondContact O-CB 3.43Å; G462-A466 PolarHBondContact O-N 3.39Å; F463-A466 PolarHBondContact O-N 3.38Å; M464-A466 VanDerWaalsContact C-N 3.34Å; A466-W468 VanDerWaalsContact C-N 3.32Å; A466-W468 PolarHBondContact O-N 3.04Å; A466-A469 PolarHBondContact O-N 3.03Å; A466-T470 WeakPolarHBondContact O-CG2 3.45Å; A466-T470 PolarHBondContact O-N 3.12Å; A466-T470 PolarHBondContact O-OG1 3.42Å; A466-T470 VanDerWaalsContact O-OG1 3.07Å |
| 467 | N | 80.8 | Confident | 73.1 | Confident | 15 Ų | 15 | 73 Ų | 73 | 8% | 0.08 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -63 | -36.8 | 177.7 | -73.3 | -13.2 | 0 | 0 | 0 | 112.9 | S265 Y266 F463 M464 T470 G471 Q472 | S265-N467 PolarHBondContact OG-ND2 3.28Å; Y266-N467 WeakPolarHBondContact CE2-ND2 2.95Å; F463-N467 WeakPolarHBondContact O-CB 3.13Å; F463-N467 VanDerWaalsContact O-CG 3.25Å; F463-N467 PolarHBondContact O-N 3.3Å; M464-N467 PolarHBondContact O-N 3.01Å; N467-T470 PolarHBondContact O-OG1 3.14Å; N467-G471 PolarHBondContact O-N 2.84Å; N467-Q472 PolarHBondContact O-N 3.12Å |
| 468 | W | 80.9 | Confident | 69.8 | Low | 97 Ų | 97 | 82.5 Ų | 82.5 | 37% | 0.367 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -69.2 | -39.2 | 173.8 | -71.2 | -10.9 | 0 | 0 | 0 | 112.1 | F409 M464 F465 A466 G471 | F409-W468 HydrophobicContact CD2-CH2 4.06Å; M464-W468 HydrophobicContact CG-CD2 4.32Å; M464-W468 HydrophobicContact CG-CH2 4.33Å; M464-W468 HydrophobicContact CG-CZ2 3.96Å; M464-W468 PolarHBondContact O-N 2.88Å; M464-W468 HydrophobicContact SD-CH2 4.16Å; M464-W468 HydrophobicContact SD-CZ2 3.98Å; F465-W468 AromaticContact CD1-CE3 3.9Å; F465-W468 HydrophobicContact CD1-CE3 3.9Å; F465-W468 HydrophobicContact CD1-CZ3 4.16Å; F465-W468 HydrophobicContact CE1-CE3 4.11Å; F465-W468 AromaticContact CE1-CZ3 3.9Å; F465-W468 HydrophobicContact CE1-CZ3 3.9Å; F465-W468 PolarHBondContact O-N 3.27Å; A466-W468 VanDerWaalsContact C-N 3.32Å; A466-W468 PolarHBondContact O-N 3.04Å; W468-G471 PolarHBondContact O-N 3.47Å |
| 469 | A | 84.1 | Confident | 68.6 | Low | 89 Ų | 89 | 83.7 Ų | 83.7 | 74% | 0.736 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -70.2 | -36.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | F465 A466 G471 | F465-A469 WeakPolarHBondContact O-CB 3.04Å; F465-A469 PolarHBondContact O-N 3.01Å; A466-A469 PolarHBondContact O-N 3.03Å; A469-G471 VanDerWaalsContact C-N 3.28Å; A469-G471 PolarHBondContact O-N 2.03Å |
| 470 | T | 79.7 | Confident | 67.4 | Low | 94 Ų | 94 | 83.2 Ų | 83.2 | 58% | 0.577 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.3 | -7 | 178.4 | 58.2 | 0 | 0 | 0 | 0 | 113.5 | A466 N467 Q472 | A466-T470 WeakPolarHBondContact O-CG2 3.45Å; A466-T470 PolarHBondContact O-N 3.12Å; A466-T470 PolarHBondContact O-OG1 3.42Å; A466-T470 VanDerWaalsContact O-OG1 3.07Å; N467-T470 PolarHBondContact O-OG1 3.14Å; T470-Q472 PolarHBondContact O-N 3.13Å |
| 471 | G | 64.2 | Low | 66.1 | Low | 31 Ų | 31 | 87.2 Ų | 87.2 | 32% | 0.32 | 48% | 0.483 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.9 | 6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | N467 W468 A469 S473 R474 | N467-G471 PolarHBondContact O-N 2.84Å; W468-G471 PolarHBondContact O-N 3.47Å; A469-G471 VanDerWaalsContact C-N 3.28Å; A469-G471 PolarHBondContact O-N 2.03Å; G471-S473 PolarHBondContact O-N 3.1Å; G471-S473 VanDerWaalsContact O-N 3.15Å; G471-R474 PolarHBondContact O-N 3.29Å; G471-R474 VanDerWaalsContact O-N 3.09Å |
| 472 | Q | 56 | Low | 64.7 | Low | 90 Ų | 90 | 90.3 Ų | 90.3 | 42% | 0.421 | 50% | 0.501 | S | S | . | . | G | 310 helix | trans | -61.6 | -22.7 | 179 | -77.1 | -174.9 | -23.9 | 0 | 0 | 112.9 | N467 T470 R474 M475 | N467-Q472 PolarHBondContact O-N 3.12Å; T470-Q472 PolarHBondContact O-N 3.13Å; Q472-R474 VanDerWaalsContact C-N 3.25Å; Q472-R474 PolarHBondContact O-N 2.7Å; Q472-M475 PolarHBondContact O-N 3.05Å |
| 473 | S | 49.1 | Very low | 63.1 | Low | 37 Ų | 37 | 93.4 Ų | 93.4 | 26% | 0.259 | 51% | 0.505 | S | S | . | . | G | 310 helix | trans | -65.1 | -24.1 | 175.3 | 60.5 | 0 | 0 | 0 | 0 | 114.1 | G471 | G471-S473 PolarHBondContact O-N 3.1Å; G471-S473 VanDerWaalsContact O-N 3.15Å |
| 474 | R | 40 | Very low | 61.5 | Low | 214 Ų | 214 | 91.9 Ų | 91.9 | 81% | 0.808 | 51% | 0.505 | S | S | * | . | G | 310 helix | trans | -82.9 | -18.7 | 179 | -73.5 | -174.4 | 173.4 | -178.1 | -1.4 | 114 | G471 Q472 | G471-R474 PolarHBondContact O-N 3.29Å; G471-R474 VanDerWaalsContact O-N 3.09Å; Q472-R474 VanDerWaalsContact C-N 3.25Å; Q472-R474 PolarHBondContact O-N 2.7Å |
| 475 | M | 37.1 | Very low | 59.8 | Low | 164 Ų | 164 | 98.1 Ų | 98.1 | 81% | 0.808 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | -12.2 | -175.6 | -69.2 | -176.9 | 64.1 | 0 | 0 | 114.2 | Q472 | Q472-M475 PolarHBondContact O-N 3.05Š|
| 476 | S | 36.2 | Very low | 57.8 | Low | 74 Ų | 74 | 97.2 Ų | 97.2 | 52% | 0.517 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | 8.4 | -175.4 | -175.7 | 0 | 0 | 0 | 0 | 113.6 | ||
| 477 | G | 31.6 | Very low | 55.4 | Low | 63 Ų | 63 | 101.5 Ų | 101.5 | 65% | 0.649 | 56% | 0.558 | S | S | * | * | trans | -123.7 | 19.9 | -172.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 478 | H | 25.3 | Very low | 53.1 | Low | 250 Ų | 250 | 109.4 Ų | 109.4 | 100% | 1.157 | 60% | 0.602 | S | S | * | * | trans | -113.2 | 0 | 168.2 | -81.7 | -49.2 | 0 | 0 | 0 | 110.4 |
Retrieved 478 of 478 residues in 87.2 ms
(Link to these results)