| 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 | 32.3 | Very low | 29 | Very low | 252 Ų | 252 | 148.4 Ų | 148.4 | 100% | 1.241 | 78% | 0.777 | S | S | * | * | 0 | 111.7 | 0 | -65 | 169.5 | 171.5 | 0 | 0 | 107.4 | |||||
| 2 | G | 33.2 | Very low | 28.6 | Very low | 64 Ų | 64 | 142.7 Ų | 142.7 | 66% | 0.66 | 77% | 0.768 | S | S | * | * | cis | -171.3 | 139.7 | -6.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 3 | E | 31.6 | Very low | 28.3 | Very low | 178 Ų | 178 | 144.2 Ų | 144.2 | 83% | 0.832 | 77% | 0.774 | S | S | * | * | trans | 26.1 | 120.9 | 141.9 | -69.7 | 152.7 | 120.1 | 0 | 0 | 119.8 | ||||
| 4 | C | 28.6 | Very low | 28.2 | Very low | 111 Ų | 111 | 143.1 Ų | 143.1 | 75% | 0.75 | 78% | 0.775 | S | S | * | * | 78.1 | 127.9 | 70.4 | -71.8 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 5 | N | 31.7 | Very low | 28 | Very low | 151 Ų | 151 | 138.2 Ų | 138.2 | 81% | 0.807 | 77% | 0.771 | S | S | * | * | 179.6 | 163.8 | 115.8 | -96.9 | -36.8 | 0 | 0 | 0 | 116.4 | |||||
| 6 | N | 29.8 | Very low | 28.1 | Very low | 139 Ų | 139 | 140.1 Ų | 140.1 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | trans | 76.8 | 125.6 | 168.8 | -61.8 | -21.9 | 0 | 0 | 0 | 118 | ||||
| 7 | C | 27.9 | Very low | 28.3 | Very low | 107 Ų | 107 | 141.8 Ų | 141.8 | 72% | 0.723 | 78% | 0.78 | S | S | * | * | cis | 85.8 | 138 | 42.7 | -67 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 8 | T | 28.4 | Very low | 28.2 | Very low | 130 Ų | 130 | 140.9 Ų | 140.9 | 80% | 0.798 | 77% | 0.774 | S | S | * | * | cis | -173.1 | 175.3 | 9.7 | 12.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 9 | R | 24.6 | Very low | 28.1 | Very low | 192 Ų | 192 | 140.6 Ų | 140.6 | 73% | 0.725 | 78% | 0.776 | S | S | * | * | cis | -176.1 | 131.4 | -3.7 | 164.5 | -177.8 | 178.1 | 153.4 | 12.3 | 112.3 | ||||
| 10 | E | 26 | Very low | 28 | Very low | 120 Ų | 120 | 139.6 Ų | 139.6 | 56% | 0.561 | 77% | 0.774 | S | S | * | * | trans | 58.7 | 168.3 | 160.2 | -62.6 | -175.4 | 93.5 | 0 | 0 | 119 | ||||
| 11 | R | 25 | Very low | 28 | Very low | 188 Ų | 188 | 138 Ų | 138 | 71% | 0.709 | 77% | 0.768 | S | S | * | * | cis | -159.4 | 156.1 | 3.7 | -145.6 | 177.1 | -110 | 174.7 | -2.1 | 113.5 | ||||
| 12 | A | 24.2 | Very low | 27.6 | Very low | 80 Ų | 80 | 130.4 Ų | 130.4 | 66% | 0.661 | 75% | 0.746 | S | S | * | * | trans | 46.1 | 157.8 | 142.2 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 13 | L | 25 | Very low | 27.4 | Very low | 163 Ų | 163 | 136.7 Ų | 136.7 | 85% | 0.853 | 76% | 0.755 | S | S | * | * | cis | -170.7 | -176.8 | -14.8 | -100.7 | 170.9 | 0 | 0 | 0 | 105.9 | ||||
| 14 | T | 27.1 | Very low | 27.2 | Very low | 129 Ų | 129 | 136.5 Ų | 136.5 | 79% | 0.791 | 75% | 0.754 | S | S | * | * | cis | -137.7 | -173.3 | 5.5 | 52 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 15 | G | 25.2 | Very low | 27 | Very low | 69 Ų | 69 | 139.7 Ų | 139.7 | 71% | 0.711 | 76% | 0.755 | S | S | * | * | trans | 142.1 | 107 | 156.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 16 | E | 29.9 | Very low | 26.8 | Very low | 168 Ų | 168 | 138 Ų | 138 | 79% | 0.785 | 75% | 0.75 | S | S | * | * | trans | -78.3 | 141.3 | -179.9 | -59.8 | 100.9 | 115.6 | 0 | 0 | 115.2 | ||||
| 17 | D | 30.6 | Very low | 26.7 | Very low | 169 Ų | 169 | 136.9 Ų | 136.9 | 90% | 0.904 | 75% | 0.747 | S | S | * | * | -178.7 | 139 | 100.7 | -102 | -26.2 | 0 | 0 | 0 | 111.2 | |||||
| 18 | D | 27 | Very low | 26.6 | Very low | 126 Ų | 126 | 136.9 Ų | 136.9 | 67% | 0.674 | 75% | 0.749 | S | S | * | * | trans | -136.1 | 134.3 | -178 | 173.5 | 31.7 | 0 | 0 | 0 | 112.3 | T20 | D18-T20 PolarHBondContact OD1-N 3.44Å; D18-T20 VanDerWaalsContact OD1-N 3.12Å; D18-T20 PolarHBondContact OD1-OG1 3.13Å | ||
| 19 | V | 26.8 | Very low | 26.5 | Very low | 135 Ų | 135 | 139.1 Ų | 139.1 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | trans | -143.8 | 85.8 | 161.5 | -173.4 | 0 | 0 | 0 | 0 | 110 | V21 | V19-V21 HydrophobicContact CG1-CG2 4.19Š| ||
| 20 | T | 25.6 | Very low | 26.6 | Very low | 120 Ų | 120 | 137.6 Ų | 137.6 | 74% | 0.736 | 76% | 0.756 | S | S | * | * | trans | -108 | 101.7 | 171.4 | -51.9 | 0 | 0 | 0 | 0 | 111 | D18 A22 | D18-T20 PolarHBondContact OD1-N 3.44Å; D18-T20 VanDerWaalsContact OD1-N 3.12Å; D18-T20 PolarHBondContact OD1-OG1 3.13Å; T20-A22 PolarHBondContact O-N 2.69Å | ||
| 21 | V | 26.8 | Very low | 26.6 | Very low | 108 Ų | 108 | 137.6 Ų | 137.6 | 66% | 0.655 | 76% | 0.76 | S | S | * | * | trans | -80.8 | 108.9 | -176 | -176.8 | 0 | 0 | 0 | 0 | 111.7 | V19 F23 | V19-V21 HydrophobicContact CG1-CG2 4.19Å; V21-F23 HydrophobicContact CG1-CD2 4.06Å; V21-F23 HydrophobicContact CG1-CE2 3.58Å; V21-F23 HydrophobicContact CG1-CZ 4.19Å | ||
| 22 | A | 25.8 | Very low | 26.7 | Very low | 92 Ų | 92 | 137.9 Ų | 137.9 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | trans | -116.1 | 126 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | T20 | T20-A22 PolarHBondContact O-N 2.69Š| ||
| 23 | F | 27.6 | Very low | 26.8 | Very low | 196 Ų | 196 | 140.8 Ų | 140.8 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | -91.7 | 113.7 | 176.6 | -78.7 | -83 | 0 | 0 | 0 | 111 | V21 | V21-F23 HydrophobicContact CG1-CD2 4.06Å; V21-F23 HydrophobicContact CG1-CE2 3.58Å; V21-F23 HydrophobicContact CG1-CZ 4.19Å | ||
| 24 | H | 27.2 | Very low | 26.8 | Very low | 174 Ų | 174 | 142.5 Ų | 142.5 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | trans | -80.7 | 135 | 177.6 | -158.4 | -80.2 | 0 | 0 | 0 | 111.1 | V26 | H24-V26 PolarHBondContact O-N 2.67Š| ||
| 25 | K | 25 | Very low | 26.7 | Very low | 178 Ų | 178 | 144.4 Ų | 144.4 | 77% | 0.774 | 78% | 0.775 | S | S | * | * | trans | -82.4 | 114.7 | 170.5 | -174.4 | 178.5 | 179.4 | -176.7 | 0 | 108.7 | ||||
| 26 | V | 27.9 | Very low | 26.7 | Very low | 115 Ų | 115 | 149.6 Ų | 149.6 | 70% | 0.697 | 77% | 0.774 | S | S | * | * | trans | -81.1 | 136 | 172.2 | 179.6 | 0 | 0 | 0 | 0 | 109.1 | H24 | H24-V26 PolarHBondContact O-N 2.67Š| ||
| 27 | V | 26.4 | Very low | 26.5 | Very low | 115 Ų | 115 | 147.7 Ų | 147.7 | 70% | 0.697 | 77% | 0.77 | S | S | * | * | trans | -125.4 | 121 | 164.9 | 175.2 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 28 | S | 26.1 | Very low | 26.2 | Very low | 107 Ų | 107 | 147.3 Ų | 147.3 | 75% | 0.748 | 76% | 0.762 | S | S | * | * | trans | -122.8 | 115 | 170.2 | -60.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 29 | H | 27.3 | Very low | 26.1 | Very low | 177 Ų | 177 | 147.5 Ų | 147.5 | 82% | 0.819 | 76% | 0.759 | S | S | * | * | trans | -86.9 | 140.6 | 150.7 | -97.6 | -88 | 0 | 0 | 0 | 107.1 | ||||
| 30 | D | 26.1 | Very low | 26.1 | Very low | 160 Ų | 160 | 147.9 Ų | 147.9 | 86% | 0.856 | 75% | 0.752 | S | S | * | * | trans | -136.2 | 161.4 | 147.8 | -143.2 | -28 | 0 | 0 | 0 | 108.8 | ||||
| 31 | N | 26.5 | Very low | 26.1 | Very low | 121 Ų | 121 | 148.9 Ų | 148.9 | 65% | 0.647 | 75% | 0.752 | S | S | * | * | trans | -154.3 | 134.5 | -157.1 | 173.7 | 52.5 | 0 | 0 | 0 | 111.5 | ||||
| 32 | Q | 26.5 | Very low | 26 | Very low | 194 Ų | 194 | 151.2 Ų | 151.2 | 91% | 0.907 | 76% | 0.761 | S | S | * | * | trans | -149.5 | 138.2 | 165.1 | -119.3 | 165.9 | 26.5 | 0 | 0 | 114.1 | ||||
| 33 | N | 26.2 | Very low | 26.1 | Very low | 140 Ų | 140 | 154.7 Ų | 154.7 | 75% | 0.749 | 76% | 0.762 | S | S | * | * | trans | -83 | 159.3 | 175.4 | -60.2 | -42.8 | 0 | 0 | 0 | 111.1 | ||||
| 34 | Q | 24.6 | Very low | 26 | Very low | 199 Ų | 199 | 153.7 Ų | 153.7 | 93% | 0.93 | 76% | 0.759 | S | S | * | * | -152 | 159.2 | 124.9 | -114.3 | 170.4 | 7.3 | 0 | 0 | 111.1 | |||||
| 35 | F | 26.1 | Very low | 25.9 | Very low | 169 Ų | 169 | 148.9 Ų | 148.9 | 74% | 0.741 | 76% | 0.757 | S | S | * | * | trans | -151.1 | 142.3 | -169.6 | -136.9 | -55.3 | 0 | 0 | 0 | 110 | ||||
| 36 | Y | 25.8 | Very low | 25.9 | Very low | 179 Ų | 179 | 147.1 Ų | 147.1 | 70% | 0.702 | 76% | 0.756 | S | S | * | * | trans | 78.7 | 124 | 164.3 | -71.6 | -62.1 | 0 | 0 | 0 | 121.6 | ||||
| 37 | N | 25 | Very low | 25.8 | Very low | 128 Ų | 128 | 149 Ų | 149 | 68% | 0.684 | 76% | 0.762 | S | S | * | * | trans | 89.5 | 108 | 130.7 | -74.8 | -0.8 | 0 | 0 | 0 | 122.9 | ||||
| 38 | H | 25.1 | Very low | 25.9 | Very low | 161 Ų | 161 | 151.4 Ų | 151.4 | 75% | 0.745 | 77% | 0.766 | S | S | * | * | 72.3 | 126.4 | 121 | -100.7 | -74.7 | 0 | 0 | 0 | 122.3 | |||||
| 39 | Q | 23.9 | Very low | 25.9 | Very low | 130 Ų | 130 | 153.2 Ų | 153.2 | 61% | 0.607 | 76% | 0.763 | S | S | * | * | trans | 98.1 | 129.4 | 131.1 | -147.2 | 69.5 | 10.9 | 0 | 0 | 120.1 | ||||
| 40 | E | 26.1 | Very low | 25.6 | Very low | 143 Ų | 143 | 150.1 Ų | 150.1 | 67% | 0.668 | 76% | 0.756 | S | S | * | * | trans | 66.4 | 116.9 | 154.4 | -80.3 | 147.3 | -145.7 | 0 | 0 | 121.8 | ||||
| 41 | D | 25.8 | Very low | 25.6 | Very low | 140 Ų | 140 | 149.4 Ų | 149.4 | 75% | 0.749 | 75% | 0.752 | S | S | * | * | 73.6 | 109.5 | 128 | -54.4 | -0.8 | 0 | 0 | 0 | 123.5 | |||||
| 42 | D | 26.3 | Very low | 25.6 | Very low | 158 Ų | 158 | 150.4 Ų | 150.4 | 85% | 0.845 | 75% | 0.753 | S | S | * | * | trans | 80.9 | 143.6 | 131 | -81.2 | -20.1 | 0 | 0 | 0 | 126.1 | ||||
| 43 | E | 27.3 | Very low | 25.4 | Very low | 165 Ų | 165 | 146.7 Ų | 146.7 | 77% | 0.771 | 74% | 0.744 | S | S | * | * | trans | 69.7 | 112.1 | 163.8 | -65 | -157.6 | 131.6 | 0 | 0 | 124.4 | ||||
| 44 | H | 26 | Very low | 25.3 | Very low | 174 Ų | 174 | 145 Ų | 145 | 81% | 0.806 | 74% | 0.738 | S | S | * | * | trans | 75.9 | 131.2 | 141.1 | -78.5 | 45.8 | 0 | 0 | 0 | 120.6 | ||||
| 45 | G | 24.8 | Very low | 25.2 | Very low | 73 Ų | 73 | 143.4 Ų | 143.4 | 75% | 0.753 | 73% | 0.731 | S | S | * | * | trans | 164.4 | 12.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 46 | D | 24.8 | Very low | 25 | Very low | 141 Ų | 141 | 142.7 Ų | 142.7 | 75% | 0.754 | 73% | 0.734 | S | S | * | * | trans | 52.2 | 112.5 | 163.5 | -52.4 | -5.8 | 0 | 0 | 0 | 121.3 | ||||
| 47 | D | 25.2 | Very low | 24.8 | Very low | 155 Ų | 155 | 143 Ų | 143 | 83% | 0.829 | 73% | 0.734 | S | S | * | * | trans | 70.4 | 102 | 137.9 | -62.8 | -2.3 | 0 | 0 | 0 | 123.9 | ||||
| 48 | E | 28 | Very low | 24.7 | Very low | 165 Ų | 165 | 143.7 Ų | 143.7 | 77% | 0.771 | 74% | 0.743 | S | S | * | * | -19.3 | 164.1 | 129.8 | -68 | -177.4 | 77.4 | 0 | 0 | 118.3 | |||||
| 49 | Q | 26.1 | Very low | 24.7 | Very low | 146 Ų | 146 | 141.2 Ų | 141.2 | 68% | 0.682 | 74% | 0.735 | S | S | * | * | cis | -149.7 | -155.5 | 11.7 | -132 | 173.1 | 51.2 | 0 | 0 | 108.4 | ||||
| 50 | T | 22.8 | Very low | 24.7 | Very low | 111 Ų | 111 | 146 Ų | 146 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | cis | -154 | -172.4 | 12.3 | -24.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 51 | D | 26.2 | Very low | 24.6 | Very low | 145 Ų | 145 | 147.1 Ų | 147.1 | 78% | 0.775 | 76% | 0.758 | S | S | * | * | trans | -64.2 | 178.1 | 175.4 | -53.6 | -65.7 | 0 | 0 | 0 | 116.7 | ||||
| 52 | E | 25.6 | Very low | 24.5 | Very low | 143 Ų | 143 | 148.8 Ų | 148.8 | 67% | 0.668 | 76% | 0.762 | S | S | * | * | cis | -146 | -155.8 | 9.6 | -150.2 | -130.7 | 144.9 | 0 | 0 | 108.6 | ||||
| 53 | T | 22.3 | Very low | 24.4 | Very low | 116 Ų | 116 | 148.4 Ų | 148.4 | 71% | 0.712 | 76% | 0.76 | S | S | * | * | cis | -147.8 | 156.2 | 14 | -60.7 | 0 | 0 | 0 | 0 | 113 | ||||
| 54 | V | 23.6 | Very low | 24.4 | Very low | 103 Ų | 103 | 150.1 Ų | 150.1 | 62% | 0.624 | 77% | 0.768 | S | S | * | * | trans | -83.1 | 149 | -177.5 | -151.7 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 55 | H | 22.3 | Very low | 24.3 | Very low | 167 Ų | 167 | 150.2 Ų | 150.2 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | trans | 140.4 | 158.1 | 135.1 | -82.1 | -22.8 | 0 | 0 | 0 | 114.9 | ||||
| 56 | L | 21.8 | Very low | 24.3 | Very low | 154 Ų | 154 | 150.4 Ų | 150.4 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | cis | -135.8 | -147.5 | 3.7 | -136.5 | 176.8 | 0 | 0 | 0 | 111.6 | ||||
| 57 | R | 22.5 | Very low | 24.2 | Very low | 186 Ų | 186 | 151.8 Ų | 151.8 | 70% | 0.702 | 78% | 0.778 | S | S | * | * | trans | -160 | 148.9 | -164.7 | -179 | -179.3 | -179.6 | 171.8 | 4.6 | 114.3 | N59 | R57-N59 PolarHBondContact NE-OD1 3.05Å; R57-N59 PolarHBondContact NH2-OD1 2.8Å | ||
| 58 | T | 22.3 | Very low | 24.2 | Very low | 142 Ų | 142 | 151.9 Ų | 151.9 | 87% | 0.871 | 77% | 0.774 | S | S | * | * | trans | -141.6 | 149.2 | 158.6 | -51.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 59 | N | 24.8 | Very low | 24 | Very low | 109 Ų | 109 | 150.2 Ų | 150.2 | 58% | 0.583 | 76% | 0.764 | S | S | * | * | trans | -113.2 | 162.9 | -171.8 | -67.9 | -26.2 | 0 | 0 | 0 | 114.2 | R57 | R57-N59 PolarHBondContact NE-OD1 3.05Å; R57-N59 PolarHBondContact NH2-OD1 2.8Å | ||
| 60 | Y | 23.6 | Very low | 23.9 | Very low | 230 Ų | 230 | 151.8 Ų | 151.8 | 90% | 0.902 | 77% | 0.771 | S | S | * | * | trans | -78.9 | 166.1 | 159.6 | -98.1 | -100.9 | 0 | 0 | 0 | 112.2 | ||||
| 61 | L | 24.3 | Very low | 23.9 | Very low | 166 Ų | 166 | 158 Ų | 158 | 87% | 0.869 | 78% | 0.782 | S | S | * | * | trans | -149.6 | 178.5 | 156.7 | -109.9 | 171.6 | 0 | 0 | 0 | 110.7 | ||||
| 62 | Q | 23.7 | Very low | 23.8 | Very low | 176 Ų | 176 | 155.6 Ų | 155.6 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | -109.4 | 167.5 | -146.9 | -140 | 145.4 | -53.7 | 0 | 0 | 116 | ||||
| 63 | D | 25.1 | Very low | 23.7 | Very low | 150 Ų | 150 | 160.9 Ų | 160.9 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -71.4 | 155.9 | 166.5 | -51.9 | -80.9 | 0 | 0 | 0 | 113 | ||||
| 64 | E | 25.9 | Very low | 23.7 | Very low | 200 Ų | 200 | 158.9 Ų | 158.9 | 94% | 0.935 | 80% | 0.799 | S | S | * | * | trans | -155 | 155.8 | 142.4 | -83.3 | -145.7 | 130 | 0 | 0 | 110.8 | ||||
| 65 | D | 24.3 | Very low | 23.7 | Very low | 176 Ų | 176 | 158.8 Ų | 158.8 | 94% | 0.941 | 80% | 0.803 | S | S | * | * | trans | -81.1 | 164.9 | -177.9 | -79.6 | -65.2 | 0 | 0 | 0 | 114.5 | ||||
| 66 | G | 25 | Very low | 23.8 | Very low | 78 Ų | 78 | 158 Ų | 158 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -175.3 | 110.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 67 | E | 23.7 | Very low | 23.8 | Very low | 170 Ų | 170 | 157.3 Ų | 157.3 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | trans | -75.2 | 153.4 | 165.5 | -62.7 | -164.4 | 128.5 | 0 | 0 | 111.9 | K69 | E67-K69 IonicContact OE2-NZ 3.68Š| ||
| 68 | E | 24.5 | Very low | 23.9 | Very low | 157 Ų | 157 | 154.5 Ų | 154.5 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | -174.6 | 174 | 119 | -100 | -94.4 | 84.8 | 0 | 0 | 112.9 | |||||
| 69 | K | 23.1 | Very low | 24 | Very low | 129 Ų | 129 | 155.3 Ų | 155.3 | 56% | 0.561 | 80% | 0.798 | S | S | * | * | trans | -113.7 | 150.7 | -160.5 | -51 | 151.1 | -166.2 | 69.7 | 0 | 112.3 | E67 | E67-K69 IonicContact OE2-NZ 3.68Š| ||
| 70 | Q | 25.5 | Very low | 23.9 | Very low | 180 Ų | 180 | 159.2 Ų | 159.2 | 84% | 0.841 | 81% | 0.813 | S | S | * | * | -179.8 | 124.2 | 129 | -94.6 | 146.8 | 65.6 | 0 | 0 | 110.2 | |||||
| 71 | R | 22.2 | Very low | 23.9 | Very low | 241 Ų | 241 | 152 Ų | 152 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | 79.7 | 89.9 | 59 | -87.8 | -168.7 | 166.8 | -176.1 | -0.8 | 116.2 | |||||
| 72 | A | 24.8 | Very low | 23.9 | Very low | 95 Ų | 95 | 147.5 Ų | 147.5 | 79% | 0.785 | 80% | 0.802 | S | S | * | * | trans | -172.1 | 127 | 139 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 73 | R | 22.3 | Very low | 24.2 | Very low | 253 Ų | 253 | 148.5 Ų | 148.5 | 96% | 0.955 | 81% | 0.807 | S | S | * | * | 50.3 | 123.1 | 80.8 | -84.6 | -172.9 | 170.6 | -174.9 | -3 | 114.1 | |||||
| 74 | G | 22.9 | Very low | 24.3 | Very low | 74 Ų | 74 | 150.9 Ų | 150.9 | 76% | 0.763 | 81% | 0.81 | S | S | * | * | cis | 164.9 | 172.4 | -6.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 75 | S | 23.2 | Very low | 24.6 | Very low | 102 Ų | 102 | 149.9 Ų | 149.9 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | 56.4 | 114.6 | 163.3 | -77.7 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 76 | E | 24.1 | Very low | 24.8 | Very low | 150 Ų | 150 | 147.5 Ų | 147.5 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | 75.3 | 111.1 | 118.3 | -64.7 | 171.8 | 88.6 | 0 | 0 | 123.7 | |||||
| 77 | N | 22.6 | Very low | 25.2 | Very low | 139 Ų | 139 | 150.8 Ų | 150.8 | 74% | 0.743 | 80% | 0.801 | S | S | * | * | 73.8 | 159.5 | 119.5 | -59.1 | -25.8 | 0 | 0 | 0 | 123.2 | |||||
| 78 | V | 23.5 | Very low | 25.5 | Very low | 128 Ų | 128 | 149.7 Ų | 149.7 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | 98.4 | 92.6 | 155.3 | -168.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 79 | L | 24.6 | Very low | 25.5 | Very low | 159 Ų | 159 | 148.5 Ų | 148.5 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | trans | 64.2 | 161.5 | 134 | -85.9 | 166.9 | 0 | 0 | 0 | 124 | ||||
| 80 | E | 23.6 | Very low | 26 | Very low | 191 Ų | 191 | 147.5 Ų | 147.5 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | trans | 62 | 150.9 | 172.1 | -67.1 | -179.8 | 124.6 | 0 | 0 | 117 | ||||
| 81 | G | 23.5 | Very low | 26.5 | Very low | 77 Ų | 77 | 146.2 Ų | 146.2 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | cis | 141.6 | 93.9 | -0.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 82 | G | 23.3 | Very low | 27.5 | Very low | 73 Ų | 73 | 140.9 Ų | 140.9 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | trans | -177 | 139.9 | -177 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 83 | E | 29.8 | Very low | 27.8 | Very low | 197 Ų | 197 | 140.4 Ų | 140.4 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | trans | -67.6 | 152.6 | 177.1 | -68.4 | 160 | 90.3 | 0 | 0 | 111.6 | ||||
| 84 | K | 28.6 | Very low | 28.2 | Very low | 199 Ų | 199 | 138 Ų | 138 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -118.3 | 105.3 | 173 | -76.8 | -171.3 | 174.5 | -178.9 | 0 | 111 | S86 | K84-S86 PolarHBondContact O-N 3.25Š| ||
| 85 | E | 31 | Very low | 28.3 | Very low | 179 Ų | 179 | 140.5 Ų | 140.5 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | trans | -54.5 | 131.8 | 168.8 | -63.7 | -176.8 | 99.2 | 0 | 0 | 110.7 | L87 | E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 3.14Å; E85-L87 VanDerWaalsContact O-N 3.13Å | ||
| 86 | S | 30 | Very low | 28.7 | Very low | 127 Ų | 127 | 141.5 Ų | 141.5 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -88.1 | 70.4 | 177 | -65.3 | 0 | 0 | 0 | 0 | 110.6 | K84 | K84-S86 PolarHBondContact O-N 3.25Š| ||
| 87 | L | 31.5 | Very low | 28.9 | Very low | 146 Ų | 146 | 146.2 Ų | 146.2 | 76% | 0.764 | 82% | 0.817 | S | S | * | * | trans | -71.8 | 154 | 177.1 | -143.3 | 78.4 | 0 | 0 | 0 | 112 | E85 | E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 3.14Å; E85-L87 VanDerWaalsContact O-N 3.13Å | ||
| 88 | L | 31.8 | Very low | 29.1 | Very low | 148 Ų | 148 | 143 Ų | 143 | 78% | 0.775 | 82% | 0.818 | S | S | * | * | trans | -61.6 | 134.6 | -170.4 | -71.2 | 70.8 | 0 | 0 | 0 | 112.7 | V90 | L88-V90 HydrophobicContact CB-CG2 4.3Å; L88-V90 HydrophobicContact CD2-CG2 4.35Å | ||
| 89 | C | 24.3 | Very low | 29.3 | Very low | 132 Ų | 132 | 146.3 Ų | 146.3 | 89% | 0.892 | 82% | 0.822 | S | S | * | * | trans | -110.1 | 100.7 | 162.6 | -157.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 90 | V | 32.3 | Very low | 29.5 | Very low | 108 Ų | 108 | 147 Ų | 147 | 66% | 0.655 | 82% | 0.82 | S | S | * | * | trans | -95.3 | 128.5 | -179.1 | 174.9 | 0 | 0 | 0 | 0 | 109.6 | L88 | L88-V90 HydrophobicContact CB-CG2 4.3Å; L88-V90 HydrophobicContact CD2-CG2 4.35Å | ||
| 91 | L | 36.5 | Very low | 29.8 | Very low | 153 Ų | 153 | 144.4 Ų | 144.4 | 80% | 0.801 | 82% | 0.818 | S | S | * | * | trans | 61.1 | 116.4 | 174.6 | -69.1 | 163.3 | 0 | 0 | 0 | 116.8 | ||||
| 92 | P | 43 | Very low | 30.2 | Very low | 128 Ų | 128 | 145.7 Ų | 145.7 | 83% | 0.831 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 124.8 | 160.6 | 32 | -30.2 | 0 | 0 | 0 | 110.4 | ||
| 93 | A | 31.8 | Very low | 30.4 | Very low | 86 Ų | 86 | 147.6 Ų | 147.6 | 71% | 0.711 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 165.1 | 169 | 0 | 0 | 0 | 0 | 0 | 111.8 | C95 | A93-C95 PolarHBondContact O-N 3.22Š|
| 94 | F | 30.5 | Very low | 30.3 | Very low | 201 Ų | 201 | 144.1 Ų | 144.1 | 88% | 0.882 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 118.3 | 172.7 | -102.6 | -112.3 | 0 | 0 | 0 | 110.8 | T96 | F94-T96 HydrophobicContact CD1-CG2 4.19Š|
| 95 | C | 24.8 | Very low | 30.8 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 86% | 0.858 | 82% | 0.818 | S | S | * | * | trans | -112 | 98.8 | 166.3 | -68.2 | 0 | 0 | 0 | 0 | 110 | A93 | A93-C95 PolarHBondContact O-N 3.22Š| ||
| 96 | T | 31 | Very low | 30.8 | Very low | 123 Ų | 123 | 139 Ų | 139 | 76% | 0.755 | 82% | 0.82 | S | S | * | * | trans | -103.1 | 107.4 | 172.6 | 47.6 | 0 | 0 | 0 | 0 | 110.6 | F94 | F94-T96 HydrophobicContact CD1-CG2 4.19Š| ||
| 97 | R | 27.9 | Very low | 31 | Very low | 249 Ų | 249 | 142.3 Ų | 142.3 | 94% | 0.94 | 82% | 0.822 | S | S | * | * | trans | -160 | 145.7 | 172.6 | -167.2 | 175.6 | -172.6 | 168.9 | 2.3 | 106.9 | ||||
| 98 | G | 27 | Very low | 31 | Very low | 73 Ų | 73 | 141.6 Ų | 141.6 | 75% | 0.753 | 82% | 0.824 | S | S | * | * | cis | -159.8 | 167.5 | -10.8 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 99 | K | 29.3 | Very low | 31.4 | Very low | 197 Ų | 197 | 139.7 Ų | 139.7 | 86% | 0.857 | 82% | 0.82 | S | S | * | * | trans | -120.2 | 114.8 | -169.8 | -179.5 | -160.5 | 175.9 | -165.5 | 0 | 112 | ||||
| 100 | E | 28.8 | Very low | 32.1 | Very low | 173 Ų | 173 | 139.4 Ų | 139.4 | 81% | 0.808 | 82% | 0.817 | S | S | * | * | trans | -166 | 117 | 159.5 | -106 | 136.4 | -144 | 0 | 0 | 106.8 | ||||
| 101 | T | 28.6 | Very low | 32.4 | Very low | 136 Ų | 136 | 142.9 Ų | 142.9 | 83% | 0.834 | 83% | 0.826 | S | S | * | * | 74.9 | 155.5 | 92.9 | 57.9 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 102 | A | 32.7 | Very low | 32.7 | Very low | 105 Ų | 105 | 142.7 Ų | 142.7 | 87% | 0.868 | 82% | 0.821 | S | S | * | * | trans | -140.9 | 149.1 | -157 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 103 | S | 27.8 | Very low | 32.5 | Very low | 113 Ų | 113 | 145.1 Ų | 145.1 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | trans | -169.4 | 174.3 | 147.5 | -159.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 104 | S | 27.1 | Very low | 33.1 | Very low | 124 Ų | 124 | 146.6 Ų | 146.6 | 87% | 0.867 | 82% | 0.821 | S | S | * | * | trans | 62 | 150.8 | 171.4 | 43.6 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 105 | G | 39.7 | Very low | 33.7 | Very low | 79 Ų | 79 | 144.4 Ų | 144.4 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | trans | -120.2 | 125.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 106 | E | 30 | Very low | 35.2 | Very low | 190 Ų | 190 | 147.2 Ų | 147.2 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | trans | -128.9 | 159.8 | 158.9 | -78.6 | -176.5 | 103.6 | 0 | 0 | 108 | T108 | E106-T108 PolarHBondContact O-N 2.95Å; E106-T108 VanDerWaalsContact O-N 3.14Å | ||
| 107 | E | 35.3 | Very low | 36.5 | Very low | 198 Ų | 198 | 145.7 Ų | 145.7 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | trans | -66.8 | 112.6 | 178.9 | -65.1 | -168.5 | 132.8 | 0 | 0 | 110.4 | ||||
| 108 | T | 31.1 | Very low | 38.4 | Very low | 130 Ų | 130 | 140.1 Ų | 140.1 | 80% | 0.798 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 128.4 | -177.9 | 37.9 | 0 | 0 | 0 | 0 | 111.1 | E106 | E106-T108 PolarHBondContact O-N 2.95Å; E106-T108 VanDerWaalsContact O-N 3.14Å |
| 109 | P | 40.5 | Very low | 41.1 | Very low | 108 Ų | 108 | 137.8 Ų | 137.8 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 149.2 | 170.7 | 27.2 | -34 | 0 | 0 | 0 | 109.6 | E111 | P109-E111 PolarHBondContact O-N 3.19Š|
| 110 | P | 39.4 | Very low | 44 | Very low | 126 Ų | 126 | 132 Ų | 132 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 126.3 | -171.2 | 24.2 | -34.5 | 0 | 0 | 0 | 111.4 | E112 | P110-E112 PolarHBondContact O-N 2.88Š|
| 111 | E | 38.7 | Very low | 46.9 | Very low | 181 Ų | 181 | 123.8 Ų | 123.8 | 85% | 0.846 | 71% | 0.714 | S | S | * | * | trans | -48.5 | 115.7 | 176.5 | -78.8 | -169.7 | 118.7 | 0 | 0 | 111.1 | P109 K113 | P109-E111 PolarHBondContact O-N 3.19Å; E111-K113 VanDerWaalsContact C-N 3.25Å; E111-K113 PolarHBondContact O-N 3.25Å | ||
| 112 | E | 42.2 | Very low | 49.9 | Very low | 150 Ų | 150 | 119.6 Ų | 119.6 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | trans | -63.7 | 91.8 | 163.5 | -99.8 | -138.2 | 133.4 | 0 | 0 | 108.2 | P110 P114 K115 | P110-E112 PolarHBondContact O-N 2.88Å; E112-P114 VanDerWaalsContact O-N 3.09Å; E112-K115 VanDerWaalsContact OE1-CE 3.23Å; E112-K115 WeakPolarHBondContact OE1-CE 3.23Å; E112-K115 IonicContact OE1-NZ 2.67Å; E112-K115 PolarHBondContact OE1-NZ 2.93Å; E112-K115 IonicContact OE2-NZ 2.69Å; E112-K115 PolarHBondContact OE2-NZ 3.19Å | ||
| 113 | K | 37.7 | Very low | 52.8 | Low | 178 Ų | 178 | 120.3 Ų | 120.3 | 77% | 0.774 | 67% | 0.67 | S | S | * | * | trans | -47.3 | 119.3 | 175.7 | -71.7 | 164.9 | -176.6 | 160.6 | 0 | 108.5 | E111 K115 | E111-K113 VanDerWaalsContact C-N 3.25Å; E111-K113 PolarHBondContact O-N 3.25Å; K113-K115 PolarHBondContact O-N 3.31Å | ||
| 114 | P | 44.3 | Very low | 56 | Low | 117 Ų | 117 | 117.2 Ų | 117.2 | 76% | 0.76 | 64% | 0.641 | S | S | * | * | trans | -55.4 | 127.6 | -164.4 | 16.5 | -30.9 | 0 | 0 | 0 | 111.1 | E112 K116 | E112-P114 VanDerWaalsContact O-N 3.09Å; P114-K116 PolarHBondContact O-N 2.84Å | ||
| 115 | K | 44 | Very low | 59.2 | Low | 155 Ų | 155 | 111.3 Ų | 111.3 | 67% | 0.674 | 60% | 0.6 | S | S | * | * | trans | -59.9 | 96 | -173 | -75.4 | 160.7 | 177.9 | 144 | 0 | 109.7 | E112 K113 C117 | E112-K115 VanDerWaalsContact OE1-CE 3.23Å; E112-K115 WeakPolarHBondContact OE1-CE 3.23Å; E112-K115 IonicContact OE1-NZ 2.67Å; E112-K115 PolarHBondContact OE1-NZ 2.93Å; E112-K115 IonicContact OE2-NZ 2.69Å; E112-K115 PolarHBondContact OE2-NZ 3.19Å; K113-K115 PolarHBondContact O-N 3.31Å; K115-C117 PolarHBondContact O-N 3.22Å; K115-C117 VanDerWaalsContact O-N 3.13Å | ||
| 116 | K | 55.6 | Low | 61.9 | Low | 186 Ų | 186 | 110.9 Ų | 110.9 | 81% | 0.809 | 58% | 0.578 | S | S | * | * | trans | -60.2 | 114.5 | -179.3 | -70.7 | 166.3 | -175.5 | 145.9 | 0 | 108.9 | P114 P118 | P114-K116 PolarHBondContact O-N 2.84Å; K116-P118 VanDerWaalsContact O-CD 3.31Å; K116-P118 WeakPolarHBondContact O-CD 3.21Å | ||
| 117 | C | 58.9 | Low | 65 | Low | 91 Ų | 91 | 104 Ų | 104 | 62% | 0.615 | 55% | 0.548 | S | S | * | . | trans | -53.8 | 113.7 | 176.6 | -53.9 | 0 | 0 | 0 | 0 | 109.8 | K115 G119 L120 | K115-C117 PolarHBondContact O-N 3.22Å; K115-C117 VanDerWaalsContact O-N 3.13Å; C117-G119 PolarHBondContact O-N 3.35Å; C117-L120 PolarHBondContact O-N 3.46Å | ||
| 118 | P | 68.8 | Low | 67.9 | Low | 132 Ų | 132 | 94.7 Ų | 94.7 | 86% | 0.857 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | 136 | -178.9 | 25.8 | -33.1 | 0 | 0 | 0 | 109.5 | K116 | K116-P118 VanDerWaalsContact O-CD 3.31Å; K116-P118 WeakPolarHBondContact O-CD 3.21Å |
| 119 | G | 83.2 | Confident | 70.9 | Confident | 25 Ų | 25 | 88.5 Ų | 88.5 | 26% | 0.258 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.4 | 1.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | C117 G121 L122 F123 | C117-G119 PolarHBondContact O-N 3.35Å; G119-G121 PolarHBondContact O-N 2.82Å; G119-G121 VanDerWaalsContact O-N 3.17Å; G119-L122 WeakPolarHBondContact O-CA 3.38Å; G119-L122 WeakPolarHBondContact O-CB 3.34Å; G119-L122 PolarHBondContact O-N 3.04Å; G119-F123 PolarHBondContact O-N 3.03Å |
| 120 | L | 89.6 | Confident | 73.6 | Confident | 76 Ų | 76 | 85.8 Ų | 85.8 | 40% | 0.398 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -55.2 | -35.9 | 175.5 | -176.6 | 66.8 | 0 | 0 | 0 | 112.6 | C117 F123 Y124 | C117-L120 PolarHBondContact O-N 3.46Å; L120-F123 PolarHBondContact O-N 3.04Å; L120-Y124 HydrophobicContact CD1-CE2 4.19Å; L120-Y124 HydrophobicContact CD2-CE2 4.16Å; L120-Y124 HydrophobicContact CG-CD2 4.33Å; L120-Y124 HydrophobicContact CG-CE2 3.8Å; L120-Y124 VanDerWaalsContact O-CD2 3.32Å; L120-Y124 WeakPolarHBondContact O-CD2 3.31Å; L120-Y124 PolarHBondContact O-N 2.92Å; L120-Y124 VanDerWaalsContact O-N 3.13Å |
| 121 | G | 90.3 | Very high | 76.4 | Confident | 0 Ų | 0 | 81.8 Ų | 81.8 | 0% | 0 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -73.2 | -26.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | G119 A125 A355 | G119-G121 PolarHBondContact O-N 2.82Å; G119-G121 VanDerWaalsContact O-N 3.17Å; G121-A125 WeakPolarHBondContact O-CB 3.36Å; G121-A125 PolarHBondContact O-N 3.44Å; G121-A355 VanDerWaalsContact O-CB 3.25Å; G121-A355 WeakPolarHBondContact O-CB 3.05Å |
| 122 | L | 91.6 | Very high | 79.1 | Confident | 48 Ų | 48 | 74.4 Ų | 74.4 | 25% | 0.251 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -70.9 | -40.2 | 171.3 | -85.3 | 61.3 | 0 | 0 | 0 | 110.4 | G119 Y124 A125 L126 E359 P363 M367 | G119-L122 WeakPolarHBondContact O-CA 3.38Å; G119-L122 WeakPolarHBondContact O-CB 3.34Å; G119-L122 PolarHBondContact O-N 3.04Å; L122-Y124 PolarHBondContact O-N 2.88Å; L122-A125 WeakPolarHBondContact O-CB 3.19Å; L122-A125 PolarHBondContact O-N 3.13Å; L122-A125 VanDerWaalsContact O-N 3.11Å; L122-L126 PolarHBondContact O-N 3.07Å; L122-E359 HydrophobicContact CD1-CB 4.22Å; L122-E359 HydrophobicContact CD1-CG 3.65Å; L122-P363 HydrophobicContact CD1-CB 3.79Å; L122-P363 HydrophobicContact CD2-CB 4.47Å; L122-P363 HydrophobicContact CG-CB 4.29Å; L122-M367 HydrophobicContact CB-CG 4.06Å; L122-M367 HydrophobicContact CB-SD 4.15Å; L122-M367 HydrophobicContact CD2-CE 4.39Å; L122-M367 HydrophobicContact CD2-SD 4.4Å; L122-M367 HydrophobicContact CG-CG 3.94Å; L122-M367 HydrophobicContact CG-SD 4.26Å |
| 123 | F | 94.1 | Very high | 81.6 | Confident | 119 Ų | 119 | 67.4 Ų | 67.4 | 52% | 0.522 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.8 | -45.7 | 173.1 | 178.7 | -99.9 | 0 | 0 | 0 | 111.8 | G119 L120 A125 L126 L127 | G119-F123 PolarHBondContact O-N 3.03Å; L120-F123 PolarHBondContact O-N 3.04Å; F123-A125 VanDerWaalsContact C-N 3.31Å; F123-A125 PolarHBondContact O-N 3.01Å; F123-L126 PolarHBondContact O-N 3.44Å; F123-L127 HydrophobicContact CE1-CD2 4.25Å; F123-L127 WeakPolarHBondContact O-CB 3.46Å; F123-L127 PolarHBondContact O-N 2.94Å |
| 124 | Y | 94 | Very high | 84.5 | Confident | 49 Ų | 49 | 61.3 Ų | 61.3 | 19% | 0.192 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.5 | -33.9 | 172.7 | -68 | -42.6 | 0 | 0 | 0 | 113 | L120 L122 A128 F351 K354 I358 | L120-Y124 HydrophobicContact CD1-CE2 4.19Å; L120-Y124 HydrophobicContact CD2-CE2 4.16Å; L120-Y124 HydrophobicContact CG-CD2 4.33Å; L120-Y124 HydrophobicContact CG-CE2 3.8Å; L120-Y124 VanDerWaalsContact O-CD2 3.32Å; L120-Y124 WeakPolarHBondContact O-CD2 3.31Å; L120-Y124 PolarHBondContact O-N 2.92Å; L120-Y124 VanDerWaalsContact O-N 3.13Å; L122-Y124 PolarHBondContact O-N 2.88Å; Y124-A128 WeakPolarHBondContact O-CB 3.01Å; Y124-A128 PolarHBondContact O-N 3.39Å; Y124-F351 AromaticContact CD1-CD1 3.54Å; Y124-F351 HydrophobicContact CD1-CD1 3.54Å; Y124-F351 AromaticContact CD1-CE1 3.94Å; Y124-F351 HydrophobicContact CD1-CE1 3.94Å; Y124-F351 HydrophobicContact CD1-CG 4.2Å; Y124-F351 AromaticContact CE1-CD1 3.93Å; Y124-F351 HydrophobicContact CE1-CD1 3.93Å; Y124-F351 AromaticContact CE1-CE1 3.9Å; Y124-F351 HydrophobicContact CE1-CE1 3.9Å; Y124-F351 HydrophobicContact CG-CD1 4.28Å; Y124-K354 HydrophobicContact CD2-CB 4.17Å; Y124-K354 HydrophobicContact CE2-CD 4.33Å; Y124-I358 HydrophobicContact CD2-CD1 3.91Å; Y124-I358 HydrophobicContact CE2-CD1 3.89Å |
| 125 | A | 94.3 | Very high | 86.9 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.1 | -42.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G121 L122 F123 T129 A355 V364 M367 | G121-A125 WeakPolarHBondContact O-CB 3.36Å; G121-A125 PolarHBondContact O-N 3.44Å; L122-A125 WeakPolarHBondContact O-CB 3.19Å; L122-A125 PolarHBondContact O-N 3.13Å; L122-A125 VanDerWaalsContact O-N 3.11Å; F123-A125 VanDerWaalsContact C-N 3.31Å; F123-A125 PolarHBondContact O-N 3.01Å; A125-T129 WeakPolarHBondContact O-CB 3.4Å; A125-T129 PolarHBondContact O-N 2.92Å; A125-T129 PolarHBondContact O-OG1 3.13Å; A125-A355 HydrophobicContact CB-CB 3.93Å; A125-V364 HydrophobicContact CB-CB 4.39Å; A125-V364 HydrophobicContact CB-CG1 3.91Å; A125-V364 HydrophobicContact CB-CG2 4.36Å; A125-M367 HydrophobicContact CB-CB 3.72Å; A125-M367 HydrophobicContact CB-CG 4.01Å |
| 126 | L | 95.7 | Very high | 89.4 | Confident | 69 Ų | 69 | 48.6 Ų | 48.6 | 36% | 0.361 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.6 | -50.6 | 175.7 | -173.2 | 77.8 | 0 | 0 | 0 | 111 | L122 F123 A128 T129 V130 V370 | L122-L126 PolarHBondContact O-N 3.07Å; F123-L126 PolarHBondContact O-N 3.44Å; L126-A128 PolarHBondContact O-N 3.36Å; L126-T129 WeakPolarHBondContact O-CA 3.38Å; L126-T129 WeakPolarHBondContact O-CB 3.49Å; L126-T129 PolarHBondContact O-N 3.13Å; L126-T129 VanDerWaalsContact O-N 3.07Å; L126-V130 PolarHBondContact O-N 3.32Å; L126-V370 HydrophobicContact CD1-CG2 4.13Å |
| 127 | L | 95.9 | Very high | 91.3 | Very high | 47 Ų | 47 | 40.3 Ų | 40.3 | 25% | 0.246 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.4 | -39.4 | -179.4 | -175.7 | 57.7 | 0 | 0 | 0 | 112.1 | F123 T129 F131 F351 | F123-L127 HydrophobicContact CE1-CD2 4.25Å; F123-L127 WeakPolarHBondContact O-CB 3.46Å; F123-L127 PolarHBondContact O-N 2.94Å; L127-T129 VanDerWaalsContact C-N 3.33Å; L127-F131 HydrophobicContact CD1-CE1 3.85Å; L127-F131 HydrophobicContact CD1-CE2 4.17Å; L127-F131 HydrophobicContact CD1-CZ 3.66Å; L127-F131 HydrophobicContact CG-CE2 4.12Å; L127-F131 HydrophobicContact CG-CZ 4.11Å; L127-F131 WeakPolarHBondContact O-CG 3.35Å; L127-F131 PolarHBondContact O-N 3.07Å; L127-F351 HydrophobicContact CB-CD2 4.5Å; L127-F351 HydrophobicContact CD2-CD2 3.8Å; L127-F351 HydrophobicContact CD2-CE2 3.42Å; L127-F351 VanDerWaalsContact CD2-CE2 3.42Å; L127-F351 HydrophobicContact CD2-CZ 3.97Å; L127-F351 HydrophobicContact CG-CD2 3.9Å; L127-F351 HydrophobicContact CG-CE2 3.92Å |
| 128 | A | 96.1 | Very high | 93 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.008 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.3 | -44.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y124 L126 F131 F132 G348 F351 L352 | Y124-A128 WeakPolarHBondContact O-CB 3.01Å; Y124-A128 PolarHBondContact O-N 3.39Å; L126-A128 PolarHBondContact O-N 3.36Å; A128-F131 PolarHBondContact O-N 3.4Å; A128-F132 HydrophobicContact CB-CD2 4.43Å; A128-F132 HydrophobicContact CB-CE2 4.41Å; A128-F132 WeakPolarHBondContact O-CD2 3.38Å; A128-F132 PolarHBondContact O-N 2.95Å; A128-G348 WeakPolarHBondContact CB-O 3.2Å; A128-F351 HydrophobicContact CB-CB 3.91Å; A128-L352 HydrophobicContact CB-CB 3.95Å |
| 129 | T | 95 | Very high | 94.2 | Very high | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.006 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.1 | -51.8 | -180 | -60.3 | 0 | 0 | 0 | 0 | 111.1 | A125 L126 L127 F131 F132 S133 V370 D371 | A125-T129 WeakPolarHBondContact O-CB 3.4Å; A125-T129 PolarHBondContact O-N 2.92Å; A125-T129 PolarHBondContact O-OG1 3.13Å; L126-T129 WeakPolarHBondContact O-CA 3.38Å; L126-T129 WeakPolarHBondContact O-CB 3.49Å; L126-T129 PolarHBondContact O-N 3.13Å; L126-T129 VanDerWaalsContact O-N 3.07Å; L127-T129 VanDerWaalsContact C-N 3.33Å; T129-F131 VanDerWaalsContact C-N 3.27Å; T129-F131 PolarHBondContact O-N 3.45Å; T129-F132 PolarHBondContact O-N 2.94Å; T129-S133 PolarHBondContact O-N 3.15Å; T129-S133 PolarHBondContact O-OG 2.84Å; T129-V370 HydrophobicContact CG2-CB 4.07Å; T129-D371 HydrophobicContact CG2-CB 3.59Å |
| 130 | V | 96.9 | Very high | 94.7 | Very high | 51 Ų | 51 | 31.3 Ų | 31.3 | 31% | 0.309 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -54.4 | -43.5 | 177 | 174.2 | 0 | 0 | 0 | 0 | 111.5 | L126 S133 I134 L374 | L126-V130 PolarHBondContact O-N 3.32Å; V130-S133 PolarHBondContact O-N 2.61Å; V130-I134 HydrophobicContact CG1-CD1 3.9Å; V130-I134 VanDerWaalsContact O-CG1 3.28Å; V130-I134 WeakPolarHBondContact O-CG1 3.32Å; V130-I134 PolarHBondContact O-N 2.71Å; V130-L374 HydrophobicContact CG2-CD1 4.14Å |
| 131 | F | 96.8 | Very high | 94.8 | Very high | 42 Ų | 42 | 29.8 Ų | 29.8 | 18% | 0.184 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -66.2 | -40.1 | 176.2 | -66.1 | -13 | 0 | 0 | 0 | 112.9 | L127 A128 T129 I134 I135 L344 A347 F351 | L127-F131 HydrophobicContact CD1-CE1 3.85Å; L127-F131 HydrophobicContact CD1-CE2 4.17Å; L127-F131 HydrophobicContact CD1-CZ 3.66Å; L127-F131 HydrophobicContact CG-CE2 4.12Å; L127-F131 HydrophobicContact CG-CZ 4.11Å; L127-F131 WeakPolarHBondContact O-CG 3.35Å; L127-F131 PolarHBondContact O-N 3.07Å; A128-F131 PolarHBondContact O-N 3.4Å; T129-F131 VanDerWaalsContact C-N 3.27Å; T129-F131 PolarHBondContact O-N 3.45Å; F131-I134 PolarHBondContact O-N 3.23Å; F131-I135 WeakPolarHBondContact O-CB 3.43Å; F131-I135 VanDerWaalsContact O-CD1 3.31Å; F131-I135 WeakPolarHBondContact O-CD1 3.36Å; F131-I135 WeakPolarHBondContact O-CG1 3.47Å; F131-I135 PolarHBondContact O-N 3.27Å; F131-L344 HydrophobicContact CB-CB 4.5Å; F131-L344 HydrophobicContact CD1-CD2 3.83Å; F131-L344 HydrophobicContact CE1-CD2 4.09Å; F131-L344 HydrophobicContact CG-CD2 4.1Å; F131-A347 HydrophobicContact CD2-CB 3.82Å; F131-A347 HydrophobicContact CE2-CB 3.63Å; F131-F351 HydrophobicContact CD2-CD2 4.34Å; F131-F351 HydrophobicContact CE2-CD2 4.02Å; F131-F351 AromaticContact CE2-CE2 3.83Å; F131-F351 HydrophobicContact CE2-CE2 3.83Å |
| 132 | F | 95.4 | Very high | 94.8 | Very high | 26 Ų | 26 | 30 Ų | 30 | 11% | 0.114 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -65.5 | -38.9 | 175.2 | -79.3 | -68.1 | 0 | 0 | 0 | 112.6 | A128 T129 I135 S136 Q349 L352 | A128-F132 HydrophobicContact CB-CD2 4.43Å; A128-F132 HydrophobicContact CB-CE2 4.41Å; A128-F132 WeakPolarHBondContact O-CD2 3.38Å; A128-F132 PolarHBondContact O-N 2.95Å; T129-F132 PolarHBondContact O-N 2.94Å; F132-I135 HydrophobicContact CD1-CD1 4.42Å; F132-I135 PolarHBondContact O-N 3.3Å; F132-S136 PolarHBondContact O-N 3.36Å; F132-S136 PolarHBondContact O-OG 3.29Å; F132-Q349 HydrophobicContact CZ-CB 4.31Å; F132-L352 HydrophobicContact CE2-CB 4.05Å; F132-L352 HydrophobicContact CE2-CD2 3.78Å; F132-L352 HydrophobicContact CZ-CD2 4.19Å |
| 133 | S | 96.1 | Very high | 94.3 | Very high | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.014 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.8 | -41.6 | 176.1 | -43.7 | 0 | 0 | 0 | 0 | 112.1 | T129 V130 S136 L137 D371 | T129-S133 PolarHBondContact O-N 3.15Å; T129-S133 PolarHBondContact O-OG 2.84Å; V130-S133 PolarHBondContact O-N 2.61Å; S133-S136 PolarHBondContact O-N 3.19Å; S133-L137 PolarHBondContact O-N 2.94Å; S133-D371 PolarHBondContact N-OD1 2.98Å; S133-D371 WeakPolarHBondContact OG-CA 3.36Å; S133-D371 PolarHBondContact OG-OD1 2.93Å |
| 134 | I | 96.8 | Very high | 93.5 | Very high | 50 Ų | 50 | 34.1 Ų | 34.1 | 26% | 0.256 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -63.5 | -44.9 | 173.9 | -66.3 | 165 | 0 | 0 | 0 | 110.2 | V130 F131 S136 L137 L138 L344 F378 | V130-I134 HydrophobicContact CG1-CD1 3.9Å; V130-I134 VanDerWaalsContact O-CG1 3.28Å; V130-I134 WeakPolarHBondContact O-CG1 3.32Å; V130-I134 PolarHBondContact O-N 2.71Å; F131-I134 PolarHBondContact O-N 3.23Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 2.88Å; I134-L137 WeakPolarHBondContact O-CB 3.17Å; I134-L137 PolarHBondContact O-N 3.46Å; I134-L138 HydrophobicContact CG2-CD1 3.97Å; I134-L138 HydrophobicContact CG2-CG 4.23Å; I134-L138 VanDerWaalsContact O-CG 3.3Å; I134-L138 WeakPolarHBondContact O-CG 3.31Å; I134-L138 PolarHBondContact O-N 2.97Å; I134-L344 HydrophobicContact CB-CD1 4.23Å; I134-L344 HydrophobicContact CG2-CD1 3.55Å; I134-F378 HydrophobicContact CG1-CE2 4.21Å; I134-F378 HydrophobicContact CG1-CZ 4.14Å |
| 135 | I | 96.6 | Very high | 93.1 | Very high | 1 Ų | 1 | 32.8 Ų | 32.8 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.1 | -46.7 | 175.5 | -71.6 | 160.8 | 0 | 0 | 0 | 111 | F131 F132 L137 L138 V139 Y198 I341 L344 | F131-I135 WeakPolarHBondContact O-CB 3.43Å; F131-I135 VanDerWaalsContact O-CD1 3.31Å; F131-I135 WeakPolarHBondContact O-CD1 3.36Å; F131-I135 WeakPolarHBondContact O-CG1 3.47Å; F131-I135 PolarHBondContact O-N 3.27Å; F132-I135 HydrophobicContact CD1-CD1 4.42Å; F132-I135 PolarHBondContact O-N 3.3Å; I135-L137 VanDerWaalsContact C-N 3.33Å; I135-L137 PolarHBondContact O-N 3.49Å; I135-L138 PolarHBondContact O-N 2.74Å; I135-L138 VanDerWaalsContact O-N 3.15Å; I135-V139 HydrophobicContact CG2-CG2 4.11Å; I135-V139 WeakPolarHBondContact O-CB 3.2Å; I135-V139 VanDerWaalsContact O-CG2 3.24Å; I135-V139 WeakPolarHBondContact O-CG2 3.28Å; I135-V139 PolarHBondContact O-N 3.07Å; I135-Y198 HydrophobicContact CG2-CE1 3.91Å; I135-Y198 VanDerWaalsContact CG2-OH 3.24Å; I135-Y198 WeakPolarHBondContact CG2-OH 3.44Å; I135-I341 HydrophobicContact CG2-CG2 4.16Å; I135-L344 HydrophobicContact CD1-CB 3.81Å; I135-L344 HydrophobicContact CG1-CB 3.74Å; I135-L344 HydrophobicContact CG1-CD1 4.36Å |
| 136 | S | 95.1 | Very high | 92.9 | Very high | 5 Ų | 5 | 34.7 Ų | 34.7 | 4% | 0.035 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.7 | -37.3 | 179.9 | -66 | 0 | 0 | 0 | 0 | 112.5 | F132 S133 I134 K140 V201 | F132-S136 PolarHBondContact O-N 3.36Å; F132-S136 PolarHBondContact O-OG 3.29Å; S133-S136 PolarHBondContact O-N 3.19Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 2.88Å; S136-K140 PolarHBondContact O-N 2.88Å; S136-K140 VanDerWaalsContact O-N 3.08Å; S136-V201 WeakPolarHBondContact O-CG1 3.22Å |
| 137 | L | 95.9 | Very high | 92.7 | Very high | 11 Ų | 11 | 31.4 Ų | 31.4 | 6% | 0.058 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.1 | -50.1 | 169.1 | 166.9 | 61.9 | 0 | 0 | 0 | 111.6 | S133 I134 I135 V139 K140 T141 L206 F378 F382 F383 | S133-L137 PolarHBondContact O-N 2.94Å; I134-L137 WeakPolarHBondContact O-CB 3.17Å; I134-L137 PolarHBondContact O-N 3.46Å; I135-L137 VanDerWaalsContact C-N 3.33Å; I135-L137 PolarHBondContact O-N 3.49Å; L137-V139 VanDerWaalsContact C-N 3.33Å; L137-V139 PolarHBondContact O-N 2.96Å; L137-K140 WeakPolarHBondContact O-CB 3.3Å; L137-K140 PolarHBondContact O-N 2.96Å; L137-K140 VanDerWaalsContact O-N 3.1Å; L137-T141 HydrophobicContact CD1-CG2 4.19Å; L137-T141 WeakPolarHBondContact O-CG2 3.29Å; L137-T141 PolarHBondContact O-N 3.44Å; L137-L206 HydrophobicContact CB-CD2 4.33Å; L137-F378 HydrophobicContact CB-CB 4.43Å; L137-F378 HydrophobicContact CB-CD2 4.04Å; L137-F378 HydrophobicContact CB-CG 4.42Å; L137-F378 HydrophobicContact CD1-CB 4.35Å; L137-F378 HydrophobicContact CD2-CB 4.17Å; L137-F378 HydrophobicContact CD2-CD1 4.13Å; L137-F378 HydrophobicContact CD2-CD2 4.09Å; L137-F378 HydrophobicContact CD2-CG 3.89Å; L137-F382 HydrophobicContact CD1-CB 3.88Å; L137-F382 HydrophobicContact CD1-CD1 4.41Å; L137-F382 HydrophobicContact CD1-CD2 4.07Å; L137-F382 HydrophobicContact CD1-CG 3.86Å; L137-F382 HydrophobicContact CD2-CD1 4.35Å; L137-F382 HydrophobicContact CD2-CD2 3.68Å; L137-F382 HydrophobicContact CD2-CE1 4.27Å; L137-F382 HydrophobicContact CD2-CE2 3.59Å; L137-F382 HydrophobicContact CD2-CG 4.07Å; L137-F382 HydrophobicContact CD2-CZ 3.9Å; L137-F383 HydrophobicContact CD1-CE2 3.53Å; L137-F383 HydrophobicContact CD1-CZ 3.96Å |
| 138 | L | 94.9 | Very high | 92.5 | Very high | 26 Ų | 26 | 29.7 Ų | 29.7 | 14% | 0.136 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.7 | -39.2 | -179.1 | -65.6 | 175.6 | 0 | 0 | 0 | 112.1 | I134 I135 K140 T141 I142 I337 L340 I341 L344 | I134-L138 HydrophobicContact CG2-CD1 3.97Å; I134-L138 HydrophobicContact CG2-CG 4.23Å; I134-L138 VanDerWaalsContact O-CG 3.3Å; I134-L138 WeakPolarHBondContact O-CG 3.31Å; I134-L138 PolarHBondContact O-N 2.97Å; I135-L138 PolarHBondContact O-N 2.74Å; I135-L138 VanDerWaalsContact O-N 3.15Å; L138-K140 VanDerWaalsContact C-N 3.32Å; L138-K140 PolarHBondContact O-N 2.69Å; L138-T141 WeakPolarHBondContact CA-OG1 3.5Å; L138-T141 PolarHBondContact O-N 3.26Å; L138-T141 PolarHBondContact O-OG1 2.96Å; L138-I142 PolarHBondContact O-N 2.85Å; L138-I337 HydrophobicContact CB-CG2 3.84Å; L138-I337 HydrophobicContact CD2-CG2 4.11Å; L138-I337 HydrophobicContact CG-CG2 4.39Å; L138-L340 HydrophobicContact CD1-CB 4.3Å; L138-L340 HydrophobicContact CD1-CD2 3.65Å; L138-L340 HydrophobicContact CD1-CG 3.77Å; L138-I341 HydrophobicContact CB-CD1 3.85Å; L138-I341 HydrophobicContact CB-CG1 3.71Å; L138-I341 HydrophobicContact CD1-CG1 4.06Å; L138-L344 HydrophobicContact CD1-CD1 4.17Å |
| 139 | V | 94.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.9 | -38.9 | 173.4 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | I135 L137 T141 I142 I150 Y198 V201 Q202 I341 | I135-V139 HydrophobicContact CG2-CG2 4.11Å; I135-V139 WeakPolarHBondContact O-CB 3.2Å; I135-V139 VanDerWaalsContact O-CG2 3.24Å; I135-V139 WeakPolarHBondContact O-CG2 3.28Å; I135-V139 PolarHBondContact O-N 3.07Å; L137-V139 VanDerWaalsContact C-N 3.33Å; L137-V139 PolarHBondContact O-N 2.96Å; V139-T141 VanDerWaalsContact C-N 3.34Å; V139-I142 PolarHBondContact O-N 3.07Å; V139-I150 HydrophobicContact CG1-CD1 4.47Å; V139-I150 HydrophobicContact CG2-CG2 4.16Å; V139-Y198 HydrophobicContact CG1-CD1 4.36Å; V139-Y198 HydrophobicContact CG1-CD2 4.44Å; V139-Y198 HydrophobicContact CG1-CG 4.04Å; V139-Y198 HydrophobicContact CG2-CD1 4.04Å; V139-Y198 HydrophobicContact CG2-CD2 4.1Å; V139-Y198 HydrophobicContact CG2-CE1 3.92Å; V139-Y198 HydrophobicContact CG2-CE2 3.98Å; V139-Y198 HydrophobicContact CG2-CG 4.12Å; V139-V201 HydrophobicContact CB-CG1 4.46Å; V139-V201 HydrophobicContact CG1-CG1 4.16Å; V139-Q202 HydrophobicContact CG1-CG 4.45Å; V139-I341 HydrophobicContact CG2-CD1 3.94Å |
| 140 | K | 93.2 | Very high | 92.1 | Very high | 34 Ų | 34 | 29.9 Ų | 29.9 | 15% | 0.148 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -68.6 | -30.1 | 175.2 | -170.1 | 71.2 | -169.5 | -179.1 | 0 | 112.8 | S136 L137 L138 I142 V201 Q202 M204 F383 | S136-K140 PolarHBondContact O-N 2.88Å; S136-K140 VanDerWaalsContact O-N 3.08Å; L137-K140 WeakPolarHBondContact O-CB 3.3Å; L137-K140 PolarHBondContact O-N 2.96Å; L137-K140 VanDerWaalsContact O-N 3.1Å; L138-K140 VanDerWaalsContact C-N 3.32Å; L138-K140 PolarHBondContact O-N 2.69Å; K140-I142 VanDerWaalsContact C-N 3.29Å; K140-I142 PolarHBondContact O-N 2.84Å; K140-V201 HydrophobicContact CB-CG1 3.76Å; K140-V201 HydrophobicContact CD-CG1 4.04Å; K140-V201 WeakPolarHBondContact CD-O 3.41Å; K140-V201 WeakPolarHBondContact CE-O 3.44Å; K140-V201 HydrophobicContact CG-CG1 4.47Å; K140-V201 PolarHBondContact NZ-O 3.47Å; K140-Q202 PolarHBondContact NZ-O 2.97Å; K140-M204 PolarHBondContact NZ-O 3.45Å; K140-F383 HydrophobicContact CB-CE2 4.31Å; K140-F383 HydrophobicContact CB-CZ 3.71Å; K140-F383 HydrophobicContact CG-CE1 3.79Å; K140-F383 HydrophobicContact CG-CE2 3.94Å; K140-F383 HydrophobicContact CG-CZ 3.33Å |
| 141 | T | 91.8 | Very high | 92 | Very high | 44 Ų | 44 | 27.5 Ų | 27.5 | 27% | 0.27 | 16% | 0.156 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -4.7 | 177.3 | 60.7 | 0 | 0 | 0 | 0 | 114.9 | L137 L138 V139 F383 | L137-T141 HydrophobicContact CD1-CG2 4.19Å; L137-T141 WeakPolarHBondContact O-CG2 3.29Å; L137-T141 PolarHBondContact O-N 3.44Å; L138-T141 WeakPolarHBondContact CA-OG1 3.5Å; L138-T141 PolarHBondContact O-N 3.26Å; L138-T141 PolarHBondContact O-OG1 2.96Å; V139-T141 VanDerWaalsContact C-N 3.34Å; T141-F383 HydrophobicContact CG2-CE1 4.36Å; T141-F383 HydrophobicContact CG2-CZ 3.93Å |
| 142 | I | 89.5 | Confident | 91.8 | Very high | 4 Ų | 4 | 26 Ų | 26 | 2% | 0.021 | 15% | 0.152 | C | C | . | . | trans | -94 | 108 | 175.1 | -67.1 | 170.9 | 0 | 0 | 0 | 108.9 | L138 V139 K140 L145 I150 Q202 I337 L338 I341 | L138-I142 PolarHBondContact O-N 2.85Å; V139-I142 PolarHBondContact O-N 3.07Å; K140-I142 VanDerWaalsContact C-N 3.29Å; K140-I142 PolarHBondContact O-N 2.84Å; I142-L145 HydrophobicContact CG2-CB 3.75Å; I142-L145 HydrophobicContact CG2-CD1 3.77Å; I142-L145 HydrophobicContact CG2-CG 4Å; I142-I150 HydrophobicContact CB-CD1 4.12Å; I142-I150 HydrophobicContact CD1-CD1 4.15Å; I142-I150 HydrophobicContact CG2-CD1 3.85Å; I142-Q202 PolarHBondContact O-NE2 2.88Å; I142-I337 HydrophobicContact CD1-CB 4.4Å; I142-I337 HydrophobicContact CD1-CG2 3.81Å; I142-I337 HydrophobicContact CG1-CG2 3.98Å; I142-L338 HydrophobicContact CD1-CD2 3.93Å; I142-L338 HydrophobicContact CD1-CG 4.09Å; I142-I341 HydrophobicContact CD1-CD1 3.65Å | ||
| 143 | E | 81.2 | Confident | 91.7 | Very high | 171 Ų | 171 | 26.1 Ų | 26.1 | 80% | 0.799 | 15% | 0.153 | S | C | * | . | trans | -95.5 | 150.6 | 171.9 | -64.4 | 176.5 | -173.4 | 0 | 0 | 110.2 | L145 | E143-L145 VanDerWaalsContact C-N 3.28Å; E143-L145 PolarHBondContact O-N 3.26Å | ||
| 144 | G | 78.2 | Confident | 91.5 | Very high | 82 Ų | 82 | 26.1 Ų | 26.1 | 85% | 0.845 | 15% | 0.153 | S | C | * | . | S | Bend | trans | 77.7 | -9.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 145 | L | 85.6 | Confident | 91.5 | Very high | 22 Ų | 22 | 23.8 Ų | 23.8 | 12% | 0.115 | 14% | 0.141 | C | C | . | . | S | Bend | trans | -107.9 | 142.2 | 173.1 | -58.8 | 177.5 | 0 | 0 | 0 | 111.2 | I142 E143 I150 Q202 N327 P329 L338 | I142-L145 HydrophobicContact CG2-CB 3.75Å; I142-L145 HydrophobicContact CG2-CD1 3.77Å; I142-L145 HydrophobicContact CG2-CG 4Å; E143-L145 VanDerWaalsContact C-N 3.28Å; E143-L145 PolarHBondContact O-N 3.26Å; L145-I150 HydrophobicContact CB-CG1 4.49Å; L145-Q202 PolarHBondContact O-NE2 3.13Å; L145-N327 WeakPolarHBondContact CD2-O 3.32Å; L145-P329 HydrophobicContact CD1-CB 3.97Å; L145-P329 HydrophobicContact CD1-CG 3.57Å; L145-P329 HydrophobicContact CD2-CB 4.16Å; L145-P329 HydrophobicContact CD2-CG 4.23Å; L145-L338 HydrophobicContact CD1-CD1 4.06Å |
| 146 | H | 89.1 | Confident | 91.4 | Very high | 40 Ų | 40 | 28.2 Ų | 28.2 | 19% | 0.185 | 16% | 0.16 | C | C | . | . | trans | -81.8 | 141.6 | -177.1 | -165 | -122.9 | 0 | 0 | 0 | 111.9 | I148 E149 I150 Y199 | H146-I148 VanDerWaalsContact CE1-CD1 3.46Å; H146-I148 WeakPolarHBondContact CE1-CD1 3.46Å; H146-I148 PolarHBondContact O-N 2.65Å; H146-E149 HydrophobicContact CB-CG 4.29Å; H146-E149 PolarHBondContact N-OE2 3.15Å; H146-E149 WeakPolarHBondContact O-CB 3.29Å; H146-E149 PolarHBondContact O-N 3.34Å; H146-I150 PolarHBondContact O-N 3.03Å; H146-Y199 AromaticContact NE2-CD2 3.59Å; H146-Y199 AromaticContact NE2-CE2 3.47Å; H146-Y199 WeakPolarHBondContact NE2-CE2 3.36Å | ||
| 147 | A | 91.3 | Very high | 91.3 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -50.3 | -29.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | S151 Y199 | A147-S151 WeakPolarHBondContact O-CB 3.41Å; A147-S151 PolarHBondContact O-N 3.01Å; A147-S151 PolarHBondContact O-OG 3.29Å; A147-Y199 HydrophobicContact CB-CD2 4.42Å; A147-Y199 VanDerWaalsContact CB-N 3.33Å |
| 148 | I | 92 | Very high | 91.3 | Very high | 10 Ų | 10 | 30.3 Ų | 30.3 | 5% | 0.051 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.5 | -35.3 | 177.2 | -56.8 | 172.3 | 0 | 0 | 0 | 111.2 | H146 S151 A152 I195 C316 T319 T320 L323 | H146-I148 VanDerWaalsContact CE1-CD1 3.46Å; H146-I148 WeakPolarHBondContact CE1-CD1 3.46Å; H146-I148 PolarHBondContact O-N 2.65Å; I148-S151 CarbonylContact O-C 3.57Å; I148-S151 WeakPolarHBondContact O-CB 3.25Å; I148-S151 PolarHBondContact O-N 3.5Å; I148-A152 WeakPolarHBondContact O-CB 3.47Å; I148-A152 PolarHBondContact O-N 3.24Å; I148-I195 HydrophobicContact CG1-CG2 3.9Å; I148-C316 HydrophobicContact CG2-CB 3.75Å; I148-T319 HydrophobicContact CD1-CG2 3.57Å; I148-T320 VanDerWaalsContact CG2-OG1 3.28Å; I148-T320 WeakPolarHBondContact CG2-OG1 3.39Å; I148-L323 HydrophobicContact CD1-CD1 3.45Å; I148-L323 VanDerWaalsContact CD1-CD1 3.45Å |
| 149 | E | 90.3 | Very high | 91.2 | Very high | 5 Ų | 5 | 31.3 Ų | 31.3 | 2% | 0.023 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -72.9 | -42.7 | 179.1 | -54.2 | 178.2 | 103.9 | 0 | 0 | 110.9 | H146 S151 A152 I153 N327 | H146-E149 HydrophobicContact CB-CG 4.29Å; H146-E149 PolarHBondContact N-OE2 3.15Å; H146-E149 WeakPolarHBondContact O-CB 3.29Å; H146-E149 PolarHBondContact O-N 3.34Å; E149-S151 PolarHBondContact O-N 2.86Å; E149-A152 WeakPolarHBondContact O-CB 3.32Å; E149-A152 PolarHBondContact O-N 2.88Å; E149-A152 VanDerWaalsContact O-N 3.16Å; E149-I153 WeakPolarHBondContact O-CG1 3.43Å; E149-I153 PolarHBondContact O-N 3.48Å; E149-N327 VanDerWaalsContact OE1-C 3.22Å; E149-N327 WeakPolarHBondContact OE1-CA 3.44Å; E149-N327 PolarHBondContact OE1-N 3.36Å |
| 150 | I | 92.5 | Very high | 91.2 | Very high | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.01 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.8 | -39.4 | 171.3 | -53.1 | 176.9 | 0 | 0 | 0 | 110.1 | V139 I142 L145 H146 R154 Y198 L338 I341 | V139-I150 HydrophobicContact CG1-CD1 4.47Å; V139-I150 HydrophobicContact CG2-CG2 4.16Å; I142-I150 HydrophobicContact CB-CD1 4.12Å; I142-I150 HydrophobicContact CD1-CD1 4.15Å; I142-I150 HydrophobicContact CG2-CD1 3.85Å; L145-I150 HydrophobicContact CB-CG1 4.49Å; H146-I150 PolarHBondContact O-N 3.03Å; I150-R154 WeakPolarHBondContact O-CB 3.45Å; I150-R154 PolarHBondContact O-N 3.11Å; I150-R154 VanDerWaalsContact O-N 3.16Å; I150-Y198 HydrophobicContact CB-CD2 4.25Å; I150-Y198 HydrophobicContact CB-CE2 4.47Å; I150-Y198 HydrophobicContact CG2-CD2 3.97Å; I150-Y198 HydrophobicContact CG2-CE2 3.81Å; I150-L338 HydrophobicContact CB-CD2 4.21Å; I150-L338 HydrophobicContact CG1-CD2 4.13Å; I150-L338 HydrophobicContact CG2-CD2 3.87Å; I150-I341 HydrophobicContact CG2-CD1 4.14Å; I150-I341 HydrophobicContact CG2-CG2 4.36Å |
| 151 | S | 94.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -68.1 | -43.7 | 174.6 | -61.7 | 0 | 0 | 0 | 0 | 112.6 | A147 I148 E149 R154 C155 Y198 C316 | A147-S151 WeakPolarHBondContact O-CB 3.41Å; A147-S151 PolarHBondContact O-N 3.01Å; A147-S151 PolarHBondContact O-OG 3.29Å; I148-S151 CarbonylContact O-C 3.57Å; I148-S151 WeakPolarHBondContact O-CB 3.25Å; I148-S151 PolarHBondContact O-N 3.5Å; E149-S151 PolarHBondContact O-N 2.86Å; S151-R154 PolarHBondContact O-N 2.89Å; S151-C155 WeakPolarHBondContact O-CB 2.75Å; S151-C155 PolarHBondContact O-N 2.98Å; S151-C155 PolarHBondContact O-SG 2.89Å; S151-C155 VanDerWaalsContact O-SG 3.37Å; S151-Y198 VanDerWaalsContact OG-CD2 3.29Å; S151-Y198 WeakPolarHBondContact OG-CD2 3.4Å; S151-C316 VanDerWaalsContact CB-SG 3.56Å |
| 152 | A | 93.4 | Very high | 91.1 | Very high | 12 Ų | 12 | 37.8 Ų | 37.8 | 10% | 0.099 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.8 | -48.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | I148 E149 R154 C155 F156 L313 C316 | I148-A152 WeakPolarHBondContact O-CB 3.47Å; I148-A152 PolarHBondContact O-N 3.24Å; E149-A152 WeakPolarHBondContact O-CB 3.32Å; E149-A152 PolarHBondContact O-N 2.88Å; E149-A152 VanDerWaalsContact O-N 3.16Å; A152-R154 PolarHBondContact O-N 3.17Å; A152-C155 PolarHBondContact O-N 3.23Å; A152-F156 WeakPolarHBondContact O-CB 3.34Å; A152-F156 PolarHBondContact O-N 3.47Å; A152-L313 HydrophobicContact CB-CD1 4.45Å; A152-C316 HydrophobicContact CB-CB 3.68Å |
| 153 | I | 92.2 | Very high | 91.2 | Very high | 28 Ų | 28 | 40.5 Ų | 40.5 | 14% | 0.144 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.3 | -44.8 | 178.9 | -67.6 | 170.4 | 0 | 0 | 0 | 110.4 | E149 C155 F156 F157 L328 L338 | E149-I153 WeakPolarHBondContact O-CG1 3.43Å; E149-I153 PolarHBondContact O-N 3.48Å; I153-C155 PolarHBondContact O-N 3.02Å; I153-F156 PolarHBondContact O-N 2.96Å; I153-F157 HydrophobicContact CG2-CD2 3.83Å; I153-F157 HydrophobicContact CG2-CE2 3.89Å; I153-F157 WeakPolarHBondContact O-CD2 3.41Å; I153-F157 PolarHBondContact O-N 3.13Å; I153-F157 VanDerWaalsContact O-N 3.08Å; I153-L328 HydrophobicContact CD1-CG 4.47Å; I153-L338 HydrophobicContact CD1-CD1 3.94Å; I153-L338 HydrophobicContact CD1-CD2 4.28Å; I153-L338 HydrophobicContact CG2-CB 4.33Å |
| 154 | R | 93.9 | Very high | 91.7 | Very high | 2 Ų | 2 | 35.8 Ų | 35.8 | 1% | 0.008 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.6 | -48.2 | 173 | 174 | 172.7 | 171.1 | 171.5 | 6.1 | 111.7 | I150 S151 A152 Q158 M194 Y198 G345 | I150-R154 WeakPolarHBondContact O-CB 3.45Å; I150-R154 PolarHBondContact O-N 3.11Å; I150-R154 VanDerWaalsContact O-N 3.16Å; S151-R154 PolarHBondContact O-N 2.89Å; A152-R154 PolarHBondContact O-N 3.17Å; R154-Q158 WeakPolarHBondContact O-CB 3.4Å; R154-Q158 PolarHBondContact O-N 3.31Å; R154-M194 HydrophobicContact CG-SD 4.49Å; R154-Y198 WeakPolarHBondContact CD-OH 3.36Å; R154-Y198 PolarHBondContact NH1-OH 3.18Å; R154-G345 PolarHBondContact NH2-O 2.8Å |
| 155 | C | 95.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -64.9 | -39.2 | -179.4 | -74.8 | 0 | 0 | 0 | 0 | 112.3 | S151 A152 I153 Q158 M159 L313 | S151-C155 WeakPolarHBondContact O-CB 2.75Å; S151-C155 PolarHBondContact O-N 2.98Å; S151-C155 PolarHBondContact O-SG 2.89Å; S151-C155 VanDerWaalsContact O-SG 3.37Å; A152-C155 PolarHBondContact O-N 3.23Å; I153-C155 PolarHBondContact O-N 3.02Å; C155-Q158 PolarHBondContact O-N 3.36Å; C155-M159 VanDerWaalsContact O-CB 3.31Å; C155-M159 WeakPolarHBondContact O-CB 3.36Å; C155-M159 PolarHBondContact O-N 2.67Å; C155-L313 HydrophobicContact CB-CB 3.99Å |
| 156 | F | 94.7 | Very high | 92.4 | Very high | 95 Ų | 95 | 33.2 Ų | 33.2 | 42% | 0.417 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -60.6 | -53.6 | 175.5 | 176.1 | -98.1 | 0 | 0 | 0 | 112.2 | A152 I153 Q158 M159 L160 L313 | A152-F156 WeakPolarHBondContact O-CB 3.34Å; A152-F156 PolarHBondContact O-N 3.47Å; I153-F156 PolarHBondContact O-N 2.96Å; F156-Q158 VanDerWaalsContact C-N 3.33Å; F156-Q158 PolarHBondContact O-N 2.92Å; F156-M159 HydrophobicContact CD2-CE 4.38Å; F156-M159 WeakPolarHBondContact O-CB 3.48Å; F156-M159 PolarHBondContact O-N 3.02Å; F156-L160 WeakPolarHBondContact O-CB 3.21Å; F156-L160 PolarHBondContact O-N 3.49Å; F156-L313 HydrophobicContact CB-CD1 4.16Å; F156-L313 HydrophobicContact CB-CD2 4.42Å; F156-L313 HydrophobicContact CD2-CD2 4.28Å |
| 157 | F | 93.9 | Very high | 92.3 | Very high | 60 Ų | 60 | 36 Ų | 36 | 26% | 0.263 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -66.5 | -34.3 | 177.6 | -78.8 | -67.1 | 0 | 0 | 0 | 112.5 | I153 L160 F161 M339 A342 | I153-F157 HydrophobicContact CG2-CD2 3.83Å; I153-F157 HydrophobicContact CG2-CE2 3.89Å; I153-F157 WeakPolarHBondContact O-CD2 3.41Å; I153-F157 PolarHBondContact O-N 3.13Å; I153-F157 VanDerWaalsContact O-N 3.08Å; F157-L160 HydrophobicContact CD1-CD2 4.32Å; F157-L160 PolarHBondContact O-N 3.04Å; F157-F161 WeakPolarHBondContact O-CB 3.18Å; F157-F161 PolarHBondContact O-N 3.32Å; F157-M339 HydrophobicContact CD1-CE 4.39Å; F157-M339 HydrophobicContact CD2-SD 4.15Å; F157-M339 HydrophobicContact CE1-CE 4.03Å; F157-M339 HydrophobicContact CE1-SD 3.96Å; F157-M339 HydrophobicContact CE2-SD 3.52Å; F157-M339 VanDerWaalsContact CE2-SD 3.52Å; F157-M339 HydrophobicContact CZ-CE 4.11Å; F157-M339 HydrophobicContact CZ-SD 3.42Å; F157-M339 WeakPolarHBondContact CZ-SD 3.49Å; F157-A342 HydrophobicContact CB-CB 3.75Å; F157-A342 HydrophobicContact CD2-CB 4.11Å; F157-A342 HydrophobicContact CG-CB 4.21Å |
| 158 | Q | 94.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -67.3 | -35.3 | 174.9 | -171.4 | 179.8 | -55.9 | 0 | 0 | 112.3 | R154 C155 F156 V162 V305 A309 I346 | R154-Q158 WeakPolarHBondContact O-CB 3.4Å; R154-Q158 PolarHBondContact O-N 3.31Å; C155-Q158 PolarHBondContact O-N 3.36Å; F156-Q158 VanDerWaalsContact C-N 3.33Å; F156-Q158 PolarHBondContact O-N 2.92Å; Q158-V162 VanDerWaalsContact O-CB 3.32Å; Q158-V162 WeakPolarHBondContact O-CB 3.4Å; Q158-V162 WeakPolarHBondContact O-CG2 3.18Å; Q158-V162 PolarHBondContact O-N 3.39Å; Q158-V305 HydrophobicContact CG-CG1 4.12Å; Q158-V305 PolarHBondContact NE2-O 3.43Å; Q158-A309 HydrophobicContact CB-CB 4.11Å; Q158-A309 HydrophobicContact CG-CB 4.06Å; Q158-I346 HydrophobicContact CB-CG1 3.79Å; Q158-I346 HydrophobicContact CG-CG1 3.82Å |
| 159 | M | 93.9 | Very high | 91.8 | Very high | 46 Ų | 46 | 48.8 Ų | 48.8 | 23% | 0.227 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -65 | -51.5 | 171.4 | -174.7 | 179.5 | 67.6 | 0 | 0 | 110.2 | C155 F156 F161 V162 L163 W306 A309 V310 L313 | C155-M159 VanDerWaalsContact O-CB 3.31Å; C155-M159 WeakPolarHBondContact O-CB 3.36Å; C155-M159 PolarHBondContact O-N 2.67Å; F156-M159 HydrophobicContact CD2-CE 4.38Å; F156-M159 WeakPolarHBondContact O-CB 3.48Å; F156-M159 PolarHBondContact O-N 3.02Å; M159-F161 VanDerWaalsContact C-N 3.34Å; M159-F161 PolarHBondContact O-N 3.01Å; M159-V162 PolarHBondContact O-N 3.29Å; M159-L163 WeakPolarHBondContact O-CB 3.47Å; M159-L163 PolarHBondContact O-N 3.02Å; M159-W306 HydrophobicContact CB-CZ3 4.37Å; M159-W306 HydrophobicContact CG-CE3 4.12Å; M159-W306 HydrophobicContact CG-CH2 3.74Å; M159-W306 HydrophobicContact CG-CZ3 3.36Å; M159-W306 WeakPolarHBondContact O-CZ3 3.24Å; M159-W306 HydrophobicContact SD-CH2 4.43Å; M159-A309 HydrophobicContact CB-CB 3.95Å; M159-V310 HydrophobicContact CG-CG2 4.1Å; M159-V310 HydrophobicContact SD-CG2 3.93Å; M159-L313 HydrophobicContact CE-CD2 3.61Å; M159-L313 HydrophobicContact SD-CD2 4.08Å |
| 160 | L | 94.2 | Very high | 91.4 | Very high | 96 Ų | 96 | 57.7 Ų | 57.7 | 50% | 0.503 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -57.4 | -41.7 | -179.1 | -177.3 | 62.9 | 0 | 0 | 0 | 113 | F156 F157 P164 | F156-L160 WeakPolarHBondContact O-CB 3.21Å; F156-L160 PolarHBondContact O-N 3.49Å; F157-L160 HydrophobicContact CD1-CD2 4.32Å; F157-L160 PolarHBondContact O-N 3.04Å; L160-P164 WeakPolarHBondContact O-CD 3.44Å |
| 161 | F | 92.2 | Very high | 90.6 | Very high | 118 Ų | 118 | 58.8 Ų | 58.8 | 52% | 0.518 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -78.3 | -33.1 | -179 | -169.7 | -92.5 | 0 | 0 | 0 | 113.6 | F157 M159 P164 L165 I346 | F157-F161 WeakPolarHBondContact O-CB 3.18Å; F157-F161 PolarHBondContact O-N 3.32Å; M159-F161 VanDerWaalsContact C-N 3.34Å; M159-F161 PolarHBondContact O-N 3.01Å; F161-P164 WeakPolarHBondContact O-CD 3.4Å; F161-P164 WeakPolarHBondContact O-CG 3.02Å; F161-L165 HydrophobicContact CD1-CD1 4Å; F161-L165 HydrophobicContact CE1-CD1 3.71Å; F161-I346 HydrophobicContact CB-CD1 3.78Å; F161-I346 HydrophobicContact CD1-CD1 4.45Å; F161-I346 HydrophobicContact CD1-CG2 3.61Å; F161-I346 HydrophobicContact CE1-CG2 4.02Å; F161-I346 HydrophobicContact CG-CD1 4.13Å; F161-I346 HydrophobicContact CG-CG2 4.37Å |
| 162 | V | 91.1 | Very high | 89.6 | Confident | 1 Ų | 1 | 60.6 Ų | 60.6 | 1% | 0.006 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -80.1 | -26.8 | -179.6 | 174.7 | 0 | 0 | 0 | 0 | 112.1 | Q158 M159 L165 L166 V305 W306 | Q158-V162 VanDerWaalsContact O-CB 3.32Å; Q158-V162 WeakPolarHBondContact O-CB 3.4Å; Q158-V162 WeakPolarHBondContact O-CG2 3.18Å; Q158-V162 PolarHBondContact O-N 3.39Å; M159-V162 PolarHBondContact O-N 3.29Å; V162-L165 PolarHBondContact O-N 3.44Å; V162-L166 WeakPolarHBondContact O-CB 3.25Å; V162-L166 PolarHBondContact O-N 3.09Å; V162-V305 HydrophobicContact CG2-CG1 3.92Å; V162-W306 HydrophobicContact CG1-CB 4Å |
| 163 | L | 91.8 | Very high | 88.9 | Confident | 60 Ų | 60 | 64.1 Ų | 64.1 | 31% | 0.314 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -48.8 | -59.2 | 175.6 | 176.6 | 55.4 | 0 | 0 | 0 | 114 | M159 L165 L166 I167 F173 W306 | M159-L163 WeakPolarHBondContact O-CB 3.47Å; M159-L163 PolarHBondContact O-N 3.02Å; L163-L165 VanDerWaalsContact C-N 3.33Å; L163-L165 PolarHBondContact O-N 2.96Å; L163-L166 PolarHBondContact O-N 2.68Å; L163-I167 HydrophobicContact CD1-CD1 3.85Å; L163-I167 HydrophobicContact CD1-CG1 4.37Å; L163-I167 HydrophobicContact CG-CD1 4.21Å; L163-I167 WeakPolarHBondContact O-CG1 3.32Å; L163-I167 PolarHBondContact O-N 3.39Å; L163-I167 VanDerWaalsContact O-N 3.1Å; L163-F173 HydrophobicContact CD1-CE1 3.49Å; L163-F173 VanDerWaalsContact CD1-CE1 3.49Å; L163-F173 HydrophobicContact CD1-CZ 3.75Å; L163-W306 HydrophobicContact CB-CH2 4.41Å; L163-W306 HydrophobicContact CB-CZ3 3.82Å; L163-W306 HydrophobicContact CD1-CH2 4.05Å; L163-W306 HydrophobicContact CD1-CZ3 4.21Å |
| 164 | P | 91.2 | Very high | 88.1 | Confident | 73 Ų | 73 | 67.3 Ų | 67.3 | 47% | 0.474 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.9 | -34.7 | -179.1 | 25.6 | -35.3 | 0 | 0 | 0 | 112.9 | L160 F161 L166 I167 Y168 | L160-P164 WeakPolarHBondContact O-CD 3.44Å; F161-P164 WeakPolarHBondContact O-CD 3.4Å; F161-P164 WeakPolarHBondContact O-CG 3.02Å; P164-L166 VanDerWaalsContact C-N 3.32Å; P164-L166 PolarHBondContact O-N 3.06Å; P164-I167 PolarHBondContact O-N 2.95Å; P164-Y168 VanDerWaalsContact O-CB 3.31Å; P164-Y168 WeakPolarHBondContact O-CB 3.29Å; P164-Y168 PolarHBondContact O-N 3.33Å |
| 165 | L | 88.9 | Confident | 87.5 | Confident | 49 Ų | 49 | 68 Ų | 68 | 26% | 0.257 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.1 | -35.9 | 177.2 | -62.2 | 176.3 | 0 | 0 | 0 | 111.9 | F161 V162 L163 H169 Y302 | F161-L165 HydrophobicContact CD1-CD1 4Å; F161-L165 HydrophobicContact CE1-CD1 3.71Å; V162-L165 PolarHBondContact O-N 3.44Å; L163-L165 VanDerWaalsContact C-N 3.33Å; L163-L165 PolarHBondContact O-N 2.96Å; L165-H169 PolarHBondContact O-CD2 3.43Å; L165-H169 PolarHBondContact O-N 3.39Å; L165-Y302 HydrophobicContact CB-CD1 4.26Å; L165-Y302 HydrophobicContact CB-CE1 4.03Å; L165-Y302 HydrophobicContact CD1-CD1 4.45Å; L165-Y302 HydrophobicContact CD1-CE1 3.78Å; L165-Y302 HydrophobicContact CG-CE1 4.49Å |
| 166 | L | 88.7 | Confident | 86.9 | Confident | 1 Ų | 1 | 70.8 Ų | 70.8 | 1% | 0.005 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -72.6 | -36 | 177.8 | -167.4 | 145 | 0 | 0 | 0 | 112.2 | V162 L163 P164 K170 T171 F173 L303 W306 | V162-L166 WeakPolarHBondContact O-CB 3.25Å; V162-L166 PolarHBondContact O-N 3.09Å; L163-L166 PolarHBondContact O-N 2.68Å; P164-L166 VanDerWaalsContact C-N 3.32Å; P164-L166 PolarHBondContact O-N 3.06Å; L166-K170 PolarHBondContact O-N 2.62Å; L166-T171 PolarHBondContact O-N 2.95Å; L166-F173 HydrophobicContact CD2-CD1 3.61Å; L166-F173 HydrophobicContact CD2-CE1 3.75Å; L166-F173 HydrophobicContact CD2-CG 4.08Å; L166-F173 HydrophobicContact CD2-CZ 4.32Å; L166-L303 HydrophobicContact CD1-CB 4.38Å; L166-L303 HydrophobicContact CD1-CD1 3.88Å; L166-W306 HydrophobicContact CD1-CB 3.75Å; L166-W306 HydrophobicContact CD1-CD2 4.45Å; L166-W306 HydrophobicContact CD1-CG 3.86Å |
| 167 | I | 88.8 | Confident | 86.3 | Confident | 99 Ų | 99 | 76 Ų | 76 | 51% | 0.508 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65.1 | -50.3 | 170.7 | -65.5 | 166.1 | 0 | 0 | 0 | 110.2 | L163 P164 H169 K170 F173 | L163-I167 HydrophobicContact CD1-CD1 3.85Å; L163-I167 HydrophobicContact CD1-CG1 4.37Å; L163-I167 HydrophobicContact CG-CD1 4.21Å; L163-I167 WeakPolarHBondContact O-CG1 3.32Å; L163-I167 PolarHBondContact O-N 3.39Å; L163-I167 VanDerWaalsContact O-N 3.1Å; P164-I167 PolarHBondContact O-N 2.95Å; I167-H169 PolarHBondContact O-N 3.22Å; I167-K170 PolarHBondContact O-N 3.39Å; I167-F173 HydrophobicContact CD1-CZ 4.15Å; I167-F173 HydrophobicContact CG1-CE2 4.37Å; I167-F173 HydrophobicContact CG1-CZ 3.69Å |
| 168 | Y | 89.1 | Confident | 85.8 | Confident | 183 Ų | 183 | 79.4 Ų | 79.4 | 72% | 0.718 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -58.1 | -45.7 | -178.7 | -180 | -97.6 | 0 | 0 | 0 | 112.6 | P164 K170 | P164-Y168 VanDerWaalsContact O-CB 3.31Å; P164-Y168 WeakPolarHBondContact O-CB 3.29Å; P164-Y168 PolarHBondContact O-N 3.33Å; Y168-K170 PolarHBondContact O-N 3.23Å |
| 169 | H | 83.6 | Confident | 85.5 | Confident | 95 Ų | 95 | 82.3 Ų | 82.3 | 44% | 0.44 | 41% | 0.405 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | 2.3 | 176.1 | -77.5 | -68.6 | 0 | 0 | 0 | 114.6 | L165 I167 T171 Y302 | L165-H169 PolarHBondContact O-CD2 3.43Å; L165-H169 PolarHBondContact O-N 3.39Å; I167-H169 PolarHBondContact O-N 3.22Å; H169-T171 HydrophobicContact CB-CG2 3.89Å; H169-T171 PolarHBondContact O-N 2.98Å; H169-Y302 AromaticContact CD2-CD2 3.91Å; H169-Y302 AromaticContact CD2-CE2 3.3Å; H169-Y302 WeakPolarHBondContact CD2-CE2 3.34Å; H169-Y302 AromaticContact NE2-CE2 3.59Å |
| 170 | K | 81.3 | Confident | 85.3 | Confident | 191 Ų | 191 | 84.1 Ų | 84.1 | 83% | 0.83 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.5 | 28.4 | 176 | -57.4 | -172.4 | 179.6 | -177.2 | 0 | 115.3 | L166 I167 Y168 G172 | L166-K170 PolarHBondContact O-N 2.62Å; I167-K170 PolarHBondContact O-N 3.39Å; Y168-K170 PolarHBondContact O-N 3.23Å; K170-G172 PolarHBondContact O-N 3.19Å |
| 171 | T | 74.9 | Confident | 85.2 | Confident | 25 Ų | 25 | 84.4 Ų | 84.4 | 15% | 0.153 | 41% | 0.41 | C | S | . | . | trans | -74.9 | -8.4 | -172 | 72.1 | 0 | 0 | 0 | 0 | 114.3 | L166 H169 H300 | L166-T171 PolarHBondContact O-N 2.95Å; H169-T171 HydrophobicContact CB-CG2 3.89Å; H169-T171 PolarHBondContact O-N 2.98Å; T171-H300 HydrophobicContact CG2-CB 3.99Å | ||
| 172 | G | 74.9 | Confident | 85.2 | Confident | 38 Ų | 38 | 81.7 Ų | 81.7 | 39% | 0.392 | 40% | 0.397 | S | S | . | . | trans | 75.4 | 133.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | K170 L174 G175 L303 | K170-G172 PolarHBondContact O-N 3.19Å; G172-L174 VanDerWaalsContact C-N 3.3Å; G172-L174 PolarHBondContact O-N 3.37Å; G172-G175 PolarHBondContact O-N 3.32Å; G172-L303 WeakPolarHBondContact O-CD1 3.49Å | ||
| 173 | F | 77.7 | Confident | 85.3 | Confident | 86 Ų | 86 | 81.7 Ų | 81.7 | 38% | 0.377 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -29.7 | -174.7 | -72.3 | -75.1 | 0 | 0 | 0 | 115.3 | L163 L166 I167 L303 W306 | L163-F173 HydrophobicContact CD1-CE1 3.49Å; L163-F173 VanDerWaalsContact CD1-CE1 3.49Å; L163-F173 HydrophobicContact CD1-CZ 3.75Å; L166-F173 HydrophobicContact CD2-CD1 3.61Å; L166-F173 HydrophobicContact CD2-CE1 3.75Å; L166-F173 HydrophobicContact CD2-CG 4.08Å; L166-F173 HydrophobicContact CD2-CZ 4.32Å; I167-F173 HydrophobicContact CD1-CZ 4.15Å; I167-F173 HydrophobicContact CG1-CE2 4.37Å; I167-F173 HydrophobicContact CG1-CZ 3.69Å; F173-L303 WeakPolarHBondContact O-CD1 3.48Å; F173-W306 HydrophobicContact CD1-CZ2 4.08Å; F173-W306 HydrophobicContact CE1-CZ2 4.28Å |
| 174 | L | 76.4 | Confident | 85.5 | Confident | 95 Ų | 95 | 81.8 Ų | 81.8 | 50% | 0.497 | 40% | 0.4 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.4 | -8.1 | -177.2 | -68.6 | 73.5 | 0 | 0 | 0 | 113.2 | G172 R180 | G172-L174 VanDerWaalsContact C-N 3.3Å; G172-L174 PolarHBondContact O-N 3.37Å; L174-R180 WeakPolarHBondContact O-CG 3.46Å; L174-R180 PolarHBondContact O-NE 3.05Å |
| 175 | G | 80.8 | Confident | 85.7 | Confident | 17 Ų | 17 | 81.2 Ų | 81.2 | 18% | 0.175 | 39% | 0.393 | C | S | . | . | trans | 51.3 | -163.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | G172 R177 R180 L303 | G172-G175 PolarHBondContact O-N 3.32Å; G175-R177 PolarHBondContact O-N 2.95Å; G175-R180 PolarHBondContact O-NE 3.09Å; G175-R180 PolarHBondContact O-NH2 3.27Å; G175-L303 VanDerWaalsContact CA-CD2 3.5Å | ||
| 176 | P | 82.1 | Confident | 85.9 | Confident | 58 Ų | 58 | 78.9 Ų | 78.9 | 38% | 0.377 | 38% | 0.381 | S | S | . | . | trans | -60.5 | 130.8 | 178.8 | -21.9 | 33.2 | 0 | 0 | 0 | 111.8 | D178 K179 R180 | P176-D178 VanDerWaalsContact C-N 3.28Å; P176-D178 PolarHBondContact O-N 2.99Å; P176-K179 HydrophobicContact CB-CB 4.45Å; P176-K179 HydrophobicContact CB-CG 4.31Å; P176-K179 PolarHBondContact O-N 2.68Å; P176-R180 PolarHBondContact O-N 3.35Å | ||
| 177 | R | 81.7 | Confident | 86.2 | Confident | 205 Ų | 205 | 78.8 Ų | 78.8 | 77% | 0.774 | 38% | 0.38 | S | S | * | . | G | 310 helix | trans | -52.6 | -45.7 | -174.3 | -70.8 | -179.1 | 176.8 | -179.1 | -1.9 | 111.8 | G175 K179 R180 | G175-R177 PolarHBondContact O-N 2.95Å; R177-K179 PolarHBondContact O-N 2.87Å; R177-K179 VanDerWaalsContact O-N 3.15Å; R177-R180 PolarHBondContact O-N 3.01Å |
| 178 | D | 84.8 | Confident | 86.6 | Confident | 132 Ų | 132 | 78.5 Ų | 78.5 | 71% | 0.706 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -71 | -10.5 | -175 | -34.4 | -76.4 | 0 | 0 | 0 | 114.2 | P176 | P176-D178 VanDerWaalsContact C-N 3.28Å; P176-D178 PolarHBondContact O-N 2.99Å |
| 179 | K | 86.6 | Confident | 86.9 | Confident | 61 Ų | 61 | 72 Ų | 72 | 27% | 0.265 | 35% | 0.351 | S | S | . | . | G | 310 helix | trans | -109.4 | -5.7 | -179.5 | -56.4 | -58.6 | -178 | -176.7 | 0 | 113.5 | P176 R177 I181 Y182 L183 V299 | P176-K179 HydrophobicContact CB-CB 4.45Å; P176-K179 HydrophobicContact CB-CG 4.31Å; P176-K179 PolarHBondContact O-N 2.68Å; R177-K179 PolarHBondContact O-N 2.87Å; R177-K179 VanDerWaalsContact O-N 3.15Å; K179-I181 PolarHBondContact O-N 2.94Å; K179-Y182 HydrophobicContact CD-CD2 4.45Å; K179-Y182 PolarHBondContact O-N 3.05Å; K179-Y182 VanDerWaalsContact O-N 3.09Å; K179-L183 PolarHBondContact O-N 3.03Å; K179-V299 HydrophobicContact CB-CG2 3.95Å; K179-V299 HydrophobicContact CG-CG2 3.94Å |
| 180 | R | 90.3 | Very high | 87.5 | Confident | 84 Ų | 84 | 67.8 Ų | 67.8 | 32% | 0.317 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -56.7 | -45.6 | -178.3 | -73.8 | 174 | -172.3 | -173 | 1.4 | 113.4 | L174 G175 P176 R177 Y182 L183 V184 | L174-R180 WeakPolarHBondContact O-CG 3.46Å; L174-R180 PolarHBondContact O-NE 3.05Å; G175-R180 PolarHBondContact O-NE 3.09Å; G175-R180 PolarHBondContact O-NH2 3.27Å; P176-R180 PolarHBondContact O-N 3.35Å; R177-R180 PolarHBondContact O-N 3.01Å; R180-Y182 VanDerWaalsContact C-N 3.3Å; R180-Y182 PolarHBondContact O-N 3.49Å; R180-L183 WeakPolarHBondContact O-CB 3.39Å; R180-L183 PolarHBondContact O-N 2.97Å; R180-V184 WeakPolarHBondContact O-CG2 3.26Å; R180-V184 PolarHBondContact O-N 3.1Å |
| 181 | I | 93 | Very high | 88.2 | Confident | 101 Ų | 101 | 58.7 Ų | 58.7 | 52% | 0.518 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.2 | -37.9 | 177.7 | -171.1 | 59.5 | 0 | 0 | 0 | 112 | K179 V184 L185 | K179-I181 PolarHBondContact O-N 2.94Å; I181-V184 PolarHBondContact O-N 3.37Å; I181-L185 HydrophobicContact CD1-CD1 4.35Å; I181-L185 HydrophobicContact CD1-CG 4.36Å; I181-L185 HydrophobicContact CG1-CD1 4.03Å; I181-L185 HydrophobicContact CG1-CG 4.47Å; I181-L185 WeakPolarHBondContact O-CB 3.36Å; I181-L185 VanDerWaalsContact O-CG 3.24Å; I181-L185 WeakPolarHBondContact O-CG 3.35Å; I181-L185 PolarHBondContact O-N 3.45Å |
| 182 | Y | 92.5 | Very high | 89.2 | Confident | 62 Ų | 62 | 59.6 Ų | 59.6 | 24% | 0.243 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -71.1 | -33.7 | 176 | -63.7 | -73.8 | 0 | 0 | 0 | 112.3 | K179 R180 R186 I291 K294 | K179-Y182 HydrophobicContact CD-CD2 4.45Å; K179-Y182 PolarHBondContact O-N 3.05Å; K179-Y182 VanDerWaalsContact O-N 3.09Å; R180-Y182 VanDerWaalsContact C-N 3.3Å; R180-Y182 PolarHBondContact O-N 3.49Å; Y182-R186 WeakPolarHBondContact O-CB 3.35Å; Y182-R186 PolarHBondContact O-N 3.21Å; Y182-I291 HydrophobicContact CD1-CG2 4.34Å; Y182-I291 WeakPolarHBondContact O-CG2 3.45Å; Y182-K294 HydrophobicContact CD1-CD 4.37Å; Y182-K294 HydrophobicContact CE1-CD 3.68Å; Y182-K294 WeakPolarHBondContact OH-CE 3.34Å; Y182-K294 PolarHBondContact OH-NZ 3.35Å |
| 183 | L | 93.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.5 | -43.9 | 171.9 | -80.3 | 163.5 | 0 | 0 | 0 | 112.2 | K179 R180 R186 G187 M295 V299 L303 Y307 | K179-L183 PolarHBondContact O-N 3.03Å; R180-L183 WeakPolarHBondContact O-CB 3.39Å; R180-L183 PolarHBondContact O-N 2.97Å; L183-R186 PolarHBondContact O-N 2.9Å; L183-G187 PolarHBondContact O-N 3.11Å; L183-M295 HydrophobicContact CD2-SD 4.15Å; L183-M295 HydrophobicContact CG-SD 4.04Å; L183-V299 HydrophobicContact CD1-CG1 4.24Å; L183-V299 HydrophobicContact CD2-CG1 4.09Å; L183-V299 HydrophobicContact CG-CG1 4.47Å; L183-L303 HydrophobicContact CD1-CD2 3.58Å; L183-L303 HydrophobicContact CD1-CG 3.99Å; L183-L303 HydrophobicContact CD2-CG 4.21Å; L183-Y307 HydrophobicContact CB-CD1 3.91Å; L183-Y307 HydrophobicContact CB-CD2 3.91Å; L183-Y307 HydrophobicContact CB-CE1 4.14Å; L183-Y307 HydrophobicContact CB-CE2 4.12Å; L183-Y307 HydrophobicContact CB-CG 3.79Å; L183-Y307 HydrophobicContact CD1-CD2 4.17Å; L183-Y307 HydrophobicContact CD1-CE2 3.98Å; L183-Y307 HydrophobicContact CD2-CD2 4.02Å; L183-Y307 HydrophobicContact CD2-CG 4.31Å; L183-Y307 HydrophobicContact CG-CD2 4.26Å; L183-Y307 HydrophobicContact CG-CE2 4.48Å |
| 184 | V | 95.2 | Very high | 91.1 | Very high | 63 Ų | 63 | 54.6 Ų | 54.6 | 38% | 0.382 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.2 | -49.8 | 176.2 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | R180 I181 R186 G187 F188 Y307 I311 | R180-V184 WeakPolarHBondContact O-CG2 3.26Å; R180-V184 PolarHBondContact O-N 3.1Å; I181-V184 PolarHBondContact O-N 3.37Å; V184-R186 VanDerWaalsContact C-N 3.34Å; V184-R186 PolarHBondContact O-N 3.46Å; V184-G187 WeakPolarHBondContact O-CA 3.34Å; V184-G187 PolarHBondContact O-N 2.99Å; V184-G187 VanDerWaalsContact O-N 3.11Å; V184-F188 PolarHBondContact O-N 3.29Å; V184-Y307 HydrophobicContact CG2-CD1 4.1Å; V184-Y307 HydrophobicContact CG2-CE1 3.73Å; V184-I311 HydrophobicContact CB-CD1 4.15Å; V184-I311 HydrophobicContact CG1-CD1 3.98Å; V184-I311 HydrophobicContact CG2-CD1 4.29Å; V184-I311 WeakPolarHBondContact O-CD1 3.17Å |
| 185 | L | 95.1 | Very high | 92 | Very high | 60 Ų | 60 | 50.9 Ų | 50.9 | 31% | 0.314 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65 | -35.1 | 177.8 | -65.9 | 171 | 0 | 0 | 0 | 112.3 | I181 G187 F189 I291 | I181-L185 HydrophobicContact CD1-CD1 4.35Å; I181-L185 HydrophobicContact CD1-CG 4.36Å; I181-L185 HydrophobicContact CG1-CD1 4.03Å; I181-L185 HydrophobicContact CG1-CG 4.47Å; I181-L185 WeakPolarHBondContact O-CB 3.36Å; I181-L185 VanDerWaalsContact O-CG 3.24Å; I181-L185 WeakPolarHBondContact O-CG 3.35Å; I181-L185 PolarHBondContact O-N 3.45Å; L185-G187 VanDerWaalsContact C-N 3.29Å; L185-G187 PolarHBondContact O-N 3.34Å; L185-F189 HydrophobicContact CB-CD2 4.38Å; L185-F189 HydrophobicContact CD2-CE2 4.12Å; L185-F189 WeakPolarHBondContact O-CB 3.42Å; L185-F189 WeakPolarHBondContact O-CD2 3.45Å; L185-F189 PolarHBondContact O-N 3.22Å; L185-I291 HydrophobicContact CB-CD1 3.79Å |
| 186 | R | 93.2 | Very high | 92.8 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.8 | -42.4 | 171.7 | -173.3 | -85.7 | 168.5 | 138.1 | 10.7 | 110.8 | Y182 L183 V184 G190 T288 I291 L292 M295 S304 T353 | Y182-R186 WeakPolarHBondContact O-CB 3.35Å; Y182-R186 PolarHBondContact O-N 3.21Å; L183-R186 PolarHBondContact O-N 2.9Å; V184-R186 VanDerWaalsContact C-N 3.34Å; V184-R186 PolarHBondContact O-N 3.46Å; R186-G190 WeakPolarHBondContact O-CA 3.15Å; R186-G190 PolarHBondContact O-N 3.3Å; R186-G190 VanDerWaalsContact O-N 3.13Å; R186-T288 HydrophobicContact CG-CG2 4.11Å; R186-I291 HydrophobicContact CB-CG2 3.86Å; R186-L292 HydrophobicContact CG-CD2 4.02Å; R186-L292 HydrophobicContact CG-CG 4.05Å; R186-M295 HydrophobicContact CB-CE 4.03Å; R186-M295 HydrophobicContact CG-CE 4.02Å; R186-S304 WeakPolarHBondContact CD-OG 3.45Å; R186-S304 PolarHBondContact NH1-O 3.24Å; R186-S304 PolarHBondContact NH1-OG 3.39Å; R186-T353 PolarHBondContact NH2-OG1 2.83Å |
| 187 | G | 94.8 | Very high | 93.5 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -58.9 | -67.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | L183 V184 L185 F189 G190 S191 | L183-G187 PolarHBondContact O-N 3.11Å; V184-G187 WeakPolarHBondContact O-CA 3.34Å; V184-G187 PolarHBondContact O-N 2.99Å; V184-G187 VanDerWaalsContact O-N 3.11Å; L185-G187 VanDerWaalsContact C-N 3.29Å; L185-G187 PolarHBondContact O-N 3.34Å; G187-F189 PolarHBondContact O-N 3.42Å; G187-G190 CarbonylContact O-C 3.6Å; G187-G190 WeakPolarHBondContact O-CA 3.45Å; G187-G190 PolarHBondContact O-N 3.13Å; G187-S191 PolarHBondContact O-N 2.86Å; G187-S191 PolarHBondContact O-OG 3.35Å |
| 188 | F | 96.7 | Very high | 94.1 | Very high | 92 Ų | 92 | 40.7 Ų | 40.7 | 40% | 0.404 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -51.7 | -56.4 | -176.5 | 178.7 | -106 | 0 | 0 | 0 | 113.9 | V184 G190 S191 N192 I311 | V184-F188 PolarHBondContact O-N 3.29Å; F188-G190 PolarHBondContact O-N 3.14Å; F188-S191 PolarHBondContact O-N 3.34Å; F188-S191 PolarHBondContact O-OG 3.12Å; F188-N192 WeakPolarHBondContact O-CB 3.46Å; F188-N192 PolarHBondContact O-N 3.12Å; F188-I311 HydrophobicContact CB-CG2 4.11Å |
| 189 | F | 96.9 | Very high | 94.6 | Very high | 48 Ų | 48 | 37.1 Ų | 37.1 | 21% | 0.211 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66.8 | -26.9 | 180 | -73.5 | -63.6 | 0 | 0 | 0 | 112.8 | L185 G187 A193 F287 T288 I291 | L185-F189 HydrophobicContact CB-CD2 4.38Å; L185-F189 HydrophobicContact CD2-CE2 4.12Å; L185-F189 WeakPolarHBondContact O-CB 3.42Å; L185-F189 WeakPolarHBondContact O-CD2 3.45Å; L185-F189 PolarHBondContact O-N 3.22Å; G187-F189 PolarHBondContact O-N 3.42Å; F189-A193 WeakPolarHBondContact O-CB 3.35Å; F189-A193 PolarHBondContact O-N 3.07Å; F189-F287 HydrophobicContact CB-CB 4.01Å; F189-F287 HydrophobicContact CD1-CB 4.07Å; F189-F287 HydrophobicContact CD1-CD2 4.29Å; F189-F287 HydrophobicContact CD1-CG 4.29Å; F189-F287 HydrophobicContact CD2-CB 3.88Å; F189-F287 HydrophobicContact CD2-CG 4.32Å; F189-F287 HydrophobicContact CE1-CD2 4.15Å; F189-F287 HydrophobicContact CE1-CG 4.28Å; F189-F287 HydrophobicContact CE2-CB 4.35Å; F189-F287 HydrophobicContact CE2-CD1 4.29Å; F189-F287 HydrophobicContact CE2-CG 4.3Å; F189-F287 HydrophobicContact CG-CB 3.73Å; F189-F287 HydrophobicContact CG-CG 4.32Å; F189-F287 HydrophobicContact CZ-CD1 4.4Å; F189-F287 HydrophobicContact CZ-CD2 4.47Å; F189-F287 HydrophobicContact CZ-CG 4.28Å; F189-T288 PolarHBondContact O-OG1 3.19Å; F189-I291 HydrophobicContact CD2-CD1 3.91Å |
| 190 | G | 95.4 | Very high | 95 | Very high | 5 Ų | 5 | 34.2 Ų | 34.2 | 5% | 0.052 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -77 | -43.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | R186 G187 F188 M194 T288 Y308 | R186-G190 WeakPolarHBondContact O-CA 3.15Å; R186-G190 PolarHBondContact O-N 3.3Å; R186-G190 VanDerWaalsContact O-N 3.13Å; G187-G190 CarbonylContact O-C 3.6Å; G187-G190 WeakPolarHBondContact O-CA 3.45Å; G187-G190 PolarHBondContact O-N 3.13Å; F188-G190 PolarHBondContact O-N 3.14Å; G190-M194 PolarHBondContact O-N 3.32Å; G190-T288 VanDerWaalsContact CA-OG1 3.25Å; G190-T288 WeakPolarHBondContact CA-OG1 3.3Å; G190-T288 PolarHBondContact N-OG1 3.38Å; G190-T288 VanDerWaalsContact N-OG1 3.12Å; G190-Y308 VanDerWaalsContact O-CE2 3.31Å; G190-Y308 WeakPolarHBondContact O-CE2 3.32Å |
| 191 | S | 95.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -69.7 | -46.2 | 177.3 | 47.8 | 0 | 0 | 0 | 0 | 111.2 | G187 F188 A193 M194 I195 G312 E315 | G187-S191 PolarHBondContact O-N 2.86Å; G187-S191 PolarHBondContact O-OG 3.35Å; F188-S191 PolarHBondContact O-N 3.34Å; F188-S191 PolarHBondContact O-OG 3.12Å; S191-A193 VanDerWaalsContact C-N 3.32Å; S191-A193 PolarHBondContact O-N 3.45Å; S191-M194 WeakPolarHBondContact O-CA 3.32Å; S191-M194 WeakPolarHBondContact O-CB 3.29Å; S191-M194 PolarHBondContact O-N 2.94Å; S191-I195 VanDerWaalsContact O-CG1 3.32Å; S191-I195 WeakPolarHBondContact O-CG1 3.49Å; S191-I195 PolarHBondContact O-N 3.42Å; S191-G312 WeakPolarHBondContact OG-CA 3.35Å; S191-E315 WeakPolarHBondContact CB-OE2 3.45Å; S191-E315 PolarHBondContact OG-OE2 3.49Å |
| 192 | N | 96.4 | Very high | 95.2 | Very high | 45 Ų | 45 | 27.2 Ų | 27.2 | 24% | 0.241 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -54.1 | -47.8 | 173.8 | -167 | -12.3 | 0 | 0 | 0 | 111.4 | F188 M194 I195 L196 E315 | F188-N192 WeakPolarHBondContact O-CB 3.46Å; F188-N192 PolarHBondContact O-N 3.12Å; N192-M194 VanDerWaalsContact C-N 3.28Å; N192-M194 PolarHBondContact O-N 2.7Å; N192-I195 PolarHBondContact O-N 2.67Å; N192-L196 WeakPolarHBondContact O-CB 3.33Å; N192-L196 VanDerWaalsContact O-CG 3.31Å; N192-L196 WeakPolarHBondContact O-CG 3.49Å; N192-L196 PolarHBondContact O-N 2.97Å; N192-L196 WeakPolarHBondContact OD1-CD1 3.49Å; N192-L196 WeakPolarHBondContact OD1-CG 3.44Å; N192-E315 WeakPolarHBondContact CA-OE1 3.48Å; N192-E315 WeakPolarHBondContact CB-OE1 3.45Å; N192-E315 PolarHBondContact N-OE2 3.44Å; N192-E315 VanDerWaalsContact N-OE2 3.12Å |
| 193 | A | 96.9 | Very high | 95.1 | Very high | 8 Ų | 8 | 26.4 Ų | 26.4 | 7% | 0.066 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.3 | -32 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | F189 S191 L197 G281 A285 | F189-A193 WeakPolarHBondContact O-CB 3.35Å; F189-A193 PolarHBondContact O-N 3.07Å; S191-A193 VanDerWaalsContact C-N 3.32Å; S191-A193 PolarHBondContact O-N 3.45Å; A193-L197 VanDerWaalsContact O-CB 3.31Å; A193-L197 WeakPolarHBondContact O-CB 3.16Å; A193-L197 PolarHBondContact O-N 3.28Å; A193-L197 VanDerWaalsContact O-N 3.09Å; A193-G281 WeakPolarHBondContact CB-O 3.26Å; A193-A285 HydrophobicContact CB-CB 4.1Å |
| 194 | M | 95.9 | Very high | 94.9 | Very high | 11 Ų | 11 | 26.5 Ų | 26.5 | 5% | 0.054 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -73.8 | -45.3 | 173.7 | -177.9 | -165.2 | 71 | 0 | 0 | 111.8 | R154 G190 S191 N192 L196 L197 Y198 Y308 | R154-M194 HydrophobicContact CG-SD 4.49Å; G190-M194 PolarHBondContact O-N 3.32Å; S191-M194 WeakPolarHBondContact O-CA 3.32Å; S191-M194 WeakPolarHBondContact O-CB 3.29Å; S191-M194 PolarHBondContact O-N 2.94Å; N192-M194 VanDerWaalsContact C-N 3.28Å; N192-M194 PolarHBondContact O-N 2.7Å; M194-L196 VanDerWaalsContact C-N 3.34Å; M194-L196 PolarHBondContact O-N 3.01Å; M194-L197 PolarHBondContact O-N 2.8Å; M194-Y198 HydrophobicContact CG-CD1 4.2Å; M194-Y198 HydrophobicContact CG-CE1 3.83Å; M194-Y198 HydrophobicContact CG-CE2 4.36Å; M194-Y198 WeakPolarHBondContact O-CD1 3.47Å; M194-Y198 PolarHBondContact O-N 3.48Å; M194-Y198 HydrophobicContact SD-CE2 4.38Å; M194-Y308 VanDerWaalsContact CB-OH 3.3Å; M194-Y308 WeakPolarHBondContact CB-OH 3.36Å; M194-Y308 HydrophobicContact SD-CE1 4.33Å; M194-Y308 PolarHBondContact SD-OH 3.3Å |
| 195 | I | 95.6 | Very high | 94.7 | Very high | 16 Ų | 16 | 23.9 Ų | 23.9 | 8% | 0.082 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -59.8 | -47.5 | 178.6 | -65.8 | 159.7 | 0 | 0 | 0 | 109.7 | I148 S191 N192 L197 Y198 Y199 E315 | I148-I195 HydrophobicContact CG1-CG2 3.9Å; S191-I195 VanDerWaalsContact O-CG1 3.32Å; S191-I195 WeakPolarHBondContact O-CG1 3.49Å; S191-I195 PolarHBondContact O-N 3.42Å; N192-I195 PolarHBondContact O-N 2.67Å; I195-L197 PolarHBondContact O-N 3.37Å; I195-Y198 PolarHBondContact O-N 3.48Å; I195-Y199 WeakPolarHBondContact O-CB 3.37Å; I195-Y199 PolarHBondContact O-N 3.27Å; I195-E315 HydrophobicContact CD1-CB 4.48Å; I195-E315 HydrophobicContact CD1-CG 3.87Å |
| 196 | L | 96.6 | Very high | 94.6 | Very high | 43 Ų | 43 | 21.1 Ų | 21.1 | 23% | 0.225 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64.5 | -36.6 | 176.3 | -69.8 | 176.9 | 0 | 0 | 0 | 112.9 | N192 M194 A200 A277 | N192-L196 WeakPolarHBondContact O-CB 3.33Å; N192-L196 VanDerWaalsContact O-CG 3.31Å; N192-L196 WeakPolarHBondContact O-CG 3.49Å; N192-L196 PolarHBondContact O-N 2.97Å; N192-L196 WeakPolarHBondContact OD1-CD1 3.49Å; N192-L196 WeakPolarHBondContact OD1-CG 3.44Å; M194-L196 VanDerWaalsContact C-N 3.34Å; M194-L196 PolarHBondContact O-N 3.01Å; L196-A200 VanDerWaalsContact O-CB 3.24Å; L196-A200 WeakPolarHBondContact O-CB 3.47Å; L196-A200 PolarHBondContact O-N 2.88Å; L196-A277 HydrophobicContact CB-CB 4.39Å; L196-A277 WeakPolarHBondContact CB-O 3.26Å; L196-A277 HydrophobicContact CD2-CB 3.96Å |
| 197 | L | 96.3 | Very high | 94.6 | Very high | 21 Ų | 21 | 21.1 Ų | 21.1 | 11% | 0.11 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63.8 | -48 | 172.4 | 176.6 | 57.2 | 0 | 0 | 0 | 111.5 | A193 M194 I195 Y199 A200 V201 M213 | A193-L197 VanDerWaalsContact O-CB 3.31Å; A193-L197 WeakPolarHBondContact O-CB 3.16Å; A193-L197 PolarHBondContact O-N 3.28Å; A193-L197 VanDerWaalsContact O-N 3.09Å; M194-L197 PolarHBondContact O-N 2.8Å; I195-L197 PolarHBondContact O-N 3.37Å; L197-Y199 VanDerWaalsContact C-N 3.34Å; L197-Y199 PolarHBondContact O-N 3.12Å; L197-A200 PolarHBondContact O-N 3.3Å; L197-V201 HydrophobicContact CD1-CG2 4.01Å; L197-V201 HydrophobicContact CG-CG2 4.47Å; L197-V201 WeakPolarHBondContact O-CB 3.27Å; L197-V201 WeakPolarHBondContact O-CG2 3.4Å; L197-V201 PolarHBondContact O-N 2.95Å; L197-M213 HydrophobicContact CB-CE 3.82Å; L197-M213 HydrophobicContact CD1-CB 4.01Å; L197-M213 HydrophobicContact CD1-CE 4.14Å; L197-M213 HydrophobicContact CD1-CG 4.03Å; L197-M213 HydrophobicContact CD2-CG 4.3Å; L197-M213 HydrophobicContact CG-CE 4.42Å |
| 198 | Y | 95.6 | Very high | 94.5 | Very high | 3 Ų | 3 | 21.3 Ų | 21.3 | 1% | 0.012 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62.9 | -43.1 | -179.5 | -76.1 | 12.7 | 0 | 0 | 0 | 111.1 | I135 V139 I150 S151 R154 M194 I195 V201 Q202 | I135-Y198 HydrophobicContact CG2-CE1 3.91Å; I135-Y198 VanDerWaalsContact CG2-OH 3.24Å; I135-Y198 WeakPolarHBondContact CG2-OH 3.44Å; V139-Y198 HydrophobicContact CG1-CD1 4.36Å; V139-Y198 HydrophobicContact CG1-CD2 4.44Å; V139-Y198 HydrophobicContact CG1-CG 4.04Å; V139-Y198 HydrophobicContact CG2-CD1 4.04Å; V139-Y198 HydrophobicContact CG2-CD2 4.1Å; V139-Y198 HydrophobicContact CG2-CE1 3.92Å; V139-Y198 HydrophobicContact CG2-CE2 3.98Å; V139-Y198 HydrophobicContact CG2-CG 4.12Å; I150-Y198 HydrophobicContact CB-CD2 4.25Å; I150-Y198 HydrophobicContact CB-CE2 4.47Å; I150-Y198 HydrophobicContact CG2-CD2 3.97Å; I150-Y198 HydrophobicContact CG2-CE2 3.81Å; S151-Y198 VanDerWaalsContact OG-CD2 3.29Å; S151-Y198 WeakPolarHBondContact OG-CD2 3.4Å; R154-Y198 WeakPolarHBondContact CD-OH 3.36Å; R154-Y198 PolarHBondContact NH1-OH 3.18Å; M194-Y198 HydrophobicContact CG-CD1 4.2Å; M194-Y198 HydrophobicContact CG-CE1 3.83Å; M194-Y198 HydrophobicContact CG-CE2 4.36Å; M194-Y198 WeakPolarHBondContact O-CD1 3.47Å; M194-Y198 PolarHBondContact O-N 3.48Å; M194-Y198 HydrophobicContact SD-CE2 4.38Å; I195-Y198 PolarHBondContact O-N 3.48Å; Y198-V201 PolarHBondContact O-N 2.94Å; Y198-Q202 PolarHBondContact O-N 3.11Å |
| 199 | Y | 94.9 | Very high | 94.4 | Very high | 56 Ų | 56 | 16.9 Ų | 16.9 | 22% | 0.22 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.4 | -44.8 | 175.5 | -176.2 | -98.6 | 0 | 0 | 0 | 111.4 | H146 A147 I195 L197 V201 Q202 Q203 K273 A277 | H146-Y199 AromaticContact NE2-CD2 3.59Å; H146-Y199 AromaticContact NE2-CE2 3.47Å; H146-Y199 WeakPolarHBondContact NE2-CE2 3.36Å; A147-Y199 HydrophobicContact CB-CD2 4.42Å; A147-Y199 VanDerWaalsContact CB-N 3.33Å; I195-Y199 WeakPolarHBondContact O-CB 3.37Å; I195-Y199 PolarHBondContact O-N 3.27Å; L197-Y199 VanDerWaalsContact C-N 3.34Å; L197-Y199 PolarHBondContact O-N 3.12Å; Y199-V201 PolarHBondContact O-N 3.18Å; Y199-Q202 PolarHBondContact O-N 3.21Å; Y199-Q203 HydrophobicContact CD1-CG 4.08Å; Y199-Q203 HydrophobicContact CD2-CG 4.34Å; Y199-Q203 HydrophobicContact CE1-CG 3.77Å; Y199-Q203 HydrophobicContact CE2-CG 4.03Å; Y199-Q203 HydrophobicContact CG-CG 4.37Å; Y199-Q203 WeakPolarHBondContact O-CB 3.39Å; Y199-Q203 VanDerWaalsContact O-CG 3.26Å; Y199-Q203 WeakPolarHBondContact O-CG 3.44Å; Y199-Q203 PolarHBondContact O-N 2.96Å; Y199-K273 HydrophobicContact CE1-CB 4.13Å; Y199-A277 HydrophobicContact CD1-CB 3.73Å; Y199-A277 HydrophobicContact CE1-CB 4.41Å |
| 200 | A | 95.4 | Very high | 94.3 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.9 | -42.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L196 L197 Q202 Q203 M204 A209 G274 A277 A278 | L196-A200 VanDerWaalsContact O-CB 3.24Å; L196-A200 WeakPolarHBondContact O-CB 3.47Å; L196-A200 PolarHBondContact O-N 2.88Å; L197-A200 PolarHBondContact O-N 3.3Å; A200-Q202 VanDerWaalsContact C-N 3.32Å; A200-Q202 PolarHBondContact O-N 3.44Å; A200-Q203 PolarHBondContact O-N 3.28Å; A200-M204 HydrophobicContact CB-CE 3.97Å; A200-M204 WeakPolarHBondContact O-CG 3.47Å; A200-M204 PolarHBondContact O-N 3.23Å; A200-A209 HydrophobicContact CB-CB 4.31Å; A200-G274 VanDerWaalsContact CB-O 3.27Å; A200-G274 WeakPolarHBondContact CB-O 3.36Å; A200-A277 HydrophobicContact CB-CB 4.21Å; A200-A278 HydrophobicContact CB-CB 3.72Å |
| 201 | V | 94.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -60.6 | -40.6 | 175 | 166.6 | 0 | 0 | 0 | 0 | 111 | S136 V139 K140 L197 Y198 Y199 L206 A209 | S136-V201 WeakPolarHBondContact O-CG1 3.22Å; V139-V201 HydrophobicContact CB-CG1 4.46Å; V139-V201 HydrophobicContact CG1-CG1 4.16Å; K140-V201 HydrophobicContact CB-CG1 3.76Å; K140-V201 HydrophobicContact CD-CG1 4.04Å; K140-V201 WeakPolarHBondContact CD-O 3.41Å; K140-V201 WeakPolarHBondContact CE-O 3.44Å; K140-V201 HydrophobicContact CG-CG1 4.47Å; K140-V201 PolarHBondContact NZ-O 3.47Å; L197-V201 HydrophobicContact CD1-CG2 4.01Å; L197-V201 HydrophobicContact CG-CG2 4.47Å; L197-V201 WeakPolarHBondContact O-CB 3.27Å; L197-V201 WeakPolarHBondContact O-CG2 3.4Å; L197-V201 PolarHBondContact O-N 2.95Å; Y198-V201 PolarHBondContact O-N 2.94Å; Y199-V201 PolarHBondContact O-N 3.18Å; V201-L206 HydrophobicContact CG1-CD1 3.99Å; V201-L206 HydrophobicContact CG2-CD1 4.26Å; V201-A209 HydrophobicContact CB-CB 4.49Å; V201-A209 HydrophobicContact CG2-CB 3.73Å |
| 202 | Q | 92.3 | Very high | 94.3 | Very high | 38 Ų | 38 | 14.7 Ų | 14.7 | 18% | 0.178 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -64.6 | -49.6 | 174.1 | -72.9 | -172 | -40.8 | 0 | 0 | 111.8 | V139 K140 I142 L145 Y198 Y199 A200 M204 | V139-Q202 HydrophobicContact CG1-CG 4.45Å; K140-Q202 PolarHBondContact NZ-O 2.97Å; I142-Q202 PolarHBondContact O-NE2 2.88Å; L145-Q202 PolarHBondContact O-NE2 3.13Å; Y198-Q202 PolarHBondContact O-N 3.11Å; Y199-Q202 PolarHBondContact O-N 3.21Å; A200-Q202 VanDerWaalsContact C-N 3.32Å; A200-Q202 PolarHBondContact O-N 3.44Å; Q202-M204 PolarHBondContact O-N 2.9Å |
| 203 | Q | 90.2 | Very high | 94.2 | Very high | 46 Ų | 46 | 12.9 Ų | 12.9 | 22% | 0.215 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -78.7 | -14.2 | -169.6 | -62.2 | -65.7 | -39.7 | 0 | 0 | 116.1 | Y199 A200 N270 | Y199-Q203 HydrophobicContact CD1-CG 4.08Å; Y199-Q203 HydrophobicContact CD2-CG 4.34Å; Y199-Q203 HydrophobicContact CE1-CG 3.77Å; Y199-Q203 HydrophobicContact CE2-CG 4.03Å; Y199-Q203 HydrophobicContact CG-CG 4.37Å; Y199-Q203 WeakPolarHBondContact O-CB 3.39Å; Y199-Q203 VanDerWaalsContact O-CG 3.26Å; Y199-Q203 WeakPolarHBondContact O-CG 3.44Å; Y199-Q203 PolarHBondContact O-N 2.96Å; A200-Q203 PolarHBondContact O-N 3.28Å; Q203-N270 CarbonylContact O-C 3.56Å |
| 204 | M | 90.5 | Very high | 94 | Very high | 1 Ų | 1 | 12.8 Ų | 12.8 | 1% | 0.005 | 6% | 0.061 | C | C | . | . | S | Bend | trans | -145.6 | 178.5 | 177.6 | 65.7 | 161.6 | 166.5 | 0 | 0 | 112 | K140 A200 Q202 D208 A209 I212 H271 G274 A278 | K140-M204 PolarHBondContact NZ-O 3.45Å; A200-M204 HydrophobicContact CB-CE 3.97Å; A200-M204 WeakPolarHBondContact O-CG 3.47Å; A200-M204 PolarHBondContact O-N 3.23Å; Q202-M204 PolarHBondContact O-N 2.9Å; M204-D208 HydrophobicContact SD-CB 4.01Å; M204-A209 VanDerWaalsContact CE-CA 3.41Å; M204-A209 HydrophobicContact CE-CB 3.76Å; M204-A209 HydrophobicContact CG-CB 4.35Å; M204-I212 HydrophobicContact CE-CD1 3.96Å; M204-I212 HydrophobicContact SD-CD1 4.36Å; M204-H271 WeakPolarHBondContact CB-ND1 3.35Å; M204-G274 WeakPolarHBondContact CE-O 3.18Å; M204-A278 HydrophobicContact CE-CB 3.55Å |
| 205 | P | 91.2 | Very high | 93.9 | Very high | 9 Ų | 9 | 12.2 Ų | 12.2 | 6% | 0.058 | 6% | 0.059 | C | C | . | . | trans | -60 | 145.5 | 179.7 | -26.5 | 36.8 | 0 | 0 | 0 | 113.7 | A207 D208 A209 E265 | P205-A207 VanDerWaalsContact C-N 3.33Å; P205-A207 PolarHBondContact O-N 3.5Å; P205-D208 HydrophobicContact CB-CB 4.26Å; P205-D208 PolarHBondContact O-N 2.96Å; P205-A209 PolarHBondContact O-N 3.19Å; P205-E265 HydrophobicContact CG-CB 4.38Å | ||
| 206 | L | 92.2 | Very high | 93.8 | Very high | 2 Ų | 2 | 11.5 Ų | 11.5 | 1% | 0.01 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -56.8 | -43.2 | -175.3 | 173.7 | 61.6 | 0 | 0 | 0 | 112.7 | L137 V201 T210 F378 F383 | L137-L206 HydrophobicContact CB-CD2 4.33Å; V201-L206 HydrophobicContact CG1-CD1 3.99Å; V201-L206 HydrophobicContact CG2-CD1 4.26Å; L206-T210 PolarHBondContact O-N 2.9Å; L206-T210 VanDerWaalsContact O-N 3.14Å; L206-T210 PolarHBondContact O-OG1 3.44Å; L206-F378 HydrophobicContact CD2-CB 4.06Å; L206-F383 HydrophobicContact CD2-CE2 4.32Å |
| 207 | A | 92.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -70.7 | -44.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | P205 A209 T210 V211 F376 | P205-A207 VanDerWaalsContact C-N 3.33Å; P205-A207 PolarHBondContact O-N 3.5Å; A207-A209 VanDerWaalsContact C-N 3.26Å; A207-A209 PolarHBondContact O-N 3.36Å; A207-T210 PolarHBondContact O-N 2.93Å; A207-V211 WeakPolarHBondContact O-CB 3.33Å; A207-V211 WeakPolarHBondContact O-CG2 3.34Å; A207-V211 PolarHBondContact O-N 3.37Å; A207-F376 HydrophobicContact CB-CB 4.48Å; A207-F376 HydrophobicContact CB-CD1 3.45Å; A207-F376 VanDerWaalsContact CB-CD1 3.45Å; A207-F376 HydrophobicContact CB-CD2 4.03Å; A207-F376 HydrophobicContact CB-CE1 3.49Å; A207-F376 VanDerWaalsContact CB-CE1 3.49Å; A207-F376 HydrophobicContact CB-CE2 4.06Å; A207-F376 HydrophobicContact CB-CG 3.73Å; A207-F376 HydrophobicContact CB-CZ 3.8Å |
| 208 | D | 93.1 | Very high | 93.3 | Very high | 3 Ų | 3 | 9 Ų | 9 | 2% | 0.016 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -55.3 | -43.4 | 176.7 | -72.6 | 2.3 | 0 | 0 | 0 | 110.8 | M204 P205 I212 I250 R252 H271 S391 | M204-D208 HydrophobicContact SD-CB 4.01Å; P205-D208 HydrophobicContact CB-CB 4.26Å; P205-D208 PolarHBondContact O-N 2.96Å; D208-I212 WeakPolarHBondContact O-CG1 3.41Å; D208-I212 PolarHBondContact O-N 2.86Å; D208-I250 HydrophobicContact CB-CG2 3.54Å; D208-I250 VanDerWaalsContact CG-CG2 3.49Å; D208-R252 IonicContact OD2-NH2 3.97Å; D208-R252 PolarHBondContact OD2-NH2 3.43Å; D208-H271 VanDerWaalsContact CG-CE1 3.5Å; D208-H271 IonicContact OD2-CE1 3.07Å; D208-H271 PolarHBondContact OD2-CE1 3.33Å; D208-S391 VanDerWaalsContact OD1-CB 3.23Å; D208-S391 WeakPolarHBondContact OD1-CB 3.44Å; D208-S391 PolarHBondContact OD1-OG 3.5Å |
| 209 | A | 95.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -63.6 | -50.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | A200 V201 M204 P205 A207 V211 I212 M213 | A200-A209 HydrophobicContact CB-CB 4.31Å; V201-A209 HydrophobicContact CB-CB 4.49Å; V201-A209 HydrophobicContact CG2-CB 3.73Å; M204-A209 VanDerWaalsContact CE-CA 3.41Å; M204-A209 HydrophobicContact CE-CB 3.76Å; M204-A209 HydrophobicContact CG-CB 4.35Å; P205-A209 PolarHBondContact O-N 3.19Å; A207-A209 VanDerWaalsContact C-N 3.26Å; A207-A209 PolarHBondContact O-N 3.36Å; A209-V211 VanDerWaalsContact C-N 3.33Å; A209-V211 PolarHBondContact O-N 3.47Å; A209-I212 PolarHBondContact O-N 2.92Å; A209-M213 VanDerWaalsContact O-CB 3.31Å; A209-M213 WeakPolarHBondContact O-CB 3.35Å; A209-M213 PolarHBondContact O-N 2.86Å |
| 210 | T | 94.6 | Very high | 92.9 | Very high | 6 Ų | 6 | 8 Ų | 8 | 4% | 0.037 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -65.3 | -36.7 | 179.5 | -62.9 | 0 | 0 | 0 | 0 | 111.8 | L206 A207 M213 F214 D371 V372 | L206-T210 PolarHBondContact O-N 2.9Å; L206-T210 VanDerWaalsContact O-N 3.14Å; L206-T210 PolarHBondContact O-OG1 3.44Å; A207-T210 PolarHBondContact O-N 2.93Å; T210-M213 PolarHBondContact O-N 3.39Å; T210-F214 WeakPolarHBondContact O-CB 3.46Å; T210-F214 PolarHBondContact O-N 2.99Å; T210-D371 HydrophobicContact CG2-CB 4.17Å; T210-V372 HydrophobicContact CG2-CG2 4.24Å |
| 211 | V | 95.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -65 | -50.2 | 176.2 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | A207 A209 M213 F214 I250 V372 F376 A395 V398 | A207-V211 WeakPolarHBondContact O-CB 3.33Å; A207-V211 WeakPolarHBondContact O-CG2 3.34Å; A207-V211 PolarHBondContact O-N 3.37Å; A209-V211 VanDerWaalsContact C-N 3.33Å; A209-V211 PolarHBondContact O-N 3.47Å; V211-M213 VanDerWaalsContact C-N 3.28Å; V211-M213 PolarHBondContact O-N 2.91Å; V211-F214 WeakPolarHBondContact O-CA 3.13Å; V211-F214 WeakPolarHBondContact O-CB 3.37Å; V211-F214 PolarHBondContact O-N 3.29Å; V211-I250 HydrophobicContact CB-CD1 4.08Å; V211-I250 HydrophobicContact CG1-CD1 3.31Å; V211-V372 HydrophobicContact CG2-CG1 3.59Å; V211-V372 HydrophobicContact CG2-CG2 4.4Å; V211-F376 HydrophobicContact CG2-CE2 3.65Å; V211-F376 HydrophobicContact CG2-CZ 4.06Å; V211-A395 HydrophobicContact CB-CB 4.48Å; V211-A395 HydrophobicContact CG1-CB 3.91Å; V211-A395 HydrophobicContact CG2-CB 3.68Å; V211-V398 HydrophobicContact CG1-CB 4.12Å; V211-V398 HydrophobicContact CG1-CG2 4.25Å |
| 212 | I | 95.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 10.6 Ų | 10.6 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -62.2 | -40.7 | 178.6 | -67.7 | 167.2 | 0 | 0 | 0 | 109.9 | M204 D208 A209 F214 S215 V247 I250 T275 A278 F279 | M204-I212 HydrophobicContact CE-CD1 3.96Å; M204-I212 HydrophobicContact SD-CD1 4.36Å; D208-I212 WeakPolarHBondContact O-CG1 3.41Å; D208-I212 PolarHBondContact O-N 2.86Å; A209-I212 PolarHBondContact O-N 2.92Å; I212-F214 VanDerWaalsContact C-N 3.26Å; I212-F214 PolarHBondContact O-N 3.45Å; I212-S215 WeakPolarHBondContact O-CB 3.33Å; I212-S215 PolarHBondContact O-N 3.17Å; I212-S215 PolarHBondContact O-OG 2.69Å; I212-V247 HydrophobicContact CG1-CG1 4.29Å; I212-V247 HydrophobicContact CG1-CG2 4.35Å; I212-V247 HydrophobicContact CG2-CG1 4.22Å; I212-V247 HydrophobicContact CG2-CG2 4.27Å; I212-I250 HydrophobicContact CD1-CB 4.09Å; I212-I250 HydrophobicContact CD1-CG2 3.67Å; I212-I250 HydrophobicContact CG1-CB 4.33Å; I212-I250 HydrophobicContact CG1-CD1 3.93Å; I212-I250 HydrophobicContact CG1-CG2 4.15Å; I212-T275 HydrophobicContact CD1-CG2 4.2Å; I212-A278 HydrophobicContact CB-CB 3.83Å; I212-A278 HydrophobicContact CG2-CB 3.56Å; I212-F279 HydrophobicContact CG2-CB 4.19Å |
| 213 | M | 95.2 | Very high | 92.4 | Very high | 8 Ų | 8 | 10 Ų | 10 | 4% | 0.039 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -59.9 | -33.5 | 172.2 | -179.8 | 57.6 | 53.9 | 0 | 0 | 112.8 | L197 A209 T210 V211 S215 N216 A282 A285 | L197-M213 HydrophobicContact CB-CE 3.82Å; L197-M213 HydrophobicContact CD1-CB 4.01Å; L197-M213 HydrophobicContact CD1-CE 4.14Å; L197-M213 HydrophobicContact CD1-CG 4.03Å; L197-M213 HydrophobicContact CD2-CG 4.3Å; L197-M213 HydrophobicContact CG-CE 4.42Å; A209-M213 VanDerWaalsContact O-CB 3.31Å; A209-M213 WeakPolarHBondContact O-CB 3.35Å; A209-M213 PolarHBondContact O-N 2.86Å; T210-M213 PolarHBondContact O-N 3.39Å; V211-M213 VanDerWaalsContact C-N 3.28Å; V211-M213 PolarHBondContact O-N 2.91Å; M213-S215 PolarHBondContact O-N 3.39Å; M213-N216 WeakPolarHBondContact O-CB 3.14Å; M213-N216 PolarHBondContact O-N 2.83Å; M213-N216 PolarHBondContact O-ND2 2.99Å; M213-A282 HydrophobicContact SD-CB 4.42Å; M213-A285 HydrophobicContact SD-CB 4.16Å |
| 214 | F | 92.2 | Very high | 92.3 | Very high | 5 Ų | 5 | 7.8 Ų | 7.8 | 2% | 0.022 | 4% | 0.042 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -2.4 | 179 | -165.1 | -111.9 | 0 | 0 | 0 | 114.6 | T210 V211 I212 N216 P217 S365 R368 T369 V372 V398 V399 T402 | T210-F214 WeakPolarHBondContact O-CB 3.46Å; T210-F214 PolarHBondContact O-N 2.99Å; V211-F214 WeakPolarHBondContact O-CA 3.13Å; V211-F214 WeakPolarHBondContact O-CB 3.37Å; V211-F214 PolarHBondContact O-N 3.29Å; I212-F214 VanDerWaalsContact C-N 3.26Å; I212-F214 PolarHBondContact O-N 3.45Å; F214-N216 PolarHBondContact O-N 3.2Å; F214-P217 WeakPolarHBondContact O-CD 3.37Å; F214-S365 WeakPolarHBondContact CZ-O 3.26Å; F214-R368 HydrophobicContact CD2-CB 4.48Å; F214-R368 VanDerWaalsContact CE2-C 3.44Å; F214-R368 HydrophobicContact CE2-CB 3.81Å; F214-R368 WeakPolarHBondContact CE2-O 3.36Å; F214-T369 HydrophobicContact CE1-CG2 3.83Å; F214-T369 HydrophobicContact CE2-CG2 4.49Å; F214-T369 HydrophobicContact CZ-CG2 3.46Å; F214-T369 VanDerWaalsContact CZ-CG2 3.46Å; F214-V372 HydrophobicContact CB-CG2 3.73Å; F214-V372 HydrophobicContact CD1-CG2 3.95Å; F214-V372 HydrophobicContact CD2-CG2 4.33Å; F214-V372 HydrophobicContact CG-CG2 3.73Å; F214-V398 HydrophobicContact CB-CG1 4.49Å; F214-V398 HydrophobicContact CD1-CG1 4.37Å; F214-V399 HydrophobicContact CD1-CG2 4.05Å; F214-V399 HydrophobicContact CE1-CG2 4.2Å; F214-T402 HydrophobicContact CD1-CG2 4.02Å; F214-T402 HydrophobicContact CE1-CG2 3.29Å; F214-T402 HydrophobicContact CE2-CG2 4.11Å; F214-T402 HydrophobicContact CZ-CG2 3.33Å; F214-T402 PolarHBondContact O-OG1 3.2Å |
| 215 | S | 93.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 7% | 0.067 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | -15.6 | 165.8 | 65.5 | 0 | 0 | 0 | 0 | 113.9 | I212 M213 P217 V218 F219 A282 | I212-S215 WeakPolarHBondContact O-CB 3.33Å; I212-S215 PolarHBondContact O-N 3.17Å; I212-S215 PolarHBondContact O-OG 2.69Å; M213-S215 PolarHBondContact O-N 3.39Å; S215-P217 VanDerWaalsContact C-N 3.34Å; S215-P217 VanDerWaalsContact O-N 3.12Å; S215-V218 PolarHBondContact O-N 2.77Å; S215-F219 WeakPolarHBondContact OG-CE2 3.29Å; S215-A282 WeakPolarHBondContact OG-CB 3.39Å |
| 216 | N | 93.1 | Very high | 92.1 | Very high | 1 Ų | 1 | 18 Ų | 18 | 1% | 0.005 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -51.6 | -34.2 | -174.8 | 73.5 | 77.6 | 0 | 0 | 0 | 116.1 | M213 F214 V218 F219 T220 A282 A285 A286 | M213-N216 WeakPolarHBondContact O-CB 3.14Å; M213-N216 PolarHBondContact O-N 2.83Å; M213-N216 PolarHBondContact O-ND2 2.99Å; F214-N216 PolarHBondContact O-N 3.2Å; N216-V218 VanDerWaalsContact C-N 3.29Å; N216-V218 PolarHBondContact O-N 2.85Å; N216-F219 PolarHBondContact O-N 3.29Å; N216-T220 WeakPolarHBondContact O-CB 3.47Å; N216-T220 PolarHBondContact O-N 3.19Å; N216-T220 PolarHBondContact O-OG1 3.34Å; N216-A282 HydrophobicContact CB-CB 4.31Å; N216-A282 WeakPolarHBondContact CB-O 3.36Å; N216-A285 HydrophobicContact CB-CB 3.94Å; N216-A286 WeakPolarHBondContact O-CB 3.5Å |
| 217 | P | 90.9 | Very high | 91.9 | Very high | 10 Ų | 10 | 22.8 Ų | 22.8 | 7% | 0.065 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -72.1 | -22.8 | -179.3 | -21.1 | 37.9 | 0 | 0 | 0 | 113.3 | F214 S215 T220 S221 T402 | F214-P217 WeakPolarHBondContact O-CD 3.37Å; S215-P217 VanDerWaalsContact C-N 3.34Å; S215-P217 VanDerWaalsContact O-N 3.12Å; P217-T220 WeakPolarHBondContact O-CB 3.35Å; P217-T220 PolarHBondContact O-N 2.98Å; P217-S221 PolarHBondContact O-N 2.9Å; P217-T402 HydrophobicContact CB-CG2 3.88Å; P217-T402 HydrophobicContact CG-CG2 3.57Å |
| 218 | V | 91.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -76 | -46.2 | 176.8 | -175.4 | 0 | 0 | 0 | 0 | 109.8 | S215 N216 T220 S221 I222 T243 T402 V405 | S215-V218 PolarHBondContact O-N 2.77Å; N216-V218 VanDerWaalsContact C-N 3.29Å; N216-V218 PolarHBondContact O-N 2.85Å; V218-T220 VanDerWaalsContact C-N 3.28Å; V218-T220 PolarHBondContact O-N 3.31Å; V218-S221 WeakPolarHBondContact O-CA 3.48Å; V218-S221 WeakPolarHBondContact O-CB 3.27Å; V218-S221 PolarHBondContact O-N 3.46Å; V218-I222 PolarHBondContact O-N 2.89Å; V218-T243 HydrophobicContact CG2-CG2 4.43Å; V218-T402 WeakPolarHBondContact CG2-OG1 3.44Å; V218-V405 HydrophobicContact CG1-CG2 4.42Å; V218-V405 HydrophobicContact CG2-CG2 4.1Å |
| 219 | F | 92.3 | Very high | 91.1 | Very high | 24 Ų | 24 | 33.7 Ų | 33.7 | 11% | 0.105 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.3 | -35.9 | 168.4 | -63.2 | -60.7 | 0 | 0 | 0 | 112.2 | S215 N216 S221 I222 L223 L244 F279 I283 A286 | S215-F219 WeakPolarHBondContact OG-CE2 3.29Å; N216-F219 PolarHBondContact O-N 3.29Å; F219-S221 PolarHBondContact O-N 3.23Å; F219-I222 HydrophobicContact CD1-CD1 4.22Å; F219-I222 PolarHBondContact O-N 3.34Å; F219-L223 WeakPolarHBondContact O-CB 3.43Å; F219-L223 WeakPolarHBondContact O-CG 3.22Å; F219-L223 PolarHBondContact O-N 3.09Å; F219-L244 HydrophobicContact CZ-CD2 4.17Å; F219-F279 HydrophobicContact CE1-CZ 4.4Å; F219-F279 AromaticContact CE2-CE2 3.89Å; F219-F279 HydrophobicContact CE2-CE2 3.89Å; F219-F279 HydrophobicContact CE2-CZ 4.33Å; F219-F279 AromaticContact CZ-CE2 3.55Å; F219-F279 HydrophobicContact CZ-CE2 3.55Å; F219-F279 AromaticContact CZ-CZ 3.68Å; F219-F279 HydrophobicContact CZ-CZ 3.68Å; F219-I283 HydrophobicContact CD1-CG1 4.49Å; F219-I283 HydrophobicContact CD2-CG1 4.23Å; F219-I283 HydrophobicContact CE2-CG1 4.46Å; F219-I283 HydrophobicContact CG-CG1 4.26Å; F219-A286 HydrophobicContact CB-CB 3.65Å |
| 220 | T | 91 | Very high | 90.6 | Very high | 15 Ų | 15 | 36.2 Ų | 36.2 | 9% | 0.092 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.2 | -32.1 | 171.8 | -58.5 | 0 | 0 | 0 | 0 | 111 | N216 P217 V218 A224 A286 F289 V290 | N216-T220 WeakPolarHBondContact O-CB 3.47Å; N216-T220 PolarHBondContact O-N 3.19Å; N216-T220 PolarHBondContact O-OG1 3.34Å; P217-T220 WeakPolarHBondContact O-CB 3.35Å; P217-T220 PolarHBondContact O-N 2.98Å; V218-T220 VanDerWaalsContact C-N 3.28Å; V218-T220 PolarHBondContact O-N 3.31Å; T220-A224 WeakPolarHBondContact O-CB 3.36Å; T220-A224 PolarHBondContact O-N 2.97Å; T220-A286 WeakPolarHBondContact OG1-CA 3.46Å; T220-A286 WeakPolarHBondContact OG1-CB 3.43Å; T220-F289 HydrophobicContact CG2-CB 4.01Å; T220-V290 HydrophobicContact CG2-CG2 3.85Å |
| 221 | S | 88.6 | Confident | 89.9 | Confident | 4 Ų | 4 | 46.9 Ų | 46.9 | 3% | 0.028 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.9 | -48 | 175.7 | -162.9 | 0 | 0 | 0 | 0 | 112.1 | P217 V218 F219 A224 W225 D236 K409 | P217-S221 PolarHBondContact O-N 2.9Å; V218-S221 WeakPolarHBondContact O-CA 3.48Å; V218-S221 WeakPolarHBondContact O-CB 3.27Å; V218-S221 PolarHBondContact O-N 3.46Å; F219-S221 PolarHBondContact O-N 3.23Å; S221-A224 PolarHBondContact O-N 3.49Å; S221-W225 PolarHBondContact O-N 2.9Å; S221-D236 PolarHBondContact OG-OD1 2.91Å; S221-K409 PolarHBondContact O-NZ 3.01Å; S221-K409 WeakPolarHBondContact OG-CE 3.41Å; S221-K409 PolarHBondContact OG-NZ 3.41Å |
| 222 | I | 90.4 | Very high | 89.1 | Confident | 51 Ų | 51 | 49.3 Ų | 49.3 | 26% | 0.262 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.7 | -49.5 | 179.3 | -54.5 | 169.2 | 0 | 0 | 0 | 110.3 | V218 F219 A224 W225 V226 T240 | V218-I222 PolarHBondContact O-N 2.89Å; F219-I222 HydrophobicContact CD1-CD1 4.22Å; F219-I222 PolarHBondContact O-N 3.34Å; I222-A224 VanDerWaalsContact C-N 3.27Å; I222-A224 PolarHBondContact O-N 3.03Å; I222-W225 WeakPolarHBondContact O-CB 3.46Å; I222-W225 PolarHBondContact O-N 2.81Å; I222-V226 PolarHBondContact O-N 3.45Å; I222-T240 HydrophobicContact CD1-CG2 3.8Å |
| 223 | L | 90.8 | Very high | 88.6 | Confident | 24 Ų | 24 | 51.6 Ų | 51.6 | 13% | 0.126 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64 | -31.2 | 179.3 | -66.7 | 175.7 | 0 | 0 | 0 | 112 | F219 V226 F227 A286 F287 V290 | F219-L223 WeakPolarHBondContact O-CB 3.43Å; F219-L223 WeakPolarHBondContact O-CG 3.22Å; F219-L223 PolarHBondContact O-N 3.09Å; L223-V226 PolarHBondContact O-N 2.89Å; L223-F227 HydrophobicContact CB-CD2 4.42Å; L223-F227 HydrophobicContact CD2-CD2 4.35Å; L223-F227 HydrophobicContact CD2-CE2 4.04Å; L223-F227 WeakPolarHBondContact O-CB 3.43Å; L223-F227 WeakPolarHBondContact O-CD2 3.31Å; L223-F227 PolarHBondContact O-N 3.19Å; L223-A286 HydrophobicContact CD1-CB 3.8Å; L223-F287 HydrophobicContact CD1-CD1 4.07Å; L223-F287 HydrophobicContact CD1-CD2 3.8Å; L223-F287 HydrophobicContact CD1-CE1 4.22Å; L223-F287 HydrophobicContact CD1-CE2 3.94Å; L223-F287 HydrophobicContact CD1-CG 3.85Å; L223-F287 HydrophobicContact CD1-CZ 4.15Å; L223-F287 HydrophobicContact CD2-CD1 4.49Å; L223-F287 HydrophobicContact CD2-CE1 3.87Å; L223-F287 HydrophobicContact CD2-CE2 4.16Å; L223-F287 HydrophobicContact CD2-CZ 3.67Å; L223-V290 HydrophobicContact CB-CG2 3.74Å |
| 224 | A | 88 | Confident | 88.1 | Confident | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.008 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -71.2 | -26.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | T220 S221 I222 L228 K229 E230 V290 | T220-A224 WeakPolarHBondContact O-CB 3.36Å; T220-A224 PolarHBondContact O-N 2.97Å; S221-A224 PolarHBondContact O-N 3.49Å; I222-A224 VanDerWaalsContact C-N 3.27Å; I222-A224 PolarHBondContact O-N 3.03Å; A224-L228 CarbonylContact O-C 3.57Å; A224-L228 WeakPolarHBondContact O-CA 3.35Å; A224-L228 VanDerWaalsContact O-CB 3.26Å; A224-L228 WeakPolarHBondContact O-CB 3.38Å; A224-L228 PolarHBondContact O-N 2.91Å; A224-L228 VanDerWaalsContact O-N 3.1Å; A224-K229 PolarHBondContact O-N 3.28Å; A224-E230 HydrophobicContact CB-CG 4.32Å; A224-E230 VanDerWaalsContact CB-OE2 3.3Å; A224-E230 WeakPolarHBondContact CB-OE2 3.11Å; A224-E230 PolarHBondContact O-N 3.39Å; A224-V290 HydrophobicContact CB-CG2 4.38Å |
| 225 | W | 88.5 | Confident | 87.8 | Confident | 138 Ų | 138 | 64.9 Ų | 64.9 | 52% | 0.523 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -66.4 | -48.3 | 167.7 | 167.2 | 48 | 0 | 0 | 0 | 111.1 | S221 I222 K229 E230 C232 | S221-W225 PolarHBondContact O-N 2.9Å; I222-W225 WeakPolarHBondContact O-CB 3.46Å; I222-W225 PolarHBondContact O-N 2.81Å; W225-K229 WeakPolarHBondContact O-CA 3.36Å; W225-K229 PolarHBondContact O-N 2.75Å; W225-K229 VanDerWaalsContact O-N 3.09Å; W225-E230 VanDerWaalsContact CA-O 3.31Å; W225-E230 WeakPolarHBondContact CA-O 3.42Å; W225-E230 WeakPolarHBondContact CB-O 3.28Å; W225-C232 HydrophobicContact CB-CB 3.81Å; W225-C232 HydrophobicContact CD2-CB 3.6Å; W225-C232 HydrophobicContact CE3-CB 4.05Å; W225-C232 HydrophobicContact CG-CB 3.5Å; W225-C232 VanDerWaalsContact CG-CB 3.5Å |
| 226 | V | 89.9 | Confident | 87.5 | Confident | 85 Ų | 85 | 65 Ų | 65 | 52% | 0.515 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -65.5 | -53.4 | -179 | 179.6 | 0 | 0 | 0 | 0 | 112 | I222 L223 | I222-V226 PolarHBondContact O-N 3.45Å; L223-V226 PolarHBondContact O-N 2.89Å |
| 227 | F | 87.9 | Confident | 87.2 | Confident | 103 Ų | 103 | 68.6 Ų | 68.6 | 45% | 0.452 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -91.9 | -22.7 | -169.4 | -72.1 | -80.7 | 0 | 0 | 0 | 115.3 | L223 F287 V290 | L223-F227 HydrophobicContact CB-CD2 4.42Å; L223-F227 HydrophobicContact CD2-CD2 4.35Å; L223-F227 HydrophobicContact CD2-CE2 4.04Å; L223-F227 WeakPolarHBondContact O-CB 3.43Å; L223-F227 WeakPolarHBondContact O-CD2 3.31Å; L223-F227 PolarHBondContact O-N 3.19Å; F227-F287 HydrophobicContact CE2-CD1 4.45Å; F227-F287 AromaticContact CE2-CE1 3.67Å; F227-F287 HydrophobicContact CE2-CE1 3.67Å; F227-F287 HydrophobicContact CE2-CZ 4.48Å; F227-F287 AromaticContact CZ-CE1 3.98Å; F227-F287 HydrophobicContact CZ-CE1 3.98Å; F227-V290 HydrophobicContact CB-CG1 4.05Å |
| 228 | L | 84.6 | Confident | 87.3 | Confident | 45 Ų | 45 | 71.6 Ų | 71.6 | 24% | 0.236 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -116.1 | 0.2 | -179.2 | -82.9 | 61.3 | 0 | 0 | 0 | 112.7 | A224 E230 V290 R293 K294 | A224-L228 CarbonylContact O-C 3.57Å; A224-L228 WeakPolarHBondContact O-CA 3.35Å; A224-L228 VanDerWaalsContact O-CB 3.26Å; A224-L228 WeakPolarHBondContact O-CB 3.38Å; A224-L228 PolarHBondContact O-N 2.91Å; A224-L228 VanDerWaalsContact O-N 3.1Å; L228-E230 HydrophobicContact CB-CG 4.34Å; L228-E230 PolarHBondContact O-N 3.47Å; L228-V290 HydrophobicContact CD1-CG1 3.5Å; L228-R293 HydrophobicContact CD2-CB 4.46Å; L228-K294 HydrophobicContact CD1-CB 4.25Å; L228-K294 HydrophobicContact CD1-CD 4.11Å; L228-K294 HydrophobicContact CD1-CG 4.39Å |
| 229 | K | 84.2 | Confident | 87.2 | Confident | 188 Ų | 188 | 73.4 Ų | 73.4 | 82% | 0.817 | 35% | 0.35 | S | S | * | . | trans | 57.4 | 27.8 | -179.8 | -56.7 | -174 | 179 | -176 | 0 | 113.8 | A224 W225 | A224-K229 PolarHBondContact O-N 3.28Å; W225-K229 WeakPolarHBondContact O-CA 3.36Å; W225-K229 PolarHBondContact O-N 2.75Å; W225-K229 VanDerWaalsContact O-N 3.09Å | ||
| 230 | E | 84.9 | Confident | 87.2 | Confident | 53 Ų | 53 | 73.3 Ų | 73.3 | 25% | 0.248 | 35% | 0.351 | C | S | . | . | trans | -65.5 | 137.5 | 170 | -63.8 | -159.1 | 131.8 | 0 | 0 | 110.5 | A224 W225 L228 C232 R293 K409 | A224-E230 HydrophobicContact CB-CG 4.32Å; A224-E230 VanDerWaalsContact CB-OE2 3.3Å; A224-E230 WeakPolarHBondContact CB-OE2 3.11Å; A224-E230 PolarHBondContact O-N 3.39Å; W225-E230 VanDerWaalsContact CA-O 3.31Å; W225-E230 WeakPolarHBondContact CA-O 3.42Å; W225-E230 WeakPolarHBondContact CB-O 3.28Å; L228-E230 HydrophobicContact CB-CG 4.34Å; L228-E230 PolarHBondContact O-N 3.47Å; E230-C232 PolarHBondContact O-N 3.26Å; E230-R293 IonicContact OE1-CZ 2.55Å; E230-R293 IonicContact OE1-NH1 3.13Å; E230-R293 PolarHBondContact OE1-NH1 2.65Å; E230-R293 IonicContact OE1-NH2 3.98Å; E230-R293 PolarHBondContact OE1-NH2 3.42Å; E230-R293 IonicContact OE2-CZ 3.63Å; E230-R293 IonicContact OE2-NH1 3.47Å; E230-R293 PolarHBondContact OE2-NH1 2.77Å; E230-K409 IonicContact OE2-NZ 2.74Å; E230-K409 PolarHBondContact OE2-NZ 3.49Å | ||
| 231 | R | 79.6 | Confident | 87.3 | Confident | 230 Ų | 230 | 76.5 Ų | 76.5 | 87% | 0.868 | 37% | 0.371 | S | S | * | . | trans | -64 | 105.9 | 177.1 | -64.1 | -172.3 | -174.6 | -174.6 | 1.1 | 110.7 | ||||
| 232 | C | 78 | Confident | 87.5 | Confident | 50 Ų | 50 | 80.5 Ų | 80.5 | 34% | 0.338 | 39% | 0.388 | S | S | . | . | trans | -63.2 | 153.9 | 162.4 | -169.4 | 0 | 0 | 0 | 0 | 109.9 | W225 E230 | W225-C232 HydrophobicContact CB-CB 3.81Å; W225-C232 HydrophobicContact CD2-CB 3.6Å; W225-C232 HydrophobicContact CE3-CB 4.05Å; W225-C232 HydrophobicContact CG-CB 3.5Å; W225-C232 VanDerWaalsContact CG-CB 3.5Å; E230-C232 PolarHBondContact O-N 3.26Å | ||
| 233 | T | 84.6 | Confident | 87.7 | Confident | 49 Ų | 49 | 78.1 Ų | 78.1 | 30% | 0.301 | 38% | 0.375 | S | S | . | . | trans | -146.8 | 168.2 | -179 | 68.2 | 0 | 0 | 0 | 0 | 111.5 | W235 D236 C237 R408 | T233-W235 PolarHBondContact O-N 2.91Å; T233-W235 VanDerWaalsContact O-N 3.15Å; T233-D236 PolarHBondContact N-OD2 2.99Å; T233-D236 WeakPolarHBondContact O-CB 3.31Å; T233-D236 PolarHBondContact O-N 3.49Å; T233-D236 PolarHBondContact OG1-OD2 3.45Å; T233-C237 PolarHBondContact O-N 3.05Å; T233-R408 PolarHBondContact OG1-NH1 3.02Å; T233-R408 VanDerWaalsContact OG1-NH1 3.07Å; T233-R408 PolarHBondContact OG1-NH2 3.26Å | ||
| 234 | I | 86 | Confident | 87.8 | Confident | 139 Ų | 139 | 80.1 Ų | 80.1 | 71% | 0.713 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -50.3 | -41.6 | 179.3 | -58.8 | 167.2 | 0 | 0 | 0 | 112 | D236 C237 V238 | I234-D236 VanDerWaalsContact C-N 3.35Å; I234-D236 PolarHBondContact O-N 3.42Å; I234-C237 WeakPolarHBondContact O-CB 3.41Å; I234-C237 PolarHBondContact O-N 2.89Å; I234-C237 VanDerWaalsContact O-N 3.13Å; I234-V238 HydrophobicContact CG2-CG2 4.4Å; I234-V238 WeakPolarHBondContact O-CG2 3.4Å; I234-V238 PolarHBondContact O-N 2.64Å |
| 235 | W | 86.3 | Confident | 88 | Confident | 153 Ų | 153 | 82.9 Ų | 82.9 | 58% | 0.58 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -61.9 | -37.2 | 177.7 | -67.9 | 104.9 | 0 | 0 | 0 | 113.8 | T233 C237 V238 F239 | T233-W235 PolarHBondContact O-N 2.91Å; T233-W235 VanDerWaalsContact O-N 3.15Å; W235-C237 VanDerWaalsContact C-N 3.28Å; W235-C237 PolarHBondContact O-N 3.26Å; W235-V238 PolarHBondContact O-N 2.94Å; W235-F239 HydrophobicContact CB-CD2 4.5Å; W235-F239 HydrophobicContact CB-CE2 4.23Å; W235-F239 WeakPolarHBondContact O-CD2 3.28Å; W235-F239 WeakPolarHBondContact O-CG 3.18Å; W235-F239 PolarHBondContact O-N 2.86Å |
| 236 | D | 85.4 | Confident | 88.2 | Confident | 3 Ų | 3 | 76.3 Ų | 76.3 | 2% | 0.016 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.2 | -34.2 | 176.6 | -58.6 | -85.3 | 0 | 0 | 0 | 110.7 | S221 T233 I234 T240 R408 | S221-D236 PolarHBondContact OG-OD1 2.91Å; T233-D236 PolarHBondContact N-OD2 2.99Å; T233-D236 WeakPolarHBondContact O-CB 3.31Å; T233-D236 PolarHBondContact O-N 3.49Å; T233-D236 PolarHBondContact OG1-OD2 3.45Å; I234-D236 VanDerWaalsContact C-N 3.35Å; I234-D236 PolarHBondContact O-N 3.42Å; D236-T240 WeakPolarHBondContact O-CB 3.47Å; D236-T240 PolarHBondContact O-N 2.77Å; D236-T240 PolarHBondContact O-OG1 3.5Å; D236-R408 IonicContact OD1-NH1 3.54Å; D236-R408 IonicContact OD2-CZ 3.87Å; D236-R408 IonicContact OD2-NH1 2.82Å; D236-R408 PolarHBondContact OD2-NH1 3.05Å |
| 237 | C | 88 | Confident | 88.3 | Confident | 75 Ų | 75 | 72.7 Ų | 72.7 | 51% | 0.507 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -67.2 | -48.3 | 171.3 | -173.9 | 0 | 0 | 0 | 0 | 111.9 | T233 I234 W235 F239 T240 V241 | T233-C237 PolarHBondContact O-N 3.05Å; I234-C237 WeakPolarHBondContact O-CB 3.41Å; I234-C237 PolarHBondContact O-N 2.89Å; I234-C237 VanDerWaalsContact O-N 3.13Å; W235-C237 VanDerWaalsContact C-N 3.28Å; W235-C237 PolarHBondContact O-N 3.26Å; C237-F239 PolarHBondContact O-N 3.4Å; C237-T240 WeakPolarHBondContact O-CA 3.38Å; C237-T240 WeakPolarHBondContact O-CB 3.24Å; C237-T240 PolarHBondContact O-N 3.48Å; C237-V241 PolarHBondContact O-N 3.25Å |
| 238 | V | 91.8 | Very high | 88.4 | Confident | 74 Ų | 74 | 71.4 Ų | 71.4 | 45% | 0.448 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -56.5 | -47.4 | 177.3 | 172 | 0 | 0 | 0 | 0 | 111.4 | I234 W235 T240 V241 F242 | I234-V238 HydrophobicContact CG2-CG2 4.4Å; I234-V238 WeakPolarHBondContact O-CG2 3.4Å; I234-V238 PolarHBondContact O-N 2.64Å; W235-V238 PolarHBondContact O-N 2.94Å; V238-T240 VanDerWaalsContact C-N 3.31Å; V238-T240 PolarHBondContact O-N 3.01Å; V238-V241 PolarHBondContact O-N 2.85Å; V238-F242 PolarHBondContact O-N 3.05Å |
| 239 | F | 91.4 | Very high | 88.7 | Confident | 38 Ų | 38 | 71 Ų | 71 | 17% | 0.167 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.1 | -34 | 175.7 | -65.7 | -50.3 | 0 | 0 | 0 | 112.4 | W235 C237 F242 T243 S401 V405 | W235-F239 HydrophobicContact CB-CD2 4.5Å; W235-F239 HydrophobicContact CB-CE2 4.23Å; W235-F239 WeakPolarHBondContact O-CD2 3.28Å; W235-F239 WeakPolarHBondContact O-CG 3.18Å; W235-F239 PolarHBondContact O-N 2.86Å; C237-F239 PolarHBondContact O-N 3.4Å; F239-F242 PolarHBondContact O-N 3.4Å; F239-T243 WeakPolarHBondContact O-CB 3.29Å; F239-T243 PolarHBondContact O-N 3.44Å; F239-T243 PolarHBondContact O-OG1 3.39Å; F239-S401 WeakPolarHBondContact O-CB 3.28Å; F239-V405 HydrophobicContact CB-CG2 3.51Å; F239-V405 HydrophobicContact CD2-CB 4.45Å; F239-V405 HydrophobicContact CD2-CG2 3.45Å; F239-V405 VanDerWaalsContact CD2-CG2 3.45Å; F239-V405 HydrophobicContact CE2-CG2 4.38Å; F239-V405 HydrophobicContact CG-CG2 3.72Å |
| 240 | T | 90.9 | Very high | 88.8 | Confident | 21 Ų | 21 | 62 Ų | 62 | 13% | 0.129 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.8 | -48.4 | 174 | -58.2 | 0 | 0 | 0 | 0 | 111.5 | I222 D236 C237 V238 F242 T243 L244 | I222-T240 HydrophobicContact CD1-CG2 3.8Å; D236-T240 WeakPolarHBondContact O-CB 3.47Å; D236-T240 PolarHBondContact O-N 2.77Å; D236-T240 PolarHBondContact O-OG1 3.5Å; C237-T240 WeakPolarHBondContact O-CA 3.38Å; C237-T240 WeakPolarHBondContact O-CB 3.24Å; C237-T240 PolarHBondContact O-N 3.48Å; V238-T240 VanDerWaalsContact C-N 3.31Å; V238-T240 PolarHBondContact O-N 3.01Å; T240-F242 PolarHBondContact O-N 3.03Å; T240-T243 WeakPolarHBondContact O-CB 3.46Å; T240-T243 PolarHBondContact O-N 3.22Å; T240-L244 HydrophobicContact CG2-CD1 4.17Å; T240-L244 WeakPolarHBondContact O-CG 3.48Å; T240-L244 PolarHBondContact O-N 3.06Å |
| 241 | V | 93.1 | Very high | 88.7 | Confident | 83 Ų | 83 | 60.3 Ų | 60.3 | 50% | 0.503 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -58.6 | -48.8 | 176.3 | 175.8 | 0 | 0 | 0 | 0 | 110.6 | C237 V238 T243 L244 T245 | C237-V241 PolarHBondContact O-N 3.25Å; V238-V241 PolarHBondContact O-N 2.85Å; V241-T243 VanDerWaalsContact C-N 3.26Å; V241-T243 PolarHBondContact O-N 3.21Å; V241-L244 PolarHBondContact O-N 3.47Å; V241-L244 VanDerWaalsContact O-N 3.13Å; V241-T245 PolarHBondContact O-N 3.29Å; V241-T245 PolarHBondContact O-OG1 3.19Å; V241-T245 VanDerWaalsContact O-OG1 3.11Å |
| 242 | F | 93.4 | Very high | 88.8 | Confident | 88 Ų | 88 | 49.4 Ų | 49.4 | 39% | 0.386 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.3 | -33 | 179.8 | -157.5 | -119.2 | 0 | 0 | 0 | 113 | V238 F239 T240 G246 C397 L400 | V238-F242 PolarHBondContact O-N 3.05Å; F239-F242 PolarHBondContact O-N 3.4Å; T240-F242 PolarHBondContact O-N 3.03Å; F242-G246 PolarHBondContact O-N 3.15Å; F242-C397 HydrophobicContact CD1-CB 4.18Å; F242-C397 WeakPolarHBondContact CD1-O 3.31Å; F242-C397 HydrophobicContact CE1-CB 3.93Å; F242-C397 HydrophobicContact CZ-CB 4.18Å; F242-C397 VanDerWaalsContact CZ-SG 3.59Å; F242-L400 HydrophobicContact CE1-CB 4.29Å |
| 243 | T | 93.6 | Very high | 88.7 | Confident | 1 Ų | 1 | 47.7 Ų | 47.7 | 1% | 0.006 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -68.8 | -44.7 | 173.7 | -51.8 | 0 | 0 | 0 | 0 | 111.7 | V218 F239 T240 V241 G246 V247 V398 S401 | V218-T243 HydrophobicContact CG2-CG2 4.43Å; F239-T243 WeakPolarHBondContact O-CB 3.29Å; F239-T243 PolarHBondContact O-N 3.44Å; F239-T243 PolarHBondContact O-OG1 3.39Å; T240-T243 WeakPolarHBondContact O-CB 3.46Å; T240-T243 PolarHBondContact O-N 3.22Å; V241-T243 VanDerWaalsContact C-N 3.26Å; V241-T243 PolarHBondContact O-N 3.21Å; T243-G246 PolarHBondContact O-N 2.91Å; T243-V247 WeakPolarHBondContact O-CG2 3.3Å; T243-V247 PolarHBondContact O-N 3.04Å; T243-V398 HydrophobicContact CG2-CG1 4.32Å; T243-V398 HydrophobicContact CG2-CG2 4.3Å; T243-S401 WeakPolarHBondContact OG1-CB 3.47Å; T243-S401 PolarHBondContact OG1-OG 3.4Å |
| 244 | L | 93.5 | Very high | 87.9 | Confident | 65 Ų | 65 | 47.7 Ų | 47.7 | 34% | 0.34 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 176.3 | -69.4 | 170.4 | 0 | 0 | 0 | 111.1 | F219 T240 V241 G246 V247 I248 F279 | F219-L244 HydrophobicContact CZ-CD2 4.17Å; T240-L244 HydrophobicContact CG2-CD1 4.17Å; T240-L244 WeakPolarHBondContact O-CG 3.48Å; T240-L244 PolarHBondContact O-N 3.06Å; V241-L244 PolarHBondContact O-N 3.47Å; V241-L244 VanDerWaalsContact O-N 3.13Å; L244-G246 VanDerWaalsContact C-N 3.34Å; L244-G246 PolarHBondContact O-N 3.34Å; L244-V247 PolarHBondContact O-N 2.93Å; L244-I248 WeakPolarHBondContact O-CD1 3.41Å; L244-I248 VanDerWaalsContact O-CG1 3.26Å; L244-I248 WeakPolarHBondContact O-CG1 3.47Å; L244-I248 PolarHBondContact O-N 2.63Å; L244-F279 HydrophobicContact CD2-CE2 3.84Å; L244-F279 HydrophobicContact CD2-CZ 3.84Å |
| 245 | T | 92.8 | Very high | 87.1 | Confident | 59 Ų | 59 | 49.1 Ų | 49.1 | 36% | 0.362 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -56.3 | -47.3 | 170.6 | -58.8 | 0 | 0 | 0 | 0 | 111.2 | V241 V247 I248 L249 | V241-T245 PolarHBondContact O-N 3.29Å; V241-T245 PolarHBondContact O-OG1 3.19Å; V241-T245 VanDerWaalsContact O-OG1 3.11Å; T245-V247 PolarHBondContact O-N 3.46Å; T245-I248 PolarHBondContact O-N 3.15Å; T245-L249 HydrophobicContact CG2-CD1 3.93Å; T245-L249 VanDerWaalsContact O-CD1 3.27Å; T245-L249 WeakPolarHBondContact O-CD1 3.23Å; T245-L249 PolarHBondContact O-N 3.08Å |
| 246 | G | 92.5 | Very high | 86.5 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.4 | -42.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | F242 T243 L244 L249 I250 G394 | F242-G246 PolarHBondContact O-N 3.15Å; T243-G246 PolarHBondContact O-N 2.91Å; L244-G246 VanDerWaalsContact C-N 3.34Å; L244-G246 PolarHBondContact O-N 3.34Å; G246-L249 PolarHBondContact O-N 3.15Å; G246-I250 WeakPolarHBondContact O-CD1 3.21Å; G246-I250 WeakPolarHBondContact O-CG1 3.26Å; G246-I250 PolarHBondContact O-N 2.57Å; G246-G394 WeakPolarHBondContact O-CA 3.42Å |
| 247 | V | 91.8 | Very high | 86 | Confident | 10 Ų | 10 | 49.3 Ų | 49.3 | 6% | 0.061 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 174.2 | 172.6 | 0 | 0 | 0 | 0 | 111.5 | I212 T243 L244 T245 L249 I250 A251 F279 V398 | I212-V247 HydrophobicContact CG1-CG1 4.29Å; I212-V247 HydrophobicContact CG1-CG2 4.35Å; I212-V247 HydrophobicContact CG2-CG1 4.22Å; I212-V247 HydrophobicContact CG2-CG2 4.27Å; T243-V247 WeakPolarHBondContact O-CG2 3.3Å; T243-V247 PolarHBondContact O-N 3.04Å; L244-V247 PolarHBondContact O-N 2.93Å; T245-V247 PolarHBondContact O-N 3.46Å; V247-L249 VanDerWaalsContact C-N 3.33Å; V247-L249 PolarHBondContact O-N 3.26Å; V247-I250 PolarHBondContact O-N 3.48Å; V247-I250 VanDerWaalsContact O-N 3.15Å; V247-A251 VanDerWaalsContact O-CB 3.29Å; V247-A251 WeakPolarHBondContact O-CB 3.29Å; V247-A251 PolarHBondContact O-N 3.47Å; V247-F279 HydrophobicContact CG1-CD2 4.01Å; V247-F279 HydrophobicContact CG1-CE2 4.5Å; V247-F279 HydrophobicContact CG2-CD2 4.43Å; V247-V398 HydrophobicContact CG2-CG2 4.37Å |
| 248 | I | 90.6 | Very high | 85 | Confident | 75 Ų | 75 | 47.4 Ų | 47.4 | 39% | 0.385 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.9 | -38.5 | 177.8 | -69.1 | 162.8 | 0 | 0 | 0 | 111.5 | L244 T245 I250 A251 R252 L256 | L244-I248 WeakPolarHBondContact O-CD1 3.41Å; L244-I248 VanDerWaalsContact O-CG1 3.26Å; L244-I248 WeakPolarHBondContact O-CG1 3.47Å; L244-I248 PolarHBondContact O-N 2.63Å; T245-I248 PolarHBondContact O-N 3.15Å; I248-I250 PolarHBondContact O-N 3.48Å; I248-A251 PolarHBondContact O-N 3Å; I248-R252 PolarHBondContact O-N 3.33Å; I248-L256 HydrophobicContact CG2-CD1 3.61Å |
| 249 | L | 89.5 | Confident | 83.5 | Confident | 37 Ų | 37 | 52.5 Ų | 52.5 | 19% | 0.194 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.6 | -27.8 | 175.2 | -99 | 70.7 | 0 | 0 | 0 | 113.3 | T245 G246 V247 R252 W390 | T245-L249 HydrophobicContact CG2-CD1 3.93Å; T245-L249 VanDerWaalsContact O-CD1 3.27Å; T245-L249 WeakPolarHBondContact O-CD1 3.23Å; T245-L249 PolarHBondContact O-N 3.08Å; G246-L249 PolarHBondContact O-N 3.15Å; V247-L249 VanDerWaalsContact C-N 3.33Å; V247-L249 PolarHBondContact O-N 3.26Å; L249-R252 WeakPolarHBondContact O-CG 3.45Å; L249-W390 HydrophobicContact CD2-CE3 4.44Å; L249-W390 HydrophobicContact CG-CE3 4.19Å |
| 250 | I | 87.3 | Confident | 81.8 | Confident | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -87.8 | -43.5 | 178.6 | -60.3 | 157.4 | 0 | 0 | 0 | 110.5 | D208 V211 I212 G246 V247 I248 R252 H271 | D208-I250 HydrophobicContact CB-CG2 3.54Å; D208-I250 VanDerWaalsContact CG-CG2 3.49Å; V211-I250 HydrophobicContact CB-CD1 4.08Å; V211-I250 HydrophobicContact CG1-CD1 3.31Å; I212-I250 HydrophobicContact CD1-CB 4.09Å; I212-I250 HydrophobicContact CD1-CG2 3.67Å; I212-I250 HydrophobicContact CG1-CB 4.33Å; I212-I250 HydrophobicContact CG1-CD1 3.93Å; I212-I250 HydrophobicContact CG1-CG2 4.15Å; G246-I250 WeakPolarHBondContact O-CD1 3.21Å; G246-I250 WeakPolarHBondContact O-CG1 3.26Å; G246-I250 PolarHBondContact O-N 2.57Å; V247-I250 PolarHBondContact O-N 3.48Å; V247-I250 VanDerWaalsContact O-N 3.15Å; I248-I250 PolarHBondContact O-N 3.48Å; I250-R252 PolarHBondContact O-N 2.99Å; I250-R252 PolarHBondContact O-NE 3.21Å; I250-H271 PolarHBondContact O-NE2 3.31Å |
| 251 | A | 82.5 | Confident | 80.4 | Confident | 16 Ų | 16 | 60.6 Ų | 60.6 | 13% | 0.132 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.6 | -34.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | V247 I248 H271 T275 | V247-A251 VanDerWaalsContact O-CB 3.29Å; V247-A251 WeakPolarHBondContact O-CB 3.29Å; V247-A251 PolarHBondContact O-N 3.47Å; I248-A251 PolarHBondContact O-N 3Å; A251-H271 VanDerWaalsContact CA-NE2 3.34Å; A251-H271 WeakPolarHBondContact CA-NE2 3.25Å; A251-H271 PolarHBondContact O-NE2 2.92Å; A251-T275 HydrophobicContact CB-CG2 3.59Å |
| 252 | R | 82.3 | Confident | 78.7 | Confident | 1 Ų | 1 | 61.5 Ų | 61.5 | 0% | 0.004 | 32% | 0.324 | C | S | . | . | trans | 47.2 | 57.4 | 176.5 | -66.3 | 175.1 | -80.9 | 163.9 | -6.8 | 113.3 | D208 I248 L249 I250 F257 L261 S262 G263 I264 W390 | D208-R252 IonicContact OD2-NH2 3.97Å; D208-R252 PolarHBondContact OD2-NH2 3.43Å; I248-R252 PolarHBondContact O-N 3.33Å; L249-R252 WeakPolarHBondContact O-CG 3.45Å; I250-R252 PolarHBondContact O-N 2.99Å; I250-R252 PolarHBondContact O-NE 3.21Å; R252-F257 HydrophobicContact CB-CD2 4.33Å; R252-L261 HydrophobicContact CB-CD1 4.18Å; R252-L261 HydrophobicContact CB-CD2 3.97Å; R252-L261 HydrophobicContact CG-CD2 4.42Å; R252-L261 WeakPolarHBondContact O-CD1 3.22Å; R252-S262 PolarHBondContact NH1-O 3.3Å; R252-G263 PolarHBondContact NH1-O 2.89Å; R252-G263 PolarHBondContact NH2-O 3.33Å; R252-I264 HydrophobicContact CB-CD1 4.5Å; R252-W390 HydrophobicContact CG-CB 4.29Å | ||
| 253 | P | 74.9 | Confident | 77 | Confident | 15 Ų | 15 | 59.7 Ų | 59.7 | 10% | 0.097 | 33% | 0.33 | C | S | . | . | trans | -65.7 | 139.2 | 179.4 | 27.8 | -35.8 | 0 | 0 | 0 | 112 | F255 L256 F257 | P253-F255 HydrophobicContact CB-CD1 3.74Å; P253-F255 HydrophobicContact CB-CE1 3.46Å; P253-F255 VanDerWaalsContact CB-CE1 3.46Å; P253-F255 HydrophobicContact CB-CZ 4.04Å; P253-F255 HydrophobicContact CG-CD1 4.47Å; P253-F255 HydrophobicContact CG-CE1 3.97Å; P253-F255 HydrophobicContact CG-CZ 4.01Å; P253-F255 PolarHBondContact O-N 3.14Å; P253-F255 VanDerWaalsContact O-N 3.17Å; P253-L256 HydrophobicContact CG-CB 4.34Å; P253-L256 HydrophobicContact CG-CD1 3.94Å; P253-L256 HydrophobicContact CG-CG 4.15Å; P253-L256 PolarHBondContact O-N 2.9Å; P253-F257 PolarHBondContact O-N 3.31Å; P253-F257 VanDerWaalsContact O-N 3.17Å | ||
| 254 | P | 69.3 | Low | 75.6 | Confident | 48 Ų | 48 | 61.3 Ų | 61.3 | 31% | 0.312 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.3 | -23.8 | -172.5 | 26 | -35.6 | 0 | 0 | 0 | 112.8 | L256 F257 G258 Y268 | P254-L256 PolarHBondContact O-N 2.98Å; P254-F257 PolarHBondContact O-N 3.16Å; P254-G258 WeakPolarHBondContact CA-O 3.36Å; P254-G258 WeakPolarHBondContact O-CA 3.21Å; P254-G258 PolarHBondContact O-N 3.27Å; P254-Y268 WeakPolarHBondContact CD-OH 3.32Å; P254-Y268 HydrophobicContact CG-CE1 4.18Å |
| 255 | F | 68.7 | Low | 73.9 | Confident | 170 Ų | 170 | 61.1 Ų | 61.1 | 75% | 0.746 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -69.2 | -11.2 | 174 | 72.2 | -100.7 | 0 | 0 | 0 | 114.1 | P253 | P253-F255 HydrophobicContact CB-CD1 3.74Å; P253-F255 HydrophobicContact CB-CE1 3.46Å; P253-F255 VanDerWaalsContact CB-CE1 3.46Å; P253-F255 HydrophobicContact CB-CZ 4.04Å; P253-F255 HydrophobicContact CG-CD1 4.47Å; P253-F255 HydrophobicContact CG-CE1 3.97Å; P253-F255 HydrophobicContact CG-CZ 4.01Å; P253-F255 PolarHBondContact O-N 3.14Å; P253-F255 VanDerWaalsContact O-N 3.17Å |
| 256 | L | 73.4 | Confident | 72.5 | Confident | 100 Ų | 100 | 61.4 Ų | 61.4 | 52% | 0.524 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -110.4 | -28.3 | 171.7 | -63.7 | -178.3 | 0 | 0 | 0 | 113.3 | I248 P253 P254 | I248-L256 HydrophobicContact CG2-CD1 3.61Å; P253-L256 HydrophobicContact CG-CB 4.34Å; P253-L256 HydrophobicContact CG-CD1 3.94Å; P253-L256 HydrophobicContact CG-CG 4.15Å; P253-L256 PolarHBondContact O-N 2.9Å; P254-L256 PolarHBondContact O-N 2.98Å |
| 257 | F | 75.4 | Confident | 71.6 | Confident | 60 Ų | 60 | 66.7 Ų | 66.7 | 26% | 0.263 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -124.5 | 0.2 | -168.3 | -60.5 | -80 | 0 | 0 | 0 | 115.1 | R252 P253 P254 L261 W390 | R252-F257 HydrophobicContact CB-CD2 4.33Å; P253-F257 PolarHBondContact O-N 3.31Å; P253-F257 VanDerWaalsContact O-N 3.17Å; P254-F257 PolarHBondContact O-N 3.16Å; F257-L261 HydrophobicContact CB-CD1 4.35Å; F257-L261 HydrophobicContact CB-CD2 3.8Å; F257-L261 HydrophobicContact CB-CG 4.38Å; F257-W390 HydrophobicContact CD1-CH2 4.14Å; F257-W390 HydrophobicContact CD1-CZ2 4.05Å; F257-W390 HydrophobicContact CD1-CZ3 4.46Å; F257-W390 HydrophobicContact CE1-CD2 4.31Å; F257-W390 AromaticContact CE1-CE3 3.95Å; F257-W390 HydrophobicContact CE1-CE3 3.95Å; F257-W390 AromaticContact CE1-CH2 3.67Å; F257-W390 HydrophobicContact CE1-CH2 3.67Å; F257-W390 HydrophobicContact CE1-CZ2 4.01Å; F257-W390 AromaticContact CE1-CZ3 3.63Å; F257-W390 HydrophobicContact CE1-CZ3 3.63Å; F257-W390 HydrophobicContact CZ-CZ3 4.39Å |
| 258 | G | 66.1 | Low | 71 | Confident | 35 Ų | 35 | 70.3 Ų | 70.3 | 36% | 0.361 | 39% | 0.392 | S | S | . | . | trans | 81 | 172.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | P254 L261 | P254-G258 WeakPolarHBondContact CA-O 3.36Å; P254-G258 WeakPolarHBondContact O-CA 3.21Å; P254-G258 PolarHBondContact O-N 3.27Å; G258-L261 VanDerWaalsContact O-CD1 3.32Å; G258-L261 WeakPolarHBondContact O-CD1 3.47Å | ||
| 259 | E | 61.3 | Low | 70.7 | Confident | 181 Ų | 181 | 70.8 Ų | 70.8 | 85% | 0.846 | 40% | 0.399 | S | S | * | . | S | Bend | trans | -80.5 | -31.8 | -176.3 | -64.5 | -178.4 | 114.6 | 0 | 0 | 113.4 | L261 | E259-L261 PolarHBondContact O-N 3.24Š|
| 260 | H | 55 | Low | 70.4 | Confident | 198 Ų | 198 | 70.8 Ų | 70.8 | 92% | 0.917 | 40% | 0.399 | S | S | * | . | trans | -82.2 | 63.1 | -179.2 | -77.5 | -65.5 | 0 | 0 | 0 | 113 | S262 | H260-S262 PolarHBondContact O-N 2.86Š| ||
| 261 | L | 62.3 | Low | 70.3 | Confident | 31 Ų | 31 | 70.8 Ų | 70.8 | 16% | 0.162 | 40% | 0.399 | C | S | . | . | trans | -84.9 | 101.2 | -179.6 | -85.3 | 160.8 | 0 | 0 | 0 | 112.8 | R252 F257 G258 E259 I264 | R252-L261 HydrophobicContact CB-CD1 4.18Å; R252-L261 HydrophobicContact CB-CD2 3.97Å; R252-L261 HydrophobicContact CG-CD2 4.42Å; R252-L261 WeakPolarHBondContact O-CD1 3.22Å; F257-L261 HydrophobicContact CB-CD1 4.35Å; F257-L261 HydrophobicContact CB-CD2 3.8Å; F257-L261 HydrophobicContact CB-CG 4.38Å; G258-L261 VanDerWaalsContact O-CD1 3.32Å; G258-L261 WeakPolarHBondContact O-CD1 3.47Å; E259-L261 PolarHBondContact O-N 3.24Å; L261-I264 HydrophobicContact CB-CD1 3.76Å; L261-I264 HydrophobicContact CB-CG1 4.31Å; L261-I264 HydrophobicContact CD1-CD1 4.02Å; L261-I264 HydrophobicContact CG-CD1 4.41Å | ||
| 262 | S | 55.8 | Low | 70.6 | Confident | 102 Ų | 102 | 72.2 Ų | 72.2 | 71% | 0.713 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | 140.4 | 174.6 | 56.7 | 0 | 0 | 0 | 0 | 112.5 | R252 H260 | R252-S262 PolarHBondContact NH1-O 3.3Å; H260-S262 PolarHBondContact O-N 2.86Å |
| 263 | G | 58.5 | Low | 71 | Confident | 49 Ų | 49 | 76.6 Ų | 76.6 | 51% | 0.505 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.3 | 37.2 | 178 | 0 | 0 | 0 | 0 | 0 | 114.6 | R252 | R252-G263 PolarHBondContact NH1-O 2.89Å; R252-G263 PolarHBondContact NH2-O 3.33Å |
| 264 | I | 64.8 | Low | 71.9 | Confident | 35 Ų | 35 | 75.9 Ų | 75.9 | 18% | 0.179 | 42% | 0.42 | C | S | . | . | trans | -97.9 | 145.7 | 155.4 | -64.4 | -175.9 | 0 | 0 | 0 | 107.3 | R252 L261 Y268 H271 | R252-I264 HydrophobicContact CB-CD1 4.5Å; L261-I264 HydrophobicContact CB-CD1 3.76Å; L261-I264 HydrophobicContact CB-CG1 4.31Å; L261-I264 HydrophobicContact CD1-CD1 4.02Å; L261-I264 HydrophobicContact CG-CD1 4.41Å; I264-Y268 HydrophobicContact CD1-CD2 3.87Å; I264-Y268 HydrophobicContact CD1-CE2 4.38Å; I264-H271 HydrophobicContact CG2-CB 3.63Å | ||
| 265 | E | 58 | Low | 73 | Confident | 61 Ų | 61 | 74.3 Ų | 74.3 | 29% | 0.285 | 41% | 0.41 | S | S | . | . | trans | -109.7 | 121.3 | -174.5 | -176 | 162.9 | -160.5 | 0 | 0 | 110.7 | P205 R385 | P205-E265 HydrophobicContact CG-CB 4.38Å; E265-R385 IonicContact OE1-CZ 2.69Å; E265-R385 IonicContact OE1-NE 2.77Å; E265-R385 PolarHBondContact OE1-NE 2.81Å; E265-R385 IonicContact OE1-NH2 2.84Å; E265-R385 PolarHBondContact OE1-NH2 3.48Å; E265-R385 IonicContact OE2-CZ 3.22Å; E265-R385 IonicContact OE2-NE 3.63Å; E265-R385 PolarHBondContact OE2-NE 3.19Å | ||
| 266 | G | 62.7 | Low | 74.2 | Confident | 66 Ų | 66 | 70.9 Ų | 70.9 | 68% | 0.68 | 40% | 0.402 | S | S | * | . | S | Bend | trans | 72.9 | -165.3 | -170.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 267 | D | 74.4 | Confident | 75.3 | Confident | 111 Ų | 111 | 66.5 Ų | 66.5 | 59% | 0.594 | 38% | 0.381 | S | S | * | . | trans | -60.6 | 139.2 | 175.3 | -59.8 | -54.8 | 0 | 0 | 0 | 111.4 | T269 N270 H271 | D267-T269 PolarHBondContact O-N 3.05Å; D267-T269 VanDerWaalsContact O-N 3.09Å; D267-N270 WeakPolarHBondContact O-CB 3.32Å; D267-N270 PolarHBondContact O-N 2.81Å; D267-H271 PolarHBondContact O-N 3.12Å | ||
| 268 | Y | 78.6 | Confident | 76.3 | Confident | 85 Ų | 85 | 63.6 Ų | 63.6 | 33% | 0.333 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -51.2 | -36.9 | 172.9 | 172.7 | -99.7 | 0 | 0 | 0 | 112.4 | P254 I264 N270 H271 V272 | P254-Y268 WeakPolarHBondContact CD-OH 3.32Å; P254-Y268 HydrophobicContact CG-CE1 4.18Å; I264-Y268 HydrophobicContact CD1-CD2 3.87Å; I264-Y268 HydrophobicContact CD1-CE2 4.38Å; Y268-N270 PolarHBondContact O-N 3.24Å; Y268-H271 PolarHBondContact O-N 3.14Å; Y268-V272 HydrophobicContact CD1-CG2 4.07Å; Y268-V272 HydrophobicContact CD2-CG2 4.45Å; Y268-V272 HydrophobicContact CE1-CG2 3.36Å; Y268-V272 HydrophobicContact CE2-CG2 3.81Å; Y268-V272 WeakPolarHBondContact O-CG2 3.42Å; Y268-V272 PolarHBondContact O-N 3.46Å; Y268-V272 WeakPolarHBondContact OH-CG2 3.44Å |
| 269 | T | 83.1 | Confident | 77.7 | Confident | 85 Ų | 85 | 64.8 Ų | 64.8 | 52% | 0.521 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -52.7 | -38.4 | 173.4 | -54.8 | 0 | 0 | 0 | 0 | 113.2 | D267 K273 | D267-T269 PolarHBondContact O-N 3.05Å; D267-T269 VanDerWaalsContact O-N 3.09Å; T269-K273 VanDerWaalsContact O-CG 3.31Å; T269-K273 WeakPolarHBondContact O-CG 3.31Å; T269-K273 PolarHBondContact O-N 3.41Å |
| 270 | N | 84.8 | Confident | 79.4 | Confident | 37 Ų | 37 | 57.5 Ų | 57.5 | 20% | 0.198 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -78.8 | -38.2 | -179.5 | -63 | -24.3 | 0 | 0 | 0 | 111.2 | Q203 D267 Y268 V272 K273 G274 | Q203-N270 CarbonylContact O-C 3.56Å; D267-N270 WeakPolarHBondContact O-CB 3.32Å; D267-N270 PolarHBondContact O-N 2.81Å; Y268-N270 PolarHBondContact O-N 3.24Å; N270-V272 VanDerWaalsContact C-N 3.27Å; N270-V272 PolarHBondContact O-N 3.31Å; N270-K273 PolarHBondContact O-N 3.31Å; N270-K273 PolarHBondContact OD1-NZ 2.98Å; N270-G274 PolarHBondContact O-N 3.01Å |
| 271 | H | 85.3 | Confident | 81.4 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.6 | -38.2 | 170.5 | -167.9 | 76.5 | 0 | 0 | 0 | 112.3 | M204 D208 I250 A251 I264 D267 Y268 T275 | M204-H271 WeakPolarHBondContact CB-ND1 3.35Å; D208-H271 VanDerWaalsContact CG-CE1 3.5Å; D208-H271 IonicContact OD2-CE1 3.07Å; D208-H271 PolarHBondContact OD2-CE1 3.33Å; I250-H271 PolarHBondContact O-NE2 3.31Å; A251-H271 VanDerWaalsContact CA-NE2 3.34Å; A251-H271 WeakPolarHBondContact CA-NE2 3.25Å; A251-H271 PolarHBondContact O-NE2 2.92Å; I264-H271 HydrophobicContact CG2-CB 3.63Å; D267-H271 PolarHBondContact O-N 3.12Å; Y268-H271 PolarHBondContact O-N 3.14Å; H271-T275 VanDerWaalsContact O-CB 3.3Å; H271-T275 WeakPolarHBondContact O-CB 3.43Å; H271-T275 PolarHBondContact O-N 3.49Å; H271-T275 PolarHBondContact O-OG1 3.33Å |
| 272 | V | 88.2 | Confident | 83 | Confident | 47 Ų | 47 | 46.6 Ų | 46.6 | 29% | 0.285 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -67.5 | -48.4 | 173.2 | 175.3 | 0 | 0 | 0 | 0 | 112.1 | Y268 N270 G274 T275 V276 | Y268-V272 HydrophobicContact CD1-CG2 4.07Å; Y268-V272 HydrophobicContact CD2-CG2 4.45Å; Y268-V272 HydrophobicContact CE1-CG2 3.36Å; Y268-V272 HydrophobicContact CE2-CG2 3.81Å; Y268-V272 WeakPolarHBondContact O-CG2 3.42Å; Y268-V272 PolarHBondContact O-N 3.46Å; Y268-V272 WeakPolarHBondContact OH-CG2 3.44Å; N270-V272 VanDerWaalsContact C-N 3.27Å; N270-V272 PolarHBondContact O-N 3.31Å; V272-G274 VanDerWaalsContact C-N 3.26Å; V272-G274 PolarHBondContact O-N 3.38Å; V272-T275 PolarHBondContact O-N 3.09Å; V272-V276 HydrophobicContact CG1-CG2 4.25Å; V272-V276 WeakPolarHBondContact O-CG2 3.43Å; V272-V276 PolarHBondContact O-N 3.31Å |
| 273 | K | 90.9 | Very high | 84.9 | Confident | 93 Ų | 93 | 44.4 Ų | 44.4 | 40% | 0.404 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -53.9 | -46.4 | 175.3 | -73.3 | 168.7 | -172.4 | 162.4 | 0 | 110.9 | Y199 T269 N270 A277 | Y199-K273 HydrophobicContact CE1-CB 4.13Å; T269-K273 VanDerWaalsContact O-CG 3.31Å; T269-K273 WeakPolarHBondContact O-CG 3.31Å; T269-K273 PolarHBondContact O-N 3.41Å; N270-K273 PolarHBondContact O-N 3.31Å; N270-K273 PolarHBondContact OD1-NZ 2.98Å; K273-A277 WeakPolarHBondContact O-CB 3.19Å; K273-A277 PolarHBondContact O-N 3.24Å |
| 274 | G | 92.6 | Very high | 86.7 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.3 | -49.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | A200 M204 N270 V272 V276 A277 A278 | A200-G274 VanDerWaalsContact CB-O 3.27Å; A200-G274 WeakPolarHBondContact CB-O 3.36Å; M204-G274 WeakPolarHBondContact CE-O 3.18Å; N270-G274 PolarHBondContact O-N 3.01Å; V272-G274 VanDerWaalsContact C-N 3.26Å; V272-G274 PolarHBondContact O-N 3.38Å; G274-V276 PolarHBondContact O-N 2.93Å; G274-A277 PolarHBondContact O-N 3.48Å; G274-A278 PolarHBondContact O-N 3.35Å |
| 275 | T | 92.6 | Very high | 88.1 | Confident | 15 Ų | 15 | 41.3 Ų | 41.3 | 9% | 0.092 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -55.2 | -49.6 | 177.6 | -65.9 | 0 | 0 | 0 | 0 | 112 | I212 A251 H271 V272 A277 A278 F279 | I212-T275 HydrophobicContact CD1-CG2 4.2Å; A251-T275 HydrophobicContact CB-CG2 3.59Å; H271-T275 VanDerWaalsContact O-CB 3.3Å; H271-T275 WeakPolarHBondContact O-CB 3.43Å; H271-T275 PolarHBondContact O-N 3.49Å; H271-T275 PolarHBondContact O-OG1 3.33Å; V272-T275 PolarHBondContact O-N 3.09Å; T275-A277 VanDerWaalsContact C-N 3.35Å; T275-A277 PolarHBondContact O-N 3.49Å; T275-A278 PolarHBondContact O-N 2.86Å; T275-F279 WeakPolarHBondContact O-CB 3.5Å; T275-F279 PolarHBondContact O-N 3.17Å |
| 276 | V | 94.8 | Very high | 89.9 | Confident | 97 Ų | 97 | 38.4 Ų | 38.4 | 59% | 0.588 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -63.9 | -41 | 179.6 | 172.6 | 0 | 0 | 0 | 0 | 110.8 | V272 G274 F279 G280 | V272-V276 HydrophobicContact CG1-CG2 4.25Å; V272-V276 WeakPolarHBondContact O-CG2 3.43Å; V272-V276 PolarHBondContact O-N 3.31Å; G274-V276 PolarHBondContact O-N 2.93Å; V276-F279 PolarHBondContact O-N 2.94Å; V276-G280 PolarHBondContact O-N 2.9Å |
| 277 | A | 95.9 | Very high | 91.4 | Very high | 8 Ų | 8 | 37.6 Ų | 37.6 | 7% | 0.066 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.9 | -48 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L196 Y199 A200 K273 G274 T275 F279 G280 G281 | L196-A277 HydrophobicContact CB-CB 4.39Å; L196-A277 WeakPolarHBondContact CB-O 3.26Å; L196-A277 HydrophobicContact CD2-CB 3.96Å; Y199-A277 HydrophobicContact CD1-CB 3.73Å; Y199-A277 HydrophobicContact CE1-CB 4.41Å; A200-A277 HydrophobicContact CB-CB 4.21Å; K273-A277 WeakPolarHBondContact O-CB 3.19Å; K273-A277 PolarHBondContact O-N 3.24Å; G274-A277 PolarHBondContact O-N 3.48Å; T275-A277 VanDerWaalsContact C-N 3.35Å; T275-A277 PolarHBondContact O-N 3.49Å; A277-F279 VanDerWaalsContact C-N 3.28Å; A277-F279 PolarHBondContact O-N 3.37Å; A277-G280 PolarHBondContact O-N 3.43Å; A277-G281 PolarHBondContact O-N 3.42Å |
| 278 | A | 96.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.2 | -38.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A200 M204 I212 G274 T275 A282 | A200-A278 HydrophobicContact CB-CB 3.72Å; M204-A278 HydrophobicContact CE-CB 3.55Å; I212-A278 HydrophobicContact CB-CB 3.83Å; I212-A278 HydrophobicContact CG2-CB 3.56Å; G274-A278 PolarHBondContact O-N 3.35Å; T275-A278 PolarHBondContact O-N 2.86Å; A278-A282 WeakPolarHBondContact O-CB 3.41Å; A278-A282 PolarHBondContact O-N 3.06Å |
| 279 | F | 95.8 | Very high | 93 | Very high | 59 Ų | 59 | 29.4 Ų | 29.4 | 26% | 0.259 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -69.5 | -46.9 | 177.8 | -171.4 | -101.8 | 0 | 0 | 0 | 112.4 | I212 F219 L244 V247 T275 V276 A277 G281 A282 I283 | I212-F279 HydrophobicContact CG2-CB 4.19Å; F219-F279 HydrophobicContact CE1-CZ 4.4Å; F219-F279 AromaticContact CE2-CE2 3.89Å; F219-F279 HydrophobicContact CE2-CE2 3.89Å; F219-F279 HydrophobicContact CE2-CZ 4.33Å; F219-F279 AromaticContact CZ-CE2 3.55Å; F219-F279 HydrophobicContact CZ-CE2 3.55Å; F219-F279 AromaticContact CZ-CZ 3.68Å; F219-F279 HydrophobicContact CZ-CZ 3.68Å; L244-F279 HydrophobicContact CD2-CE2 3.84Å; L244-F279 HydrophobicContact CD2-CZ 3.84Å; V247-F279 HydrophobicContact CG1-CD2 4.01Å; V247-F279 HydrophobicContact CG1-CE2 4.5Å; V247-F279 HydrophobicContact CG2-CD2 4.43Å; T275-F279 WeakPolarHBondContact O-CB 3.5Å; T275-F279 PolarHBondContact O-N 3.17Å; V276-F279 PolarHBondContact O-N 2.94Å; A277-F279 VanDerWaalsContact C-N 3.28Å; A277-F279 PolarHBondContact O-N 3.37Å; F279-G281 VanDerWaalsContact C-N 3.3Å; F279-G281 PolarHBondContact O-N 3.43Å; F279-A282 WeakPolarHBondContact O-CB 3.34Å; F279-A282 PolarHBondContact O-N 3.15Å; F279-I283 HydrophobicContact CD1-CD1 4.04Å; F279-I283 HydrophobicContact CE1-CD1 3.7Å; F279-I283 HydrophobicContact CZ-CD1 4.3Å; F279-I283 PolarHBondContact O-N 3.42Å; F279-I283 VanDerWaalsContact O-N 3.15Å |
| 280 | G | 96.7 | Very high | 93.4 | Very high | 29 Ų | 29 | 25.6 Ų | 25.6 | 30% | 0.299 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -60.8 | -40.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V276 A277 I283 G284 | V276-G280 PolarHBondContact O-N 2.9Å; A277-G280 PolarHBondContact O-N 3.43Å; G280-I283 PolarHBondContact O-N 3.13Å; G280-G284 PolarHBondContact O-N 3.33Å |
| 281 | G | 96.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -65.6 | -36.1 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | A193 A277 F279 I283 G284 A285 | A193-G281 WeakPolarHBondContact CB-O 3.26Å; A277-G281 PolarHBondContact O-N 3.42Å; F279-G281 VanDerWaalsContact C-N 3.3Å; F279-G281 PolarHBondContact O-N 3.43Å; G281-I283 VanDerWaalsContact C-N 3.33Å; G281-I283 PolarHBondContact O-N 2.93Å; G281-G284 PolarHBondContact O-N 2.91Å; G281-A285 VanDerWaalsContact O-CB 3.32Å; G281-A285 WeakPolarHBondContact O-CB 3.2Å; G281-A285 PolarHBondContact O-N 3.28Å |
| 282 | A | 96.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -64.3 | -38 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | M213 S215 N216 A278 F279 A286 | M213-A282 HydrophobicContact SD-CB 4.42Å; S215-A282 WeakPolarHBondContact OG-CB 3.39Å; N216-A282 HydrophobicContact CB-CB 4.31Å; N216-A282 WeakPolarHBondContact CB-O 3.36Å; A278-A282 WeakPolarHBondContact O-CB 3.41Å; A278-A282 PolarHBondContact O-N 3.06Å; F279-A282 WeakPolarHBondContact O-CB 3.34Å; F279-A282 PolarHBondContact O-N 3.15Å; A282-A286 WeakPolarHBondContact O-CB 3.31Å; A282-A286 PolarHBondContact O-N 3.22Å |
| 283 | I | 96.3 | Very high | 93.7 | Very high | 56 Ų | 56 | 27.2 Ų | 27.2 | 29% | 0.287 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -68 | -44.4 | 173.6 | -65.4 | 168.3 | 0 | 0 | 0 | 110.5 | F219 F279 G280 G281 A286 F287 | F219-I283 HydrophobicContact CD1-CG1 4.49Å; F219-I283 HydrophobicContact CD2-CG1 4.23Å; F219-I283 HydrophobicContact CE2-CG1 4.46Å; F219-I283 HydrophobicContact CG-CG1 4.26Å; F279-I283 HydrophobicContact CD1-CD1 4.04Å; F279-I283 HydrophobicContact CE1-CD1 3.7Å; F279-I283 HydrophobicContact CZ-CD1 4.3Å; F279-I283 PolarHBondContact O-N 3.42Å; F279-I283 VanDerWaalsContact O-N 3.15Å; G280-I283 PolarHBondContact O-N 3.13Å; G281-I283 VanDerWaalsContact C-N 3.33Å; G281-I283 PolarHBondContact O-N 2.93Å; I283-A286 WeakPolarHBondContact O-CB 3.14Å; I283-A286 PolarHBondContact O-N 3.48Å; I283-A286 VanDerWaalsContact O-N 3.16Å; I283-F287 HydrophobicContact CG2-CD2 3.99Å; I283-F287 HydrophobicContact CG2-CE2 3.81Å; I283-F287 WeakPolarHBondContact O-CD2 3.37Å; I283-F287 PolarHBondContact O-N 2.91Å |
| 284 | G | 96.4 | Very high | 93.5 | Very high | 8 Ų | 8 | 26.7 Ų | 26.7 | 8% | 0.082 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -57.7 | -48.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G280 G281 A286 F287 T288 | G280-G284 PolarHBondContact O-N 3.33Å; G281-G284 PolarHBondContact O-N 2.91Å; G284-A286 VanDerWaalsContact C-N 3.26Å; G284-A286 PolarHBondContact O-N 3.47Å; G284-F287 WeakPolarHBondContact O-CB 3.19Å; G284-F287 PolarHBondContact O-N 3.21Å; G284-F287 VanDerWaalsContact O-N 3.14Å; G284-T288 PolarHBondContact O-N 2.91Å; G284-T288 PolarHBondContact O-OG1 3.41Å |
| 285 | A | 94.9 | Very high | 93.3 | Very high | 11 Ų | 11 | 27 Ų | 27 | 9% | 0.091 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.1 | -37.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A193 M213 N216 G281 T288 F289 | A193-A285 HydrophobicContact CB-CB 4.1Å; M213-A285 HydrophobicContact SD-CB 4.16Å; N216-A285 HydrophobicContact CB-CB 3.94Å; G281-A285 VanDerWaalsContact O-CB 3.32Å; G281-A285 WeakPolarHBondContact O-CB 3.2Å; G281-A285 PolarHBondContact O-N 3.28Å; A285-T288 WeakPolarHBondContact O-CB 3.47Å; A285-T288 PolarHBondContact O-N 3.25Å; A285-F289 WeakPolarHBondContact O-CB 3.31Å; A285-F289 VanDerWaalsContact O-CD1 3.27Å; A285-F289 WeakPolarHBondContact O-CD1 3.37Å; A285-F289 PolarHBondContact O-N 3.02Å |
| 286 | A | 94.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65.5 | -42.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | N216 F219 T220 L223 A282 I283 G284 F289 V290 | N216-A286 WeakPolarHBondContact O-CB 3.5Å; F219-A286 HydrophobicContact CB-CB 3.65Å; T220-A286 WeakPolarHBondContact OG1-CA 3.46Å; T220-A286 WeakPolarHBondContact OG1-CB 3.43Å; L223-A286 HydrophobicContact CD1-CB 3.8Å; A282-A286 WeakPolarHBondContact O-CB 3.31Å; A282-A286 PolarHBondContact O-N 3.22Å; I283-A286 WeakPolarHBondContact O-CB 3.14Å; I283-A286 PolarHBondContact O-N 3.48Å; I283-A286 VanDerWaalsContact O-N 3.16Å; G284-A286 VanDerWaalsContact C-N 3.26Å; G284-A286 PolarHBondContact O-N 3.47Å; A286-F289 PolarHBondContact O-N 3.07Å; A286-V290 WeakPolarHBondContact O-CG2 3.43Å; A286-V290 PolarHBondContact O-N 3.38Å |
| 287 | F | 95.1 | Very high | 92.2 | Very high | 48 Ų | 48 | 29.9 Ų | 29.9 | 21% | 0.211 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -58.4 | -48.8 | 169.5 | -83.7 | -77.4 | 0 | 0 | 0 | 111.1 | F189 L223 F227 I283 G284 F289 V290 I291 | F189-F287 HydrophobicContact CB-CB 4.01Å; F189-F287 HydrophobicContact CD1-CB 4.07Å; F189-F287 HydrophobicContact CD1-CD2 4.29Å; F189-F287 HydrophobicContact CD1-CG 4.29Å; F189-F287 HydrophobicContact CD2-CB 3.88Å; F189-F287 HydrophobicContact CD2-CG 4.32Å; F189-F287 HydrophobicContact CE1-CD2 4.15Å; F189-F287 HydrophobicContact CE1-CG 4.28Å; F189-F287 HydrophobicContact CE2-CB 4.35Å; F189-F287 HydrophobicContact CE2-CD1 4.29Å; F189-F287 HydrophobicContact CE2-CG 4.3Å; F189-F287 HydrophobicContact CG-CB 3.73Å; F189-F287 HydrophobicContact CG-CG 4.32Å; F189-F287 HydrophobicContact CZ-CD1 4.4Å; F189-F287 HydrophobicContact CZ-CD2 4.47Å; F189-F287 HydrophobicContact CZ-CG 4.28Å; L223-F287 HydrophobicContact CD1-CD1 4.07Å; L223-F287 HydrophobicContact CD1-CD2 3.8Å; L223-F287 HydrophobicContact CD1-CE1 4.22Å; L223-F287 HydrophobicContact CD1-CE2 3.94Å; L223-F287 HydrophobicContact CD1-CG 3.85Å; L223-F287 HydrophobicContact CD1-CZ 4.15Å; L223-F287 HydrophobicContact CD2-CD1 4.49Å; L223-F287 HydrophobicContact CD2-CE1 3.87Å; L223-F287 HydrophobicContact CD2-CE2 4.16Å; L223-F287 HydrophobicContact CD2-CZ 3.67Å; F227-F287 HydrophobicContact CE2-CD1 4.45Å; F227-F287 AromaticContact CE2-CE1 3.67Å; F227-F287 HydrophobicContact CE2-CE1 3.67Å; F227-F287 HydrophobicContact CE2-CZ 4.48Å; F227-F287 AromaticContact CZ-CE1 3.98Å; F227-F287 HydrophobicContact CZ-CE1 3.98Å; I283-F287 HydrophobicContact CG2-CD2 3.99Å; I283-F287 HydrophobicContact CG2-CE2 3.81Å; I283-F287 WeakPolarHBondContact O-CD2 3.37Å; I283-F287 PolarHBondContact O-N 2.91Å; G284-F287 WeakPolarHBondContact O-CB 3.19Å; G284-F287 PolarHBondContact O-N 3.21Å; G284-F287 VanDerWaalsContact O-N 3.14Å; F287-F289 VanDerWaalsContact C-N 3.29Å; F287-F289 PolarHBondContact O-N 3.04Å; F287-V290 PolarHBondContact O-N 2.96Å; F287-I291 HydrophobicContact CB-CD1 4.44Å; F287-I291 WeakPolarHBondContact O-CB 3.34Å; F287-I291 WeakPolarHBondContact O-CD1 3.37Å; F287-I291 WeakPolarHBondContact O-CG1 3.36Å; F287-I291 PolarHBondContact O-N 2.79Å |
| 288 | T | 94.1 | Very high | 91.6 | Very high | 7 Ų | 7 | 32.7 Ų | 32.7 | 4% | 0.043 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -55.9 | -42.5 | 177.1 | -49.7 | 0 | 0 | 0 | 0 | 112 | R186 F189 G190 G284 A285 I291 L292 | R186-T288 HydrophobicContact CG-CG2 4.11Å; F189-T288 PolarHBondContact O-OG1 3.19Å; G190-T288 VanDerWaalsContact CA-OG1 3.25Å; G190-T288 WeakPolarHBondContact CA-OG1 3.3Å; G190-T288 PolarHBondContact N-OG1 3.38Å; G190-T288 VanDerWaalsContact N-OG1 3.12Å; G284-T288 PolarHBondContact O-N 2.91Å; G284-T288 PolarHBondContact O-OG1 3.41Å; A285-T288 WeakPolarHBondContact O-CB 3.47Å; A285-T288 PolarHBondContact O-N 3.25Å; T288-I291 PolarHBondContact O-N 3.38Å; T288-L292 HydrophobicContact CG2-CD1 4.09Å; T288-L292 WeakPolarHBondContact O-CB 3.4Å; T288-L292 VanDerWaalsContact O-CG 3.29Å; T288-L292 WeakPolarHBondContact O-CG 3.49Å; T288-L292 PolarHBondContact O-N 2.78Å |
| 289 | F | 91.6 | Very high | 91 | Very high | 17 Ų | 17 | 33 Ų | 33 | 8% | 0.075 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -66.9 | -44.3 | 179.2 | -87.4 | 37.2 | 0 | 0 | 0 | 111.6 | T220 A285 A286 F287 L292 R293 L352 L356 | T220-F289 HydrophobicContact CG2-CB 4.01Å; A285-F289 WeakPolarHBondContact O-CB 3.31Å; A285-F289 VanDerWaalsContact O-CD1 3.27Å; A285-F289 WeakPolarHBondContact O-CD1 3.37Å; A285-F289 PolarHBondContact O-N 3.02Å; A286-F289 PolarHBondContact O-N 3.07Å; F287-F289 VanDerWaalsContact C-N 3.29Å; F287-F289 PolarHBondContact O-N 3.04Å; F289-L292 PolarHBondContact O-N 3.47Å; F289-R293 WeakPolarHBondContact O-CB 3.31Å; F289-R293 PolarHBondContact O-N 3.48Å; F289-L352 HydrophobicContact CE1-CD2 4.41Å; F289-L352 HydrophobicContact CZ-CD1 4.33Å; F289-L356 HydrophobicContact CD1-CD1 4.13Å; F289-L356 HydrophobicContact CD2-CD2 4.46Å; F289-L356 HydrophobicContact CE1-CD1 3.91Å; F289-L356 HydrophobicContact CE2-CD1 4.36Å; F289-L356 HydrophobicContact CE2-CD2 4.33Å; F289-L356 HydrophobicContact CG-CD1 4.44Å; F289-L356 HydrophobicContact CZ-CD1 4.02Å |
| 290 | V | 91.4 | Very high | 90.6 | Very high | 5 Ų | 5 | 35.7 Ų | 35.7 | 3% | 0.03 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63 | -42.3 | 174.9 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | T220 L223 A224 F227 L228 A286 F287 R293 K294 | T220-V290 HydrophobicContact CG2-CG2 3.85Å; L223-V290 HydrophobicContact CB-CG2 3.74Å; A224-V290 HydrophobicContact CB-CG2 4.38Å; F227-V290 HydrophobicContact CB-CG1 4.05Å; L228-V290 HydrophobicContact CD1-CG1 3.5Å; A286-V290 WeakPolarHBondContact O-CG2 3.43Å; A286-V290 PolarHBondContact O-N 3.38Å; F287-V290 PolarHBondContact O-N 2.96Å; V290-R293 PolarHBondContact O-N 3.38Å; V290-K294 PolarHBondContact O-N 2.98Å |
| 291 | I | 92.4 | Very high | 90.2 | Very high | 14 Ų | 14 | 36.2 Ų | 36.2 | 7% | 0.072 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -66 | -45.5 | 179 | -66.1 | 161.1 | 0 | 0 | 0 | 110.9 | Y182 L185 R186 F189 F287 T288 R293 K294 M295 | Y182-I291 HydrophobicContact CD1-CG2 4.34Å; Y182-I291 WeakPolarHBondContact O-CG2 3.45Å; L185-I291 HydrophobicContact CB-CD1 3.79Å; R186-I291 HydrophobicContact CB-CG2 3.86Å; F189-I291 HydrophobicContact CD2-CD1 3.91Å; F287-I291 HydrophobicContact CB-CD1 4.44Å; F287-I291 WeakPolarHBondContact O-CB 3.34Å; F287-I291 WeakPolarHBondContact O-CD1 3.37Å; F287-I291 WeakPolarHBondContact O-CG1 3.36Å; F287-I291 PolarHBondContact O-N 2.79Å; T288-I291 PolarHBondContact O-N 3.38Å; I291-R293 VanDerWaalsContact C-N 3.31Å; I291-R293 PolarHBondContact O-N 3.06Å; I291-K294 PolarHBondContact O-N 2.82Å; I291-K294 VanDerWaalsContact O-N 3.11Å; I291-M295 HydrophobicContact CG2-CE 4.18Å; I291-M295 PolarHBondContact O-N 3.14Å |
| 292 | L | 89.5 | Confident | 89.8 | Confident | 7 Ų | 7 | 37.8 Ų | 37.8 | 4% | 0.037 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -57 | -44.1 | 172.7 | -77.9 | 168 | 0 | 0 | 0 | 111.3 | R186 T288 F289 K294 M295 G296 T353 L356 | R186-L292 HydrophobicContact CG-CD2 4.02Å; R186-L292 HydrophobicContact CG-CG 4.05Å; T288-L292 HydrophobicContact CG2-CD1 4.09Å; T288-L292 WeakPolarHBondContact O-CB 3.4Å; T288-L292 VanDerWaalsContact O-CG 3.29Å; T288-L292 WeakPolarHBondContact O-CG 3.49Å; T288-L292 PolarHBondContact O-N 2.78Å; F289-L292 PolarHBondContact O-N 3.47Å; L292-K294 VanDerWaalsContact C-N 3.28Å; L292-K294 PolarHBondContact O-N 3.32Å; L292-M295 HydrophobicContact CD2-CE 3.96Å; L292-M295 PolarHBondContact O-N 2.73Å; L292-G296 PolarHBondContact O-N 3.24Å; L292-T353 HydrophobicContact CD2-CG2 4.19Å; L292-L356 HydrophobicContact CD1-CD1 3.77Å |
| 293 | R | 83.7 | Confident | 89.6 | Confident | 97 Ų | 97 | 37.9 Ų | 37.9 | 37% | 0.366 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -62.7 | -32.1 | 176.3 | -132.4 | -169.6 | 87.5 | 171.9 | 13.1 | 113.3 | L228 E230 F289 V290 I291 | L228-R293 HydrophobicContact CD2-CB 4.46Å; E230-R293 IonicContact OE1-CZ 2.55Å; E230-R293 IonicContact OE1-NH1 3.13Å; E230-R293 PolarHBondContact OE1-NH1 2.65Å; E230-R293 IonicContact OE1-NH2 3.98Å; E230-R293 PolarHBondContact OE1-NH2 3.42Å; E230-R293 IonicContact OE2-CZ 3.63Å; E230-R293 IonicContact OE2-NH1 3.47Å; E230-R293 PolarHBondContact OE2-NH1 2.77Å; F289-R293 WeakPolarHBondContact O-CB 3.31Å; F289-R293 PolarHBondContact O-N 3.48Å; V290-R293 PolarHBondContact O-N 3.38Å; I291-R293 VanDerWaalsContact C-N 3.31Å; I291-R293 PolarHBondContact O-N 3.06Å |
| 294 | K | 86.7 | Confident | 89.3 | Confident | 83 Ų | 83 | 35.2 Ų | 35.2 | 36% | 0.361 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -80.8 | -22.4 | 178.6 | -163.7 | 173.8 | -177.3 | -178.4 | 0 | 113.4 | Y182 L228 V290 I291 L292 | Y182-K294 HydrophobicContact CD1-CD 4.37Å; Y182-K294 HydrophobicContact CE1-CD 3.68Å; Y182-K294 WeakPolarHBondContact OH-CE 3.34Å; Y182-K294 PolarHBondContact OH-NZ 3.35Å; L228-K294 HydrophobicContact CD1-CB 4.25Å; L228-K294 HydrophobicContact CD1-CD 4.11Å; L228-K294 HydrophobicContact CD1-CG 4.39Å; V290-K294 PolarHBondContact O-N 2.98Å; I291-K294 PolarHBondContact O-N 2.82Å; I291-K294 VanDerWaalsContact O-N 3.11Å; L292-K294 VanDerWaalsContact C-N 3.28Å; L292-K294 PolarHBondContact O-N 3.32Å |
| 295 | M | 87.6 | Confident | 89.1 | Confident | 6 Ų | 6 | 34.9 Ų | 34.9 | 3% | 0.03 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -82.7 | -39.9 | 168.4 | -66.2 | -171.9 | -62.8 | 0 | 0 | 111.7 | L183 R186 I291 L292 K297 S298 V299 | L183-M295 HydrophobicContact CD2-SD 4.15Å; L183-M295 HydrophobicContact CG-SD 4.04Å; R186-M295 HydrophobicContact CB-CE 4.03Å; R186-M295 HydrophobicContact CG-CE 4.02Å; I291-M295 HydrophobicContact CG2-CE 4.18Å; I291-M295 PolarHBondContact O-N 3.14Å; L292-M295 HydrophobicContact CD2-CE 3.96Å; L292-M295 PolarHBondContact O-N 2.73Å; M295-K297 PolarHBondContact O-N 3.26Å; M295-S298 PolarHBondContact O-N 3.49Å; M295-S298 VanDerWaalsContact O-N 3.12Å; M295-S298 PolarHBondContact O-OG 3.28Å; M295-V299 HydrophobicContact CB-CG2 4.13Å; M295-V299 HydrophobicContact CG-CG2 4.39Å; M295-V299 HydrophobicContact SD-CG2 4.32Å |
| 296 | G | 81.9 | Confident | 89.1 | Confident | 20 Ų | 20 | 36.1 Ų | 36.1 | 21% | 0.206 | 17% | 0.17 | C | C | . | . | G | 310 helix | trans | 52.8 | -133.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | L292 Q357 | L292-G296 PolarHBondContact O-N 3.24Å; G296-Q357 WeakPolarHBondContact O-CG 3.14Å; G296-Q357 PolarHBondContact O-NE2 3.47Å |
| 297 | K | 82.7 | Confident | 89.1 | Confident | 153 Ų | 153 | 37.7 Ų | 37.7 | 67% | 0.665 | 18% | 0.176 | S | C | * | . | G | 310 helix | trans | -85.1 | 0.6 | 178.6 | -61.5 | 178.8 | -175.7 | 175.1 | 0 | 114.2 | M295 V299 Q357 | M295-K297 PolarHBondContact O-N 3.26Å; K297-V299 PolarHBondContact O-N 2.95Å; K297-Q357 WeakPolarHBondContact CE-O 3.35Å; K297-Q357 WeakPolarHBondContact CG-O 3.39Å |
| 298 | S | 82.4 | Confident | 89.1 | Confident | 66 Ų | 66 | 35.7 Ų | 35.7 | 46% | 0.462 | 17% | 0.167 | S | C | . | . | G | 310 helix | trans | -78.7 | 2.4 | -178.4 | 71.7 | 0 | 0 | 0 | 0 | 114.7 | M295 | M295-S298 PolarHBondContact O-N 3.49Å; M295-S298 VanDerWaalsContact O-N 3.12Å; M295-S298 PolarHBondContact O-OG 3.28Å |
| 299 | V | 85.3 | Confident | 89.1 | Confident | 6 Ų | 6 | 35.3 Ų | 35.3 | 4% | 0.036 | 17% | 0.165 | C | C | . | . | S | Bend | trans | -143.3 | 133.7 | -178.6 | -172.6 | 0 | 0 | 0 | 0 | 108.7 | K179 L183 M295 K297 Y301 L303 Q357 | K179-V299 HydrophobicContact CB-CG2 3.95Å; K179-V299 HydrophobicContact CG-CG2 3.94Å; L183-V299 HydrophobicContact CD1-CG1 4.24Å; L183-V299 HydrophobicContact CD2-CG1 4.09Å; L183-V299 HydrophobicContact CG-CG1 4.47Å; M295-V299 HydrophobicContact CB-CG2 4.13Å; M295-V299 HydrophobicContact CG-CG2 4.39Å; M295-V299 HydrophobicContact SD-CG2 4.32Å; K297-V299 PolarHBondContact O-N 2.95Å; V299-Y301 PolarHBondContact O-N 3.05Å; V299-L303 HydrophobicContact CG1-CB 4.36Å; V299-L303 HydrophobicContact CG1-CD2 3.96Å; V299-Q357 PolarHBondContact O-NE2 3.32Å |
| 300 | H | 87.8 | Confident | 89.3 | Confident | 116 Ų | 116 | 36.4 Ų | 36.4 | 54% | 0.537 | 17% | 0.173 | S | C | . | . | trans | -64.7 | 134.3 | 176.1 | -64 | -86.1 | 0 | 0 | 0 | 111.2 | T171 Y302 L303 S304 | T171-H300 HydrophobicContact CG2-CB 3.99Å; H300-Y302 VanDerWaalsContact C-N 3.25Å; H300-Y302 PolarHBondContact O-N 3.34Å; H300-L303 WeakPolarHBondContact O-CB 3.32Å; H300-L303 PolarHBondContact O-N 3.18Å; H300-S304 PolarHBondContact O-N 2.86Å | ||
| 301 | Y | 87.3 | Confident | 89.5 | Confident | 41 Ų | 41 | 37.6 Ų | 37.6 | 16% | 0.161 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -53.8 | -39.3 | 179.6 | 57.8 | -83.9 | 0 | 0 | 0 | 113 | V299 L303 S304 V305 T350 K354 | V299-Y301 PolarHBondContact O-N 3.05Å; Y301-L303 VanDerWaalsContact C-N 3.31Å; Y301-L303 PolarHBondContact O-N 2.99Å; Y301-S304 WeakPolarHBondContact O-CA 3.27Å; Y301-S304 WeakPolarHBondContact O-CB 3.16Å; Y301-S304 PolarHBondContact O-N 3.46Å; Y301-V305 WeakPolarHBondContact O-CG2 3.46Å; Y301-V305 PolarHBondContact O-N 3.24Å; Y301-T350 HydrophobicContact CD2-CG2 4Å; Y301-T350 HydrophobicContact CE2-CG2 3.93Å; Y301-K354 HydrophobicContact CD1-CG 4.21Å; Y301-K354 HydrophobicContact CD2-CG 4.13Å; Y301-K354 HydrophobicContact CE1-CG 4.44Å; Y301-K354 HydrophobicContact CE2-CD 4.4Å; Y301-K354 HydrophobicContact CE2-CG 4.33Å; Y301-K354 HydrophobicContact CG-CG 4.07Å; Y301-K354 WeakPolarHBondContact OH-CE 3.08Å; Y301-K354 PolarHBondContact OH-NZ 3.17Å |
| 302 | Y | 88.9 | Confident | 89.7 | Confident | 32 Ų | 32 | 36.9 Ų | 36.9 | 13% | 0.125 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -52.8 | -45.9 | 175.6 | -68.9 | -59.3 | 0 | 0 | 0 | 112.5 | L165 H169 H300 S304 V305 W306 | L165-Y302 HydrophobicContact CB-CD1 4.26Å; L165-Y302 HydrophobicContact CB-CE1 4.03Å; L165-Y302 HydrophobicContact CD1-CD1 4.45Å; L165-Y302 HydrophobicContact CD1-CE1 3.78Å; L165-Y302 HydrophobicContact CG-CE1 4.49Å; H169-Y302 AromaticContact CD2-CD2 3.91Å; H169-Y302 AromaticContact CD2-CE2 3.3Å; H169-Y302 WeakPolarHBondContact CD2-CE2 3.34Å; H169-Y302 AromaticContact NE2-CE2 3.59Å; H300-Y302 VanDerWaalsContact C-N 3.25Å; H300-Y302 PolarHBondContact O-N 3.34Å; Y302-S304 VanDerWaalsContact C-N 3.3Å; Y302-S304 PolarHBondContact O-N 3.17Å; Y302-V305 PolarHBondContact O-N 2.82Å; Y302-W306 WeakPolarHBondContact O-CB 3.09Å; Y302-W306 PolarHBondContact O-N 3.41Å |
| 303 | L | 90.9 | Very high | 89.9 | Confident | 3 Ų | 3 | 37.7 Ų | 37.7 | 2% | 0.016 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.4 | -37 | 178.1 | -174.4 | 66.9 | 0 | 0 | 0 | 111.7 | L166 G172 F173 G175 L183 V299 H300 Y301 W306 Y307 | L166-L303 HydrophobicContact CD1-CB 4.38Å; L166-L303 HydrophobicContact CD1-CD1 3.88Å; G172-L303 WeakPolarHBondContact O-CD1 3.49Å; F173-L303 WeakPolarHBondContact O-CD1 3.48Å; G175-L303 VanDerWaalsContact CA-CD2 3.5Å; L183-L303 HydrophobicContact CD1-CD2 3.58Å; L183-L303 HydrophobicContact CD1-CG 3.99Å; L183-L303 HydrophobicContact CD2-CG 4.21Å; V299-L303 HydrophobicContact CG1-CB 4.36Å; V299-L303 HydrophobicContact CG1-CD2 3.96Å; H300-L303 WeakPolarHBondContact O-CB 3.32Å; H300-L303 PolarHBondContact O-N 3.18Å; Y301-L303 VanDerWaalsContact C-N 3.31Å; Y301-L303 PolarHBondContact O-N 2.99Å; L303-W306 WeakPolarHBondContact O-CB 3.3Å; L303-W306 PolarHBondContact O-N 2.87Å; L303-Y307 HydrophobicContact CD1-CD2 3.98Å; L303-Y307 HydrophobicContact CD1-CE2 3.85Å; L303-Y307 HydrophobicContact CG-CD2 4.13Å; L303-Y307 HydrophobicContact CG-CE2 4.21Å; L303-Y307 WeakPolarHBondContact O-CD2 3.4Å; L303-Y307 PolarHBondContact O-N 3.48Å |
| 304 | S | 90.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.9 | -41.5 | 174.7 | -158.2 | 0 | 0 | 0 | 0 | 112 | R186 H300 Y301 Y302 Y308 | R186-S304 WeakPolarHBondContact CD-OG 3.45Å; R186-S304 PolarHBondContact NH1-O 3.24Å; R186-S304 PolarHBondContact NH1-OG 3.39Å; H300-S304 PolarHBondContact O-N 2.86Å; Y301-S304 WeakPolarHBondContact O-CA 3.27Å; Y301-S304 WeakPolarHBondContact O-CB 3.16Å; Y301-S304 PolarHBondContact O-N 3.46Å; Y302-S304 VanDerWaalsContact C-N 3.3Å; Y302-S304 PolarHBondContact O-N 3.17Å; S304-Y308 PolarHBondContact O-N 2.97Å |
| 305 | V | 92.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -70.6 | -32.6 | 178.2 | -179.5 | 0 | 0 | 0 | 0 | 111.5 | Q158 V162 Y301 Y302 A309 Q349 T353 | Q158-V305 HydrophobicContact CG-CG1 4.12Å; Q158-V305 PolarHBondContact NE2-O 3.43Å; V162-V305 HydrophobicContact CG2-CG1 3.92Å; Y301-V305 WeakPolarHBondContact O-CG2 3.46Å; Y301-V305 PolarHBondContact O-N 3.24Å; Y302-V305 PolarHBondContact O-N 2.82Å; V305-A309 PolarHBondContact O-N 2.78Å; V305-Q349 HydrophobicContact CG1-CG 4.42Å; V305-Q349 HydrophobicContact CG2-CG 4.43Å; V305-T353 HydrophobicContact CG2-CG2 4.37Å |
| 306 | W | 94.1 | Very high | 91.1 | Very high | 37 Ų | 37 | 34.6 Ų | 34.6 | 14% | 0.14 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.7 | -55.1 | 170.9 | 172.4 | -105.7 | 0 | 0 | 0 | 111.9 | M159 V162 L163 L166 F173 Y302 L303 Y308 A309 V310 | M159-W306 HydrophobicContact CB-CZ3 4.37Å; M159-W306 HydrophobicContact CG-CE3 4.12Å; M159-W306 HydrophobicContact CG-CH2 3.74Å; M159-W306 HydrophobicContact CG-CZ3 3.36Å; M159-W306 WeakPolarHBondContact O-CZ3 3.24Å; M159-W306 HydrophobicContact SD-CH2 4.43Å; V162-W306 HydrophobicContact CG1-CB 4Å; L163-W306 HydrophobicContact CB-CH2 4.41Å; L163-W306 HydrophobicContact CB-CZ3 3.82Å; L163-W306 HydrophobicContact CD1-CH2 4.05Å; L163-W306 HydrophobicContact CD1-CZ3 4.21Å; L166-W306 HydrophobicContact CD1-CB 3.75Å; L166-W306 HydrophobicContact CD1-CD2 4.45Å; L166-W306 HydrophobicContact CD1-CG 3.86Å; F173-W306 HydrophobicContact CD1-CZ2 4.08Å; F173-W306 HydrophobicContact CE1-CZ2 4.28Å; Y302-W306 WeakPolarHBondContact O-CB 3.09Å; Y302-W306 PolarHBondContact O-N 3.41Å; L303-W306 WeakPolarHBondContact O-CB 3.3Å; L303-W306 PolarHBondContact O-N 2.87Å; W306-Y308 PolarHBondContact O-N 2.17Å; W306-A309 PolarHBondContact O-N 2.99Å; W306-V310 HydrophobicContact CD2-CG2 3.91Å; W306-V310 HydrophobicContact CE3-CG2 4.26Å; W306-V310 HydrophobicContact CG-CG2 4.46Å; W306-V310 HydrophobicContact CH2-CG2 4.05Å; W306-V310 HydrophobicContact CZ2-CG2 3.68Å; W306-V310 HydrophobicContact CZ3-CG2 4.32Å; W306-V310 WeakPolarHBondContact O-CG2 3.49Å; W306-V310 PolarHBondContact O-N 3.19Å |
| 307 | Y | 94.1 | Very high | 91.6 | Very high | 34 Ų | 34 | 37.1 Ų | 37.1 | 13% | 0.133 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.1 | -35.1 | 178.4 | -93.8 | -94.2 | 0 | 0 | 0 | 112.8 | L183 V184 L303 I311 | L183-Y307 HydrophobicContact CB-CD1 3.91Å; L183-Y307 HydrophobicContact CB-CD2 3.91Å; L183-Y307 HydrophobicContact CB-CE1 4.14Å; L183-Y307 HydrophobicContact CB-CE2 4.12Å; L183-Y307 HydrophobicContact CB-CG 3.79Å; L183-Y307 HydrophobicContact CD1-CD2 4.17Å; L183-Y307 HydrophobicContact CD1-CE2 3.98Å; L183-Y307 HydrophobicContact CD2-CD2 4.02Å; L183-Y307 HydrophobicContact CD2-CG 4.31Å; L183-Y307 HydrophobicContact CG-CD2 4.26Å; L183-Y307 HydrophobicContact CG-CE2 4.48Å; V184-Y307 HydrophobicContact CG2-CD1 4.1Å; V184-Y307 HydrophobicContact CG2-CE1 3.73Å; L303-Y307 HydrophobicContact CD1-CD2 3.98Å; L303-Y307 HydrophobicContact CD1-CE2 3.85Å; L303-Y307 HydrophobicContact CG-CD2 4.13Å; L303-Y307 HydrophobicContact CG-CE2 4.21Å; L303-Y307 WeakPolarHBondContact O-CD2 3.4Å; L303-Y307 PolarHBondContact O-N 3.48Å; Y307-I311 HydrophobicContact CD1-CD1 4Å; Y307-I311 VanDerWaalsContact O-CB 3.31Å; Y307-I311 WeakPolarHBondContact O-CB 3.19Å; Y307-I311 WeakPolarHBondContact O-CG1 3.31Å; Y307-I311 PolarHBondContact O-N 3.33Å |
| 308 | Y | 94.1 | Very high | 92.1 | Very high | 5 Ų | 5 | 34.8 Ų | 34.8 | 2% | 0.02 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.7 | -45.6 | 171.4 | 175.4 | -74.9 | 0 | 0 | 0 | 112.5 | G190 M194 S304 W306 G312 Q349 | G190-Y308 VanDerWaalsContact O-CE2 3.31Å; G190-Y308 WeakPolarHBondContact O-CE2 3.32Å; M194-Y308 VanDerWaalsContact CB-OH 3.3Å; M194-Y308 WeakPolarHBondContact CB-OH 3.36Å; M194-Y308 HydrophobicContact SD-CE1 4.33Å; M194-Y308 PolarHBondContact SD-OH 3.3Å; S304-Y308 PolarHBondContact O-N 2.97Å; W306-Y308 PolarHBondContact O-N 2.17Å; Y308-G312 PolarHBondContact O-N 3.32Å; Y308-Q349 VanDerWaalsContact CD2-NE2 3.29Å; Y308-Q349 VanDerWaalsContact CZ-NE2 3.34Å |
| 309 | A | 95.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.2 | -44.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q158 M159 V305 W306 L313 | Q158-A309 HydrophobicContact CB-CB 4.11Å; Q158-A309 HydrophobicContact CG-CB 4.06Å; M159-A309 HydrophobicContact CB-CB 3.95Å; V305-A309 PolarHBondContact O-N 2.78Å; W306-A309 PolarHBondContact O-N 2.99Å; A309-L313 VanDerWaalsContact O-CB 3.27Å; A309-L313 WeakPolarHBondContact O-CB 3.47Å; A309-L313 PolarHBondContact O-N 3.39Å |
| 310 | V | 95.6 | Very high | 92.5 | Very high | 40 Ų | 40 | 34 Ų | 34 | 24% | 0.242 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.8 | -51.4 | 178.7 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | M159 W306 L313 L314 | M159-V310 HydrophobicContact CG-CG2 4.1Å; M159-V310 HydrophobicContact SD-CG2 3.93Å; W306-V310 HydrophobicContact CD2-CG2 3.91Å; W306-V310 HydrophobicContact CE3-CG2 4.26Å; W306-V310 HydrophobicContact CG-CG2 4.46Å; W306-V310 HydrophobicContact CH2-CG2 4.05Å; W306-V310 HydrophobicContact CZ2-CG2 3.68Å; W306-V310 HydrophobicContact CZ3-CG2 4.32Å; W306-V310 WeakPolarHBondContact O-CG2 3.49Å; W306-V310 PolarHBondContact O-N 3.19Å; V310-L313 PolarHBondContact O-N 2.79Å; V310-L314 HydrophobicContact CG1-CD1 4.27Å; V310-L314 WeakPolarHBondContact O-CG 3.31Å; V310-L314 PolarHBondContact O-N 3.47Å; V310-L314 VanDerWaalsContact O-N 3.09Å |
| 311 | I | 95.9 | Very high | 92.4 | Very high | 29 Ų | 29 | 32.2 Ų | 32.2 | 15% | 0.149 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.8 | -38.5 | -177.4 | -65.9 | 170.7 | 0 | 0 | 0 | 110.8 | V184 F188 Y307 L313 L314 E315 | V184-I311 HydrophobicContact CB-CD1 4.15Å; V184-I311 HydrophobicContact CG1-CD1 3.98Å; V184-I311 HydrophobicContact CG2-CD1 4.29Å; V184-I311 WeakPolarHBondContact O-CD1 3.17Å; F188-I311 HydrophobicContact CB-CG2 4.11Å; Y307-I311 HydrophobicContact CD1-CD1 4Å; Y307-I311 VanDerWaalsContact O-CB 3.31Å; Y307-I311 WeakPolarHBondContact O-CB 3.19Å; Y307-I311 WeakPolarHBondContact O-CG1 3.31Å; Y307-I311 PolarHBondContact O-N 3.33Å; I311-L313 VanDerWaalsContact C-N 3.34Å; I311-L313 PolarHBondContact O-N 2.55Å; I311-L314 PolarHBondContact O-N 3.22Å; I311-E315 WeakPolarHBondContact O-CB 3.42Å; I311-E315 PolarHBondContact O-N 2.84Å |
| 312 | G | 95.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.5 | -34.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | S191 Y308 C316 | S191-G312 WeakPolarHBondContact OG-CA 3.35Å; Y308-G312 PolarHBondContact O-N 3.32Å; G312-C316 WeakPolarHBondContact O-CB 3.21Å; G312-C316 PolarHBondContact O-N 3.42Å; G312-C316 PolarHBondContact O-SG 2.98Å |
| 313 | L | 95.6 | Very high | 92.1 | Very high | 23 Ų | 23 | 38.8 Ų | 38.8 | 12% | 0.12 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -66.7 | -44.5 | 173.1 | -177.5 | 60 | 0 | 0 | 0 | 111.2 | A152 C155 F156 M159 A309 V310 I311 C316 I317 | A152-L313 HydrophobicContact CB-CD1 4.45Å; C155-L313 HydrophobicContact CB-CB 3.99Å; F156-L313 HydrophobicContact CB-CD1 4.16Å; F156-L313 HydrophobicContact CB-CD2 4.42Å; F156-L313 HydrophobicContact CD2-CD2 4.28Å; M159-L313 HydrophobicContact CE-CD2 3.61Å; M159-L313 HydrophobicContact SD-CD2 4.08Å; A309-L313 VanDerWaalsContact O-CB 3.27Å; A309-L313 WeakPolarHBondContact O-CB 3.47Å; A309-L313 PolarHBondContact O-N 3.39Å; V310-L313 PolarHBondContact O-N 2.79Å; I311-L313 VanDerWaalsContact C-N 3.34Å; I311-L313 PolarHBondContact O-N 2.55Å; L313-C316 PolarHBondContact O-N 2.81Å; L313-I317 HydrophobicContact CD1-CD1 4.08Å; L313-I317 HydrophobicContact CD1-CG1 4.4Å; L313-I317 HydrophobicContact CG-CD1 3.92Å; L313-I317 VanDerWaalsContact O-CG1 3.27Å; L313-I317 WeakPolarHBondContact O-CG1 3.36Å; L313-I317 PolarHBondContact O-N 3.34Å |
| 314 | L | 95.7 | Very high | 91.2 | Very high | 96 Ų | 96 | 41.5 Ų | 41.5 | 50% | 0.503 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -61.8 | -45.4 | 175.3 | -68.8 | 170.5 | 0 | 0 | 0 | 111.9 | V310 I311 C316 I317 I318 | V310-L314 HydrophobicContact CG1-CD1 4.27Å; V310-L314 WeakPolarHBondContact O-CG 3.31Å; V310-L314 PolarHBondContact O-N 3.47Å; V310-L314 VanDerWaalsContact O-N 3.09Å; I311-L314 PolarHBondContact O-N 3.22Å; L314-C316 VanDerWaalsContact C-N 3.35Å; L314-C316 PolarHBondContact O-N 3.48Å; L314-I317 PolarHBondContact O-N 2.86Å; L314-I318 WeakPolarHBondContact O-CB 3.5Å; L314-I318 WeakPolarHBondContact O-CD1 3.3Å; L314-I318 VanDerWaalsContact O-CG1 3.23Å; L314-I318 WeakPolarHBondContact O-CG1 3.24Å; L314-I318 PolarHBondContact O-N 3.35Å |
| 315 | E | 94 | Very high | 90.2 | Very high | 26 Ų | 26 | 46.6 Ų | 46.6 | 12% | 0.121 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.6 | -43 | 176.7 | -178.4 | 175.6 | -158.4 | 0 | 0 | 111.9 | S191 N192 I195 I311 T319 | S191-E315 WeakPolarHBondContact CB-OE2 3.45Å; S191-E315 PolarHBondContact OG-OE2 3.49Å; N192-E315 WeakPolarHBondContact CA-OE1 3.48Å; N192-E315 WeakPolarHBondContact CB-OE1 3.45Å; N192-E315 PolarHBondContact N-OE2 3.44Å; N192-E315 VanDerWaalsContact N-OE2 3.12Å; I195-E315 HydrophobicContact CD1-CB 4.48Å; I195-E315 HydrophobicContact CD1-CG 3.87Å; I311-E315 WeakPolarHBondContact O-CB 3.42Å; I311-E315 PolarHBondContact O-N 2.84Å; E315-T319 WeakPolarHBondContact O-CB 3.5Å; E315-T319 PolarHBondContact O-N 2.91Å; E315-T319 PolarHBondContact O-OG1 3.05Å |
| 316 | C | 93.2 | Very high | 89 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.4 | -48.6 | 175.3 | -64.9 | 0 | 0 | 0 | 0 | 111.7 | I148 S151 A152 G312 L313 L314 I318 T319 T320 | I148-C316 HydrophobicContact CG2-CB 3.75Å; S151-C316 VanDerWaalsContact CB-SG 3.56Å; A152-C316 HydrophobicContact CB-CB 3.68Å; G312-C316 WeakPolarHBondContact O-CB 3.21Å; G312-C316 PolarHBondContact O-N 3.42Å; G312-C316 PolarHBondContact O-SG 2.98Å; L313-C316 PolarHBondContact O-N 2.81Å; L314-C316 VanDerWaalsContact C-N 3.35Å; L314-C316 PolarHBondContact O-N 3.48Å; C316-I318 VanDerWaalsContact C-N 3.33Å; C316-I318 PolarHBondContact O-N 3.48Å; C316-T319 PolarHBondContact O-N 3.21Å; C316-T320 PolarHBondContact O-N 3.12Å; C316-T320 PolarHBondContact O-OG1 3.27Å |
| 317 | I | 92.3 | Very high | 87.9 | Confident | 72 Ų | 72 | 55.9 Ų | 55.9 | 37% | 0.369 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -57.6 | -46.2 | 179.2 | -70.6 | 165.7 | 0 | 0 | 0 | 110.9 | L313 L314 S321 W326 | L313-I317 HydrophobicContact CD1-CD1 4.08Å; L313-I317 HydrophobicContact CD1-CG1 4.4Å; L313-I317 HydrophobicContact CG-CD1 3.92Å; L313-I317 VanDerWaalsContact O-CG1 3.27Å; L313-I317 WeakPolarHBondContact O-CG1 3.36Å; L313-I317 PolarHBondContact O-N 3.34Å; L314-I317 PolarHBondContact O-N 2.86Å; I317-S321 VanDerWaalsContact O-CB 3.28Å; I317-S321 WeakPolarHBondContact O-CB 3.42Å; I317-S321 PolarHBondContact O-N 3.01Å; I317-S321 PolarHBondContact O-OG 3.29Å; I317-W326 HydrophobicContact CG1-CH2 4.38Å |
| 318 | I | 92.2 | Very high | 86.6 | Confident | 104 Ų | 104 | 58.1 Ų | 58.1 | 53% | 0.533 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.6 | -50.8 | 176.9 | -68.8 | 164.4 | 0 | 0 | 0 | 109.8 | L314 C316 T320 S321 V322 | L314-I318 WeakPolarHBondContact O-CB 3.5Å; L314-I318 WeakPolarHBondContact O-CD1 3.3Å; L314-I318 VanDerWaalsContact O-CG1 3.23Å; L314-I318 WeakPolarHBondContact O-CG1 3.24Å; L314-I318 PolarHBondContact O-N 3.35Å; C316-I318 VanDerWaalsContact C-N 3.33Å; C316-I318 PolarHBondContact O-N 3.48Å; I318-T320 PolarHBondContact O-N 3.49Å; I318-S321 PolarHBondContact O-N 3.22Å; I318-S321 PolarHBondContact O-OG 3.09Å; I318-V322 WeakPolarHBondContact O-CG2 3.31Å; I318-V322 PolarHBondContact O-N 3.34Å |
| 319 | T | 89.3 | Confident | 85.1 | Confident | 52 Ų | 52 | 59.4 Ų | 59.4 | 32% | 0.319 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -67.7 | -40.7 | -174.1 | -47.3 | 0 | 0 | 0 | 0 | 112.2 | I148 E315 C316 S321 V322 L323 | I148-T319 HydrophobicContact CD1-CG2 3.57Å; E315-T319 WeakPolarHBondContact O-CB 3.5Å; E315-T319 PolarHBondContact O-N 2.91Å; E315-T319 PolarHBondContact O-OG1 3.05Å; C316-T319 PolarHBondContact O-N 3.21Å; T319-S321 VanDerWaalsContact C-N 3.35Å; T319-S321 PolarHBondContact O-N 2.87Å; T319-V322 PolarHBondContact O-N 3.21Å; T319-L323 HydrophobicContact CG2-CD1 4.09Å; T319-L323 WeakPolarHBondContact O-CG 3.47Å; T319-L323 PolarHBondContact O-N 3.27Å |
| 320 | T | 86.8 | Confident | 83.4 | Confident | 5 Ų | 5 | 68.1 Ų | 68.1 | 3% | 0.031 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -66.1 | -35.8 | 173.2 | -47.3 | 0 | 0 | 0 | 0 | 111.6 | I148 C316 I318 V322 L323 G324 E325 W326 | I148-T320 VanDerWaalsContact CG2-OG1 3.28Å; I148-T320 WeakPolarHBondContact CG2-OG1 3.39Å; C316-T320 PolarHBondContact O-N 3.12Å; C316-T320 PolarHBondContact O-OG1 3.27Å; I318-T320 PolarHBondContact O-N 3.49Å; T320-V322 VanDerWaalsContact C-N 3.29Å; T320-V322 PolarHBondContact O-N 3.13Å; T320-L323 PolarHBondContact O-N 3.24Å; T320-G324 PolarHBondContact O-N 3.06Å; T320-E325 WeakPolarHBondContact CG2-O 3.49Å; T320-W326 VanDerWaalsContact CG2-CD1 3.5Å; T320-W326 HydrophobicContact CG2-CD2 3.8Å; T320-W326 HydrophobicContact CG2-CG 3.72Å; T320-W326 HydrophobicContact CG2-CZ2 4.37Å |
| 321 | S | 86 | Confident | 82.1 | Confident | 77 Ų | 77 | 71.7 Ų | 71.7 | 54% | 0.538 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.9 | -28 | 174.5 | 74.4 | 0 | 0 | 0 | 0 | 114 | I317 I318 T319 | I317-S321 VanDerWaalsContact O-CB 3.28Å; I317-S321 WeakPolarHBondContact O-CB 3.42Å; I317-S321 PolarHBondContact O-N 3.01Å; I317-S321 PolarHBondContact O-OG 3.29Å; I318-S321 PolarHBondContact O-N 3.22Å; I318-S321 PolarHBondContact O-OG 3.09Å; T319-S321 VanDerWaalsContact C-N 3.35Å; T319-S321 PolarHBondContact O-N 2.87Å |
| 322 | V | 87.7 | Confident | 81.3 | Confident | 120 Ų | 120 | 72.4 Ų | 72.4 | 73% | 0.727 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -81.8 | -33.5 | 175.1 | 171.8 | 0 | 0 | 0 | 0 | 112 | I318 T319 T320 | I318-V322 WeakPolarHBondContact O-CG2 3.31Å; I318-V322 PolarHBondContact O-N 3.34Å; T319-V322 PolarHBondContact O-N 3.21Å; T320-V322 VanDerWaalsContact C-N 3.29Å; T320-V322 PolarHBondContact O-N 3.13Å |
| 323 | L | 82 | Confident | 80.8 | Confident | 91 Ų | 91 | 80.9 Ų | 80.9 | 48% | 0.476 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -78.8 | -26.4 | 176.7 | -71.8 | 166.4 | 0 | 0 | 0 | 113.4 | I148 T319 T320 E325 | I148-L323 HydrophobicContact CD1-CD1 3.45Å; I148-L323 VanDerWaalsContact CD1-CD1 3.45Å; T319-L323 HydrophobicContact CG2-CD1 4.09Å; T319-L323 WeakPolarHBondContact O-CG 3.47Å; T319-L323 PolarHBondContact O-N 3.27Å; T320-L323 PolarHBondContact O-N 3.24Å; L323-E325 PolarHBondContact O-N 3.5Å |
| 324 | G | 73.1 | Confident | 80.3 | Confident | 61 Ų | 61 | 81.7 Ų | 81.7 | 63% | 0.629 | 44% | 0.444 | S | S | * | . | trans | 80.1 | -12.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | T320 W326 | T320-G324 PolarHBondContact O-N 3.06Å; G324-W326 PolarHBondContact O-N 3.43Å | ||
| 325 | E | 69.7 | Low | 79.9 | Confident | 106 Ų | 106 | 83.5 Ų | 83.5 | 50% | 0.495 | 44% | 0.444 | S | S | . | . | trans | -85.9 | 84.3 | -176.9 | -63.9 | -178.4 | 171 | 0 | 0 | 112.3 | T320 L323 | T320-E325 WeakPolarHBondContact CG2-O 3.49Å; L323-E325 PolarHBondContact O-N 3.5Å | ||
| 326 | W | 67.4 | Low | 79.7 | Confident | 136 Ų | 136 | 91.1 Ų | 91.1 | 52% | 0.515 | 47% | 0.472 | S | S | . | . | trans | -100.5 | 101.3 | 169.5 | -84.5 | 89.5 | 0 | 0 | 0 | 111 | I317 T320 G324 L328 | I317-W326 HydrophobicContact CG1-CH2 4.38Å; T320-W326 VanDerWaalsContact CG2-CD1 3.5Å; T320-W326 HydrophobicContact CG2-CD2 3.8Å; T320-W326 HydrophobicContact CG2-CG 3.72Å; T320-W326 HydrophobicContact CG2-CZ2 4.37Å; G324-W326 PolarHBondContact O-N 3.43Å; W326-L328 HydrophobicContact CE3-CD1 4Å; W326-L328 HydrophobicContact CZ3-CD1 4.02Å | ||
| 327 | N | 69.8 | Low | 79.6 | Confident | 97 Ų | 97 | 92.2 Ų | 92.2 | 52% | 0.519 | 48% | 0.478 | S | S | . | . | trans | -127.8 | 55.2 | -175.2 | -70.3 | -59.3 | 0 | 0 | 0 | 112 | L145 E149 | L145-N327 WeakPolarHBondContact CD2-O 3.32Å; E149-N327 VanDerWaalsContact OE1-C 3.22Å; E149-N327 WeakPolarHBondContact OE1-CA 3.44Å; E149-N327 PolarHBondContact OE1-N 3.36Å | ||
| 328 | L | 67.4 | Low | 79.6 | Confident | 81 Ų | 81 | 89.1 Ų | 89.1 | 42% | 0.424 | 46% | 0.462 | S | S | . | . | trans | -58.9 | 131.7 | 177.2 | -112.4 | 78.4 | 0 | 0 | 0 | 111.7 | I153 W326 F330 | I153-L328 HydrophobicContact CD1-CG 4.47Å; W326-L328 HydrophobicContact CE3-CD1 4Å; W326-L328 HydrophobicContact CZ3-CD1 4.02Å; L328-F330 WeakPolarHBondContact O-CD2 3.47Å; L328-F330 PolarHBondContact O-N 3.49Å | ||
| 329 | P | 63.7 | Low | 79.6 | Confident | 32 Ų | 32 | 87.4 Ų | 87.4 | 21% | 0.208 | 45% | 0.452 | C | S | . | . | trans | -75 | 99.6 | -179 | 31.3 | -37.1 | 0 | 0 | 0 | 111 | L145 C331 L338 | L145-P329 HydrophobicContact CD1-CB 3.97Å; L145-P329 HydrophobicContact CD1-CG 3.57Å; L145-P329 HydrophobicContact CD2-CB 4.16Å; L145-P329 HydrophobicContact CD2-CG 4.23Å; P329-C331 VanDerWaalsContact C-N 3.34Å; P329-C331 PolarHBondContact O-N 2.94Å; P329-L338 HydrophobicContact CG-CD1 3.65Å | ||
| 330 | F | 58.8 | Low | 79.8 | Confident | 183 Ų | 183 | 88.8 Ų | 88.8 | 80% | 0.803 | 46% | 0.457 | S | S | * | . | trans | -62.5 | -37.9 | -178.9 | -74.4 | -89.2 | 0 | 0 | 0 | 113.3 | L328 | L328-F330 WeakPolarHBondContact O-CD2 3.47Å; L328-F330 PolarHBondContact O-N 3.49Å | ||
| 331 | C | 67.4 | Low | 80.2 | Confident | 115 Ų | 115 | 88.6 Ų | 88.6 | 78% | 0.777 | 46% | 0.456 | S | S | * | . | S | Bend | trans | -141.6 | 147.1 | -179.3 | -76 | 0 | 0 | 0 | 0 | 111.3 | P329 | P329-C331 VanDerWaalsContact C-N 3.34Å; P329-C331 PolarHBondContact O-N 2.94Å |
| 332 | G | 80.4 | Confident | 80.7 | Confident | 44 Ų | 44 | 85 Ų | 85 | 45% | 0.454 | 43% | 0.431 | S | S | . | . | S | Bend | trans | 145.9 | 176.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | D334 | G332-D334 PolarHBondContact O-N 3.44Š|
| 333 | R | 84.4 | Confident | 81 | Confident | 178 Ų | 178 | 83.4 Ų | 83.4 | 67% | 0.672 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | -38 | 170.4 | 176.5 | -176.2 | 64 | -170.6 | -1.3 | 111.2 | R335 W336 I337 | R333-R335 PolarHBondContact O-N 2.89Å; R333-W336 WeakPolarHBondContact O-CB 3.22Å; R333-W336 PolarHBondContact O-N 3.01Å; R333-I337 HydrophobicContact CG-CD1 4.21Å; R333-I337 PolarHBondContact O-N 2.97Å |
| 334 | D | 85.8 | Confident | 81.7 | Confident | 40 Ų | 40 | 80.2 Ų | 80.2 | 21% | 0.214 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -72.4 | -18.7 | -165.4 | -41.4 | -45.4 | 0 | 0 | 0 | 111.8 | G332 W336 I337 L338 | G332-D334 PolarHBondContact O-N 3.44Å; D334-W336 VanDerWaalsContact C-N 3.3Å; D334-W336 PolarHBondContact O-N 2.94Å; D334-I337 WeakPolarHBondContact O-CB 3.49Å; D334-I337 PolarHBondContact O-N 3.08Å; D334-L338 WeakPolarHBondContact O-CB 3.42Å; D334-L338 VanDerWaalsContact O-CG 3.24Å; D334-L338 WeakPolarHBondContact O-CG 3.43Å; D334-L338 PolarHBondContact O-N 3.11Å |
| 335 | R | 86.3 | Confident | 82.8 | Confident | 134 Ų | 134 | 77.3 Ų | 77.3 | 51% | 0.506 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -59.2 | -38.7 | 167.1 | -167.2 | 174.7 | 76 | -179.2 | 5.4 | 112.3 | R333 M339 | R333-R335 PolarHBondContact O-N 2.89Å; R335-M339 VanDerWaalsContact O-CG 3.31Å; R335-M339 WeakPolarHBondContact O-CG 3.24Å; R335-M339 PolarHBondContact O-N 2.93Å |
| 336 | W | 89.1 | Confident | 84 | Confident | 186 Ų | 186 | 73 Ų | 73 | 71% | 0.705 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -72 | -35.6 | 175.2 | -65.9 | 111.4 | 0 | 0 | 0 | 112 | R333 D334 M339 L340 | R333-W336 WeakPolarHBondContact O-CB 3.22Å; R333-W336 PolarHBondContact O-N 3.01Å; D334-W336 VanDerWaalsContact C-N 3.3Å; D334-W336 PolarHBondContact O-N 2.94Å; W336-M339 PolarHBondContact O-N 3.21Å; W336-L340 WeakPolarHBondContact O-CB 3.3Å; W336-L340 PolarHBondContact O-N 2.84Å |
| 337 | I | 92.1 | Very high | 85.3 | Confident | 23 Ų | 23 | 67.9 Ų | 67.9 | 12% | 0.118 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.9 | -44.1 | 174 | -56.7 | -179.9 | 0 | 0 | 0 | 110.3 | L138 I142 R333 D334 L340 I341 | L138-I337 HydrophobicContact CB-CG2 3.84Å; L138-I337 HydrophobicContact CD2-CG2 4.11Å; L138-I337 HydrophobicContact CG-CG2 4.39Å; I142-I337 HydrophobicContact CD1-CB 4.4Å; I142-I337 HydrophobicContact CD1-CG2 3.81Å; I142-I337 HydrophobicContact CG1-CG2 3.98Å; R333-I337 HydrophobicContact CG-CD1 4.21Å; R333-I337 PolarHBondContact O-N 2.97Å; D334-I337 WeakPolarHBondContact O-CB 3.49Å; D334-I337 PolarHBondContact O-N 3.08Å; I337-L340 WeakPolarHBondContact O-CB 3.46Å; I337-L340 PolarHBondContact O-N 2.99Å; I337-I341 HydrophobicContact CG2-CD1 3.99Å; I337-I341 WeakPolarHBondContact O-CG1 3.18Å; I337-I341 PolarHBondContact O-N 3.1Å |
| 338 | L | 91.9 | Very high | 86.5 | Confident | 7 Ų | 7 | 63.3 Ų | 63.3 | 4% | 0.037 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.3 | -42.4 | 176.2 | -73.6 | 164.7 | 0 | 0 | 0 | 112.6 | I142 L145 I150 I153 P329 D334 L340 I341 A342 | I142-L338 HydrophobicContact CD1-CD2 3.93Å; I142-L338 HydrophobicContact CD1-CG 4.09Å; L145-L338 HydrophobicContact CD1-CD1 4.06Å; I150-L338 HydrophobicContact CB-CD2 4.21Å; I150-L338 HydrophobicContact CG1-CD2 4.13Å; I150-L338 HydrophobicContact CG2-CD2 3.87Å; I153-L338 HydrophobicContact CD1-CD1 3.94Å; I153-L338 HydrophobicContact CD1-CD2 4.28Å; I153-L338 HydrophobicContact CG2-CB 4.33Å; P329-L338 HydrophobicContact CG-CD1 3.65Å; D334-L338 WeakPolarHBondContact O-CB 3.42Å; D334-L338 VanDerWaalsContact O-CG 3.24Å; D334-L338 WeakPolarHBondContact O-CG 3.43Å; D334-L338 PolarHBondContact O-N 3.11Å; L338-L340 VanDerWaalsContact C-N 3.32Å; L338-L340 PolarHBondContact O-N 2.98Å; L338-I341 PolarHBondContact O-N 3.41Å; L338-A342 WeakPolarHBondContact O-CB 3.41Å; L338-A342 PolarHBondContact O-N 2.83Å |
| 339 | M | 91.9 | Very high | 87.8 | Confident | 68 Ų | 68 | 60 Ų | 60 | 34% | 0.335 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.9 | -40.9 | 172.1 | -72.9 | -58 | -60.7 | 0 | 0 | 111.8 | F157 R335 W336 A342 V343 | F157-M339 HydrophobicContact CD1-CE 4.39Å; F157-M339 HydrophobicContact CD2-SD 4.15Å; F157-M339 HydrophobicContact CE1-CE 4.03Å; F157-M339 HydrophobicContact CE1-SD 3.96Å; F157-M339 HydrophobicContact CE2-SD 3.52Å; F157-M339 VanDerWaalsContact CE2-SD 3.52Å; F157-M339 HydrophobicContact CZ-CE 4.11Å; F157-M339 HydrophobicContact CZ-SD 3.42Å; F157-M339 WeakPolarHBondContact CZ-SD 3.49Å; R335-M339 VanDerWaalsContact O-CG 3.31Å; R335-M339 WeakPolarHBondContact O-CG 3.24Å; R335-M339 PolarHBondContact O-N 2.93Å; W336-M339 PolarHBondContact O-N 3.21Å; M339-A342 PolarHBondContact O-N 3.15Å; M339-V343 WeakPolarHBondContact O-CG2 3.35Å; M339-V343 PolarHBondContact O-N 3.43Å |
| 340 | L | 94.8 | Very high | 89.2 | Confident | 81 Ų | 81 | 59.3 Ų | 59.3 | 42% | 0.424 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.2 | -42.5 | 177 | -175.4 | 59.4 | 0 | 0 | 0 | 112 | L138 W336 I337 L338 A342 V343 L344 | L138-L340 HydrophobicContact CD1-CB 4.3Å; L138-L340 HydrophobicContact CD1-CD2 3.65Å; L138-L340 HydrophobicContact CD1-CG 3.77Å; W336-L340 WeakPolarHBondContact O-CB 3.3Å; W336-L340 PolarHBondContact O-N 2.84Å; I337-L340 WeakPolarHBondContact O-CB 3.46Å; I337-L340 PolarHBondContact O-N 2.99Å; L338-L340 VanDerWaalsContact C-N 3.32Å; L338-L340 PolarHBondContact O-N 2.98Å; L340-A342 VanDerWaalsContact C-N 3.29Å; L340-A342 PolarHBondContact O-N 2.92Å; L340-V343 PolarHBondContact O-N 3.04Å; L340-L344 HydrophobicContact CD1-CD1 3.92Å; L340-L344 HydrophobicContact CD1-CG 3.92Å; L340-L344 HydrophobicContact CG-CD1 3.86Å; L340-L344 HydrophobicContact CG-CG 4.29Å; L340-L344 VanDerWaalsContact O-CB 3.31Å; L340-L344 WeakPolarHBondContact O-CB 3.29Å; L340-L344 VanDerWaalsContact O-CG 3.3Å; L340-L344 WeakPolarHBondContact O-CG 3.31Å; L340-L344 PolarHBondContact O-N 3.25Å |
| 341 | I | 95.4 | Very high | 90.9 | Very high | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.005 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.1 | -40.6 | 172.1 | -73.2 | 165.8 | 0 | 0 | 0 | 111.1 | I135 L138 V139 I142 I150 I337 L338 G345 | I135-I341 HydrophobicContact CG2-CG2 4.16Å; L138-I341 HydrophobicContact CB-CD1 3.85Å; L138-I341 HydrophobicContact CB-CG1 3.71Å; L138-I341 HydrophobicContact CD1-CG1 4.06Å; V139-I341 HydrophobicContact CG2-CD1 3.94Å; I142-I341 HydrophobicContact CD1-CD1 3.65Å; I150-I341 HydrophobicContact CG2-CD1 4.14Å; I150-I341 HydrophobicContact CG2-CG2 4.36Å; I337-I341 HydrophobicContact CG2-CD1 3.99Å; I337-I341 WeakPolarHBondContact O-CG1 3.18Å; I337-I341 PolarHBondContact O-N 3.1Å; L338-I341 PolarHBondContact O-N 3.41Å; I341-G345 VanDerWaalsContact O-CA 3.29Å; I341-G345 WeakPolarHBondContact O-CA 3.24Å; I341-G345 PolarHBondContact O-N 3.05Å |
| 342 | A | 94.8 | Very high | 92.1 | Very high | 1 Ų | 1 | 47.9 Ų | 47.9 | 1% | 0.008 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.6 | -49.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F157 L338 M339 L340 G345 I346 | F157-A342 HydrophobicContact CB-CB 3.75Å; F157-A342 HydrophobicContact CD2-CB 4.11Å; F157-A342 HydrophobicContact CG-CB 4.21Å; L338-A342 WeakPolarHBondContact O-CB 3.41Å; L338-A342 PolarHBondContact O-N 2.83Å; M339-A342 PolarHBondContact O-N 3.15Å; L340-A342 VanDerWaalsContact C-N 3.29Å; L340-A342 PolarHBondContact O-N 2.92Å; A342-G345 WeakPolarHBondContact O-CA 3.47Å; A342-G345 PolarHBondContact O-N 2.89Å; A342-I346 WeakPolarHBondContact O-CD1 3.46Å; A342-I346 VanDerWaalsContact O-CG1 3.31Å; A342-I346 WeakPolarHBondContact O-CG1 3.44Å; A342-I346 PolarHBondContact O-N 3Å |
| 343 | V | 95.6 | Very high | 92.6 | Very high | 87 Ų | 87 | 45.8 Ų | 45.8 | 53% | 0.527 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.9 | -50 | -178.8 | 171.4 | 0 | 0 | 0 | 0 | 111.8 | M339 L340 G345 I346 A347 | M339-V343 WeakPolarHBondContact O-CG2 3.35Å; M339-V343 PolarHBondContact O-N 3.43Å; L340-V343 PolarHBondContact O-N 3.04Å; V343-G345 PolarHBondContact O-N 3.44Å; V343-I346 PolarHBondContact O-N 3.06Å; V343-A347 PolarHBondContact O-N 2.93Å; V343-A347 VanDerWaalsContact O-N 3.14Å |
| 344 | L | 96.4 | Very high | 92.9 | Very high | 24 Ų | 24 | 39.5 Ų | 39.5 | 13% | 0.126 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.7 | -35.4 | 172.8 | -66.2 | 176.1 | 0 | 0 | 0 | 110.8 | F131 I134 I135 L138 L340 A347 G348 | F131-L344 HydrophobicContact CB-CB 4.5Å; F131-L344 HydrophobicContact CD1-CD2 3.83Å; F131-L344 HydrophobicContact CE1-CD2 4.09Å; F131-L344 HydrophobicContact CG-CD2 4.1Å; I134-L344 HydrophobicContact CB-CD1 4.23Å; I134-L344 HydrophobicContact CG2-CD1 3.55Å; I135-L344 HydrophobicContact CD1-CB 3.81Å; I135-L344 HydrophobicContact CG1-CB 3.74Å; I135-L344 HydrophobicContact CG1-CD1 4.36Å; L138-L344 HydrophobicContact CD1-CD1 4.17Å; L340-L344 HydrophobicContact CD1-CD1 3.92Å; L340-L344 HydrophobicContact CD1-CG 3.92Å; L340-L344 HydrophobicContact CG-CD1 3.86Å; L340-L344 HydrophobicContact CG-CG 4.29Å; L340-L344 VanDerWaalsContact O-CB 3.31Å; L340-L344 WeakPolarHBondContact O-CB 3.29Å; L340-L344 VanDerWaalsContact O-CG 3.3Å; L340-L344 WeakPolarHBondContact O-CG 3.31Å; L340-L344 PolarHBondContact O-N 3.25Å; L344-A347 PolarHBondContact O-N 3.41Å; L344-G348 PolarHBondContact O-N 2.87Å |
| 345 | G | 95.2 | Very high | 93.2 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.6 | -41.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | R154 I341 A342 V343 Q349 | R154-G345 PolarHBondContact NH2-O 2.8Å; I341-G345 VanDerWaalsContact O-CA 3.29Å; I341-G345 WeakPolarHBondContact O-CA 3.24Å; I341-G345 PolarHBondContact O-N 3.05Å; A342-G345 WeakPolarHBondContact O-CA 3.47Å; A342-G345 PolarHBondContact O-N 2.89Å; V343-G345 PolarHBondContact O-N 3.44Å; G345-Q349 WeakPolarHBondContact O-CB 3.32Å; G345-Q349 PolarHBondContact O-N 3.17Å |
| 346 | I | 94.5 | Very high | 93.3 | Very high | 16 Ų | 16 | 32 Ų | 32 | 8% | 0.082 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61 | -51.8 | 171.8 | -70.5 | 155.5 | 0 | 0 | 0 | 110 | Q158 F161 A342 V343 T350 | Q158-I346 HydrophobicContact CB-CG1 3.79Å; Q158-I346 HydrophobicContact CG-CG1 3.82Å; F161-I346 HydrophobicContact CB-CD1 3.78Å; F161-I346 HydrophobicContact CD1-CD1 4.45Å; F161-I346 HydrophobicContact CD1-CG2 3.61Å; F161-I346 HydrophobicContact CE1-CG2 4.02Å; F161-I346 HydrophobicContact CG-CD1 4.13Å; F161-I346 HydrophobicContact CG-CG2 4.37Å; A342-I346 WeakPolarHBondContact O-CD1 3.46Å; A342-I346 VanDerWaalsContact O-CG1 3.31Å; A342-I346 WeakPolarHBondContact O-CG1 3.44Å; A342-I346 PolarHBondContact O-N 3Å; V343-I346 PolarHBondContact O-N 3.06Å; I346-T350 VanDerWaalsContact O-CB 3.24Å; I346-T350 WeakPolarHBondContact O-CB 3.13Å; I346-T350 PolarHBondContact O-N 3.25Å; I346-T350 PolarHBondContact O-OG1 3.06Å |
| 347 | A | 95.2 | Very high | 93.3 | Very high | 28 Ų | 28 | 24.5 Ų | 24.5 | 23% | 0.231 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.7 | -49.5 | -175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | F131 V343 L344 Q349 T350 F351 | F131-A347 HydrophobicContact CD2-CB 3.82Å; F131-A347 HydrophobicContact CE2-CB 3.63Å; V343-A347 PolarHBondContact O-N 2.93Å; V343-A347 VanDerWaalsContact O-N 3.14Å; L344-A347 PolarHBondContact O-N 3.41Å; A347-Q349 PolarHBondContact O-N 2.94Å; A347-T350 PolarHBondContact O-N 3.12Å; A347-F351 HydrophobicContact CB-CE2 4.38Å; A347-F351 WeakPolarHBondContact O-CB 3.43Å; A347-F351 VanDerWaalsContact O-CD2 3.29Å; A347-F351 WeakPolarHBondContact O-CD2 3.43Å; A347-F351 WeakPolarHBondContact O-CG 3.37Å; A347-F351 PolarHBondContact O-N 3Å |
| 348 | G | 95.2 | Very high | 93.1 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.3 | -44 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | A128 L344 T350 F351 L352 | A128-G348 WeakPolarHBondContact CB-O 3.2Å; L344-G348 PolarHBondContact O-N 2.87Å; G348-T350 VanDerWaalsContact C-N 3.35Å; G348-T350 PolarHBondContact O-N 2.87Å; G348-F351 PolarHBondContact O-N 3.34Å; G348-L352 VanDerWaalsContact O-CB 3.31Å; G348-L352 WeakPolarHBondContact O-CB 3.43Å; G348-L352 PolarHBondContact O-N 2.93Å |
| 349 | Q | 94.8 | Very high | 92.8 | Very high | 11 Ų | 11 | 29.2 Ų | 29.2 | 5% | 0.051 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -70 | -32.5 | 177.2 | -173.4 | 63.9 | -50.6 | 0 | 0 | 112.2 | F132 V305 Y308 G345 A347 T353 | F132-Q349 HydrophobicContact CZ-CB 4.31Å; V305-Q349 HydrophobicContact CG1-CG 4.42Å; V305-Q349 HydrophobicContact CG2-CG 4.43Å; Y308-Q349 VanDerWaalsContact CD2-NE2 3.29Å; Y308-Q349 VanDerWaalsContact CZ-NE2 3.34Å; G345-Q349 WeakPolarHBondContact O-CB 3.32Å; G345-Q349 PolarHBondContact O-N 3.17Å; A347-Q349 PolarHBondContact O-N 2.94Å; Q349-T353 VanDerWaalsContact O-CB 3.28Å; Q349-T353 WeakPolarHBondContact O-CB 3.49Å; Q349-T353 PolarHBondContact O-N 3.32Å; Q349-T353 PolarHBondContact O-OG1 3.36Å |
| 350 | T | 92.9 | Very high | 92.3 | Very high | 18 Ų | 18 | 29.6 Ų | 29.6 | 11% | 0.11 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -67.3 | -46.4 | 173.4 | -60.9 | 0 | 0 | 0 | 0 | 111.3 | Y301 I346 A347 G348 T353 K354 | Y301-T350 HydrophobicContact CD2-CG2 4Å; Y301-T350 HydrophobicContact CE2-CG2 3.93Å; I346-T350 VanDerWaalsContact O-CB 3.24Å; I346-T350 WeakPolarHBondContact O-CB 3.13Å; I346-T350 PolarHBondContact O-N 3.25Å; I346-T350 PolarHBondContact O-OG1 3.06Å; A347-T350 PolarHBondContact O-N 3.12Å; G348-T350 VanDerWaalsContact C-N 3.35Å; G348-T350 PolarHBondContact O-N 2.87Å; T350-T353 PolarHBondContact O-N 3.38Å; T350-K354 WeakPolarHBondContact O-CG 3.45Å; T350-K354 PolarHBondContact O-N 2.88Å |
| 351 | F | 94.3 | Very high | 91.6 | Very high | 47 Ų | 47 | 26.9 Ų | 26.9 | 21% | 0.206 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -67.9 | -40.5 | 178.2 | -68.1 | -38.2 | 0 | 0 | 0 | 112.7 | Y124 L127 A128 F131 A347 G348 T353 K354 A355 | Y124-F351 AromaticContact CD1-CD1 3.54Å; Y124-F351 HydrophobicContact CD1-CD1 3.54Å; Y124-F351 AromaticContact CD1-CE1 3.94Å; Y124-F351 HydrophobicContact CD1-CE1 3.94Å; Y124-F351 HydrophobicContact CD1-CG 4.2Å; Y124-F351 AromaticContact CE1-CD1 3.93Å; Y124-F351 HydrophobicContact CE1-CD1 3.93Å; Y124-F351 AromaticContact CE1-CE1 3.9Å; Y124-F351 HydrophobicContact CE1-CE1 3.9Å; Y124-F351 HydrophobicContact CG-CD1 4.28Å; L127-F351 HydrophobicContact CB-CD2 4.5Å; L127-F351 HydrophobicContact CD2-CD2 3.8Å; L127-F351 HydrophobicContact CD2-CE2 3.42Å; L127-F351 VanDerWaalsContact CD2-CE2 3.42Å; L127-F351 HydrophobicContact CD2-CZ 3.97Å; L127-F351 HydrophobicContact CG-CD2 3.9Å; L127-F351 HydrophobicContact CG-CE2 3.92Å; A128-F351 HydrophobicContact CB-CB 3.91Å; F131-F351 HydrophobicContact CD2-CD2 4.34Å; F131-F351 HydrophobicContact CE2-CD2 4.02Å; F131-F351 AromaticContact CE2-CE2 3.83Å; F131-F351 HydrophobicContact CE2-CE2 3.83Å; A347-F351 HydrophobicContact CB-CE2 4.38Å; A347-F351 WeakPolarHBondContact O-CB 3.43Å; A347-F351 VanDerWaalsContact O-CD2 3.29Å; A347-F351 WeakPolarHBondContact O-CD2 3.43Å; A347-F351 WeakPolarHBondContact O-CG 3.37Å; A347-F351 PolarHBondContact O-N 3Å; G348-F351 PolarHBondContact O-N 3.34Å; F351-T353 PolarHBondContact O-N 2.89Å; F351-K354 PolarHBondContact O-N 3.4Å; F351-A355 WeakPolarHBondContact O-CB 3.15Å; F351-A355 PolarHBondContact O-N 3.31Å |
| 352 | L | 92.8 | Very high | 91 | Very high | 11 Ų | 11 | 27.3 Ų | 27.3 | 6% | 0.058 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.8 | -41.7 | 173.2 | 179.3 | 60.2 | 0 | 0 | 0 | 111.8 | A128 F132 F289 G348 A355 L356 V364 | A128-L352 HydrophobicContact CB-CB 3.95Å; F132-L352 HydrophobicContact CE2-CB 4.05Å; F132-L352 HydrophobicContact CE2-CD2 3.78Å; F132-L352 HydrophobicContact CZ-CD2 4.19Å; F289-L352 HydrophobicContact CE1-CD2 4.41Å; F289-L352 HydrophobicContact CZ-CD1 4.33Å; G348-L352 VanDerWaalsContact O-CB 3.31Å; G348-L352 WeakPolarHBondContact O-CB 3.43Å; G348-L352 PolarHBondContact O-N 2.93Å; L352-A355 PolarHBondContact O-N 2.96Å; L352-L356 HydrophobicContact CD1-CD1 3.95Å; L352-L356 HydrophobicContact CD1-CG 4.18Å; L352-L356 HydrophobicContact CG-CD1 4.1Å; L352-L356 WeakPolarHBondContact O-CG 3.46Å; L352-L356 PolarHBondContact O-N 3.34Å; L352-V364 HydrophobicContact CD1-CG1 4.14Å |
| 353 | T | 91.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65.5 | -41 | 176.5 | -52.5 | 0 | 0 | 0 | 0 | 110.9 | R186 L292 V305 Q349 T350 F351 Q357 | R186-T353 PolarHBondContact NH2-OG1 2.83Å; L292-T353 HydrophobicContact CD2-CG2 4.19Å; V305-T353 HydrophobicContact CG2-CG2 4.37Å; Q349-T353 VanDerWaalsContact O-CB 3.28Å; Q349-T353 WeakPolarHBondContact O-CB 3.49Å; Q349-T353 PolarHBondContact O-N 3.32Å; Q349-T353 PolarHBondContact O-OG1 3.36Å; T350-T353 PolarHBondContact O-N 3.38Å; F351-T353 PolarHBondContact O-N 2.89Å; T353-Q357 WeakPolarHBondContact O-CG 3.47Å; T353-Q357 PolarHBondContact O-N 3.3Å |
| 354 | K | 90.7 | Very high | 90.3 | Very high | 46 Ų | 46 | 23.6 Ų | 23.6 | 20% | 0.2 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.6 | -46.3 | 172.2 | -78.4 | -174.6 | 177.4 | -177.7 | 0 | 112.4 | Y124 Y301 T350 F351 L356 Q357 I358 | Y124-K354 HydrophobicContact CD2-CB 4.17Å; Y124-K354 HydrophobicContact CE2-CD 4.33Å; Y301-K354 HydrophobicContact CD1-CG 4.21Å; Y301-K354 HydrophobicContact CD2-CG 4.13Å; Y301-K354 HydrophobicContact CE1-CG 4.44Å; Y301-K354 HydrophobicContact CE2-CD 4.4Å; Y301-K354 HydrophobicContact CE2-CG 4.33Å; Y301-K354 HydrophobicContact CG-CG 4.07Å; Y301-K354 WeakPolarHBondContact OH-CE 3.08Å; Y301-K354 PolarHBondContact OH-NZ 3.17Å; T350-K354 WeakPolarHBondContact O-CG 3.45Å; T350-K354 PolarHBondContact O-N 2.88Å; F351-K354 PolarHBondContact O-N 3.4Å; K354-L356 PolarHBondContact O-N 3.02Å; K354-Q357 PolarHBondContact O-N 3.37Å; K354-Q357 VanDerWaalsContact O-N 3.12Å; K354-I358 HydrophobicContact CB-CD1 4.39Å; K354-I358 VanDerWaalsContact O-CG1 3.29Å; K354-I358 WeakPolarHBondContact O-CG1 3.41Å; K354-I358 PolarHBondContact O-N 3.1Å |
| 355 | A | 91.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -56.9 | -50.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | G121 A125 F351 L352 Q357 I358 E359 V364 | G121-A355 VanDerWaalsContact O-CB 3.25Å; G121-A355 WeakPolarHBondContact O-CB 3.05Å; A125-A355 HydrophobicContact CB-CB 3.93Å; F351-A355 WeakPolarHBondContact O-CB 3.15Å; F351-A355 PolarHBondContact O-N 3.31Å; L352-A355 PolarHBondContact O-N 2.96Å; A355-Q357 PolarHBondContact O-N 2.96Å; A355-I358 PolarHBondContact O-N 3.38Å; A355-E359 PolarHBondContact O-N 3.39Å; A355-V364 HydrophobicContact CB-CG1 4.36Å; A355-V364 HydrophobicContact CB-CG2 4.18Å |
| 356 | L | 88.9 | Confident | 89.6 | Confident | 17 Ų | 17 | 24.1 Ų | 24.1 | 9% | 0.089 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -68.1 | -16.8 | 178 | -69.5 | 171 | 0 | 0 | 0 | 114.3 | F289 L292 L352 K354 A361 V364 | F289-L356 HydrophobicContact CD1-CD1 4.13Å; F289-L356 HydrophobicContact CD2-CD2 4.46Å; F289-L356 HydrophobicContact CE1-CD1 3.91Å; F289-L356 HydrophobicContact CE2-CD1 4.36Å; F289-L356 HydrophobicContact CE2-CD2 4.33Å; F289-L356 HydrophobicContact CG-CD1 4.44Å; F289-L356 HydrophobicContact CZ-CD1 4.02Å; L292-L356 HydrophobicContact CD1-CD1 3.77Å; L352-L356 HydrophobicContact CD1-CD1 3.95Å; L352-L356 HydrophobicContact CD1-CG 4.18Å; L352-L356 HydrophobicContact CG-CD1 4.1Å; L352-L356 WeakPolarHBondContact O-CG 3.46Å; L352-L356 PolarHBondContact O-N 3.34Å; K354-L356 PolarHBondContact O-N 3.02Å; L356-A361 HydrophobicContact CD2-CB 4.31Å; L356-V364 HydrophobicContact CD2-CB 4.01Å; L356-V364 HydrophobicContact CD2-CG1 3.67Å; L356-V364 HydrophobicContact CD2-CG2 4.34Å; L356-V364 HydrophobicContact CG-CG1 4.07Å |
| 357 | Q | 88.1 | Confident | 89.5 | Confident | 29 Ų | 29 | 26 Ų | 26 | 14% | 0.136 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -88 | -36.1 | 171 | -76.3 | -168.3 | -27.9 | 0 | 0 | 112.9 | G296 K297 V299 T353 K354 A355 | G296-Q357 WeakPolarHBondContact O-CG 3.14Å; G296-Q357 PolarHBondContact O-NE2 3.47Å; K297-Q357 WeakPolarHBondContact CE-O 3.35Å; K297-Q357 WeakPolarHBondContact CG-O 3.39Å; V299-Q357 PolarHBondContact O-NE2 3.32Å; T353-Q357 WeakPolarHBondContact O-CG 3.47Å; T353-Q357 PolarHBondContact O-N 3.3Å; K354-Q357 PolarHBondContact O-N 3.37Å; K354-Q357 VanDerWaalsContact O-N 3.12Å; A355-Q357 PolarHBondContact O-N 2.96Å |
| 358 | I | 87.5 | Confident | 89.2 | Confident | 70 Ų | 70 | 25.7 Ų | 25.7 | 36% | 0.359 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -80.1 | -46.8 | -177.3 | -64.9 | 165.1 | 0 | 0 | 0 | 110.7 | Y124 K354 A355 | Y124-I358 HydrophobicContact CD2-CD1 3.91Å; Y124-I358 HydrophobicContact CE2-CD1 3.89Å; K354-I358 HydrophobicContact CB-CD1 4.39Å; K354-I358 VanDerWaalsContact O-CG1 3.29Å; K354-I358 WeakPolarHBondContact O-CG1 3.41Å; K354-I358 PolarHBondContact O-N 3.1Å; A355-I358 PolarHBondContact O-N 3.38Å |
| 359 | E | 86.5 | Confident | 89.1 | Confident | 58 Ų | 58 | 27.3 Ų | 27.3 | 27% | 0.271 | 14% | 0.14 | S | C | . | . | S | Bend | trans | -112.3 | 164.2 | -167.9 | -81.1 | -68.4 | 176.3 | 0 | 0 | 114.1 | L122 A355 V364 | L122-E359 HydrophobicContact CD1-CB 4.22Å; L122-E359 HydrophobicContact CD1-CG 3.65Å; A355-E359 PolarHBondContact O-N 3.39Å; E359-V364 HydrophobicContact CB-CG2 3.99Å |
| 360 | K | 82.1 | Confident | 89 | Confident | 76 Ų | 76 | 28.9 Ų | 28.9 | 33% | 0.33 | 15% | 0.15 | S | C | . | . | trans | -69.6 | 141.9 | 175.6 | -62.2 | -179.6 | -174.3 | -176.9 | 0 | 110.1 | G362 P363 V364 S413 | K360-G362 PolarHBondContact O-N 3.24Å; K360-G362 VanDerWaalsContact O-N 3.15Å; K360-P363 HydrophobicContact CB-CG 4.47Å; K360-P363 VanDerWaalsContact O-CD 3.29Å; K360-P363 WeakPolarHBondContact O-CD 2.94Å; K360-V364 PolarHBondContact O-N 3.21Å; K360-S413 WeakPolarHBondContact CD-OG 3.36Å; K360-S413 WeakPolarHBondContact CE-OG 3.18Å; K360-S413 PolarHBondContact NZ-O 3.4Å; K360-S413 PolarHBondContact NZ-OG 2.9Å | ||
| 361 | A | 79.3 | Confident | 89.1 | Confident | 24 Ų | 24 | 28.3 Ų | 28.3 | 20% | 0.198 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -59.9 | -28.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | L356 V364 S365 | L356-A361 HydrophobicContact CD2-CB 4.31Å; A361-V364 PolarHBondContact O-N 3.17Å; A361-S365 PolarHBondContact O-N 2.93Å; A361-S365 PolarHBondContact O-OG 2.89Å |
| 362 | G | 83.3 | Confident | 89 | Confident | 11 Ų | 11 | 26.4 Ų | 26.4 | 11% | 0.113 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.4 | -60.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | K360 V364 S365 L366 | K360-G362 PolarHBondContact O-N 3.24Å; K360-G362 VanDerWaalsContact O-N 3.15Å; G362-V364 PolarHBondContact O-N 3.19Å; G362-S365 PolarHBondContact O-N 2.97Å; G362-S365 VanDerWaalsContact O-N 3.07Å; G362-S365 PolarHBondContact O-OG 3.07Å; G362-L366 PolarHBondContact O-N 3.33Å |
| 363 | P | 86 | Confident | 89.1 | Confident | 9 Ų | 9 | 30.6 Ų | 30.6 | 6% | 0.058 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -52 | -39.4 | 171.6 | -31.4 | 36.2 | 0 | 0 | 0 | 114.2 | L122 K360 L366 M367 W410 | L122-P363 HydrophobicContact CD1-CB 3.79Å; L122-P363 HydrophobicContact CD2-CB 4.47Å; L122-P363 HydrophobicContact CG-CB 4.29Å; K360-P363 HydrophobicContact CB-CG 4.47Å; K360-P363 VanDerWaalsContact O-CD 3.29Å; K360-P363 WeakPolarHBondContact O-CD 2.94Å; P363-L366 PolarHBondContact O-N 3.43Å; P363-M367 WeakPolarHBondContact O-CG 3.48Å; P363-M367 PolarHBondContact O-N 2.68Å; P363-W410 HydrophobicContact CG-CB 4.49Å; P363-W410 VanDerWaalsContact CG-CD1 3.49Å; P363-W410 HydrophobicContact CG-CD2 4.38Å; P363-W410 HydrophobicContact CG-CG 3.91Å |
| 364 | V | 89.2 | Confident | 89.3 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.2 | -42.1 | 175.6 | 176.3 | 0 | 0 | 0 | 0 | 111.8 | A125 L352 A355 L356 E359 K360 A361 G362 L366 M367 R368 | A125-V364 HydrophobicContact CB-CB 4.39Å; A125-V364 HydrophobicContact CB-CG1 3.91Å; A125-V364 HydrophobicContact CB-CG2 4.36Å; L352-V364 HydrophobicContact CD1-CG1 4.14Å; A355-V364 HydrophobicContact CB-CG1 4.36Å; A355-V364 HydrophobicContact CB-CG2 4.18Å; L356-V364 HydrophobicContact CD2-CB 4.01Å; L356-V364 HydrophobicContact CD2-CG1 3.67Å; L356-V364 HydrophobicContact CD2-CG2 4.34Å; L356-V364 HydrophobicContact CG-CG1 4.07Å; E359-V364 HydrophobicContact CB-CG2 3.99Å; K360-V364 PolarHBondContact O-N 3.21Å; A361-V364 PolarHBondContact O-N 3.17Å; G362-V364 PolarHBondContact O-N 3.19Å; V364-L366 VanDerWaalsContact C-N 3.32Å; V364-L366 PolarHBondContact O-N 3.32Å; V364-M367 PolarHBondContact O-N 3.18Å; V364-R368 PolarHBondContact O-N 2.83Å; V364-R368 VanDerWaalsContact O-N 3.14Å |
| 365 | S | 87.3 | Confident | 89.5 | Confident | 4 Ų | 4 | 30.1 Ų | 30.1 | 3% | 0.028 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -69.5 | -27.5 | 175.5 | 59.8 | 0 | 0 | 0 | 0 | 113.3 | F214 A361 G362 R368 T369 A406 | F214-S365 WeakPolarHBondContact CZ-O 3.26Å; A361-S365 PolarHBondContact O-N 2.93Å; A361-S365 PolarHBondContact O-OG 2.89Å; G362-S365 PolarHBondContact O-N 2.97Å; G362-S365 VanDerWaalsContact O-N 3.07Å; G362-S365 PolarHBondContact O-OG 3.07Å; S365-R368 PolarHBondContact O-N 3.19Å; S365-T369 PolarHBondContact O-N 3.35Å; S365-A406 WeakPolarHBondContact OG-CB 3.24Å |
| 366 | L | 90 | Very high | 89.6 | Confident | 32 Ų | 32 | 31.8 Ų | 31.8 | 17% | 0.168 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -67.9 | -43.4 | 171 | -69.2 | 169.9 | 0 | 0 | 0 | 111.6 | G362 P363 V364 R368 T369 A406 L407 | G362-L366 PolarHBondContact O-N 3.33Å; P363-L366 PolarHBondContact O-N 3.43Å; V364-L366 VanDerWaalsContact C-N 3.32Å; V364-L366 PolarHBondContact O-N 3.32Å; L366-R368 PolarHBondContact O-N 2.88Å; L366-T369 WeakPolarHBondContact O-CB 3.34Å; L366-T369 WeakPolarHBondContact O-CG2 3.18Å; L366-T369 PolarHBondContact O-N 2.86Å; L366-T369 PolarHBondContact O-OG1 3.01Å; L366-A406 HydrophobicContact CD1-CB 4.36Å; L366-A406 HydrophobicContact CD2-CB 3.92Å; L366-A406 HydrophobicContact CG-CB 3.79Å; L366-L407 HydrophobicContact CD1-CD2 3.68Å; L366-L407 HydrophobicContact CD1-CG 3.96Å; L366-L407 HydrophobicContact CD2-CG 4.24Å |
| 367 | M | 91.4 | Very high | 89.9 | Confident | 55 Ų | 55 | 36.5 Ų | 36.5 | 27% | 0.271 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -59.6 | -33.1 | 172.2 | -63.1 | -63.8 | 98.8 | 0 | 0 | 112 | L122 A125 P363 V364 T369 V370 | L122-M367 HydrophobicContact CB-CG 4.06Å; L122-M367 HydrophobicContact CB-SD 4.15Å; L122-M367 HydrophobicContact CD2-CE 4.39Å; L122-M367 HydrophobicContact CD2-SD 4.4Å; L122-M367 HydrophobicContact CG-CG 3.94Å; L122-M367 HydrophobicContact CG-SD 4.26Å; A125-M367 HydrophobicContact CB-CB 3.72Å; A125-M367 HydrophobicContact CB-CG 4.01Å; P363-M367 WeakPolarHBondContact O-CG 3.48Å; P363-M367 PolarHBondContact O-N 2.68Å; V364-M367 PolarHBondContact O-N 3.18Å; M367-T369 PolarHBondContact O-N 3.03Å; M367-V370 WeakPolarHBondContact O-CB 3.44Å; M367-V370 WeakPolarHBondContact O-CG2 3.32Å; M367-V370 PolarHBondContact O-N 2.96Å |
| 368 | R | 90.6 | Very high | 90.2 | Very high | 22 Ų | 22 | 36.2 Ų | 36.2 | 8% | 0.083 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -6.8 | 173.9 | -69.7 | -158.5 | 70.3 | -161.2 | -0.9 | 115 | F214 V364 S365 L366 V370 D371 | F214-R368 HydrophobicContact CD2-CB 4.48Å; F214-R368 VanDerWaalsContact CE2-C 3.44Å; F214-R368 HydrophobicContact CE2-CB 3.81Å; F214-R368 WeakPolarHBondContact CE2-O 3.36Å; V364-R368 PolarHBondContact O-N 2.83Å; V364-R368 VanDerWaalsContact O-N 3.14Å; S365-R368 PolarHBondContact O-N 3.19Å; L366-R368 PolarHBondContact O-N 2.88Å; R368-V370 PolarHBondContact O-N 3.45Å; R368-D371 IonicContact CZ-OD2 2.68Å; R368-D371 IonicContact NE-OD2 2.83Å; R368-D371 IonicContact NH2-OD2 3.18Å; R368-D371 PolarHBondContact NH2-OD2 2.92Å; R368-D371 WeakPolarHBondContact O-CB 3.38Å; R368-D371 PolarHBondContact O-N 3.48Å; R368-D371 VanDerWaalsContact O-N 3.13Å |
| 369 | T | 91.7 | Very high | 90.4 | Very high | 33 Ų | 33 | 33.5 Ų | 33.5 | 20% | 0.202 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.5 | -29.6 | 168.8 | 57.7 | 0 | 0 | 0 | 0 | 112 | F214 S365 L366 M367 D371 V372 V373 V399 | F214-T369 HydrophobicContact CE1-CG2 3.83Å; F214-T369 HydrophobicContact CE2-CG2 4.49Å; F214-T369 HydrophobicContact CZ-CG2 3.46Å; F214-T369 VanDerWaalsContact CZ-CG2 3.46Å; S365-T369 PolarHBondContact O-N 3.35Å; L366-T369 WeakPolarHBondContact O-CB 3.34Å; L366-T369 WeakPolarHBondContact O-CG2 3.18Å; L366-T369 PolarHBondContact O-N 2.86Å; L366-T369 PolarHBondContact O-OG1 3.01Å; M367-T369 PolarHBondContact O-N 3.03Å; T369-D371 PolarHBondContact O-N 2.88Å; T369-V372 WeakPolarHBondContact O-CB 3.44Å; T369-V372 PolarHBondContact O-N 2.89Å; T369-V372 VanDerWaalsContact O-N 3.12Å; T369-V373 PolarHBondContact O-N 3.3Å; T369-V399 HydrophobicContact CG2-CG1 4.3Å |
| 370 | V | 94 | Very high | 90.6 | Very high | 45 Ų | 45 | 36.2 Ų | 36.2 | 27% | 0.273 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -61.4 | -26.6 | 177.2 | -179.1 | 0 | 0 | 0 | 0 | 111.6 | L126 T129 M367 R368 V372 V373 L374 | L126-V370 HydrophobicContact CD1-CG2 4.13Å; T129-V370 HydrophobicContact CG2-CB 4.07Å; M367-V370 WeakPolarHBondContact O-CB 3.44Å; M367-V370 WeakPolarHBondContact O-CG2 3.32Å; M367-V370 PolarHBondContact O-N 2.96Å; R368-V370 PolarHBondContact O-N 3.45Å; V370-V372 VanDerWaalsContact C-N 3.29Å; V370-V372 PolarHBondContact O-N 3.31Å; V370-V373 PolarHBondContact O-N 3.46Å; V370-L374 HydrophobicContact CG1-CD1 3.89Å; V370-L374 HydrophobicContact CG1-CG 4.05Å; V370-L374 WeakPolarHBondContact O-CB 3.29Å; V370-L374 WeakPolarHBondContact O-CG 3.32Å; V370-L374 PolarHBondContact O-N 3Å |
| 371 | D | 93.8 | Very high | 91.2 | Very high | 6 Ų | 6 | 35.3 Ų | 35.3 | 3% | 0.032 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.9 | -43.1 | 176.2 | -142.5 | -10.9 | 0 | 0 | 0 | 110.8 | T129 S133 T210 R368 T369 S375 | T129-D371 HydrophobicContact CG2-CB 3.59Å; S133-D371 PolarHBondContact N-OD1 2.98Å; S133-D371 WeakPolarHBondContact OG-CA 3.36Å; S133-D371 PolarHBondContact OG-OD1 2.93Å; T210-D371 HydrophobicContact CG2-CB 4.17Å; R368-D371 IonicContact CZ-OD2 2.68Å; R368-D371 IonicContact NE-OD2 2.83Å; R368-D371 IonicContact NH2-OD2 3.18Å; R368-D371 PolarHBondContact NH2-OD2 2.92Å; R368-D371 WeakPolarHBondContact O-CB 3.38Å; R368-D371 PolarHBondContact O-N 3.48Å; R368-D371 VanDerWaalsContact O-N 3.13Å; T369-D371 PolarHBondContact O-N 2.88Å; D371-S375 WeakPolarHBondContact O-CB 3.17Å; D371-S375 PolarHBondContact O-N 2.53Å; D371-S375 PolarHBondContact O-OG 3.24Å |
| 372 | V | 93.6 | Very high | 91.8 | Very high | 6 Ų | 6 | 39.8 Ų | 39.8 | 4% | 0.036 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.7 | -46.3 | 178.4 | 175.4 | 0 | 0 | 0 | 0 | 110.7 | T210 V211 F214 T369 V370 L374 S375 F376 V399 | T210-V372 HydrophobicContact CG2-CG2 4.24Å; V211-V372 HydrophobicContact CG2-CG1 3.59Å; V211-V372 HydrophobicContact CG2-CG2 4.4Å; F214-V372 HydrophobicContact CB-CG2 3.73Å; F214-V372 HydrophobicContact CD1-CG2 3.95Å; F214-V372 HydrophobicContact CD2-CG2 4.33Å; F214-V372 HydrophobicContact CG-CG2 3.73Å; T369-V372 WeakPolarHBondContact O-CB 3.44Å; T369-V372 PolarHBondContact O-N 2.89Å; T369-V372 VanDerWaalsContact O-N 3.12Å; V370-V372 VanDerWaalsContact C-N 3.29Å; V370-V372 PolarHBondContact O-N 3.31Å; V372-L374 VanDerWaalsContact C-N 3.35Å; V372-L374 PolarHBondContact O-N 2.71Å; V372-S375 WeakPolarHBondContact CA-OG 3.32Å; V372-S375 PolarHBondContact O-N 3.05Å; V372-S375 PolarHBondContact O-OG 3.49Å; V372-F376 HydrophobicContact CG1-CD2 3.94Å; V372-F376 HydrophobicContact CG1-CE2 3.83Å; V372-F376 WeakPolarHBondContact O-CD2 3.48Å; V372-F376 PolarHBondContact O-N 3Å; V372-F376 VanDerWaalsContact O-N 3.09Å; V372-V399 HydrophobicContact CB-CG2 4.3Å; V372-V399 HydrophobicContact CG1-CG2 3.98Å; V372-V399 HydrophobicContact CG2-CG2 4.25Å |
| 373 | V | 94.7 | Very high | 92.1 | Very high | 99 Ų | 99 | 42.4 Ų | 42.4 | 60% | 0.6 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -61.7 | -43.8 | 179.2 | -177.1 | 0 | 0 | 0 | 0 | 111 | T369 V370 F377 | T369-V373 PolarHBondContact O-N 3.3Å; V370-V373 PolarHBondContact O-N 3.46Å; V373-F377 WeakPolarHBondContact O-CB 3.4Å; V373-F377 PolarHBondContact O-N 2.94Å |
| 374 | L | 95.4 | Very high | 92.1 | Very high | 35 Ų | 35 | 49.3 Ų | 49.3 | 18% | 0.183 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.6 | -36.5 | 175.5 | -70.4 | 176 | 0 | 0 | 0 | 112.4 | V130 V370 V372 F377 F378 | V130-L374 HydrophobicContact CG2-CD1 4.14Å; V370-L374 HydrophobicContact CG1-CD1 3.89Å; V370-L374 HydrophobicContact CG1-CG 4.05Å; V370-L374 WeakPolarHBondContact O-CB 3.29Å; V370-L374 WeakPolarHBondContact O-CG 3.32Å; V370-L374 PolarHBondContact O-N 3Å; V372-L374 VanDerWaalsContact C-N 3.35Å; V372-L374 PolarHBondContact O-N 2.71Å; L374-F377 PolarHBondContact O-N 2.84Å; L374-F378 HydrophobicContact CB-CD2 4.42Å; L374-F378 HydrophobicContact CB-CE2 4.12Å; L374-F378 HydrophobicContact CD2-CZ 4.37Å; L374-F378 WeakPolarHBondContact O-CB 3.49Å; L374-F378 VanDerWaalsContact O-CD2 3.31Å; L374-F378 WeakPolarHBondContact O-CD2 3.31Å; L374-F378 VanDerWaalsContact O-CG 3.22Å; L374-F378 WeakPolarHBondContact O-CG 3.38Å; L374-F378 PolarHBondContact O-N 2.89Å |
| 375 | S | 94.6 | Very high | 91.7 | Very high | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.014 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -66.1 | -39.4 | 177.4 | 70.7 | 0 | 0 | 0 | 0 | 113.2 | D371 V372 Q379 | D371-S375 WeakPolarHBondContact O-CB 3.17Å; D371-S375 PolarHBondContact O-N 2.53Å; D371-S375 PolarHBondContact O-OG 3.24Å; V372-S375 WeakPolarHBondContact CA-OG 3.32Å; V372-S375 PolarHBondContact O-N 3.05Å; V372-S375 PolarHBondContact O-OG 3.49Å; S375-Q379 VanDerWaalsContact O-CB 3.26Å; S375-Q379 WeakPolarHBondContact O-CB 3.5Å; S375-Q379 PolarHBondContact O-N 3.46Å |
| 376 | F | 93.7 | Very high | 91.5 | Very high | 34 Ų | 34 | 60.2 Ų | 60.2 | 15% | 0.149 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.2 | -43.7 | 171.5 | -82.2 | -72.5 | 0 | 0 | 0 | 111.8 | A207 V211 V372 Q379 F380 P387 A395 | A207-F376 HydrophobicContact CB-CB 4.48Å; A207-F376 HydrophobicContact CB-CD1 3.45Å; A207-F376 VanDerWaalsContact CB-CD1 3.45Å; A207-F376 HydrophobicContact CB-CD2 4.03Å; A207-F376 HydrophobicContact CB-CE1 3.49Å; A207-F376 VanDerWaalsContact CB-CE1 3.49Å; A207-F376 HydrophobicContact CB-CE2 4.06Å; A207-F376 HydrophobicContact CB-CG 3.73Å; A207-F376 HydrophobicContact CB-CZ 3.8Å; V211-F376 HydrophobicContact CG2-CE2 3.65Å; V211-F376 HydrophobicContact CG2-CZ 4.06Å; V372-F376 HydrophobicContact CG1-CD2 3.94Å; V372-F376 HydrophobicContact CG1-CE2 3.83Å; V372-F376 WeakPolarHBondContact O-CD2 3.48Å; V372-F376 PolarHBondContact O-N 3Å; V372-F376 VanDerWaalsContact O-N 3.09Å; F376-Q379 PolarHBondContact O-N 3.4Å; F376-F380 PolarHBondContact O-N 3.48Å; F376-P387 HydrophobicContact CD1-CB 3.81Å; F376-P387 HydrophobicContact CD1-CG 4.08Å; F376-P387 HydrophobicContact CE1-CB 3.62Å; F376-P387 HydrophobicContact CE1-CG 4.28Å; F376-A395 HydrophobicContact CE2-CB 3.61Å; F376-A395 HydrophobicContact CZ-CB 3.69Å |
| 377 | F | 94.6 | Very high | 91 | Very high | 116 Ų | 116 | 60.6 Ų | 60.6 | 51% | 0.509 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.6 | -48.4 | 177.3 | 175.7 | -102.2 | 0 | 0 | 0 | 111.8 | V373 L374 Q379 F380 V381 | V373-F377 WeakPolarHBondContact O-CB 3.4Å; V373-F377 PolarHBondContact O-N 2.94Å; L374-F377 PolarHBondContact O-N 2.84Å; F377-Q379 PolarHBondContact O-N 3.4Å; F377-F380 PolarHBondContact O-N 2.88Å; F377-V381 HydrophobicContact CD2-CG2 4.06Å; F377-V381 HydrophobicContact CE1-CG2 4.23Å; F377-V381 HydrophobicContact CE2-CG2 3.72Å; F377-V381 HydrophobicContact CG-CG2 4.46Å; F377-V381 HydrophobicContact CZ-CG2 3.81Å; F377-V381 WeakPolarHBondContact O-CB 3.39Å; F377-V381 WeakPolarHBondContact O-CG2 3.27Å; F377-V381 PolarHBondContact O-N 3.29Å |
| 378 | F | 94.1 | Very high | 90.8 | Very high | 24 Ų | 24 | 59.4 Ų | 59.4 | 11% | 0.105 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.7 | -36.7 | 176.9 | -65.5 | -29.2 | 0 | 0 | 0 | 112.4 | I134 L137 L206 L374 F380 V381 F382 | I134-F378 HydrophobicContact CG1-CE2 4.21Å; I134-F378 HydrophobicContact CG1-CZ 4.14Å; L137-F378 HydrophobicContact CB-CB 4.43Å; L137-F378 HydrophobicContact CB-CD2 4.04Å; L137-F378 HydrophobicContact CB-CG 4.42Å; L137-F378 HydrophobicContact CD1-CB 4.35Å; L137-F378 HydrophobicContact CD2-CB 4.17Å; L137-F378 HydrophobicContact CD2-CD1 4.13Å; L137-F378 HydrophobicContact CD2-CD2 4.09Å; L137-F378 HydrophobicContact CD2-CG 3.89Å; L206-F378 HydrophobicContact CD2-CB 4.06Å; L374-F378 HydrophobicContact CB-CD2 4.42Å; L374-F378 HydrophobicContact CB-CE2 4.12Å; L374-F378 HydrophobicContact CD2-CZ 4.37Å; L374-F378 WeakPolarHBondContact O-CB 3.49Å; L374-F378 VanDerWaalsContact O-CD2 3.31Å; L374-F378 WeakPolarHBondContact O-CD2 3.31Å; L374-F378 VanDerWaalsContact O-CG 3.22Å; L374-F378 WeakPolarHBondContact O-CG 3.38Å; L374-F378 PolarHBondContact O-N 2.89Å; F378-F380 PolarHBondContact O-N 3.38Å; F378-V381 PolarHBondContact O-N 3.32Å; F378-F382 HydrophobicContact CB-CD2 4.26Å; F378-F382 HydrophobicContact CD1-CD2 4.15Å; F378-F382 AromaticContact CD1-CE2 3.83Å; F378-F382 HydrophobicContact CD1-CE2 3.83Å; F378-F382 HydrophobicContact CE1-CE2 4.38Å; F378-F382 WeakPolarHBondContact O-CB 3.49Å; F378-F382 PolarHBondContact O-N 3.36Å |
| 379 | Q | 92 | Very high | 90.6 | Very high | 13 Ų | 13 | 69.2 Ų | 69.2 | 6% | 0.061 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 174.1 | -176.3 | 169 | -50.3 | 0 | 0 | 112.1 | S375 F376 F377 F383 H384 R385 | S375-Q379 VanDerWaalsContact O-CB 3.26Å; S375-Q379 WeakPolarHBondContact O-CB 3.5Å; S375-Q379 PolarHBondContact O-N 3.46Å; F376-Q379 PolarHBondContact O-N 3.4Å; F377-Q379 PolarHBondContact O-N 3.4Å; Q379-F383 WeakPolarHBondContact O-CB 3.46Å; Q379-F383 PolarHBondContact O-N 2.75Å; Q379-H384 PolarHBondContact O-N 3.2Å; Q379-R385 HydrophobicContact CG-CB 4.44Å |
| 380 | F | 91.5 | Very high | 90.4 | Very high | 114 Ų | 114 | 73.3 Ų | 73.3 | 50% | 0.5 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -71.6 | -41.2 | 178.2 | -178.5 | -104.3 | 0 | 0 | 0 | 112.9 | F376 F377 F378 H384 V386 | F376-F380 PolarHBondContact O-N 3.48Å; F377-F380 PolarHBondContact O-N 2.88Å; F378-F380 PolarHBondContact O-N 3.38Å; F380-H384 VanDerWaalsContact O-CA 3.26Å; F380-H384 WeakPolarHBondContact O-CA 3.34Å; F380-H384 PolarHBondContact O-N 3.37Å; F380-H384 PolarHBondContact O-ND1 3.34Å; F380-V386 HydrophobicContact CD2-CG1 4.3Å; F380-V386 HydrophobicContact CE2-CG1 4.03Å |
| 381 | V | 94.4 | Very high | 90.1 | Very high | 58 Ų | 58 | 71.2 Ų | 71.2 | 35% | 0.352 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -79 | -43.8 | -174.6 | 172.4 | 0 | 0 | 0 | 0 | 113.1 | F377 F378 H384 | F377-V381 HydrophobicContact CD2-CG2 4.06Å; F377-V381 HydrophobicContact CE1-CG2 4.23Å; F377-V381 HydrophobicContact CE2-CG2 3.72Å; F377-V381 HydrophobicContact CG-CG2 4.46Å; F377-V381 HydrophobicContact CZ-CG2 3.81Å; F377-V381 WeakPolarHBondContact O-CB 3.39Å; F377-V381 WeakPolarHBondContact O-CG2 3.27Å; F377-V381 PolarHBondContact O-N 3.29Å; F378-V381 PolarHBondContact O-N 3.32Å; V381-H384 PolarHBondContact O-CE1 3.16Å; V381-H384 PolarHBondContact O-ND1 2.96Å |
| 382 | F | 92.4 | Very high | 89.9 | Confident | 118 Ų | 118 | 74.3 Ų | 74.3 | 52% | 0.518 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -92.6 | -29.1 | -173.5 | -73.2 | -92.7 | 0 | 0 | 0 | 114.1 | L137 F378 | L137-F382 HydrophobicContact CD1-CB 3.88Å; L137-F382 HydrophobicContact CD1-CD1 4.41Å; L137-F382 HydrophobicContact CD1-CD2 4.07Å; L137-F382 HydrophobicContact CD1-CG 3.86Å; L137-F382 HydrophobicContact CD2-CD1 4.35Å; L137-F382 HydrophobicContact CD2-CD2 3.68Å; L137-F382 HydrophobicContact CD2-CE1 4.27Å; L137-F382 HydrophobicContact CD2-CE2 3.59Å; L137-F382 HydrophobicContact CD2-CG 4.07Å; L137-F382 HydrophobicContact CD2-CZ 3.9Å; F378-F382 HydrophobicContact CB-CD2 4.26Å; F378-F382 HydrophobicContact CD1-CD2 4.15Å; F378-F382 AromaticContact CD1-CE2 3.83Å; F378-F382 HydrophobicContact CD1-CE2 3.83Å; F378-F382 HydrophobicContact CE1-CE2 4.38Å; F378-F382 WeakPolarHBondContact O-CB 3.49Å; F378-F382 PolarHBondContact O-N 3.36Å |
| 383 | F | 89.3 | Confident | 89.8 | Confident | 65 Ų | 65 | 75.2 Ų | 75.2 | 29% | 0.285 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -111.9 | -1.4 | -178.3 | -55 | -86.3 | 0 | 0 | 0 | 113.1 | L137 K140 T141 L206 Q379 R385 | L137-F383 HydrophobicContact CD1-CE2 3.53Å; L137-F383 HydrophobicContact CD1-CZ 3.96Å; K140-F383 HydrophobicContact CB-CE2 4.31Å; K140-F383 HydrophobicContact CB-CZ 3.71Å; K140-F383 HydrophobicContact CG-CE1 3.79Å; K140-F383 HydrophobicContact CG-CE2 3.94Å; K140-F383 HydrophobicContact CG-CZ 3.33Å; T141-F383 HydrophobicContact CG2-CE1 4.36Å; T141-F383 HydrophobicContact CG2-CZ 3.93Å; L206-F383 HydrophobicContact CD2-CE2 4.32Å; Q379-F383 WeakPolarHBondContact O-CB 3.46Å; Q379-F383 PolarHBondContact O-N 2.75Å; F383-R385 HydrophobicContact CB-CG 4.5Å; F383-R385 WeakPolarHBondContact O-CG 3.49Å; F383-R385 PolarHBondContact O-N 3.09Å |
| 384 | H | 86.8 | Confident | 89.7 | Confident | 154 Ų | 154 | 70.5 Ų | 70.5 | 71% | 0.713 | 33% | 0.329 | S | S | * | . | trans | 51.3 | 21.7 | -179.5 | -60.4 | -41.6 | 0 | 0 | 0 | 115.2 | Q379 F380 V381 | Q379-H384 PolarHBondContact O-N 3.2Å; F380-H384 VanDerWaalsContact O-CA 3.26Å; F380-H384 WeakPolarHBondContact O-CA 3.34Å; F380-H384 PolarHBondContact O-N 3.37Å; F380-H384 PolarHBondContact O-ND1 3.34Å; V381-H384 PolarHBondContact O-CE1 3.16Å; V381-H384 PolarHBondContact O-ND1 2.96Å | ||
| 385 | R | 80.3 | Confident | 89.6 | Confident | 123 Ų | 123 | 69.2 Ų | 69.2 | 46% | 0.464 | 32% | 0.324 | S | S | . | . | P | Polyproline II helix | trans | -92.6 | 118.7 | 177.9 | -66.6 | -159.5 | -174.2 | -78.6 | 5.7 | 110.7 | E265 Q379 F383 | E265-R385 IonicContact OE1-CZ 2.69Å; E265-R385 IonicContact OE1-NE 2.77Å; E265-R385 PolarHBondContact OE1-NE 2.81Å; E265-R385 IonicContact OE1-NH2 2.84Å; E265-R385 PolarHBondContact OE1-NH2 3.48Å; E265-R385 IonicContact OE2-CZ 3.22Å; E265-R385 IonicContact OE2-NE 3.63Å; E265-R385 PolarHBondContact OE2-NE 3.19Å; Q379-R385 HydrophobicContact CG-CB 4.44Å; F383-R385 HydrophobicContact CB-CG 4.5Å; F383-R385 WeakPolarHBondContact O-CG 3.49Å; F383-R385 PolarHBondContact O-N 3.09Å |
| 386 | V | 82.1 | Confident | 89.6 | Confident | 111 Ų | 111 | 74.3 Ų | 74.3 | 67% | 0.673 | 35% | 0.35 | S | S | * | . | P | Polyproline II helix | trans | -67.1 | 135.5 | 168 | -70 | 0 | 0 | 0 | 0 | 110.6 | F380 | F380-V386 HydrophobicContact CD2-CG1 4.3Å; F380-V386 HydrophobicContact CE2-CG1 4.03Å |
| 387 | P | 81.1 | Confident | 89.6 | Confident | 40 Ų | 40 | 73.5 Ų | 73.5 | 26% | 0.26 | 35% | 0.349 | S | S | . | . | P | Polyproline II helix | trans | -71.3 | 147 | 175.3 | 30.3 | -34.7 | 0 | 0 | 0 | 111.1 | F376 L392 | F376-P387 HydrophobicContact CD1-CB 3.81Å; F376-P387 HydrophobicContact CD1-CG 4.08Å; F376-P387 HydrophobicContact CE1-CB 3.62Å; F376-P387 HydrophobicContact CE1-CG 4.28Å; P387-L392 HydrophobicContact CB-CG 4.24Å; P387-L392 HydrophobicContact CG-CD1 4.21Å; P387-L392 HydrophobicContact CG-CD2 4.18Å; P387-L392 HydrophobicContact CG-CG 4.15Å |
| 388 | T | 85.9 | Confident | 89.5 | Confident | 30 Ų | 30 | 68 Ų | 68 | 18% | 0.184 | 32% | 0.324 | C | S | . | . | P | Polyproline II helix | trans | -76 | 154.8 | 177.1 | 64.3 | 0 | 0 | 0 | 0 | 111.3 | W390 S391 L392 | T388-W390 PolarHBondContact O-N 3.49Å; T388-S391 WeakPolarHBondContact O-CB 3.31Å; T388-S391 PolarHBondContact O-N 3.22Å; T388-S391 VanDerWaalsContact O-N 3.08Å; T388-S391 WeakPolarHBondContact OG1-CB 3.48Å; T388-S391 PolarHBondContact OG1-N 2.9Å; T388-S391 VanDerWaalsContact OG1-N 3.15Å; T388-L392 PolarHBondContact O-N 3.08Å |
| 389 | W | 86.6 | Confident | 89.5 | Confident | 227 Ų | 227 | 68.6 Ų | 68.6 | 86% | 0.86 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -56.2 | -32.1 | 173.4 | -62.8 | 112.1 | 0 | 0 | 0 | 113 | L392 G393 | W389-L392 HydrophobicContact CE3-CD1 4.07Å; W389-L392 HydrophobicContact CZ3-CD1 4.39Å; W389-G393 PolarHBondContact O-N 3.41Å |
| 390 | W | 87.7 | Confident | 89.5 | Confident | 119 Ų | 119 | 72.4 Ų | 72.4 | 45% | 0.451 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -68 | -44.6 | 174.1 | -64.6 | 118.5 | 0 | 0 | 0 | 112.9 | L249 R252 F257 T388 G393 G394 | L249-W390 HydrophobicContact CD2-CE3 4.44Å; L249-W390 HydrophobicContact CG-CE3 4.19Å; R252-W390 HydrophobicContact CG-CB 4.29Å; F257-W390 HydrophobicContact CD1-CH2 4.14Å; F257-W390 HydrophobicContact CD1-CZ2 4.05Å; F257-W390 HydrophobicContact CD1-CZ3 4.46Å; F257-W390 HydrophobicContact CE1-CD2 4.31Å; F257-W390 AromaticContact CE1-CE3 3.95Å; F257-W390 HydrophobicContact CE1-CE3 3.95Å; F257-W390 AromaticContact CE1-CH2 3.67Å; F257-W390 HydrophobicContact CE1-CH2 3.67Å; F257-W390 HydrophobicContact CE1-CZ2 4.01Å; F257-W390 AromaticContact CE1-CZ3 3.63Å; F257-W390 HydrophobicContact CE1-CZ3 3.63Å; F257-W390 HydrophobicContact CZ-CZ3 4.39Å; T388-W390 PolarHBondContact O-N 3.49Å; W390-G393 PolarHBondContact O-N 3.25Å; W390-G394 PolarHBondContact O-N 3.42Å |
| 391 | S | 87.1 | Confident | 89.5 | Confident | 1 Ų | 1 | 67 Ų | 67 | 1% | 0.007 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.9 | -47.3 | 173.3 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | D208 T388 G394 A395 | D208-S391 VanDerWaalsContact OD1-CB 3.23Å; D208-S391 WeakPolarHBondContact OD1-CB 3.44Å; D208-S391 PolarHBondContact OD1-OG 3.5Å; T388-S391 WeakPolarHBondContact O-CB 3.31Å; T388-S391 PolarHBondContact O-N 3.22Å; T388-S391 VanDerWaalsContact O-N 3.08Å; T388-S391 WeakPolarHBondContact OG1-CB 3.48Å; T388-S391 PolarHBondContact OG1-N 2.9Å; T388-S391 VanDerWaalsContact OG1-N 3.15Å; S391-G394 PolarHBondContact O-N 2.95Å; S391-A395 VanDerWaalsContact O-CB 3.22Å; S391-A395 WeakPolarHBondContact O-CB 3.42Å; S391-A395 PolarHBondContact O-N 2.82Å |
| 392 | L | 91.1 | Very high | 89.2 | Confident | 72 Ų | 72 | 64.2 Ų | 64.2 | 38% | 0.377 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.8 | -46.7 | 175.8 | -75 | 162.4 | 0 | 0 | 0 | 112.5 | P387 T388 W389 A395 L396 | P387-L392 HydrophobicContact CB-CG 4.24Å; P387-L392 HydrophobicContact CG-CD1 4.21Å; P387-L392 HydrophobicContact CG-CD2 4.18Å; P387-L392 HydrophobicContact CG-CG 4.15Å; T388-L392 PolarHBondContact O-N 3.08Å; W389-L392 HydrophobicContact CE3-CD1 4.07Å; W389-L392 HydrophobicContact CZ3-CD1 4.39Å; L392-A395 PolarHBondContact O-N 3.46Å; L392-L396 WeakPolarHBondContact O-CB 3.39Å; L392-L396 PolarHBondContact O-N 2.97Å |
| 393 | G | 91.4 | Very high | 89.2 | Confident | 24 Ų | 24 | 59.7 Ų | 59.7 | 25% | 0.247 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.7 | -45.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | W389 W390 A395 L396 C397 | W389-G393 PolarHBondContact O-N 3.41Å; W390-G393 PolarHBondContact O-N 3.25Å; G393-A395 PolarHBondContact O-N 2.84Å; G393-L396 PolarHBondContact O-N 3.43Å; G393-C397 PolarHBondContact O-N 3.44Å; G393-C397 PolarHBondContact O-SG 2.84Å |
| 394 | G | 91.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | G246 W390 S391 C397 V398 | G246-G394 WeakPolarHBondContact O-CA 3.42Å; W390-G394 PolarHBondContact O-N 3.42Å; S391-G394 PolarHBondContact O-N 2.95Å; G394-C397 WeakPolarHBondContact O-CB 3.13Å; G394-C397 PolarHBondContact O-N 3.03Å; G394-V398 WeakPolarHBondContact O-CG2 3.47Å; G394-V398 PolarHBondContact O-N 2.87Å |
| 395 | A | 92.8 | Very high | 89.2 | Confident | 8 Ų | 8 | 50.3 Ų | 50.3 | 7% | 0.066 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.5 | -43.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | V211 F376 S391 L392 G393 C397 V398 V399 | V211-A395 HydrophobicContact CB-CB 4.48Å; V211-A395 HydrophobicContact CG1-CB 3.91Å; V211-A395 HydrophobicContact CG2-CB 3.68Å; F376-A395 HydrophobicContact CE2-CB 3.61Å; F376-A395 HydrophobicContact CZ-CB 3.69Å; S391-A395 VanDerWaalsContact O-CB 3.22Å; S391-A395 WeakPolarHBondContact O-CB 3.42Å; S391-A395 PolarHBondContact O-N 2.82Å; L392-A395 PolarHBondContact O-N 3.46Å; G393-A395 PolarHBondContact O-N 2.84Å; A395-C397 VanDerWaalsContact C-N 3.31Å; A395-C397 PolarHBondContact O-N 3.39Å; A395-V398 PolarHBondContact O-N 2.69Å; A395-V399 WeakPolarHBondContact O-CB 3.46Å; A395-V399 VanDerWaalsContact O-CG2 3.29Å; A395-V399 WeakPolarHBondContact O-CG2 3.31Å; A395-V399 PolarHBondContact O-N 2.97Å |
| 396 | L | 94.1 | Very high | 89.5 | Confident | 109 Ų | 109 | 44.5 Ų | 44.5 | 57% | 0.571 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -59.1 | -44.4 | 173.7 | -175.5 | 62.5 | 0 | 0 | 0 | 110.9 | L392 G393 L400 | L392-L396 WeakPolarHBondContact O-CB 3.39Å; L392-L396 PolarHBondContact O-N 2.97Å; G393-L396 PolarHBondContact O-N 3.43Å; L396-L400 HydrophobicContact CD1-CD1 3.78Å; L396-L400 HydrophobicContact CD1-CG 4.01Å; L396-L400 HydrophobicContact CG-CD1 3.83Å; L396-L400 HydrophobicContact CG-CG 4.41Å; L396-L400 VanDerWaalsContact O-CB 3.28Å; L396-L400 WeakPolarHBondContact O-CB 3.35Å; L396-L400 WeakPolarHBondContact O-CG 3.4Å; L396-L400 PolarHBondContact O-N 2.85Å |
| 397 | C | 93.5 | Very high | 89.7 | Confident | 18 Ų | 18 | 42.6 Ų | 42.6 | 12% | 0.122 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.4 | -51.2 | 176.5 | -70.4 | 0 | 0 | 0 | 0 | 112.8 | F242 G393 G394 A395 S401 | F242-C397 HydrophobicContact CD1-CB 4.18Å; F242-C397 WeakPolarHBondContact CD1-O 3.31Å; F242-C397 HydrophobicContact CE1-CB 3.93Å; F242-C397 HydrophobicContact CZ-CB 4.18Å; F242-C397 VanDerWaalsContact CZ-SG 3.59Å; G393-C397 PolarHBondContact O-N 3.44Å; G393-C397 PolarHBondContact O-SG 2.84Å; G394-C397 WeakPolarHBondContact O-CB 3.13Å; G394-C397 PolarHBondContact O-N 3.03Å; A395-C397 VanDerWaalsContact C-N 3.31Å; A395-C397 PolarHBondContact O-N 3.39Å; C397-S401 PolarHBondContact O-N 2.96Å; C397-S401 PolarHBondContact O-OG 3.09Å; C397-S401 VanDerWaalsContact O-OG 3.09Å |
| 398 | V | 93.3 | Very high | 90 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.9 | -40.2 | -178.8 | 177 | 0 | 0 | 0 | 0 | 112.2 | V211 F214 T243 V247 G394 A395 S401 T402 | V211-V398 HydrophobicContact CG1-CB 4.12Å; V211-V398 HydrophobicContact CG1-CG2 4.25Å; F214-V398 HydrophobicContact CB-CG1 4.49Å; F214-V398 HydrophobicContact CD1-CG1 4.37Å; T243-V398 HydrophobicContact CG2-CG1 4.32Å; T243-V398 HydrophobicContact CG2-CG2 4.3Å; V247-V398 HydrophobicContact CG2-CG2 4.37Å; G394-V398 WeakPolarHBondContact O-CG2 3.47Å; G394-V398 PolarHBondContact O-N 2.87Å; A395-V398 PolarHBondContact O-N 2.69Å; V398-S401 PolarHBondContact O-OG 3.46Å; V398-S401 VanDerWaalsContact O-OG 3.06Å; V398-T402 VanDerWaalsContact O-CB 3.25Å; V398-T402 WeakPolarHBondContact O-CB 3.48Å; V398-T402 PolarHBondContact O-N 2.81Å; V398-T402 PolarHBondContact O-OG1 3.45Å |
| 399 | V | 93.4 | Very high | 89.7 | Confident | 36 Ų | 36 | 44.1 Ų | 44.1 | 22% | 0.218 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -68.1 | -40.6 | 179.3 | 172.4 | 0 | 0 | 0 | 0 | 111 | F214 T369 V372 A395 S403 | F214-V399 HydrophobicContact CD1-CG2 4.05Å; F214-V399 HydrophobicContact CE1-CG2 4.2Å; T369-V399 HydrophobicContact CG2-CG1 4.3Å; V372-V399 HydrophobicContact CB-CG2 4.3Å; V372-V399 HydrophobicContact CG1-CG2 3.98Å; V372-V399 HydrophobicContact CG2-CG2 4.25Å; A395-V399 WeakPolarHBondContact O-CB 3.46Å; A395-V399 VanDerWaalsContact O-CG2 3.29Å; A395-V399 WeakPolarHBondContact O-CG2 3.31Å; A395-V399 PolarHBondContact O-N 2.97Å; V399-S403 WeakPolarHBondContact O-CB 3.48Å; V399-S403 PolarHBondContact O-N 2.92Å; V399-S403 PolarHBondContact O-OG 3.3Å |
| 400 | L | 93.1 | Very high | 89.4 | Confident | 94 Ų | 94 | 38.3 Ų | 38.3 | 49% | 0.492 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -67.5 | -43.5 | 176.6 | -71.5 | 175.4 | 0 | 0 | 0 | 112.4 | F242 L396 S403 G404 | F242-L400 HydrophobicContact CE1-CB 4.29Å; L396-L400 HydrophobicContact CD1-CD1 3.78Å; L396-L400 HydrophobicContact CD1-CG 4.01Å; L396-L400 HydrophobicContact CG-CD1 3.83Å; L396-L400 HydrophobicContact CG-CG 4.41Å; L396-L400 VanDerWaalsContact O-CB 3.28Å; L396-L400 WeakPolarHBondContact O-CB 3.35Å; L396-L400 WeakPolarHBondContact O-CG 3.4Å; L396-L400 PolarHBondContact O-N 2.85Å; L400-S403 PolarHBondContact O-N 3.16Å; L400-G404 PolarHBondContact O-N 3.37Å |
| 401 | S | 91.8 | Very high | 89.1 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.9 | -47.4 | 178.2 | 57.3 | 0 | 0 | 0 | 0 | 112.4 | F239 T243 C397 V398 S403 G404 V405 | F239-S401 WeakPolarHBondContact O-CB 3.28Å; T243-S401 WeakPolarHBondContact OG1-CB 3.47Å; T243-S401 PolarHBondContact OG1-OG 3.4Å; C397-S401 PolarHBondContact O-N 2.96Å; C397-S401 PolarHBondContact O-OG 3.09Å; C397-S401 VanDerWaalsContact O-OG 3.09Å; V398-S401 PolarHBondContact O-OG 3.46Å; V398-S401 VanDerWaalsContact O-OG 3.06Å; S401-S403 VanDerWaalsContact C-N 3.34Å; S401-S403 PolarHBondContact O-N 2.78Å; S401-G404 PolarHBondContact O-N 2.94Å; S401-V405 WeakPolarHBondContact O-CG2 3.27Å; S401-V405 PolarHBondContact O-N 3.32Å |
| 402 | T | 88.6 | Confident | 88.7 | Confident | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.6 | -44.7 | 176.2 | -78.3 | 0 | 0 | 0 | 0 | 111.1 | F214 P217 V218 V398 V405 A406 | F214-T402 HydrophobicContact CD1-CG2 4.02Å; F214-T402 HydrophobicContact CE1-CG2 3.29Å; F214-T402 HydrophobicContact CE2-CG2 4.11Å; F214-T402 HydrophobicContact CZ-CG2 3.33Å; F214-T402 PolarHBondContact O-OG1 3.2Å; P217-T402 HydrophobicContact CB-CG2 3.88Å; P217-T402 HydrophobicContact CG-CG2 3.57Å; V218-T402 WeakPolarHBondContact CG2-OG1 3.44Å; V398-T402 VanDerWaalsContact O-CB 3.25Å; V398-T402 WeakPolarHBondContact O-CB 3.48Å; V398-T402 PolarHBondContact O-N 2.81Å; V398-T402 PolarHBondContact O-OG1 3.45Å; T402-V405 PolarHBondContact O-N 2.97Å; T402-A406 VanDerWaalsContact O-CB 3.29Å; T402-A406 WeakPolarHBondContact O-CB 3.23Å; T402-A406 PolarHBondContact O-N 2.91Å |
| 403 | S | 90.8 | Very high | 87.7 | Confident | 22 Ų | 22 | 41.7 Ų | 41.7 | 15% | 0.154 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -66.1 | -39.7 | 178.5 | -58.3 | 0 | 0 | 0 | 0 | 112.1 | V399 L400 S401 A406 L407 | V399-S403 WeakPolarHBondContact O-CB 3.48Å; V399-S403 PolarHBondContact O-N 2.92Å; V399-S403 PolarHBondContact O-OG 3.3Å; L400-S403 PolarHBondContact O-N 3.16Å; S401-S403 VanDerWaalsContact C-N 3.34Å; S401-S403 PolarHBondContact O-N 2.78Å; S403-A406 PolarHBondContact O-N 3.4Å; S403-L407 WeakPolarHBondContact O-CB 3.39Å; S403-L407 WeakPolarHBondContact O-CG 3.4Å; S403-L407 PolarHBondContact O-N 3.18Å |
| 404 | G | 89.8 | Confident | 86.8 | Confident | 18 Ų | 18 | 43 Ų | 43 | 19% | 0.186 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.2 | -47.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L400 S401 R408 | L400-G404 PolarHBondContact O-N 3.37Å; S401-G404 PolarHBondContact O-N 2.94Å; G404-R408 WeakPolarHBondContact O-CB 3.4Å; G404-R408 PolarHBondContact O-N 3.26Å |
| 405 | V | 87.9 | Confident | 85.7 | Confident | 4 Ų | 4 | 54 Ų | 54 | 2% | 0.024 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.1 | -47.5 | 173 | 169.9 | 0 | 0 | 0 | 0 | 111.2 | V218 F239 S401 T402 R408 K409 | V218-V405 HydrophobicContact CG1-CG2 4.42Å; V218-V405 HydrophobicContact CG2-CG2 4.1Å; F239-V405 HydrophobicContact CB-CG2 3.51Å; F239-V405 HydrophobicContact CD2-CB 4.45Å; F239-V405 HydrophobicContact CD2-CG2 3.45Å; F239-V405 VanDerWaalsContact CD2-CG2 3.45Å; F239-V405 HydrophobicContact CE2-CG2 4.38Å; F239-V405 HydrophobicContact CG-CG2 3.72Å; S401-V405 WeakPolarHBondContact O-CG2 3.27Å; S401-V405 PolarHBondContact O-N 3.32Å; T402-V405 PolarHBondContact O-N 2.97Å; V405-R408 PolarHBondContact O-N 3.5Å; V405-K409 WeakPolarHBondContact O-CB 3.35Å; V405-K409 PolarHBondContact O-N 2.69Å |
| 406 | A | 86.1 | Confident | 83.9 | Confident | 2 Ų | 2 | 62.3 Ų | 62.3 | 2% | 0.017 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.8 | -49.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S365 L366 T402 S403 W410 | S365-A406 WeakPolarHBondContact OG-CB 3.24Å; L366-A406 HydrophobicContact CD1-CB 4.36Å; L366-A406 HydrophobicContact CD2-CB 3.92Å; L366-A406 HydrophobicContact CG-CB 3.79Å; T402-A406 VanDerWaalsContact O-CB 3.29Å; T402-A406 WeakPolarHBondContact O-CB 3.23Å; T402-A406 PolarHBondContact O-N 2.91Å; S403-A406 PolarHBondContact O-N 3.4Å; A406-W410 WeakPolarHBondContact O-CB 3.11Å; A406-W410 PolarHBondContact O-N 2.88Å |
| 407 | L | 86.8 | Confident | 81.7 | Confident | 71 Ų | 71 | 64.4 Ų | 64.4 | 37% | 0.372 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.6 | -47.5 | 174.1 | -74.4 | 168.4 | 0 | 0 | 0 | 110.8 | L366 S403 K409 W410 F411 | L366-L407 HydrophobicContact CD1-CD2 3.68Å; L366-L407 HydrophobicContact CD1-CG 3.96Å; L366-L407 HydrophobicContact CD2-CG 4.24Å; S403-L407 WeakPolarHBondContact O-CB 3.39Å; S403-L407 WeakPolarHBondContact O-CG 3.4Å; S403-L407 PolarHBondContact O-N 3.18Å; L407-K409 PolarHBondContact O-N 3.18Å; L407-W410 HydrophobicContact CD2-CE3 4.31Å; L407-W410 WeakPolarHBondContact O-CB 3.37Å; L407-W410 PolarHBondContact O-N 3.2Å; L407-W410 VanDerWaalsContact O-N 3.13Å; L407-F411 HydrophobicContact CB-CE2 4.5Å; L407-F411 WeakPolarHBondContact O-CD2 3.28Å; L407-F411 PolarHBondContact O-N 3.01Å |
| 408 | R | 85.6 | Confident | 81.1 | Confident | 55 Ų | 55 | 66.8 Ų | 66.8 | 21% | 0.208 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.2 | -40 | -176.9 | -176.3 | 172.9 | 169.3 | -85.2 | -11.2 | 112.9 | T233 D236 G404 V405 W410 N412 | T233-R408 PolarHBondContact OG1-NH1 3.02Å; T233-R408 VanDerWaalsContact OG1-NH1 3.07Å; T233-R408 PolarHBondContact OG1-NH2 3.26Å; D236-R408 IonicContact OD1-NH1 3.54Å; D236-R408 IonicContact OD2-CZ 3.87Å; D236-R408 IonicContact OD2-NH1 2.82Å; D236-R408 PolarHBondContact OD2-NH1 3.05Å; G404-R408 WeakPolarHBondContact O-CB 3.4Å; G404-R408 PolarHBondContact O-N 3.26Å; V405-R408 PolarHBondContact O-N 3.5Å; R408-W410 VanDerWaalsContact C-N 3.34Å; R408-N412 WeakPolarHBondContact O-CB 3.17Å; R408-N412 PolarHBondContact O-N 3.2Å; R408-N412 PolarHBondContact O-ND2 3.27Å |
| 409 | K | 79.8 | Confident | 80.5 | Confident | 47 Ų | 47 | 70.3 Ų | 70.3 | 20% | 0.204 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -68.1 | -33 | 172.3 | -78.2 | -158 | 169.4 | -175.7 | 0 | 112.4 | S221 E230 V405 L407 S413 | S221-K409 PolarHBondContact O-NZ 3.01Å; S221-K409 WeakPolarHBondContact OG-CE 3.41Å; S221-K409 PolarHBondContact OG-NZ 3.41Å; E230-K409 IonicContact OE2-NZ 2.74Å; E230-K409 PolarHBondContact OE2-NZ 3.49Å; V405-K409 WeakPolarHBondContact O-CB 3.35Å; V405-K409 PolarHBondContact O-N 2.69Å; L407-K409 PolarHBondContact O-N 3.18Å; K409-S413 WeakPolarHBondContact O-CB 3.45Å; K409-S413 PolarHBondContact O-N 2.75Å; K409-S413 VanDerWaalsContact O-N 3.07Å |
| 410 | W | 81.3 | Confident | 79.8 | Confident | 105 Ų | 105 | 72.2 Ų | 72.2 | 40% | 0.398 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.5 | -53.8 | 173.4 | -178.3 | 55.1 | 0 | 0 | 0 | 111.6 | P363 A406 L407 R408 N412 S413 S414 | P363-W410 HydrophobicContact CG-CB 4.49Å; P363-W410 VanDerWaalsContact CG-CD1 3.49Å; P363-W410 HydrophobicContact CG-CD2 4.38Å; P363-W410 HydrophobicContact CG-CG 3.91Å; A406-W410 WeakPolarHBondContact O-CB 3.11Å; A406-W410 PolarHBondContact O-N 2.88Å; L407-W410 HydrophobicContact CD2-CE3 4.31Å; L407-W410 WeakPolarHBondContact O-CB 3.37Å; L407-W410 PolarHBondContact O-N 3.2Å; L407-W410 VanDerWaalsContact O-N 3.13Å; R408-W410 VanDerWaalsContact C-N 3.34Å; W410-N412 PolarHBondContact O-N 3.38Å; W410-S413 CarbonylContact O-C 3.41Å; W410-S413 PolarHBondContact O-N 3.05Å; W410-S414 PolarHBondContact O-N 3.28Å; W410-S414 PolarHBondContact O-OG 3.35Å |
| 411 | F | 81.8 | Confident | 79 | Confident | 128 Ų | 128 | 70.9 Ų | 70.9 | 56% | 0.561 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -54.9 | -48.9 | 175.4 | -78.6 | -66.7 | 0 | 0 | 0 | 112.6 | L407 S413 S414 R415 | L407-F411 HydrophobicContact CB-CE2 4.5Å; L407-F411 WeakPolarHBondContact O-CD2 3.28Å; L407-F411 PolarHBondContact O-N 3.01Å; F411-S413 PolarHBondContact O-N 3.01Å; F411-S414 PolarHBondContact O-N 2.86Å; F411-R415 PolarHBondContact O-N 2.95Å |
| 412 | N | 78.1 | Confident | 78.2 | Confident | 86 Ų | 86 | 75.3 Ų | 75.3 | 46% | 0.46 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -64 | -22.4 | 177.8 | -78.1 | -24.6 | 0 | 0 | 0 | 113.9 | R408 W410 | R408-N412 WeakPolarHBondContact O-CB 3.17Å; R408-N412 PolarHBondContact O-N 3.2Å; R408-N412 PolarHBondContact O-ND2 3.27Å; W410-N412 PolarHBondContact O-N 3.38Å |
| 413 | S | 70.5 | Confident | 77.5 | Confident | 49 Ų | 49 | 80.3 Ų | 80.3 | 34% | 0.343 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -91.3 | -25 | 176.4 | -179.9 | 0 | 0 | 0 | 0 | 112.9 | K360 K409 W410 F411 | K360-S413 WeakPolarHBondContact CD-OG 3.36Å; K360-S413 WeakPolarHBondContact CE-OG 3.18Å; K360-S413 PolarHBondContact NZ-O 3.4Å; K360-S413 PolarHBondContact NZ-OG 2.9Å; K409-S413 WeakPolarHBondContact O-CB 3.45Å; K409-S413 PolarHBondContact O-N 2.75Å; K409-S413 VanDerWaalsContact O-N 3.07Å; W410-S413 CarbonylContact O-C 3.41Å; W410-S413 PolarHBondContact O-N 3.05Å; F411-S413 PolarHBondContact O-N 3.01Å |
| 414 | S | 71.4 | Confident | 76.6 | Confident | 52 Ų | 52 | 84.5 Ų | 84.5 | 36% | 0.364 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -81 | -35.4 | 173.7 | -61 | 0 | 0 | 0 | 0 | 111.4 | W410 F411 K416 S417 | W410-S414 PolarHBondContact O-N 3.28Å; W410-S414 PolarHBondContact O-OG 3.35Å; F411-S414 PolarHBondContact O-N 2.86Å; S414-K416 PolarHBondContact O-N 3.4Å; S414-S417 PolarHBondContact O-N 3.2Å |
| 415 | R | 69.6 | Low | 75.5 | Confident | 229 Ų | 229 | 89.6 Ų | 89.6 | 86% | 0.864 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | 25.4 | 175.7 | -144.3 | -172.5 | 89 | 169.1 | 9.9 | 114.8 | F411 | F411-R415 PolarHBondContact O-N 2.95Š|
| 416 | K | 55.5 | Low | 74.5 | Confident | 183 Ų | 183 | 96.8 Ų | 96.8 | 80% | 0.796 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -143.9 | 5 | -177.7 | -78.6 | -168.1 | 174.5 | -169.7 | 0 | 112.7 | S414 | S414-K416 PolarHBondContact O-N 3.4Š|
| 417 | S | 47.4 | Very low | 73.4 | Confident | 154 Ų | 154 | 105.4 Ų | 105.4 | 100% | 1.077 | 51% | 0.513 | S | S | * | . | trans | -129.3 | 0 | -177.1 | -177 | 0 | 0 | 0 | 0 | 109.5 | S414 | S414-S417 PolarHBondContact O-N 3.2Š|
Retrieved 417 of 417 residues in 1067.4 ms
(Link to these results)