| 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 | 41.1 | Very low | 41.3 | Very low | 256 Ų | 256 | 132.5 Ų | 132.5 | 100% | 1.261 | 83% | 0.825 | S | S | * | * | 0 | 133.4 | 0 | -65.5 | -161.2 | -157.6 | 0 | 0 | 107.5 | |||||
| 2 | G | 40.8 | Very low | 41 | Very low | 79 Ų | 79 | 137.9 Ų | 137.9 | 81% | 0.814 | 83% | 0.827 | S | S | * | * | trans | 153.1 | 71 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 3 | T | 43.3 | Very low | 40.6 | Very low | 130 Ų | 130 | 142.8 Ų | 142.8 | 80% | 0.798 | 83% | 0.831 | S | S | * | * | trans | -49.5 | 126 | 170.1 | -47.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 4 | V | 40.8 | Very low | 40.2 | Very low | 114 Ų | 114 | 139.5 Ų | 139.5 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | 73.3 | 152.5 | 110.5 | -156.9 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 5 | L | 38.7 | Very low | 39.8 | Very low | 145 Ų | 145 | 137.5 Ų | 137.5 | 76% | 0.759 | 83% | 0.825 | S | S | * | * | trans | 100.2 | 102.7 | 147.7 | -60.9 | 176.2 | 0 | 0 | 0 | 115.3 | ||||
| 6 | S | 45.3 | Very low | 39.6 | Very low | 94 Ų | 94 | 138.1 Ų | 138.1 | 66% | 0.657 | 82% | 0.82 | S | S | * | * | 69.5 | 120.3 | 83.6 | 81.2 | 0 | 0 | 0 | 0 | 114 | |||||
| 7 | I | 40.5 | Very low | 39.6 | Very low | 173 Ų | 173 | 140.9 Ų | 140.9 | 89% | 0.887 | 83% | 0.826 | S | S | * | * | trans | -163.7 | 123.8 | 139.3 | 39 | 169.1 | 0 | 0 | 0 | 109.4 | ||||
| 8 | S | 33.7 | Very low | 39.4 | Very low | 114 Ų | 114 | 140.8 Ų | 140.8 | 80% | 0.797 | 82% | 0.821 | S | S | * | * | trans | -90.7 | -166.4 | 157.3 | -52.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 9 | P | 56.9 | Low | 39.4 | Very low | 125 Ų | 125 | 140.9 Ų | 140.9 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | -119.5 | 172.9 | -78.1 | 34.2 | -17.7 | 0 | 0 | 0 | 110.4 | |||||
| 10 | S | 35.3 | Very low | 39.2 | Very low | 128 Ų | 128 | 143.3 Ų | 143.3 | 90% | 0.895 | 83% | 0.827 | S | S | * | * | trans | -147.3 | 147.3 | 163.3 | 45.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 11 | S | 37.9 | Very low | 39.1 | Very low | 100 Ų | 100 | 141.2 Ų | 141.2 | 70% | 0.699 | 83% | 0.827 | S | S | * | * | trans | -117.2 | 159.6 | -152.8 | 51.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 12 | K | 37.4 | Very low | 38.7 | Very low | 197 Ų | 197 | 136.2 Ų | 136.2 | 86% | 0.857 | 81% | 0.811 | S | S | * | * | trans | 95.7 | 142.9 | 150.7 | -66.5 | 174.2 | 174.1 | 176.8 | 0 | 119.8 | ||||
| 13 | K | 35.6 | Very low | 38.4 | Very low | 201 Ų | 201 | 136.3 Ų | 136.3 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | 104 | 101.3 | 142.5 | -139.1 | 170.7 | -176.9 | -177 | 0 | 113.9 | ||||
| 14 | A | 36 | Very low | 37.9 | Very low | 97 Ų | 97 | 138.3 Ų | 138.3 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | 84.2 | 121.3 | 61.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 15 | S | 34.4 | Very low | 37.5 | Very low | 110 Ų | 110 | 135.6 Ų | 135.6 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | trans | -171 | 108 | 152.8 | -173.6 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 16 | I | 36.6 | Very low | 37.3 | Very low | 146 Ų | 146 | 135.7 Ų | 135.7 | 75% | 0.749 | 81% | 0.813 | S | S | * | * | 60.1 | 111.4 | 79.1 | -59.2 | 177.6 | 0 | 0 | 0 | 113.4 | |||||
| 17 | M | 38.8 | Very low | 36.9 | Very low | 187 Ų | 187 | 140.3 Ų | 140.3 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | -164.6 | 137.8 | 128.3 | -113.3 | 174.3 | 73.5 | 0 | 0 | 112 | |||||
| 18 | D | 35.8 | Very low | 36.6 | Very low | 138 Ų | 138 | 139.2 Ų | 139.2 | 74% | 0.738 | 82% | 0.818 | S | S | * | * | trans | -72.6 | 156.9 | -173.1 | -72.6 | -61.8 | 0 | 0 | 0 | 115.7 | ||||
| 19 | T | 39 | Very low | 36.6 | Very low | 144 Ų | 144 | 140.1 Ų | 140.1 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | trans | -155 | 125.8 | 136.8 | -46.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 20 | E | 35.8 | Very low | 35.9 | Very low | 187 Ų | 187 | 143.7 Ų | 143.7 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | -75 | 145.8 | 179.1 | -63 | -174.8 | 127 | 0 | 0 | 113.2 | ||||
| 21 | A | 37.1 | Very low | 35.9 | Very low | 101 Ų | 101 | 142.7 Ų | 142.7 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | -156 | 131.6 | 147 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 22 | T | 33.9 | Very low | 36 | Very low | 150 Ų | 150 | 145.9 Ų | 145.9 | 92% | 0.92 | 82% | 0.818 | S | S | * | * | trans | -47.7 | 145.3 | -177.6 | 46.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 23 | G | 34.4 | Very low | 35.8 | Very low | 81 Ų | 81 | 145 Ų | 145 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | 174.5 | 121 | 162.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 24 | D | 32.3 | Very low | 36.3 | Very low | 172 Ų | 172 | 147.3 Ų | 147.3 | 92% | 0.92 | 82% | 0.817 | S | S | * | * | trans | -66.7 | 157.7 | -171.1 | -162.4 | 8.2 | 0 | 0 | 0 | 116.1 | ||||
| 25 | G | 32.7 | Very low | 36.8 | Very low | 57 Ų | 57 | 150.7 Ų | 150.7 | 59% | 0.588 | 82% | 0.816 | S | S | * | * | trans | 108.4 | 100.5 | 150.3 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 26 | L | 33.8 | Very low | 37.1 | Very low | 147 Ų | 147 | 149.8 Ų | 149.8 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | trans | 62.6 | 121.7 | 130.8 | -100.2 | 68.8 | 0 | 0 | 0 | 123.1 | ||||
| 27 | K | 37.6 | Very low | 37.4 | Very low | 191 Ų | 191 | 150.8 Ų | 150.8 | 83% | 0.83 | 81% | 0.813 | S | S | * | * | trans | 100.9 | 125.6 | 134.2 | -70.6 | 172.8 | 176.7 | 174.1 | 0 | 120.5 | ||||
| 28 | N | 33.9 | Very low | 37.9 | Very low | 150 Ų | 150 | 150.6 Ų | 150.6 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | trans | -59.7 | 148.8 | 177.5 | -97.7 | -8.2 | 0 | 0 | 0 | 116.5 | ||||
| 29 | D | 33.2 | Very low | 38.2 | Very low | 133 Ų | 133 | 149.5 Ų | 149.5 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 44.4 | 114.7 | 141.6 | -81.3 | -59.1 | 0 | 0 | 0 | 120.5 | ||||
| 30 | K | 41.7 | Very low | 38.3 | Very low | 200 Ų | 200 | 147.6 Ų | 147.6 | 87% | 0.87 | 80% | 0.798 | S | S | * | * | -175.1 | 118.8 | 108 | -94.7 | 158 | -172.5 | 177.9 | 0 | 111.3 | |||||
| 31 | S | 35.3 | Very low | 38.8 | Very low | 107 Ų | 107 | 146.1 Ų | 146.1 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -66.3 | 126.4 | 169.3 | 171 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 32 | L | 40.3 | Very low | 39.3 | Very low | 167 Ų | 167 | 145.8 Ų | 145.8 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -126.7 | 102 | 160.1 | -75.3 | 175.1 | 0 | 0 | 0 | 109.6 | R34 | L32-R34 PolarHBondContact O-N 2.7Š| ||
| 33 | K | 34.4 | Very low | 39.8 | Very low | 178 Ų | 178 | 151 Ų | 151 | 77% | 0.774 | 79% | 0.79 | S | S | * | * | trans | -53.4 | 123.2 | 165.4 | -95.7 | 171 | 169.7 | 170.6 | 0 | 110.2 | H35 | K33-H35 PolarHBondContact O-N 2.95Š| ||
| 34 | R | 45.9 | Very low | 40.6 | Very low | 251 Ų | 251 | 155.7 Ų | 155.7 | 95% | 0.947 | 79% | 0.787 | S | S | * | * | trans | -67.7 | 115.3 | 163.6 | -70 | 179.9 | -172.2 | 156.5 | 2.5 | 108.8 | L32 | L32-R34 PolarHBondContact O-N 2.7Š| ||
| 35 | H | 45.1 | Very low | 41.5 | Very low | 168 Ų | 168 | 157.1 Ų | 157.1 | 78% | 0.778 | 79% | 0.785 | S | S | * | * | trans | -80.7 | 116.8 | 169.1 | -85 | -94.1 | 0 | 0 | 0 | 109.6 | K33 | K33-H35 PolarHBondContact O-N 2.95Š| ||
| 36 | S | 40.8 | Very low | 42.2 | Very low | 90 Ų | 90 | 162.9 Ų | 162.9 | 63% | 0.629 | 80% | 0.802 | S | S | * | * | trans | -74.8 | 119.1 | 168.7 | -177.3 | 0 | 0 | 0 | 0 | 109.4 | F38 | S36-F38 PolarHBondContact O-N 2.75Å; S36-F38 VanDerWaalsContact OG-CD2 3.26Å; S36-F38 WeakPolarHBondContact OG-CD2 3.49Å; S36-F38 WeakPolarHBondContact OG-CE2 3.4Å | ||
| 37 | M | 42.8 | Very low | 42.6 | Very low | 167 Ų | 167 | 161.3 Ų | 161.3 | 82% | 0.823 | 80% | 0.798 | S | S | * | * | trans | -91.2 | 84.4 | 175.9 | -72.6 | -83.6 | -75.1 | 0 | 0 | 109.3 | ||||
| 38 | F | 50 | Low | 42.7 | Very low | 183 Ų | 183 | 157 Ų | 157 | 80% | 0.803 | 80% | 0.798 | S | S | * | * | trans | -84.3 | 110.8 | 161.3 | -76.1 | -79.9 | 0 | 0 | 0 | 108.5 | S36 S40 | S36-F38 PolarHBondContact O-N 2.75Å; S36-F38 VanDerWaalsContact OG-CD2 3.26Å; S36-F38 WeakPolarHBondContact OG-CD2 3.49Å; S36-F38 WeakPolarHBondContact OG-CE2 3.4Å; F38-S40 PolarHBondContact O-N 3.34Å | ||
| 39 | V | 42.1 | Very low | 42.8 | Very low | 115 Ų | 115 | 157 Ų | 157 | 70% | 0.697 | 80% | 0.798 | S | S | * | * | trans | -83.5 | 98.7 | 169 | 178 | 0 | 0 | 0 | 0 | 107.9 | L41 | V39-L41 HydrophobicContact CG1-CD1 4.5Å; V39-L41 HydrophobicContact CG1-CG 4.33Å | ||
| 40 | S | 41.5 | Very low | 43 | Very low | 104 Ų | 104 | 156.2 Ų | 156.2 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | -82.2 | 110.7 | 166.9 | 54.4 | 0 | 0 | 0 | 0 | 109.4 | F38 S42 | F38-S40 PolarHBondContact O-N 3.34Å; S40-S42 PolarHBondContact O-N 2.98Å | ||
| 41 | L | 46.5 | Very low | 42.7 | Very low | 156 Ų | 156 | 151.3 Ų | 151.3 | 82% | 0.817 | 80% | 0.8 | S | S | * | * | trans | -85.1 | 99.4 | 171.5 | -86.3 | 149 | 0 | 0 | 0 | 109.3 | V39 W43 | V39-L41 HydrophobicContact CG1-CD1 4.5Å; V39-L41 HydrophobicContact CG1-CG 4.33Å; L41-W43 PolarHBondContact O-N 3.19Å | ||
| 42 | S | 47.9 | Very low | 42.7 | Very low | 95 Ų | 95 | 156.2 Ų | 156.2 | 66% | 0.664 | 81% | 0.807 | S | S | * | * | trans | -73.6 | 108.7 | 173.2 | -62.8 | 0 | 0 | 0 | 0 | 111.3 | S40 K44 | S40-S42 PolarHBondContact O-N 2.98Å; S42-K44 PolarHBondContact O-N 3Å | ||
| 43 | W | 44.2 | Very low | 42.6 | Very low | 258 Ų | 258 | 158.1 Ų | 158.1 | 98% | 0.977 | 81% | 0.809 | S | S | * | * | trans | -70.3 | 110 | 165.9 | -81.3 | -22.9 | 0 | 0 | 0 | 110.7 | L41 | L41-W43 PolarHBondContact O-N 3.19Š| ||
| 44 | K | 50.7 | Low | 42.8 | Very low | 181 Ų | 181 | 155.5 Ų | 155.5 | 79% | 0.787 | 81% | 0.813 | S | S | * | * | trans | -103.6 | 124.1 | 166.1 | 38.9 | -176 | 172.9 | -76 | 0 | 108.4 | S42 | S42-K44 PolarHBondContact O-N 3Š| ||
| 45 | K | 51.7 | Low | 42.3 | Very low | 202 Ų | 202 | 148.1 Ų | 148.1 | 88% | 0.878 | 81% | 0.806 | S | S | * | * | trans | -54.8 | 131.2 | -179.5 | -67.2 | -162.9 | 173.4 | -174.8 | 0 | 111.4 | ||||
| 46 | L | 46.6 | Very low | 42.1 | Very low | 177 Ų | 177 | 150.5 Ų | 150.5 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | -99.2 | 110 | 161.8 | -86.8 | 162 | 0 | 0 | 0 | 108.6 | ||||
| 47 | V | 43.2 | Very low | 41.8 | Very low | 114 Ų | 114 | 155.8 Ų | 155.8 | 69% | 0.691 | 83% | 0.825 | S | S | * | * | trans | -86.4 | 122.4 | 162.3 | 174.1 | 0 | 0 | 0 | 0 | 106.4 | N49 | V47-N49 PolarHBondContact O-N 3.34Š| ||
| 48 | A | 39.8 | Very low | 41.3 | Very low | 101 Ų | 101 | 154.1 Ų | 154.1 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | -80.8 | 106.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 49 | N | 36 | Very low | 40.7 | Very low | 150 Ų | 150 | 151.1 Ų | 151.1 | 80% | 0.802 | 82% | 0.821 | S | S | * | * | trans | -77.8 | 117.1 | 164.6 | -91.4 | 24.2 | 0 | 0 | 0 | 109.3 | V47 A51 | V47-N49 PolarHBondContact O-N 3.34Å; N49-A51 PolarHBondContact O-N 3.37Å | ||
| 50 | S | 35.5 | Very low | 40.4 | Very low | 117 Ų | 117 | 151.5 Ų | 151.5 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -74 | 98.7 | 170.2 | 48 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 51 | A | 36 | Very low | 40 | Very low | 96 Ų | 96 | 153.9 Ų | 153.9 | 79% | 0.793 | 83% | 0.83 | S | S | * | * | trans | -87.6 | 107.6 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | N49 K53 | N49-A51 PolarHBondContact O-N 3.37Å; A51-K53 PolarHBondContact O-N 3.21Å | ||
| 52 | K | 36.2 | Very low | 39.8 | Very low | 210 Ų | 210 | 152.1 Ų | 152.1 | 91% | 0.913 | 83% | 0.828 | S | S | * | * | trans | -74.3 | 112.4 | 169.7 | -74.3 | -179.1 | 177.9 | 175.3 | 0 | 109.3 | ||||
| 53 | K | 37.6 | Very low | 39.6 | Very low | 207 Ų | 207 | 155.3 Ų | 155.3 | 90% | 0.9 | 84% | 0.837 | S | S | * | * | trans | -106.3 | 129.4 | 159.9 | -85.2 | -172.4 | 175.9 | -179.3 | 0 | 109.7 | A51 | A51-K53 PolarHBondContact O-N 3.21Š| ||
| 54 | S | 37.7 | Very low | 39.7 | Very low | 124 Ų | 124 | 148.1 Ų | 148.1 | 87% | 0.867 | 82% | 0.824 | S | S | * | * | trans | -70.1 | 133.3 | 179.3 | 128.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 55 | A | 36.4 | Very low | 39.9 | Very low | 96 Ų | 96 | 144.4 Ų | 144.4 | 79% | 0.793 | 82% | 0.821 | S | S | * | * | trans | -145.4 | 124.6 | 156.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 56 | K | 41.5 | Very low | 40 | Very low | 218 Ų | 218 | 139 Ų | 139 | 95% | 0.948 | 81% | 0.808 | S | S | * | * | trans | -55.5 | 128.5 | -179.9 | -78.5 | 171.6 | 171.2 | 175.6 | 0 | 111.2 | ||||
| 57 | K | 33.2 | Very low | 40.4 | Very low | 201 Ų | 201 | 137.5 Ų | 137.5 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -120.1 | 129 | 167.9 | -169.4 | 174.4 | 180 | -177.3 | 0 | 109.9 | ||||
| 58 | V | 33.8 | Very low | 41.1 | Very low | 132 Ų | 132 | 136.8 Ų | 136.8 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | trans | -63.6 | 137.3 | 175.2 | 174.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 59 | T | 36.4 | Very low | 41.8 | Very low | 119 Ų | 119 | 135.3 Ų | 135.3 | 73% | 0.73 | 78% | 0.78 | S | S | * | * | trans | -78.1 | 147.2 | 178.6 | -26.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 60 | P | 36.5 | Very low | 42.7 | Very low | 123 Ų | 123 | 133.5 Ų | 133.5 | 80% | 0.799 | 77% | 0.766 | S | S | * | * | -137 | 142.8 | 107 | 29.4 | -12.9 | 0 | 0 | 0 | 114.6 | |||||
| 61 | N | 33.5 | Very low | 43.8 | Very low | 154 Ų | 154 | 132.8 Ų | 132.8 | 82% | 0.824 | 75% | 0.753 | S | S | * | * | trans | 26.9 | 127.7 | 167.4 | -83.4 | -0.8 | 0 | 0 | 0 | 123.3 | ||||
| 62 | P | 41.3 | Very low | 44.7 | Very low | 119 Ų | 119 | 133.4 Ų | 133.4 | 77% | 0.773 | 74% | 0.743 | S | S | * | * | trans | -93.1 | 139.4 | 169.3 | 35.2 | -28.6 | 0 | 0 | 0 | 113.2 | ||||
| 63 | L | 43 | Very low | 45.8 | Very low | 162 Ų | 162 | 126.1 Ų | 126.1 | 85% | 0.848 | 72% | 0.718 | S | S | * | * | trans | -83 | 151.2 | 154.5 | -87.3 | 98.7 | 0 | 0 | 0 | 109.9 | S65 | L63-S65 PolarHBondContact O-N 2.89Š| ||
| 64 | P | 46.2 | Very low | 46.7 | Very low | 107 Ų | 107 | 120.5 Ų | 120.5 | 70% | 0.695 | 70% | 0.695 | S | S | * | * | trans | -74.5 | 113 | -163.2 | 27.4 | -33 | 0 | 0 | 0 | 113.1 | S66 | P64-S66 PolarHBondContact O-N 3.43Š| ||
| 65 | S | 56.7 | Low | 47.6 | Very low | 104 Ų | 104 | 119.7 Ų | 119.7 | 73% | 0.727 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.1 | 17 | 177.8 | 60.5 | 0 | 0 | 0 | 0 | 114.8 | L63 | L63-S65 PolarHBondContact O-N 2.89Š|
| 66 | S | 53.3 | Low | 48.3 | Very low | 88 Ų | 88 | 119.5 Ų | 119.5 | 62% | 0.615 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -87.1 | -23.4 | -174.7 | 68.6 | 0 | 0 | 0 | 0 | 114.3 | P64 | P64-S66 PolarHBondContact O-N 3.43Å |
| 67 | Q | 55.3 | Low | 49 | Very low | 146 Ų | 146 | 117.9 Ų | 117.9 | 68% | 0.682 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -78.1 | -34.7 | -178.6 | -79.8 | 175.3 | -20.4 | 0 | 0 | 113.3 | H70 L71 | Q67-H70 PolarHBondContact O-N 2.92Å; Q67-L71 WeakPolarHBondContact O-CG 3.46Å; Q67-L71 PolarHBondContact O-N 2.99Å; Q67-L71 VanDerWaalsContact O-N 3.12Å |
| 68 | V | 56.9 | Low | 49.9 | Very low | 99 Ų | 99 | 115.1 Ų | 115.1 | 60% | 0.6 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -72.3 | -34.9 | -176.5 | -174.8 | 0 | 0 | 0 | 0 | 111.9 | N72 | V68-N72 PolarHBondContact O-N 3.3Å |
| 69 | A | 55.3 | Low | 50.8 | Low | 69 Ų | 69 | 113.7 Ų | 113.7 | 57% | 0.57 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.8 | -35.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S73 | A69-S73 PolarHBondContact O-N 3.46Å |
| 70 | H | 54.6 | Low | 51.3 | Low | 113 Ų | 113 | 115.6 Ų | 115.6 | 52% | 0.523 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -68.4 | -44.5 | 177.8 | -167.3 | -88.2 | 0 | 0 | 0 | 111.7 | Q67 N72 S73 E74 | Q67-H70 PolarHBondContact O-N 2.92Å; H70-N72 PolarHBondContact O-N 2.95Å; H70-S73 PolarHBondContact O-N 3.22Å; H70-S73 VanDerWaalsContact O-N 3.15Å; H70-S73 PolarHBondContact O-OG 3.34Å; H70-E74 IonicContact CE1-OE2 3.34Å; H70-E74 IonicContact ND1-OE2 3.66Å; H70-E74 PolarHBondContact O-N 3.42Å; H70-E74 VanDerWaalsContact O-N 3.08Å |
| 71 | L | 57.5 | Low | 51.7 | Low | 102 Ų | 102 | 117.3 Ų | 117.3 | 53% | 0.534 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -64.8 | -36.2 | 178.2 | -69.4 | 169.7 | 0 | 0 | 0 | 112.9 | Q67 S73 E74 N75 | Q67-L71 WeakPolarHBondContact O-CG 3.46Å; Q67-L71 PolarHBondContact O-N 2.99Å; Q67-L71 VanDerWaalsContact O-N 3.12Å; L71-S73 VanDerWaalsContact C-N 3.32Å; L71-S73 PolarHBondContact O-N 2.78Å; L71-E74 PolarHBondContact O-N 2.87Å; L71-N75 PolarHBondContact O-N 3.44Å |
| 72 | N | 55.3 | Low | 52.2 | Low | 109 Ų | 109 | 115.9 Ų | 115.9 | 58% | 0.583 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -66.6 | -34.4 | 173.8 | -92.3 | -15.9 | 0 | 0 | 0 | 112.2 | V68 H70 V76 | V68-N72 PolarHBondContact O-N 3.3Å; H70-N72 PolarHBondContact O-N 2.95Å; N72-V76 WeakPolarHBondContact O-CG2 3.09Å; N72-V76 PolarHBondContact O-N 3Å |
| 73 | S | 58.8 | Low | 52.4 | Low | 56 Ų | 56 | 119.1 Ų | 119.1 | 39% | 0.392 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -73.7 | -30.3 | 177.8 | 74.5 | 0 | 0 | 0 | 0 | 113.6 | A69 H70 L71 R77 | A69-S73 PolarHBondContact O-N 3.46Å; H70-S73 PolarHBondContact O-N 3.22Å; H70-S73 VanDerWaalsContact O-N 3.15Å; H70-S73 PolarHBondContact O-OG 3.34Å; L71-S73 VanDerWaalsContact C-N 3.32Å; L71-S73 PolarHBondContact O-N 2.78Å; S73-R77 PolarHBondContact O-N 3.48Å |
| 74 | E | 56.7 | Low | 52.5 | Low | 90 Ų | 90 | 119.9 Ų | 119.9 | 42% | 0.421 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -73.4 | -37.3 | 174.3 | -84.4 | -172.1 | 122.1 | 0 | 0 | 112.5 | H70 L71 R77 K78 | H70-E74 IonicContact CE1-OE2 3.34Å; H70-E74 IonicContact ND1-OE2 3.66Å; H70-E74 PolarHBondContact O-N 3.42Å; H70-E74 VanDerWaalsContact O-N 3.08Å; L71-E74 PolarHBondContact O-N 2.87Å; E74-R77 PolarHBondContact O-N 3.46Å; E74-K78 PolarHBondContact O-N 2.87Å; E74-K78 VanDerWaalsContact O-N 3.11Å |
| 75 | N | 56.5 | Low | 52 | Low | 106 Ų | 106 | 124.4 Ų | 124.4 | 57% | 0.567 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -68.3 | -35.4 | 178.4 | -86.9 | -18 | 0 | 0 | 0 | 112.7 | L71 R77 K78 T79 | L71-N75 PolarHBondContact O-N 3.44Å; N75-R77 VanDerWaalsContact C-N 3.34Å; N75-K78 PolarHBondContact O-N 3.13Å; N75-T79 PolarHBondContact O-N 2.82Å; N75-T79 PolarHBondContact O-OG1 2.84Å |
| 76 | V | 52.6 | Low | 51 | Low | 92 Ų | 92 | 128.6 Ų | 128.6 | 56% | 0.558 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -71 | -28.9 | 174.7 | 174.9 | 0 | 0 | 0 | 0 | 112 | N72 T79 H80 | N72-V76 WeakPolarHBondContact O-CG2 3.09Å; N72-V76 PolarHBondContact O-N 3Å; V76-T79 PolarHBondContact O-OG1 2.95Å; V76-H80 PolarHBondContact O-CD2 2.93Å |
| 77 | R | 55.6 | Low | 50.3 | Low | 185 Ų | 185 | 130.4 Ų | 130.4 | 70% | 0.698 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -79.1 | -20.9 | 175 | -87.6 | -179.3 | 165.4 | 163.3 | -3.5 | 114.2 | S73 E74 N75 Q81 | S73-R77 PolarHBondContact O-N 3.48Å; E74-R77 PolarHBondContact O-N 3.46Å; N75-R77 VanDerWaalsContact C-N 3.34Å; R77-Q81 PolarHBondContact O-NE2 3.17Å; R77-Q81 VanDerWaalsContact O-NE2 3.1Å |
| 78 | K | 53.2 | Low | 49.4 | Very low | 142 Ų | 142 | 133.3 Ų | 133.3 | 62% | 0.617 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -82.9 | -27.7 | 175.4 | -78.1 | -178.2 | 178.6 | 174.7 | 0 | 113.2 | E74 N75 | E74-K78 PolarHBondContact O-N 2.87Å; E74-K78 VanDerWaalsContact O-N 3.11Å; N75-K78 PolarHBondContact O-N 3.13Å |
| 79 | T | 51 | Low | 48.8 | Very low | 102 Ų | 102 | 132.6 Ų | 132.6 | 63% | 0.626 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -77.6 | -21.7 | 177 | 41.5 | 0 | 0 | 0 | 0 | 114.1 | N75 V76 | N75-T79 PolarHBondContact O-N 2.82Å; N75-T79 PolarHBondContact O-OG1 2.84Å; V76-T79 PolarHBondContact O-OG1 2.95Å |
| 80 | H | 47.8 | Very low | 47.9 | Very low | 159 Ų | 159 | 135.4 Ų | 135.4 | 74% | 0.736 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | 4 | 179.4 | -77.1 | -71.8 | 0 | 0 | 0 | 115.4 | V76 | V76-H80 PolarHBondContact O-CD2 2.93Š|
| 81 | Q | 45.2 | Very low | 47.1 | Very low | 159 Ų | 159 | 137.6 Ų | 137.6 | 74% | 0.743 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -108.7 | 3.4 | 179.2 | -84.2 | -177.9 | 86.5 | 0 | 0 | 114.8 | R77 | R77-Q81 PolarHBondContact O-NE2 3.17Å; R77-Q81 VanDerWaalsContact O-NE2 3.1Å |
| 82 | T | 43 | Very low | 46 | Very low | 124 Ų | 124 | 138.1 Ų | 138.1 | 76% | 0.761 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -101.1 | -4 | -178.7 | -47.7 | 0 | 0 | 0 | 0 | 114.3 | ||
| 83 | E | 46.9 | Very low | 45.1 | Very low | 187 Ų | 187 | 139.3 Ų | 139.3 | 87% | 0.874 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -99.8 | 1.1 | -175.3 | -82.7 | -148.8 | 142.2 | 0 | 0 | 117.6 | ||
| 84 | E | 44.6 | Very low | 44 | Very low | 179 Ų | 179 | 142.3 Ų | 142.3 | 84% | 0.836 | 74% | 0.74 | S | S | * | * | trans | -133.1 | 92 | 176.3 | -66.9 | -157 | 155.5 | 0 | 0 | 113.9 | ||||
| 85 | K | 35.4 | Very low | 43.3 | Very low | 201 Ų | 201 | 143.6 Ų | 143.6 | 87% | 0.874 | 75% | 0.753 | S | S | * | * | 173 | 127.1 | 122.7 | -95.2 | 165.5 | -179.3 | 173.7 | 0 | 114.4 | |||||
| 86 | K | 35.1 | Very low | 42.3 | Very low | 193 Ų | 193 | 144.5 Ų | 144.5 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | trans | 101.8 | 130.4 | 149.9 | -78 | -174.1 | 174.2 | -178.2 | 0 | 119.6 | ||||
| 87 | P | 39.6 | Very low | 41.4 | Very low | 126 Ų | 126 | 146.1 Ų | 146.1 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -79 | 137.2 | 175.2 | 34.3 | -31.6 | 0 | 0 | 0 | 109.9 | ||||
| 88 | K | 36.4 | Very low | 40.6 | Very low | 206 Ų | 206 | 143.2 Ų | 143.2 | 90% | 0.896 | 78% | 0.777 | S | S | * | * | trans | -113.5 | 127.5 | 169.6 | -79.4 | -176.9 | 177.4 | 178.1 | 0 | 109.9 | ||||
| 89 | A | 43.6 | Very low | 39.9 | Very low | 85 Ų | 85 | 142 Ų | 142 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 165.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 90 | P | 37.1 | Very low | 38.9 | Very low | 127 Ų | 127 | 143.5 Ų | 143.5 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 136.7 | -170.8 | -12.1 | 27.1 | 0 | 0 | 0 | 112.2 | ||
| 91 | I | 36.7 | Very low | 38.4 | Very low | 159 Ų | 159 | 146 Ų | 146 | 82% | 0.815 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 133.4 | 175.3 | -61.2 | 169.7 | 0 | 0 | 0 | 108.8 | ||
| 92 | P | 34.1 | Very low | 37.7 | Very low | 114 Ų | 114 | 145.6 Ų | 145.6 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 135 | 176.5 | -9.2 | 25.2 | 0 | 0 | 0 | 111.4 | ||
| 93 | V | 37.3 | Very low | 37.3 | Very low | 133 Ų | 133 | 145.3 Ų | 145.3 | 81% | 0.806 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 129.8 | 175.9 | -140.3 | 0 | 0 | 0 | 0 | 109.5 | V95 | V93-V95 PolarHBondContact O-N 3.34Š|
| 94 | P | 35.7 | Very low | 36.7 | Very low | 120 Ų | 120 | 143.5 Ų | 143.5 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 122.3 | 173.4 | -11.6 | 27.6 | 0 | 0 | 0 | 110.8 | ||
| 95 | V | 41.1 | Very low | 36.1 | Very low | 117 Ų | 117 | 140.2 Ų | 140.2 | 71% | 0.709 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 130.9 | 169.3 | 179.2 | 0 | 0 | 0 | 0 | 109 | V93 T97 | V93-V95 PolarHBondContact O-N 3.34Å; V95-T97 PolarHBondContact O-N 3.02Å |
| 96 | P | 36.3 | Very low | 36 | Very low | 125 Ų | 125 | 136.5 Ų | 136.5 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -69.9 | 102.5 | 171.9 | -11.7 | 26.6 | 0 | 0 | 0 | 109.4 | ||||
| 97 | T | 34 | Very low | 36 | Very low | 126 Ų | 126 | 134.7 Ų | 134.7 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | -94.2 | 115.6 | 173.1 | -44.4 | 0 | 0 | 0 | 0 | 107.8 | V95 | V95-T97 PolarHBondContact O-N 3.02Š| ||
| 98 | V | 39.3 | Very low | 35.7 | Very low | 123 Ų | 123 | 136.3 Ų | 136.3 | 75% | 0.745 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 136 | 175.3 | -176.5 | 0 | 0 | 0 | 0 | 108.9 | T100 | V98-T100 PolarHBondContact O-N 3.34Š|
| 99 | P | 37.2 | Very low | 35.5 | Very low | 118 Ų | 118 | 133.7 Ų | 133.7 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -79 | 118.4 | 178.6 | 29.5 | -30.7 | 0 | 0 | 0 | 111.3 | ||
| 100 | T | 31.3 | Very low | 34.9 | Very low | 133 Ų | 133 | 133.2 Ų | 133.2 | 82% | 0.816 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 116.8 | 163.7 | 27.4 | 0 | 0 | 0 | 0 | 109.7 | V98 | V98-T100 PolarHBondContact O-N 3.34Š|
| 101 | K | 36.3 | Very low | 34.8 | Very low | 210 Ų | 210 | 138.5 Ų | 138.5 | 91% | 0.913 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 119 | 161.8 | -83.8 | -175.7 | 173.3 | -178.2 | 0 | 108.6 | ||
| 102 | N | 29.9 | Very low | 35.1 | Very low | 152 Ų | 152 | 139.2 Ų | 139.2 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -83 | 131.2 | 164.4 | -90.5 | 5.8 | 0 | 0 | 0 | 109.8 | ||
| 103 | S | 35.7 | Very low | 35.3 | Very low | 117 Ų | 117 | 138.8 Ų | 138.8 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -149.3 | 116.4 | 151.5 | 51.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 104 | D | 33.9 | Very low | 35.4 | Very low | 150 Ų | 150 | 138.8 Ų | 138.8 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | trans | -62.1 | 141.3 | 179.6 | -67.6 | -56.6 | 0 | 0 | 0 | 112.4 | ||||
| 105 | S | 32.8 | Very low | 35.9 | Very low | 109 Ų | 109 | 139.1 Ų | 139.1 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | 160.5 | 145.5 | 107.2 | 57.4 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 106 | V | 33.1 | Very low | 36.1 | Very low | 124 Ų | 124 | 142.6 Ų | 142.6 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | trans | 95.3 | 96.1 | 152.7 | -162.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 107 | L | 34.4 | Very low | 36.7 | Very low | 154 Ų | 154 | 145.9 Ų | 145.9 | 81% | 0.806 | 81% | 0.808 | S | S | * | * | 53.8 | 129.4 | 129.3 | -62.8 | 171.5 | 0 | 0 | 0 | 123.9 | |||||
| 108 | Q | 34.6 | Very low | 36.9 | Very low | 160 Ų | 160 | 148.6 Ų | 148.6 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | trans | 93.1 | 115 | 137.8 | -83.2 | -170.7 | 23.4 | 0 | 0 | 122 | ||||
| 109 | N | 30.5 | Very low | 37 | Very low | 151 Ų | 151 | 147.8 Ų | 147.8 | 81% | 0.807 | 81% | 0.809 | S | S | * | * | trans | 59.8 | 117 | 134.6 | -72.3 | -6.4 | 0 | 0 | 0 | 120.9 | ||||
| 110 | G | 32.5 | Very low | 37.3 | Very low | 75 Ų | 75 | 147.1 Ų | 147.1 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | 122.8 | 114.1 | 126.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 111 | R | 34.3 | Very low | 38.2 | Very low | 238 Ų | 238 | 147.7 Ų | 147.7 | 90% | 0.898 | 81% | 0.805 | S | S | * | * | trans | 83.8 | 115.1 | 140.1 | -138.2 | 174.9 | -171 | -170 | 1.3 | 118.5 | S113 | R111-S113 PolarHBondContact O-N 3.36Š| ||
| 112 | L | 44 | Very low | 38.6 | Very low | 174 Ų | 174 | 146.5 Ų | 146.5 | 91% | 0.911 | 80% | 0.8 | S | S | * | * | trans | -53.2 | 126.9 | 164.1 | -67.2 | 155.4 | 0 | 0 | 0 | 110.9 | ||||
| 113 | S | 38.2 | Very low | 39.2 | Very low | 106 Ų | 106 | 143.7 Ų | 143.7 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | trans | -134.9 | 100.2 | 169.8 | -47.7 | 0 | 0 | 0 | 0 | 110.3 | R111 | R111-S113 PolarHBondContact O-N 3.36Š| ||
| 114 | T | 39.4 | Very low | 39.7 | Very low | 132 Ų | 132 | 146.2 Ų | 146.2 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | 22 | 120.5 | 139 | -36.7 | 0 | 0 | 0 | 0 | 119.9 | Q116 | T114-Q116 PolarHBondContact O-N 3.27Š| ||
| 115 | V | 46.1 | Very low | 40.3 | Very low | 128 Ų | 128 | 145.4 Ų | 145.4 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | -21.7 | 120.3 | 153.5 | 177.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 116 | Q | 44.1 | Very low | 40.8 | Very low | 190 Ų | 190 | 144.8 Ų | 144.8 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | -117.7 | 106.7 | 159.8 | -153.1 | 171.2 | 15.8 | 0 | 0 | 108.7 | T114 Q118 | T114-Q116 PolarHBondContact O-N 3.27Å; Q116-Q118 PolarHBondContact O-N 2.87Å | ||
| 117 | K | 49.6 | Very low | 41.7 | Very low | 194 Ų | 194 | 144.4 Ų | 144.4 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | -61.2 | 116.9 | 171.5 | -81.3 | 177.6 | 173.7 | 176.9 | 0 | 109.1 | ||||
| 118 | Q | 37.8 | Very low | 42.5 | Very low | 182 Ų | 182 | 147.6 Ų | 147.6 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | trans | -94.2 | 124.3 | 160.7 | -134.9 | -170.4 | 2.8 | 0 | 0 | 108.2 | Q116 S120 | Q116-Q118 PolarHBondContact O-N 2.87Å; Q118-S120 PolarHBondContact O-N 2.69Å; Q118-S120 VanDerWaalsContact O-N 3.16Å | ||
| 119 | P | 42.2 | Very low | 43.5 | Very low | 107 Ų | 107 | 151.1 Ų | 151.1 | 70% | 0.695 | 79% | 0.794 | S | S | * | * | trans | -80.5 | 95.4 | 175.2 | 30.4 | -29.1 | 0 | 0 | 0 | 108.9 | N121 | P119-N121 VanDerWaalsContact C-N 3.31Å; P119-N121 PolarHBondContact O-N 3.18Å | ||
| 120 | S | 43.1 | Very low | 44.9 | Very low | 104 Ų | 104 | 149.2 Ų | 149.2 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | trans | -73.7 | 88.8 | 166.9 | 53.6 | 0 | 0 | 0 | 0 | 109.2 | Q118 F122 | Q118-S120 PolarHBondContact O-N 2.69Å; Q118-S120 VanDerWaalsContact O-N 3.16Å; S120-F122 PolarHBondContact O-N 2.82Å | ||
| 121 | N | 48.9 | Very low | 45.9 | Very low | 145 Ų | 145 | 151.7 Ų | 151.7 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | trans | -71.8 | 55.4 | 168.1 | -84.7 | -13.4 | 0 | 0 | 0 | 111.7 | P119 | P119-N121 VanDerWaalsContact C-N 3.31Å; P119-N121 PolarHBondContact O-N 3.18Å | ||
| 122 | F | 45 | Very low | 47.4 | Very low | 184 Ų | 184 | 142.8 Ų | 142.8 | 81% | 0.807 | 75% | 0.753 | S | S | * | * | trans | -120.1 | 76.2 | 164.4 | -75.3 | -78.6 | 0 | 0 | 0 | 107.9 | S120 L124 | S120-F122 PolarHBondContact O-N 2.82Å; F122-L124 VanDerWaalsContact C-N 3.33Å; F122-L124 PolarHBondContact O-N 3.47Å | ||
| 123 | S | 42.8 | Very low | 49.1 | Very low | 93 Ų | 93 | 142.5 Ų | 142.5 | 65% | 0.65 | 75% | 0.747 | S | S | * | * | trans | -57.7 | 105.3 | 154.5 | 38.1 | 0 | 0 | 0 | 0 | 106.7 | L125 | S123-L125 PolarHBondContact O-N 2.86Š| ||
| 124 | L | 46.8 | Very low | 51.3 | Low | 171 Ų | 171 | 138.4 Ų | 138.4 | 90% | 0.895 | 72% | 0.719 | S | S | * | * | trans | -58 | 89.1 | 160.7 | -68.4 | 170.9 | 0 | 0 | 0 | 106.5 | F122 S126 | F122-L124 VanDerWaalsContact C-N 3.33Å; F122-L124 PolarHBondContact O-N 3.47Å; L124-S126 PolarHBondContact O-N 3.03Å | ||
| 125 | L | 46.3 | Very low | 53.9 | Low | 133 Ų | 133 | 135.5 Ų | 135.5 | 70% | 0.696 | 70% | 0.704 | S | S | * | * | trans | -67 | 92 | 171.7 | -66.1 | 177.5 | 0 | 0 | 0 | 106.3 | S123 | S123-L125 PolarHBondContact O-N 2.86Š| ||
| 126 | S | 44.3 | Very low | 56.3 | Low | 96 Ų | 96 | 131.3 Ų | 131.3 | 67% | 0.671 | 68% | 0.679 | S | S | * | * | trans | -43.3 | 130.7 | 152.8 | 172.5 | 0 | 0 | 0 | 0 | 107 | L124 R128 | L124-S126 PolarHBondContact O-N 3.03Å; S126-R128 PolarHBondContact O-N 3.44Å | ||
| 127 | P | 51 | Low | 58.8 | Low | 115 Ų | 115 | 123.9 Ų | 123.9 | 75% | 0.747 | 65% | 0.653 | S | S | * | * | trans | -49.9 | 116 | 176.7 | -24.1 | 32 | 0 | 0 | 0 | 107.9 | R129 | P127-R129 PolarHBondContact O-N 3.23Š| ||
| 128 | R | 50.5 | Low | 61 | Low | 221 Ų | 221 | 117.2 Ų | 117.2 | 83% | 0.834 | 63% | 0.625 | S | S | * | * | trans | -58 | 111.3 | 174.6 | -77.7 | -179.7 | 174.8 | 177.7 | -1.7 | 105.2 | S126 I130 | S126-R128 PolarHBondContact O-N 3.44Å; R128-I130 PolarHBondContact O-N 3.49Å | ||
| 129 | R | 56.2 | Low | 63.9 | Low | 234 Ų | 234 | 108.6 Ų | 108.6 | 88% | 0.883 | 59% | 0.585 | S | S | * | * | trans | -56.7 | 109.1 | 171.4 | -80.9 | -175.6 | -168.9 | 149.6 | 3.5 | 106.6 | P127 V131 | P127-R129 PolarHBondContact O-N 3.23Å; R129-V131 PolarHBondContact O-N 2.91Å | ||
| 130 | I | 59.7 | Low | 66.6 | Low | 111 Ų | 111 | 103.6 Ų | 103.6 | 57% | 0.569 | 55% | 0.552 | S | S | * | * | trans | -66.7 | 104.2 | 168.1 | -58.1 | 177.9 | 0 | 0 | 0 | 104.6 | R128 I132 | R128-I130 PolarHBondContact O-N 3.49Å; I130-I132 VanDerWaalsContact C-N 3.32Å; I130-I132 HydrophobicContact CB-CG1 4.42Å; I130-I132 HydrophobicContact CG2-CD1 4.32Å; I130-I132 HydrophobicContact CG2-CG1 3.65Å; I130-I132 PolarHBondContact O-N 2.9Å | ||
| 131 | V | 54.1 | Low | 69.2 | Low | 127 Ų | 127 | 103.2 Ų | 103.2 | 77% | 0.77 | 54% | 0.535 | S | S | * | . | trans | -78.1 | 93 | 174.4 | -179.6 | 0 | 0 | 0 | 0 | 106.4 | R129 Q133 | R129-V131 PolarHBondContact O-N 2.91Å; V131-Q133 PolarHBondContact O-N 2.89Å | ||
| 132 | I | 65.8 | Low | 71.5 | Confident | 52 Ų | 52 | 96.3 Ų | 96.3 | 27% | 0.267 | 50% | 0.498 | S | S | . | . | trans | -79.5 | 108.9 | 175.3 | -62 | -177.3 | 0 | 0 | 0 | 107.4 | I130 F270 T271 F274 | I130-I132 VanDerWaalsContact C-N 3.32Å; I130-I132 HydrophobicContact CB-CG1 4.42Å; I130-I132 HydrophobicContact CG2-CD1 4.32Å; I130-I132 HydrophobicContact CG2-CG1 3.65Å; I130-I132 PolarHBondContact O-N 2.9Å; I132-F270 HydrophobicContact CD1-CD1 4.38Å; I132-F270 HydrophobicContact CD1-CE1 4.23Å; I132-T271 HydrophobicContact CD1-CG2 4Å; I132-F274 HydrophobicContact CB-CE1 4.46Å; I132-F274 HydrophobicContact CG2-CD1 3.31Å; I132-F274 HydrophobicContact CG2-CD2 3.69Å; I132-F274 HydrophobicContact CG2-CE1 3.01Å; I132-F274 HydrophobicContact CG2-CE2 3.35Å; I132-F274 HydrophobicContact CG2-CG 3.69Å; I132-F274 HydrophobicContact CG2-CZ 3.03Å | ||
| 133 | Q | 78.6 | Confident | 74 | Confident | 168 Ų | 168 | 87.6 Ų | 87.6 | 79% | 0.785 | 46% | 0.46 | S | S | * | . | trans | -103.2 | 111.4 | 180 | -166.8 | -170 | -13.4 | 0 | 0 | 110.8 | V131 | V131-Q133 PolarHBondContact O-N 2.89Š| ||
| 134 | A | 84.8 | Confident | 76.7 | Confident | 19 Ų | 19 | 83.1 Ų | 83.1 | 16% | 0.157 | 43% | 0.429 | C | S | . | . | trans | -153 | 147 | 158 | 0 | 0 | 0 | 0 | 0 | 108.4 | L139 F274 K278 | A134-L139 HydrophobicContact CB-CD1 4.38Å; A134-L139 HydrophobicContact CB-CD2 3.79Å; A134-L139 HydrophobicContact CB-CG 3.92Å; A134-F274 HydrophobicContact CB-CE2 4.04Å; A134-F274 HydrophobicContact CB-CZ 3.62Å; A134-K278 HydrophobicContact CB-CD 4.32Å | ||
| 135 | S | 94.6 | Very high | 79 | Confident | 71 Ų | 71 | 76.2 Ų | 76.2 | 50% | 0.497 | 39% | 0.392 | S | S | . | . | trans | -77.1 | 153.4 | 171.9 | 72.5 | 0 | 0 | 0 | 0 | 110.5 | G137 E138 L139 | S135-G137 PolarHBondContact O-N 3.23Å; S135-E138 WeakPolarHBondContact O-CB 3.36Å; S135-E138 PolarHBondContact O-N 2.83Å; S135-E138 VanDerWaalsContact O-N 3.1Å; S135-E138 VanDerWaalsContact OG-CB 3.31Å; S135-E138 WeakPolarHBondContact OG-CB 3.5Å; S135-E138 PolarHBondContact OG-N 3.27Å; S135-L139 PolarHBondContact O-N 3.19Å; S135-L139 VanDerWaalsContact O-N 3.1Å | ||
| 136 | T | 96.9 | Very high | 81.5 | Confident | 41 Ų | 41 | 70.1 Ų | 70.1 | 25% | 0.252 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -57 | -37.4 | 173.4 | -44.1 | 0 | 0 | 0 | 0 | 111.8 | L139 L140 I184 P186 V189 | T136-L139 PolarHBondContact O-N 3.21Å; T136-L140 HydrophobicContact CG2-CD1 4.36Å; T136-L140 WeakPolarHBondContact O-CB 3.37Å; T136-L140 VanDerWaalsContact O-CG 3.25Å; T136-L140 WeakPolarHBondContact O-CG 3.27Å; T136-L140 PolarHBondContact O-N 3.48Å; T136-I184 HydrophobicContact CG2-CG2 3.61Å; T136-P186 WeakPolarHBondContact OG1-CD 3.38Å; T136-P186 WeakPolarHBondContact OG1-CG 3.37Å; T136-V189 HydrophobicContact CG2-CG2 4.25Å |
| 137 | G | 96.8 | Very high | 84 | Confident | 34 Ų | 34 | 65.5 Ų | 65.5 | 35% | 0.351 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.7 | -37.6 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | S135 R141 | S135-G137 PolarHBondContact O-N 3.23Å; G137-R141 PolarHBondContact O-N 3.43Å; G137-R141 VanDerWaalsContact O-N 3.12Å |
| 138 | E | 96 | Very high | 86.2 | Confident | 54 Ų | 54 | 61.6 Ų | 61.6 | 25% | 0.252 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -66.1 | -45.6 | 175.3 | 179.8 | 173.2 | -158.1 | 0 | 0 | 111.8 | S135 L140 R141 C142 R281 | S135-E138 WeakPolarHBondContact O-CB 3.36Å; S135-E138 PolarHBondContact O-N 2.83Å; S135-E138 VanDerWaalsContact O-N 3.1Å; S135-E138 VanDerWaalsContact OG-CB 3.31Å; S135-E138 WeakPolarHBondContact OG-CB 3.5Å; S135-E138 PolarHBondContact OG-N 3.27Å; E138-L140 PolarHBondContact O-N 2.92Å; E138-R141 PolarHBondContact O-N 3.27Å; E138-C142 PolarHBondContact O-N 2.77Å; E138-C142 PolarHBondContact O-SG 2.85Å; E138-R281 IonicContact OE1-NH1 3.86Å; E138-R281 PolarHBondContact OE1-NH1 3.4Å |
| 139 | L | 98 | Very high | 88.3 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.3 | -38.8 | 178.2 | -63.8 | 176.5 | 0 | 0 | 0 | 112.4 | A134 S135 T136 R141 C142 L143 P186 V189 F274 L277 | A134-L139 HydrophobicContact CB-CD1 4.38Å; A134-L139 HydrophobicContact CB-CD2 3.79Å; A134-L139 HydrophobicContact CB-CG 3.92Å; S135-L139 PolarHBondContact O-N 3.19Å; S135-L139 VanDerWaalsContact O-N 3.1Å; T136-L139 PolarHBondContact O-N 3.21Å; L139-R141 VanDerWaalsContact C-N 3.31Å; L139-R141 PolarHBondContact O-N 3.41Å; L139-C142 PolarHBondContact O-N 3.25Å; L139-L143 WeakPolarHBondContact O-CB 3.5Å; L139-L143 PolarHBondContact O-N 3.15Å; L139-P186 HydrophobicContact CD1-CB 3.68Å; L139-V189 HydrophobicContact CB-CB 4.29Å; L139-V189 HydrophobicContact CB-CG1 3.78Å; L139-F274 HydrophobicContact CD1-CD2 4.44Å; L139-F274 HydrophobicContact CD1-CE2 3.9Å; L139-F274 HydrophobicContact CD2-CD2 4.36Å; L139-F274 HydrophobicContact CD2-CE2 3.76Å; L139-F274 HydrophobicContact CD2-CZ 4.16Å; L139-F274 HydrophobicContact CG-CE2 4.4Å; L139-L277 HydrophobicContact CB-CD2 4.18Å; L139-L277 HydrophobicContact CD2-CD2 4.04Å; L139-L277 HydrophobicContact CD2-CG 4.31Å |
| 140 | L | 98.3 | Very high | 90.2 | Very high | 2 Ų | 2 | 46.6 Ų | 46.6 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.4 | -42.7 | 173.4 | -78.4 | 170 | 0 | 0 | 0 | 111.5 | T136 E138 L143 G144 V163 F166 I184 V189 | T136-L140 HydrophobicContact CG2-CD1 4.36Å; T136-L140 WeakPolarHBondContact O-CB 3.37Å; T136-L140 VanDerWaalsContact O-CG 3.25Å; T136-L140 WeakPolarHBondContact O-CG 3.27Å; T136-L140 PolarHBondContact O-N 3.48Å; E138-L140 PolarHBondContact O-N 2.92Å; L140-L143 PolarHBondContact O-N 3.42Å; L140-G144 PolarHBondContact O-N 3.31Å; L140-V163 HydrophobicContact CB-CG1 4.15Å; L140-V163 HydrophobicContact CB-CG2 3.92Å; L140-V163 HydrophobicContact CD1-CG1 4.21Å; L140-V163 WeakPolarHBondContact O-CG2 3.35Å; L140-F166 HydrophobicContact CD2-CD1 3.52Å; L140-F166 HydrophobicContact CD2-CE1 3.96Å; L140-F166 HydrophobicContact CD2-CG 4.39Å; L140-I184 HydrophobicContact CD1-CG2 3.95Å; L140-I184 HydrophobicContact CD2-CG2 4.34Å; L140-I184 HydrophobicContact CG-CG2 4.45Å; L140-V189 HydrophobicContact CD2-CG1 4.46Å; L140-V189 HydrophobicContact CD2-CG2 3.88Å; L140-V189 HydrophobicContact CG-CG2 4.09Å |
| 141 | R | 97.1 | Very high | 92 | Very high | 96 Ų | 96 | 41.3 Ų | 41.3 | 36% | 0.362 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -65.5 | -42.5 | 175.7 | -171.4 | 171.9 | 65.5 | 85.4 | -5.4 | 111.8 | G137 E138 L139 L143 G144 D145 S159 R281 | G137-R141 PolarHBondContact O-N 3.43Å; G137-R141 VanDerWaalsContact O-N 3.12Å; E138-R141 PolarHBondContact O-N 3.27Å; L139-R141 VanDerWaalsContact C-N 3.31Å; L139-R141 PolarHBondContact O-N 3.41Å; R141-L143 VanDerWaalsContact C-N 3.29Å; R141-L143 PolarHBondContact O-N 3.17Å; R141-G144 PolarHBondContact O-N 2.97Å; R141-D145 IonicContact NH1-OD2 3.38Å; R141-D145 PolarHBondContact NH1-OD2 3.06Å; R141-D145 WeakPolarHBondContact O-CB 3.3Å; R141-D145 PolarHBondContact O-N 3.35Å; R141-S159 PolarHBondContact O-OG 2.9Å; R141-R281 VanDerWaalsContact NH2-CZ 3.28Å |
| 142 | C | 97.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61 | -39.1 | 175.8 | -63.7 | 0 | 0 | 0 | 0 | 112.1 | E138 L139 D145 F146 L277 Q280 | E138-C142 PolarHBondContact O-N 2.77Å; E138-C142 PolarHBondContact O-SG 2.85Å; L139-C142 PolarHBondContact O-N 3.25Å; C142-D145 PolarHBondContact O-N 2.87Å; C142-F146 WeakPolarHBondContact O-CB 3.27Å; C142-F146 PolarHBondContact O-N 2.94Å; C142-L277 HydrophobicContact CB-CD1 3.79Å; C142-L277 HydrophobicContact CB-CG 4.18Å; C142-L277 VanDerWaalsContact CB-O 3.27Å; C142-L277 WeakPolarHBondContact CB-O 3.17Å; C142-Q280 HydrophobicContact CB-CB 4.39Å |
| 143 | L | 98.5 | Very high | 95.4 | Very high | 1 Ų | 1 | 43.1 Ų | 43.1 | 1% | 0.005 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.7 | -44 | 174.7 | 174.1 | 63.8 | 0 | 0 | 0 | 111.3 | L139 L140 R141 F146 L147 F166 V189 V192 Y193 C196 F214 L277 | L139-L143 WeakPolarHBondContact O-CB 3.5Å; L139-L143 PolarHBondContact O-N 3.15Å; L140-L143 PolarHBondContact O-N 3.42Å; R141-L143 VanDerWaalsContact C-N 3.29Å; R141-L143 PolarHBondContact O-N 3.17Å; L143-F146 HydrophobicContact CD1-CD1 4.27Å; L143-F146 WeakPolarHBondContact O-CB 3.3Å; L143-F146 PolarHBondContact O-N 3.42Å; L143-L147 WeakPolarHBondContact O-CG 3.49Å; L143-L147 PolarHBondContact O-N 3.02Å; L143-F166 HydrophobicContact CD2-CD1 4.42Å; L143-V189 HydrophobicContact CB-CG1 4.48Å; L143-V189 HydrophobicContact CD2-CG1 4.3Å; L143-V192 HydrophobicContact CD2-CG1 3.91Å; L143-Y193 HydrophobicContact CD1-CD2 4.19Å; L143-C196 HydrophobicContact CD1-CB 4.45Å; L143-F214 HydrophobicContact CD2-CE2 4.16Å; L143-F214 HydrophobicContact CD2-CZ 4.3Å; L143-L277 HydrophobicContact CB-CD1 4.12Å |
| 144 | G | 97.8 | Very high | 96.2 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -63 | -43.7 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | L140 R141 F146 L147 C148 S159 | L140-G144 PolarHBondContact O-N 3.31Å; R141-G144 PolarHBondContact O-N 2.97Å; G144-F146 VanDerWaalsContact C-N 3.33Å; G144-F146 PolarHBondContact O-N 2.78Å; G144-L147 PolarHBondContact O-N 3.23Å; G144-C148 PolarHBondContact O-N 3.28Å; G144-C148 PolarHBondContact O-SG 3.07Å; G144-C148 VanDerWaalsContact O-SG 3.37Å; G144-S159 WeakPolarHBondContact CA-OG 3.25Å |
| 145 | D | 96.9 | Very high | 96.5 | Very high | 25 Ų | 25 | 43.8 Ų | 43.8 | 13% | 0.134 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.7 | -39.6 | 178.5 | -63.8 | -15.1 | 0 | 0 | 0 | 111.2 | R141 C142 C148 R149 S159 | R141-D145 IonicContact NH1-OD2 3.38Å; R141-D145 PolarHBondContact NH1-OD2 3.06Å; R141-D145 WeakPolarHBondContact O-CB 3.3Å; R141-D145 PolarHBondContact O-N 3.35Å; C142-D145 PolarHBondContact O-N 2.87Å; D145-C148 PolarHBondContact O-N 2.93Å; D145-R149 PolarHBondContact O-N 3.48Å; D145-S159 PolarHBondContact N-OG 3.25Å; D145-S159 WeakPolarHBondContact OD1-CB 3.25Å; D145-S159 PolarHBondContact OD1-OG 3.39Å |
| 146 | F | 97.8 | Very high | 96.4 | Very high | 5 Ų | 5 | 49.2 Ų | 49.2 | 2% | 0.022 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.3 | -50.4 | 171.2 | 162 | -105.9 | 0 | 0 | 0 | 112.1 | C142 L143 G144 R149 R150 Y193 C196 Q197 Q280 | C142-F146 WeakPolarHBondContact O-CB 3.27Å; C142-F146 PolarHBondContact O-N 2.94Å; L143-F146 HydrophobicContact CD1-CD1 4.27Å; L143-F146 WeakPolarHBondContact O-CB 3.3Å; L143-F146 PolarHBondContact O-N 3.42Å; G144-F146 VanDerWaalsContact C-N 3.33Å; G144-F146 PolarHBondContact O-N 2.78Å; F146-R149 PolarHBondContact O-N 3.26Å; F146-R150 HydrophobicContact CE2-CB 4.33Å; F146-R150 HydrophobicContact CZ-CB 4.35Å; F146-R150 HydrophobicContact CZ-CG 4.4Å; F146-R150 VanDerWaalsContact O-CB 3.25Å; F146-R150 WeakPolarHBondContact O-CB 3.2Å; F146-R150 PolarHBondContact O-N 2.85Å; F146-Y193 HydrophobicContact CB-CE2 4.37Å; F146-Y193 AromaticContact CD1-CD2 3.93Å; F146-Y193 HydrophobicContact CD1-CD2 3.93Å; F146-Y193 AromaticContact CD1-CE2 3.88Å; F146-Y193 HydrophobicContact CD1-CE2 3.88Å; F146-Y193 AromaticContact CD2-CE2 3.89Å; F146-Y193 HydrophobicContact CD2-CE2 3.89Å; F146-Y193 HydrophobicContact CE1-CD2 4.28Å; F146-Y193 HydrophobicContact CE1-CE2 4.17Å; F146-Y193 HydrophobicContact CE2-CE2 4.17Å; F146-Y193 HydrophobicContact CG-CD2 4.19Å; F146-Y193 AromaticContact CG-CE2 3.75Å; F146-Y193 HydrophobicContact CG-CE2 3.75Å; F146-Y193 HydrophobicContact CZ-CE2 4.34Å; F146-C196 HydrophobicContact CE1-CB 4.13Å; F146-Q197 HydrophobicContact CZ-CB 4.39Å; F146-Q280 HydrophobicContact CB-CB 4.1Å; F146-Q280 HydrophobicContact CB-CG 3.88Å |
| 147 | L | 97.6 | Very high | 96.2 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -66.6 | -39.1 | -179.2 | -68.3 | -175.2 | 0 | 0 | 0 | 112.3 | L143 G144 R150 C151 I162 C196 I200 F214 | L143-L147 WeakPolarHBondContact O-CG 3.49Å; L143-L147 PolarHBondContact O-N 3.02Å; G144-L147 PolarHBondContact O-N 3.23Å; L147-R150 PolarHBondContact O-N 2.87Å; L147-C151 VanDerWaalsContact O-CB 3.26Å; L147-C151 WeakPolarHBondContact O-CB 3.25Å; L147-C151 PolarHBondContact O-N 3.2Å; L147-C151 PolarHBondContact O-SG 3.32Å; L147-I162 HydrophobicContact CB-CG1 4.38Å; L147-I162 HydrophobicContact CD1-CD1 4.18Å; L147-I162 HydrophobicContact CD1-CG1 4.31Å; L147-I162 HydrophobicContact CD1-CG2 3.66Å; L147-C196 HydrophobicContact CD2-CB 4.26Å; L147-I200 HydrophobicContact CD1-CD1 4.26Å; L147-I200 HydrophobicContact CD2-CB 4.37Å; L147-I200 HydrophobicContact CD2-CD1 3.46Å; L147-I200 VanDerWaalsContact CD2-CD1 3.46Å; L147-I200 HydrophobicContact CD2-CG1 4.49Å; L147-I200 HydrophobicContact CD2-CG2 4.2Å; L147-F214 HydrophobicContact CD1-CD2 3.9Å; L147-F214 HydrophobicContact CD1-CE2 4.12Å; L147-F214 HydrophobicContact CD1-CG 4.45Å |
| 148 | C | 96.1 | Very high | 96.1 | Very high | 32 Ų | 32 | 50.4 Ų | 50.4 | 22% | 0.216 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.4 | -45.8 | 173.7 | -72.2 | 0 | 0 | 0 | 0 | 111.9 | G144 D145 C151 L157 N158 S159 | G144-C148 PolarHBondContact O-N 3.28Å; G144-C148 PolarHBondContact O-SG 3.07Å; G144-C148 VanDerWaalsContact O-SG 3.37Å; D145-C148 PolarHBondContact O-N 2.93Å; C148-C151 CarbonylContact O-C 3.6Å; C148-L157 PolarHBondContact SG-O 2.84Å; C148-L157 VanDerWaalsContact SG-O 3.34Å; C148-N158 VanDerWaalsContact SG-C 3.53Å; C148-S159 PolarHBondContact SG-N 3.39Å; C148-S159 VanDerWaalsContact SG-N 3.44Å |
| 149 | R | 95.3 | Very high | 96 | Very high | 84 Ų | 84 | 48.6 Ų | 48.6 | 32% | 0.317 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -68.4 | -43 | 177.8 | -76.1 | -170.1 | -70.2 | 107.2 | 6 | 112.5 | D145 F146 C151 Q280 | D145-R149 PolarHBondContact O-N 3.48Å; F146-R149 PolarHBondContact O-N 3.26Å; R149-C151 VanDerWaalsContact C-N 3.34Å; R149-C151 PolarHBondContact O-N 3Å; R149-Q280 PolarHBondContact NH2-O 3.37Å |
| 150 | R | 96.1 | Very high | 96 | Very high | 56 Ų | 56 | 50.7 Ų | 50.7 | 21% | 0.211 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.2 | -44.2 | 178.2 | -179.7 | 60.6 | 66.2 | 82.2 | -7.7 | 111.2 | F146 L147 Y152 Q197 I200 E202 | F146-R150 HydrophobicContact CE2-CB 4.33Å; F146-R150 HydrophobicContact CZ-CB 4.35Å; F146-R150 HydrophobicContact CZ-CG 4.4Å; F146-R150 VanDerWaalsContact O-CB 3.25Å; F146-R150 WeakPolarHBondContact O-CB 3.2Å; F146-R150 PolarHBondContact O-N 2.85Å; L147-R150 PolarHBondContact O-N 2.87Å; R150-Y152 VanDerWaalsContact C-N 3.3Å; R150-Y152 PolarHBondContact O-N 3.12Å; R150-Q197 PolarHBondContact NH1-O 2.91Å; R150-I200 HydrophobicContact CG-CG2 4.45Å; R150-I200 PolarHBondContact NH1-O 3.15Å; R150-E202 HydrophobicContact CG-CG 4.41Å; R150-E202 WeakPolarHBondContact O-CA 3.49Å |
| 151 | C | 96.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.9 | 53.6 | -178.6 | -59.6 | 0 | 0 | 0 | 0 | 111.6 | L147 C148 R149 K153 L154 L210 | L147-C151 VanDerWaalsContact O-CB 3.26Å; L147-C151 WeakPolarHBondContact O-CB 3.25Å; L147-C151 PolarHBondContact O-N 3.2Å; L147-C151 PolarHBondContact O-SG 3.32Å; C148-C151 CarbonylContact O-C 3.6Å; R149-C151 VanDerWaalsContact C-N 3.34Å; R149-C151 PolarHBondContact O-N 3Å; C151-K153 PolarHBondContact O-N 3.22Å; C151-L154 HydrophobicContact CB-CD1 3.92Å; C151-L154 HydrophobicContact CB-CG 4.23Å; C151-L154 PolarHBondContact O-N 3.26Å; C151-L210 HydrophobicContact CB-CD2 4.43Å |
| 152 | Y | 94.7 | Very high | 95.9 | Very high | 123 Ų | 123 | 49.7 Ų | 49.7 | 48% | 0.482 | 24% | 0.239 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -56.4 | -16.3 | -172.6 | 69.9 | -87.7 | 0 | 0 | 0 | 115.7 | R150 K155 E202 | R150-Y152 VanDerWaalsContact C-N 3.3Å; R150-Y152 PolarHBondContact O-N 3.12Å; Y152-K155 WeakPolarHBondContact O-CE 3.41Å; Y152-K155 PolarHBondContact O-NZ 2.94Å; Y152-E202 HydrophobicContact CE1-CB 4.12Å; Y152-E202 WeakPolarHBondContact CE1-O 3.32Å |
| 153 | K | 96.3 | Very high | 95.9 | Very high | 94 Ų | 94 | 50.6 Ų | 50.6 | 41% | 0.409 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75 | -23.1 | 174.9 | -62.4 | -178 | -174.9 | 175.5 | 0 | 112.9 | C151 K155 S203 | C151-K153 PolarHBondContact O-N 3.22Å; K153-K155 PolarHBondContact O-N 3.13Å; K153-S203 PolarHBondContact NZ-O 3.28Å |
| 154 | L | 95.6 | Very high | 95.9 | Very high | 24 Ų | 24 | 56 Ų | 56 | 13% | 0.126 | 27% | 0.273 | C | S | . | . | trans | -89 | 80.1 | -178.3 | -57.9 | -178.5 | 0 | 0 | 0 | 110.7 | C151 E156 L157 V204 S205 L210 | C151-L154 HydrophobicContact CB-CD1 3.92Å; C151-L154 HydrophobicContact CB-CG 4.23Å; C151-L154 PolarHBondContact O-N 3.26Å; L154-E156 VanDerWaalsContact C-N 3.26Å; L154-E156 PolarHBondContact O-N 3.41Å; L154-L157 HydrophobicContact CB-CB 3.81Å; L154-L157 HydrophobicContact CB-CD2 4.34Å; L154-L157 HydrophobicContact CD1-CD2 4.04Å; L154-L157 WeakPolarHBondContact O-CB 3.26Å; L154-L157 PolarHBondContact O-N 3.35Å; L154-V204 HydrophobicContact CD1-CG1 4.42Å; L154-S205 WeakPolarHBondContact CD2-O 3.41Å; L154-L210 HydrophobicContact CD1-CB 4.11Å; L154-L210 HydrophobicContact CD1-CD2 3.77Å | ||
| 155 | K | 91.9 | Very high | 95.9 | Very high | 178 Ų | 178 | 58 Ų | 58 | 77% | 0.774 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | -26 | -173.8 | -60.3 | -53.7 | -173 | -168.4 | 0 | 114.8 | Y152 K153 | Y152-K155 WeakPolarHBondContact O-CE 3.41Å; Y152-K155 PolarHBondContact O-NZ 2.94Å; K153-K155 PolarHBondContact O-N 3.13Å |
| 156 | E | 91.8 | Very high | 96 | Very high | 185 Ų | 185 | 56.9 Ų | 56.9 | 86% | 0.864 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.4 | -7.2 | -178.7 | -62.3 | -178.8 | 176.2 | 0 | 0 | 113.2 | L154 N158 | L154-E156 VanDerWaalsContact C-N 3.26Å; L154-E156 PolarHBondContact O-N 3.41Å; E156-N158 PolarHBondContact O-N 3.41Å |
| 157 | L | 93.6 | Very high | 96.1 | Very high | 22 Ų | 22 | 63 Ų | 63 | 12% | 0.115 | 30% | 0.297 | C | S | . | . | trans | -72.6 | 125.4 | -177.4 | -177 | 72.7 | 0 | 0 | 0 | 111 | C148 L154 I162 W165 L210 | C148-L157 PolarHBondContact SG-O 2.84Å; C148-L157 VanDerWaalsContact SG-O 3.34Å; L154-L157 HydrophobicContact CB-CB 3.81Å; L154-L157 HydrophobicContact CB-CD2 4.34Å; L154-L157 HydrophobicContact CD1-CD2 4.04Å; L154-L157 WeakPolarHBondContact O-CB 3.26Å; L154-L157 PolarHBondContact O-N 3.35Å; L157-I162 HydrophobicContact CD1-CD1 3.88Å; L157-I162 HydrophobicContact CD1-CG1 4.49Å; L157-I162 HydrophobicContact CD2-CD1 4.29Å; L157-I162 HydrophobicContact CG-CD1 4.44Å; L157-W165 HydrophobicContact CD1-CH2 4.07Å; L157-L210 HydrophobicContact CD1-CD2 4.22Å; L157-L210 HydrophobicContact CD2-CD2 3.33Å; L157-L210 HydrophobicContact CG-CD2 4.42Å | ||
| 158 | N | 93.8 | Very high | 96.1 | Very high | 77 Ų | 77 | 66.8 Ų | 66.8 | 41% | 0.412 | 32% | 0.318 | S | S | . | . | trans | -114.7 | 152.3 | 173.4 | 70.9 | 81.6 | 0 | 0 | 0 | 112.6 | C148 E156 G160 E161 | C148-N158 VanDerWaalsContact SG-C 3.53Å; E156-N158 PolarHBondContact O-N 3.41Å; N158-G160 PolarHBondContact O-N 3.16Å; N158-G160 VanDerWaalsContact OD1-CA 3.3Å; N158-G160 WeakPolarHBondContact OD1-CA 3.37Å; N158-G160 PolarHBondContact OD1-N 2.98Å; N158-G160 VanDerWaalsContact OD1-N 3.08Å; N158-E161 PolarHBondContact N-OE2 3.12Å; N158-E161 VanDerWaalsContact N-OE2 3.14Å; N158-E161 VanDerWaalsContact ND2-CG 3.33Å; N158-E161 WeakPolarHBondContact ND2-CG 3.44Å; N158-E161 PolarHBondContact ND2-OE2 3.38Å; N158-E161 WeakPolarHBondContact O-CB 3.48Å; N158-E161 PolarHBondContact O-N 3.34Å; N158-E161 VanDerWaalsContact O-N 3.08Å; N158-E161 PolarHBondContact OD1-N 3.02Å | ||
| 159 | S | 95.3 | Very high | 96.2 | Very high | 16 Ų | 16 | 65.4 Ų | 65.4 | 11% | 0.112 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -57.4 | -33.1 | -179.9 | 177.2 | 0 | 0 | 0 | 0 | 112.5 | R141 G144 D145 C148 E161 I162 V163 | R141-S159 PolarHBondContact O-OG 2.9Å; G144-S159 WeakPolarHBondContact CA-OG 3.25Å; D145-S159 PolarHBondContact N-OG 3.25Å; D145-S159 WeakPolarHBondContact OD1-CB 3.25Å; D145-S159 PolarHBondContact OD1-OG 3.39Å; C148-S159 PolarHBondContact SG-N 3.39Å; C148-S159 VanDerWaalsContact SG-N 3.44Å; S159-E161 VanDerWaalsContact C-N 3.34Å; S159-E161 PolarHBondContact O-N 3.34Å; S159-I162 PolarHBondContact O-N 3.05Å; S159-V163 WeakPolarHBondContact O-CG2 3.31Å; S159-V163 PolarHBondContact O-N 3.3Å; S159-V163 VanDerWaalsContact O-N 3.12Å |
| 160 | G | 96.9 | Very high | 96.4 | Very high | 45 Ų | 45 | 62.2 Ų | 62.2 | 46% | 0.464 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.2 | -37.9 | 176 | 0 | 0 | 0 | 0 | 0 | 113.9 | N158 V163 L164 | N158-G160 PolarHBondContact O-N 3.16Å; N158-G160 VanDerWaalsContact OD1-CA 3.3Å; N158-G160 WeakPolarHBondContact OD1-CA 3.37Å; N158-G160 PolarHBondContact OD1-N 2.98Å; N158-G160 VanDerWaalsContact OD1-N 3.08Å; G160-V163 PolarHBondContact O-N 2.84Å; G160-L164 WeakPolarHBondContact O-CB 3.26Å; G160-L164 PolarHBondContact O-N 2.93Å |
| 161 | E | 96.4 | Very high | 96.5 | Very high | 75 Ų | 75 | 67.5 Ų | 67.5 | 35% | 0.35 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.2 | -44.1 | 177 | -73 | 174.5 | 128.6 | 0 | 0 | 112.1 | N158 S159 V163 L164 W165 | N158-E161 PolarHBondContact N-OE2 3.12Å; N158-E161 VanDerWaalsContact N-OE2 3.14Å; N158-E161 VanDerWaalsContact ND2-CG 3.33Å; N158-E161 WeakPolarHBondContact ND2-CG 3.44Å; N158-E161 PolarHBondContact ND2-OE2 3.38Å; N158-E161 WeakPolarHBondContact O-CB 3.48Å; N158-E161 PolarHBondContact O-N 3.34Å; N158-E161 VanDerWaalsContact O-N 3.08Å; N158-E161 PolarHBondContact OD1-N 3.02Å; S159-E161 VanDerWaalsContact C-N 3.34Å; S159-E161 PolarHBondContact O-N 3.34Å; E161-V163 VanDerWaalsContact C-N 3.33Å; E161-V163 PolarHBondContact O-N 3.01Å; E161-L164 WeakPolarHBondContact O-CB 3.36Å; E161-L164 PolarHBondContact O-N 3.43Å; E161-W165 VanDerWaalsContact O-CG 3.3Å; E161-W165 PolarHBondContact O-N 3.42Å |
| 162 | I | 97.6 | Very high | 96.6 | Very high | 1 Ų | 1 | 69.9 Ų | 69.9 | 1% | 0.005 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59.1 | -47.6 | 176 | -58.1 | -53.6 | 0 | 0 | 0 | 110.5 | L147 L157 S159 L164 W165 F166 L210 F214 | L147-I162 HydrophobicContact CB-CG1 4.38Å; L147-I162 HydrophobicContact CD1-CD1 4.18Å; L147-I162 HydrophobicContact CD1-CG1 4.31Å; L147-I162 HydrophobicContact CD1-CG2 3.66Å; L157-I162 HydrophobicContact CD1-CD1 3.88Å; L157-I162 HydrophobicContact CD1-CG1 4.49Å; L157-I162 HydrophobicContact CD2-CD1 4.29Å; L157-I162 HydrophobicContact CG-CD1 4.44Å; S159-I162 PolarHBondContact O-N 3.05Å; I162-L164 VanDerWaalsContact C-N 3.26Å; I162-L164 PolarHBondContact O-N 3.29Å; I162-W165 HydrophobicContact CD1-CE3 3.61Å; I162-W165 HydrophobicContact CD1-CH2 3.97Å; I162-W165 HydrophobicContact CD1-CZ3 3.26Å; I162-W165 PolarHBondContact O-N 3.05Å; I162-F166 PolarHBondContact O-N 3.39Å; I162-F166 VanDerWaalsContact O-N 3.16Å; I162-L210 HydrophobicContact CD1-CD2 4.05Å; I162-F214 HydrophobicContact CG2-CE1 4.19Å; I162-F214 HydrophobicContact CG2-CZ 4.06Å |
| 163 | V | 98.4 | Very high | 96.8 | Very high | 20 Ų | 20 | 64 Ų | 64 | 12% | 0.121 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.6 | -39.3 | 178.8 | 176.1 | 0 | 0 | 0 | 0 | 110.7 | L140 S159 G160 E161 F166 R167 | L140-V163 HydrophobicContact CB-CG1 4.15Å; L140-V163 HydrophobicContact CB-CG2 3.92Å; L140-V163 HydrophobicContact CD1-CG1 4.21Å; L140-V163 WeakPolarHBondContact O-CG2 3.35Å; S159-V163 WeakPolarHBondContact O-CG2 3.31Å; S159-V163 PolarHBondContact O-N 3.3Å; S159-V163 VanDerWaalsContact O-N 3.12Å; G160-V163 PolarHBondContact O-N 2.84Å; E161-V163 VanDerWaalsContact C-N 3.33Å; E161-V163 PolarHBondContact O-N 3.01Å; V163-F166 PolarHBondContact O-N 2.97Å; V163-R167 HydrophobicContact CG1-CG 4.36Å; V163-R167 WeakPolarHBondContact O-CB 3.33Å; V163-R167 WeakPolarHBondContact O-CG 3.39Å; V163-R167 PolarHBondContact O-N 2.85Å |
| 164 | L | 98.3 | Very high | 96.9 | Very high | 115 Ų | 115 | 62.7 Ų | 62.7 | 60% | 0.602 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -64.8 | -42.3 | 177.1 | -174.7 | 63.1 | 0 | 0 | 0 | 111.8 | G160 E161 I162 F166 R167 N168 | G160-L164 WeakPolarHBondContact O-CB 3.26Å; G160-L164 PolarHBondContact O-N 2.93Å; E161-L164 WeakPolarHBondContact O-CB 3.36Å; E161-L164 PolarHBondContact O-N 3.43Å; I162-L164 VanDerWaalsContact C-N 3.26Å; I162-L164 PolarHBondContact O-N 3.29Å; L164-F166 VanDerWaalsContact C-N 3.35Å; L164-F166 PolarHBondContact O-N 2.94Å; L164-R167 PolarHBondContact O-N 3.01Å; L164-N168 WeakPolarHBondContact O-CB 3.37Å; L164-N168 PolarHBondContact O-N 3.43Å |
| 165 | W | 98 | Very high | 97 | Very high | 41 Ų | 41 | 66.6 Ų | 66.6 | 16% | 0.155 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -57.8 | -47.3 | 175.9 | -63.3 | -18.1 | 0 | 0 | 0 | 111.8 | L157 E161 I162 N168 I169 L210 Q211 F214 | L157-W165 HydrophobicContact CD1-CH2 4.07Å; E161-W165 VanDerWaalsContact O-CG 3.3Å; E161-W165 PolarHBondContact O-N 3.42Å; I162-W165 HydrophobicContact CD1-CE3 3.61Å; I162-W165 HydrophobicContact CD1-CH2 3.97Å; I162-W165 HydrophobicContact CD1-CZ3 3.26Å; I162-W165 PolarHBondContact O-N 3.05Å; W165-N168 PolarHBondContact O-N 2.86Å; W165-I169 PolarHBondContact O-N 3.17Å; W165-L210 HydrophobicContact CZ3-CD2 4.38Å; W165-L210 HydrophobicContact CZ3-CG 4.28Å; W165-Q211 HydrophobicContact CD2-CB 4.44Å; W165-Q211 HydrophobicContact CD2-CG 3.96Å; W165-Q211 HydrophobicContact CE3-CB 4.08Å; W165-Q211 HydrophobicContact CE3-CG 3.96Å; W165-Q211 HydrophobicContact CG-CG 4.49Å; W165-Q211 HydrophobicContact CH2-CB 3.87Å; W165-Q211 HydrophobicContact CH2-CG 4.4Å; W165-Q211 HydrophobicContact CZ2-CB 4.24Å; W165-Q211 HydrophobicContact CZ2-CG 4.4Å; W165-Q211 HydrophobicContact CZ3-CB 3.77Å; W165-Q211 HydrophobicContact CZ3-CG 4.18Å; W165-F214 HydrophobicContact CB-CE1 4.39Å; W165-F214 HydrophobicContact CE3-CD1 4.21Å |
| 166 | F | 98.5 | Very high | 97.3 | Very high | 1 Ų | 1 | 64 Ų | 64 | 0% | 0.004 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -64.3 | -50.3 | 179.3 | -165.5 | 175.8 | 0 | 0 | 0 | 111.3 | L140 L143 I162 V163 L164 N168 I169 D170 F183 I184 V189 V192 F214 L218 Y222 | L140-F166 HydrophobicContact CD2-CD1 3.52Å; L140-F166 HydrophobicContact CD2-CE1 3.96Å; L140-F166 HydrophobicContact CD2-CG 4.39Å; L143-F166 HydrophobicContact CD2-CD1 4.42Å; I162-F166 PolarHBondContact O-N 3.39Å; I162-F166 VanDerWaalsContact O-N 3.16Å; V163-F166 PolarHBondContact O-N 2.97Å; L164-F166 VanDerWaalsContact C-N 3.35Å; L164-F166 PolarHBondContact O-N 2.94Å; F166-N168 VanDerWaalsContact C-N 3.27Å; F166-N168 PolarHBondContact O-N 3.45Å; F166-I169 PolarHBondContact O-N 3.33Å; F166-D170 PolarHBondContact O-N 3.19Å; F166-F183 AromaticContact CE2-CD1 3.92Å; F166-F183 HydrophobicContact CE2-CD1 3.92Å; F166-F183 HydrophobicContact CE2-CE1 4.21Å; F166-F183 AromaticContact CZ-CD1 3.99Å; F166-F183 HydrophobicContact CZ-CD1 3.99Å; F166-F183 AromaticContact CZ-CE1 3.97Å; F166-F183 HydrophobicContact CZ-CE1 3.97Å; F166-I184 HydrophobicContact CD2-CD1 3.87Å; F166-I184 HydrophobicContact CD2-CG1 3.98Å; F166-I184 HydrophobicContact CE1-CG1 4.48Å; F166-I184 HydrophobicContact CE2-CD1 4.08Å; F166-I184 HydrophobicContact CE2-CG1 3.64Å; F166-I184 HydrophobicContact CG-CD1 4.17Å; F166-I184 HydrophobicContact CZ-CG1 3.92Å; F166-V189 HydrophobicContact CE1-CG2 4.19Å; F166-V192 HydrophobicContact CE1-CB 4.4Å; F166-V192 HydrophobicContact CE1-CG1 4.33Å; F166-V192 HydrophobicContact CE1-CG2 4.11Å; F166-V192 HydrophobicContact CZ-CG2 3.89Å; F166-F214 HydrophobicContact CB-CE1 4.11Å; F166-F214 HydrophobicContact CB-CZ 4.12Å; F166-F214 HydrophobicContact CD1-CZ 4.27Å; F166-F214 HydrophobicContact CG-CZ 4.35Å; F166-L218 HydrophobicContact CB-CD1 4.37Å; F166-L218 HydrophobicContact CD1-CD2 4.13Å; F166-L218 HydrophobicContact CD2-CD1 3.87Å; F166-L218 HydrophobicContact CD2-CD2 3.58Å; F166-L218 HydrophobicContact CD2-CG 4.39Å; F166-L218 HydrophobicContact CE1-CD2 4Å; F166-L218 HydrophobicContact CE2-CD1 4.49Å; F166-L218 HydrophobicContact CE2-CD2 3.46Å; F166-L218 VanDerWaalsContact CE2-CD2 3.46Å; F166-L218 HydrophobicContact CG-CD1 4.2Å; F166-L218 HydrophobicContact CG-CD2 3.95Å; F166-L218 HydrophobicContact CZ-CD2 3.69Å; F166-Y222 AromaticContact CE2-CE2 4Å; F166-Y222 HydrophobicContact CE2-CE2 4Å |
| 167 | R | 98.6 | Very high | 97.6 | Very high | 133 Ų | 133 | 58 Ų | 58 | 50% | 0.502 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61.9 | -34.4 | 179 | -74.2 | -175.7 | 175.3 | -174.9 | 0.3 | 113 | V163 L164 D170 R171 I184 | V163-R167 HydrophobicContact CG1-CG 4.36Å; V163-R167 WeakPolarHBondContact O-CB 3.33Å; V163-R167 WeakPolarHBondContact O-CG 3.39Å; V163-R167 PolarHBondContact O-N 2.85Å; L164-R167 PolarHBondContact O-N 3.01Å; R167-D170 PolarHBondContact O-N 3.06Å; R167-R171 VanDerWaalsContact O-CB 3.24Å; R167-R171 WeakPolarHBondContact O-CB 3.47Å; R167-R171 PolarHBondContact O-N 3.37Å; R167-I184 HydrophobicContact CB-CD1 4.44Å; R167-I184 HydrophobicContact CG-CD1 3.93Å |
| 168 | N | 98.5 | Very high | 97.8 | Very high | 81 Ų | 81 | 62.1 Ų | 62.1 | 43% | 0.433 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -67.1 | -40.9 | 179.6 | -171.4 | 56.4 | 0 | 0 | 0 | 111.5 | L164 W165 F166 R171 I172 | L164-N168 WeakPolarHBondContact O-CB 3.37Å; L164-N168 PolarHBondContact O-N 3.43Å; W165-N168 PolarHBondContact O-N 2.86Å; F166-N168 VanDerWaalsContact C-N 3.27Å; F166-N168 PolarHBondContact O-N 3.45Å; N168-R171 PolarHBondContact O-N 3.42Å; N168-I172 WeakPolarHBondContact O-CB 3.45Å; N168-I172 WeakPolarHBondContact O-CD1 3.44Å; N168-I172 WeakPolarHBondContact O-CG1 3.41Å; N168-I172 PolarHBondContact O-N 3.45Å |
| 169 | I | 98.4 | Very high | 98 | Very high | 3 Ų | 3 | 58.7 Ų | 58.7 | 2% | 0.015 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.3 | -49.4 | 175 | -71 | 171.1 | 0 | 0 | 0 | 110.7 | W165 F166 R171 I172 L173 Q215 L218 Y222 P235 F236 | W165-I169 PolarHBondContact O-N 3.17Å; F166-I169 PolarHBondContact O-N 3.33Å; I169-R171 VanDerWaalsContact C-N 3.31Å; I169-R171 PolarHBondContact O-N 3.02Å; I169-I172 PolarHBondContact O-N 3.5Å; I169-I172 VanDerWaalsContact O-N 3.12Å; I169-L173 HydrophobicContact CG2-CD1 4.11Å; I169-L173 WeakPolarHBondContact O-CG 3.39Å; I169-L173 PolarHBondContact O-N 2.92Å; I169-Q215 HydrophobicContact CD1-CG 3.9Å; I169-L218 HydrophobicContact CD1-CD1 3.72Å; I169-Y222 HydrophobicContact CG2-CE2 4.37Å; I169-P235 HydrophobicContact CG2-CB 4.34Å; I169-F236 HydrophobicContact CD1-CD1 4.27Å; I169-F236 HydrophobicContact CG2-CD1 4.05Å; I169-F236 HydrophobicContact CG2-CE1 3.51Å; I169-F236 HydrophobicContact CG2-CE2 4.43Å; I169-F236 HydrophobicContact CG2-CZ 3.74Å |
| 170 | D | 98.6 | Very high | 98.1 | Very high | 16 Ų | 16 | 65 Ų | 65 | 9% | 0.086 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.1 | -42.5 | -179.6 | -165.3 | 44.8 | 0 | 0 | 0 | 111.7 | F166 R167 L173 L174 Q179 F183 I184 Y222 | F166-D170 PolarHBondContact O-N 3.19Å; R167-D170 PolarHBondContact O-N 3.06Å; D170-L173 PolarHBondContact O-N 3.27Å; D170-L174 WeakPolarHBondContact O-CG 3.37Å; D170-L174 PolarHBondContact O-N 3.34Å; D170-Q179 PolarHBondContact O-NE2 3.24Å; D170-Q179 VanDerWaalsContact O-NE2 3.11Å; D170-Q179 PolarHBondContact OD1-NE2 3.19Å; D170-F183 WeakPolarHBondContact OD1-CB 3.42Å; D170-F183 PolarHBondContact OD1-N 3.38Å; D170-I184 HydrophobicContact CB-CD1 3.56Å; D170-I184 HydrophobicContact CB-CG1 3.87Å; D170-Y222 VanDerWaalsContact CA-OH 3.27Å; D170-Y222 WeakPolarHBondContact CA-OH 3.45Å; D170-Y222 VanDerWaalsContact CB-OH 3.24Å; D170-Y222 WeakPolarHBondContact CB-OH 3.48Å; D170-Y222 PolarHBondContact OD1-OH 3.29Å; D170-Y222 VanDerWaalsContact OD1-OH 3.08Å |
| 171 | R | 98.6 | Very high | 98.1 | Very high | 167 Ų | 167 | 68.9 Ų | 68.9 | 63% | 0.63 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -62.6 | -43.7 | 174.2 | 179.5 | -173.4 | 164.8 | 87.5 | 3 | 112.2 | R167 N168 I169 L173 L174 V175 | R167-R171 VanDerWaalsContact O-CB 3.24Å; R167-R171 WeakPolarHBondContact O-CB 3.47Å; R167-R171 PolarHBondContact O-N 3.37Å; N168-R171 PolarHBondContact O-N 3.42Å; I169-R171 VanDerWaalsContact C-N 3.31Å; I169-R171 PolarHBondContact O-N 3.02Å; R171-L173 VanDerWaalsContact C-N 3.32Å; R171-L173 PolarHBondContact O-N 3Å; R171-L174 PolarHBondContact O-N 3.14Å; R171-V175 HydrophobicContact CG-CG2 4.14Å; R171-V175 WeakPolarHBondContact O-CB 3.35Å; R171-V175 VanDerWaalsContact O-CG2 3.29Å; R171-V175 WeakPolarHBondContact O-CG2 3.48Å; R171-V175 PolarHBondContact O-N 3.44Å |
| 172 | I | 98.5 | Very high | 98.1 | Very high | 50 Ų | 50 | 66.4 Ų | 66.4 | 26% | 0.256 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.1 | -44.6 | 179.8 | -75.9 | 164.7 | 0 | 0 | 0 | 110.2 | N168 I169 V175 Q176 P235 | N168-I172 WeakPolarHBondContact O-CB 3.45Å; N168-I172 WeakPolarHBondContact O-CD1 3.44Å; N168-I172 WeakPolarHBondContact O-CG1 3.41Å; N168-I172 PolarHBondContact O-N 3.45Å; I169-I172 PolarHBondContact O-N 3.5Å; I169-I172 VanDerWaalsContact O-N 3.12Å; I172-V175 PolarHBondContact O-N 2.91Å; I172-Q176 HydrophobicContact CG2-CG 4.48Å; I172-Q176 VanDerWaalsContact O-CB 3.29Å; I172-Q176 WeakPolarHBondContact O-CB 3.26Å; I172-Q176 VanDerWaalsContact O-CG 3.32Å; I172-Q176 WeakPolarHBondContact O-CG 3.19Å; I172-Q176 PolarHBondContact O-N 3.24Å; I172-P235 HydrophobicContact CG2-CB 4.29Å; I172-P235 HydrophobicContact CG2-CG 3.99Å |
| 173 | L | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.4 | -44 | 178.7 | -67.9 | 170.5 | 0 | 0 | 0 | 111.7 | I169 D170 R171 G177 W178 Q179 Y222 Y231 P232 P235 F236 | I169-L173 HydrophobicContact CG2-CD1 4.11Å; I169-L173 WeakPolarHBondContact O-CG 3.39Å; I169-L173 PolarHBondContact O-N 2.92Å; D170-L173 PolarHBondContact O-N 3.27Å; R171-L173 VanDerWaalsContact C-N 3.32Å; R171-L173 PolarHBondContact O-N 3Å; L173-G177 PolarHBondContact O-N 2.91Å; L173-W178 HydrophobicContact CB-CB 4.24Å; L173-W178 HydrophobicContact CD2-CB 3.79Å; L173-W178 HydrophobicContact CD2-CG 4.07Å; L173-W178 PolarHBondContact O-N 3.21Å; L173-Q179 HydrophobicContact CB-CG 3.96Å; L173-Y222 HydrophobicContact CD1-CD1 3.73Å; L173-Y222 HydrophobicContact CD1-CE1 3.29Å; L173-Y231 HydrophobicContact CD1-CD1 4Å; L173-Y231 HydrophobicContact CD1-CE1 4.42Å; L173-Y231 HydrophobicContact CD2-CD1 4.29Å; L173-P232 HydrophobicContact CD2-CG 3.64Å; L173-P235 HydrophobicContact CD2-CG 4.08Å; L173-F236 HydrophobicContact CD1-CE2 4.25Å; L173-F236 HydrophobicContact CD1-CZ 3.85Å |
| 174 | L | 98.4 | Very high | 98.2 | Very high | 66 Ų | 66 | 67.2 Ų | 67.2 | 35% | 0.346 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -60.6 | -51.9 | 175 | -80.4 | 164.3 | 0 | 0 | 0 | 112.3 | D170 R171 Q176 G177 Q179 | D170-L174 WeakPolarHBondContact O-CG 3.37Å; D170-L174 PolarHBondContact O-N 3.34Å; R171-L174 PolarHBondContact O-N 3.14Å; L174-Q176 VanDerWaalsContact C-N 3.28Å; L174-Q176 PolarHBondContact O-N 3.39Å; L174-G177 PolarHBondContact O-N 3.12Å; L174-G177 VanDerWaalsContact O-N 3.11Å; L174-Q179 HydrophobicContact CD2-CG 3.99Å; L174-Q179 HydrophobicContact CG-CG 3.99Å |
| 175 | V | 98.3 | Very high | 98.2 | Very high | 107 Ų | 107 | 64.2 Ų | 64.2 | 65% | 0.648 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -67.5 | -30.6 | -174.4 | 170.4 | 0 | 0 | 0 | 0 | 112.1 | R171 I172 G177 | R171-V175 HydrophobicContact CG-CG2 4.14Å; R171-V175 WeakPolarHBondContact O-CB 3.35Å; R171-V175 VanDerWaalsContact O-CG2 3.29Å; R171-V175 WeakPolarHBondContact O-CG2 3.48Å; R171-V175 PolarHBondContact O-N 3.44Å; I172-V175 PolarHBondContact O-N 2.91Å; V175-G177 VanDerWaalsContact C-N 3.3Å |
| 176 | Q | 97.8 | Very high | 98.2 | Very high | 122 Ų | 122 | 64.7 Ų | 64.7 | 57% | 0.57 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.8 | 177.1 | -69.5 | -177.1 | -1.2 | 0 | 0 | 113.4 | I172 L174 | I172-Q176 HydrophobicContact CG2-CG 4.48Å; I172-Q176 VanDerWaalsContact O-CB 3.29Å; I172-Q176 WeakPolarHBondContact O-CB 3.26Å; I172-Q176 VanDerWaalsContact O-CG 3.32Å; I172-Q176 WeakPolarHBondContact O-CG 3.19Å; I172-Q176 PolarHBondContact O-N 3.24Å; L174-Q176 VanDerWaalsContact C-N 3.28Å; L174-Q176 PolarHBondContact O-N 3.39Å |
| 177 | G | 97.9 | Very high | 98.1 | Very high | 59 Ų | 59 | 66.5 Ų | 66.5 | 61% | 0.608 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.1 | 26.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | L173 L174 V175 Q179 | L173-G177 PolarHBondContact O-N 2.91Å; L174-G177 PolarHBondContact O-N 3.12Å; L174-G177 VanDerWaalsContact O-N 3.11Å; V175-G177 VanDerWaalsContact C-N 3.3Å; G177-Q179 VanDerWaalsContact C-N 3.34Å |
| 178 | W | 98.4 | Very high | 98.1 | Very high | 109 Ų | 109 | 61 Ų | 61 | 41% | 0.413 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -81.8 | -16.1 | 172.2 | -71.7 | 105.9 | 0 | 0 | 0 | 113 | L173 E228 P232 | L173-W178 HydrophobicContact CB-CB 4.24Å; L173-W178 HydrophobicContact CD2-CB 3.79Å; L173-W178 HydrophobicContact CD2-CG 4.07Å; L173-W178 PolarHBondContact O-N 3.21Å; W178-E228 WeakPolarHBondContact O-CG 3.33Å; W178-P232 HydrophobicContact CD2-CB 4.21Å; W178-P232 HydrophobicContact CD2-CG 3.6Å; W178-P232 HydrophobicContact CE3-CB 4.49Å; W178-P232 HydrophobicContact CE3-CG 4.13Å; W178-P232 HydrophobicContact CG-CG 3.79Å; W178-P232 HydrophobicContact CH2-CB 4.08Å; W178-P232 HydrophobicContact CZ2-CB 3.77Å; W178-P232 HydrophobicContact CZ2-CG 4.03Å; W178-P232 HydrophobicContact CZ3-CB 4.42Å |
| 179 | Q | 97.8 | Very high | 98.1 | Very high | 6 Ų | 6 | 57.2 Ų | 57.2 | 3% | 0.028 | 31% | 0.312 | C | S | . | . | trans | -152.3 | 149.2 | 175.5 | 64.1 | -173.5 | -1.2 | 0 | 0 | 109.7 | D170 L173 L174 G177 E228 Y231 | D170-Q179 PolarHBondContact O-NE2 3.24Å; D170-Q179 VanDerWaalsContact O-NE2 3.11Å; D170-Q179 PolarHBondContact OD1-NE2 3.19Å; L173-Q179 HydrophobicContact CB-CG 3.96Å; L174-Q179 HydrophobicContact CD2-CG 3.99Å; L174-Q179 HydrophobicContact CG-CG 3.99Å; G177-Q179 VanDerWaalsContact C-N 3.34Å; Q179-E228 HydrophobicContact CB-CG 3.9Å; Q179-Y231 HydrophobicContact CB-CE1 4.38Å | ||
| 180 | D | 97.6 | Very high | 98.1 | Very high | 149 Ų | 149 | 57 Ų | 57 | 80% | 0.797 | 31% | 0.311 | S | S | * | . | S | Bend | trans | -89.8 | -27.7 | 178.5 | -69.6 | -40.4 | 0 | 0 | 0 | 112.9 | ||
| 181 | I | 96.8 | Very high | 98.1 | Very high | 125 Ų | 125 | 56.3 Ų | 56.3 | 64% | 0.641 | 31% | 0.307 | S | S | * | . | S | Bend | trans | -125 | 141 | -178.3 | -57.2 | 174.3 | 0 | 0 | 0 | 108.4 | ||
| 182 | G | 97.4 | Very high | 98.2 | Very high | 24 Ų | 24 | 48.3 Ų | 48.3 | 25% | 0.247 | 28% | 0.277 | C | S | . | . | trans | -63.6 | 138.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I184 | G182-I184 VanDerWaalsContact C-N 3.27Å; G182-I184 PolarHBondContact O-N 2.75Å | ||
| 183 | F | 98.6 | Very high | 98.2 | Very high | 8 Ų | 8 | 46 Ų | 46 | 4% | 0.035 | 27% | 0.265 | C | S | . | . | S | Bend | trans | -70.3 | -26.9 | 178 | 175.4 | -97.7 | 0 | 0 | 0 | 112.2 | F166 D170 T185 N188 V192 A221 Y222 M225 | F166-F183 AromaticContact CE2-CD1 3.92Å; F166-F183 HydrophobicContact CE2-CD1 3.92Å; F166-F183 HydrophobicContact CE2-CE1 4.21Å; F166-F183 AromaticContact CZ-CD1 3.99Å; F166-F183 HydrophobicContact CZ-CD1 3.99Å; F166-F183 AromaticContact CZ-CE1 3.97Å; F166-F183 HydrophobicContact CZ-CE1 3.97Å; D170-F183 WeakPolarHBondContact OD1-CB 3.42Å; D170-F183 PolarHBondContact OD1-N 3.38Å; F183-T185 PolarHBondContact O-N 3.4Å; F183-N188 HydrophobicContact CD1-CB 4.24Å; F183-N188 HydrophobicContact CE1-CB 3.75Å; F183-N188 HydrophobicContact CE2-CB 4.28Å; F183-N188 HydrophobicContact CZ-CB 3.76Å; F183-N188 WeakPolarHBondContact O-CB 3.43Å; F183-N188 PolarHBondContact O-ND2 3.15Å; F183-V192 HydrophobicContact CE1-CG2 4.29Å; F183-A221 HydrophobicContact CE1-CB 4.26Å; F183-A221 WeakPolarHBondContact CE2-O 3.42Å; F183-A221 HydrophobicContact CZ-CB 3.85Å; F183-A221 WeakPolarHBondContact CZ-O 3.25Å; F183-Y222 HydrophobicContact CB-CD1 3.92Å; F183-Y222 HydrophobicContact CB-CE1 3.23Å; F183-Y222 HydrophobicContact CB-CE2 4.28Å; F183-Y222 VanDerWaalsContact CB-CZ 3.46Å; F183-Y222 HydrophobicContact CD1-CD1 4.37Å; F183-Y222 AromaticContact CD1-CD2 3.87Å; F183-Y222 HydrophobicContact CD1-CD2 3.87Å; F183-Y222 AromaticContact CD1-CE1 3.99Å; F183-Y222 HydrophobicContact CD1-CE1 3.99Å; F183-Y222 AromaticContact CD1-CE2 3.47Å; F183-Y222 HydrophobicContact CD1-CE2 3.47Å; F183-Y222 VanDerWaalsContact CD1-CE2 3.47Å; F183-Y222 HydrophobicContact CD1-CG 4.34Å; F183-Y222 AromaticContact CD1-CZ 3.54Å; F183-Y222 AromaticContact CD2-CD1 3.91Å; F183-Y222 HydrophobicContact CD2-CD1 3.91Å; F183-Y222 HydrophobicContact CD2-CD2 4.43Å; F183-Y222 HydrophobicContact CD2-CE1 4.09Å; F183-Y222 HydrophobicContact CD2-CG 4.12Å; F183-Y222 AromaticContact CE1-CD2 3.94Å; F183-Y222 HydrophobicContact CE1-CD2 3.94Å; F183-Y222 AromaticContact CE1-CE2 3.9Å; F183-Y222 HydrophobicContact CE1-CE2 3.9Å; F183-Y222 HydrophobicContact CE2-CG 4.32Å; F183-Y222 AromaticContact CG-CD1 3.81Å; F183-Y222 HydrophobicContact CG-CD1 3.81Å; F183-Y222 HydrophobicContact CG-CD2 4.12Å; F183-Y222 AromaticContact CG-CE1 3.52Å; F183-Y222 HydrophobicContact CG-CE1 3.52Å; F183-Y222 AromaticContact CG-CE2 3.89Å; F183-Y222 HydrophobicContact CG-CE2 3.89Å; F183-Y222 HydrophobicContact CG-CG 4.13Å; F183-Y222 AromaticContact CG-CZ 3.57Å; F183-Y222 HydrophobicContact CZ-CD2 4.28Å; F183-M225 HydrophobicContact CE2-CB 3.86Å; F183-M225 HydrophobicContact CZ-CB 4.16Å |
| 184 | I | 98.6 | Very high | 98.2 | Very high | 30 Ų | 30 | 46 Ų | 46 | 15% | 0.154 | 27% | 0.265 | C | S | . | . | trans | -71.6 | 99.4 | -172.2 | -61.7 | 177.2 | 0 | 0 | 0 | 110.8 | T136 L140 F166 R167 D170 G182 V189 | T136-I184 HydrophobicContact CG2-CG2 3.61Å; L140-I184 HydrophobicContact CD1-CG2 3.95Å; L140-I184 HydrophobicContact CD2-CG2 4.34Å; L140-I184 HydrophobicContact CG-CG2 4.45Å; F166-I184 HydrophobicContact CD2-CD1 3.87Å; F166-I184 HydrophobicContact CD2-CG1 3.98Å; F166-I184 HydrophobicContact CE1-CG1 4.48Å; F166-I184 HydrophobicContact CE2-CD1 4.08Å; F166-I184 HydrophobicContact CE2-CG1 3.64Å; F166-I184 HydrophobicContact CG-CD1 4.17Å; F166-I184 HydrophobicContact CZ-CG1 3.92Å; R167-I184 HydrophobicContact CB-CD1 4.44Å; R167-I184 HydrophobicContact CG-CD1 3.93Å; D170-I184 HydrophobicContact CB-CD1 3.56Å; D170-I184 HydrophobicContact CB-CG1 3.87Å; G182-I184 VanDerWaalsContact C-N 3.27Å; G182-I184 PolarHBondContact O-N 2.75Å; I184-V189 HydrophobicContact CG2-CG2 4.31Å | ||
| 185 | T | 98.1 | Very high | 98.2 | Very high | 51 Ų | 51 | 42.9 Ų | 42.9 | 31% | 0.313 | 25% | 0.248 | S | C | . | . | trans | -129.6 | 162.4 | 174.9 | 67.8 | 0 | 0 | 0 | 0 | 110.1 | F183 A187 N188 V189 | F183-T185 PolarHBondContact O-N 3.4Å; T185-A187 VanDerWaalsContact C-N 3.31Å; T185-A187 PolarHBondContact O-N 3.44Å; T185-N188 PolarHBondContact O-N 3.47Å; T185-N188 WeakPolarHBondContact OG1-CB 3.46Å; T185-N188 PolarHBondContact OG1-N 2.85Å; T185-N188 PolarHBondContact OG1-ND2 3.49Å; T185-V189 WeakPolarHBondContact O-CG2 3.45Å; T185-V189 PolarHBondContact O-N 3.46Å | ||
| 186 | P | 97.8 | Very high | 98.2 | Very high | 52 Ų | 52 | 37.8 Ų | 37.8 | 34% | 0.338 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -53.4 | -46 | 178.1 | -29.1 | 37.3 | 0 | 0 | 0 | 113.5 | T136 L139 N188 V189 V190 | T136-P186 WeakPolarHBondContact OG1-CD 3.38Å; T136-P186 WeakPolarHBondContact OG1-CG 3.37Å; L139-P186 HydrophobicContact CD1-CB 3.68Å; P186-N188 PolarHBondContact O-N 2.78Å; P186-V189 PolarHBondContact O-N 2.91Å; P186-V190 WeakPolarHBondContact O-CG2 3.32Å; P186-V190 PolarHBondContact O-N 3Å; P186-V190 VanDerWaalsContact O-N 3.15Å |
| 187 | A | 97.3 | Very high | 98.1 | Very high | 39 Ų | 39 | 33.8 Ų | 33.8 | 32% | 0.322 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -63.6 | -42.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T185 V189 V190 F191 F270 | T185-A187 VanDerWaalsContact C-N 3.31Å; T185-A187 PolarHBondContact O-N 3.44Å; A187-V189 VanDerWaalsContact C-N 3.33Å; A187-V189 PolarHBondContact O-N 2.79Å; A187-V190 WeakPolarHBondContact O-CB 3.29Å; A187-V190 PolarHBondContact O-N 3.39Å; A187-F191 PolarHBondContact O-N 3.11Å; A187-F270 HydrophobicContact CB-CE2 4.04Å; A187-F270 HydrophobicContact CB-CZ 4.15Å |
| 188 | N | 98.6 | Very high | 97.8 | Very high | 18 Ų | 18 | 33.6 Ų | 33.6 | 10% | 0.096 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -69.6 | -30.8 | 179.5 | -70.3 | -10.9 | 0 | 0 | 0 | 112.2 | F183 T185 P186 F191 V192 | F183-N188 HydrophobicContact CD1-CB 4.24Å; F183-N188 HydrophobicContact CE1-CB 3.75Å; F183-N188 HydrophobicContact CE2-CB 4.28Å; F183-N188 HydrophobicContact CZ-CB 3.76Å; F183-N188 WeakPolarHBondContact O-CB 3.43Å; F183-N188 PolarHBondContact O-ND2 3.15Å; T185-N188 PolarHBondContact O-N 3.47Å; T185-N188 WeakPolarHBondContact OG1-CB 3.46Å; T185-N188 PolarHBondContact OG1-N 2.85Å; T185-N188 PolarHBondContact OG1-ND2 3.49Å; P186-N188 PolarHBondContact O-N 2.78Å; N188-F191 PolarHBondContact O-N 3.17Å; N188-V192 VanDerWaalsContact O-CG2 3.29Å; N188-V192 WeakPolarHBondContact O-CG2 3.34Å; N188-V192 PolarHBondContact O-N 2.84Å |
| 189 | V | 98.7 | Very high | 97.7 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.1 | -39.4 | 172.4 | 178.4 | 0 | 0 | 0 | 0 | 111.1 | T136 L139 L140 L143 F166 I184 T185 P186 A187 F191 V192 Y193 L277 | T136-V189 HydrophobicContact CG2-CG2 4.25Å; L139-V189 HydrophobicContact CB-CB 4.29Å; L139-V189 HydrophobicContact CB-CG1 3.78Å; L140-V189 HydrophobicContact CD2-CG1 4.46Å; L140-V189 HydrophobicContact CD2-CG2 3.88Å; L140-V189 HydrophobicContact CG-CG2 4.09Å; L143-V189 HydrophobicContact CB-CG1 4.48Å; L143-V189 HydrophobicContact CD2-CG1 4.3Å; F166-V189 HydrophobicContact CE1-CG2 4.19Å; I184-V189 HydrophobicContact CG2-CG2 4.31Å; T185-V189 WeakPolarHBondContact O-CG2 3.45Å; T185-V189 PolarHBondContact O-N 3.46Å; P186-V189 PolarHBondContact O-N 2.91Å; A187-V189 VanDerWaalsContact C-N 3.33Å; A187-V189 PolarHBondContact O-N 2.79Å; V189-F191 VanDerWaalsContact C-N 3.34Å; V189-V192 PolarHBondContact O-N 3.46Å; V189-Y193 WeakPolarHBondContact O-CB 3.44Å; V189-Y193 PolarHBondContact O-N 3.34Å; V189-L277 HydrophobicContact CG1-CD2 4.03Å |
| 190 | V | 98.4 | Very high | 97.7 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61.4 | -43.3 | 172.9 | 178.1 | 0 | 0 | 0 | 0 | 110.8 | P186 A187 Y193 L194 L263 F270 V273 F274 L277 | P186-V190 WeakPolarHBondContact O-CG2 3.32Å; P186-V190 PolarHBondContact O-N 3Å; P186-V190 VanDerWaalsContact O-N 3.15Å; A187-V190 WeakPolarHBondContact O-CB 3.29Å; A187-V190 PolarHBondContact O-N 3.39Å; V190-Y193 WeakPolarHBondContact O-CB 3.44Å; V190-Y193 PolarHBondContact O-N 3.13Å; V190-L194 PolarHBondContact O-N 3.39Å; V190-L263 HydrophobicContact CG1-CD2 4.48Å; V190-F270 HydrophobicContact CB-CE2 4.03Å; V190-F270 HydrophobicContact CB-CZ 4.38Å; V190-F270 HydrophobicContact CG1-CD2 4.29Å; V190-F270 HydrophobicContact CG1-CE2 3.99Å; V190-F270 HydrophobicContact CG1-CZ 4.47Å; V190-F270 HydrophobicContact CG2-CE2 4.32Å; V190-F270 HydrophobicContact CG2-CZ 4.16Å; V190-V273 HydrophobicContact CG1-CB 4.05Å; V190-V273 HydrophobicContact CG1-CG1 3.67Å; V190-F274 HydrophobicContact CG1-CB 4.35Å; V190-F274 HydrophobicContact CG2-CB 4.05Å; V190-F274 HydrophobicContact CG2-CD2 3.69Å; V190-F274 HydrophobicContact CG2-CG 4.34Å; V190-L277 HydrophobicContact CG2-CD2 4.24Å |
| 191 | F | 98.8 | Very high | 97.5 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.1 | -43.4 | 176.5 | -169.1 | -84 | 0 | 0 | 0 | 112.2 | A187 N188 V189 Y193 L194 L195 A221 Y224 M225 M260 L263 | A187-F191 PolarHBondContact O-N 3.11Å; N188-F191 PolarHBondContact O-N 3.17Å; V189-F191 VanDerWaalsContact C-N 3.34Å; F191-Y193 VanDerWaalsContact C-N 3.31Å; F191-Y193 PolarHBondContact O-N 3.23Å; F191-L194 WeakPolarHBondContact O-CB 3.43Å; F191-L194 PolarHBondContact O-N 3.3Å; F191-L195 HydrophobicContact CD1-CD1 4.19Å; F191-L195 HydrophobicContact CD1-CG 4.33Å; F191-L195 HydrophobicContact CE1-CD1 3.86Å; F191-L195 HydrophobicContact CE1-CD2 4.37Å; F191-L195 HydrophobicContact CE1-CG 4.12Å; F191-L195 PolarHBondContact O-N 3.07Å; F191-A221 HydrophobicContact CD1-CB 3.9Å; F191-A221 HydrophobicContact CE1-CB 4.18Å; F191-Y224 HydrophobicContact CE1-CD1 4.36Å; F191-Y224 AromaticContact CE2-CD1 3.71Å; F191-Y224 HydrophobicContact CE2-CD1 3.71Å; F191-Y224 AromaticContact CE2-CE1 3.92Å; F191-Y224 HydrophobicContact CE2-CE1 3.92Å; F191-Y224 AromaticContact CZ-CD1 3.43Å; F191-Y224 HydrophobicContact CZ-CD1 3.43Å; F191-Y224 VanDerWaalsContact CZ-CD1 3.43Å; F191-Y224 HydrophobicContact CZ-CE1 4.02Å; F191-Y224 AromaticContact CZ-CG 3.91Å; F191-Y224 HydrophobicContact CZ-CG 3.91Å; F191-M225 HydrophobicContact CB-CG 4.26Å; F191-M225 HydrophobicContact CD1-CG 3.76Å; F191-M225 HydrophobicContact CD2-CE 4.44Å; F191-M225 HydrophobicContact CD2-CG 3.64Å; F191-M225 HydrophobicContact CD2-SD 3.67Å; F191-M225 HydrophobicContact CE1-CG 3.92Å; F191-M225 HydrophobicContact CE2-CG 3.82Å; F191-M225 HydrophobicContact CE2-SD 3.77Å; F191-M225 HydrophobicContact CG-CG 3.61Å; F191-M225 HydrophobicContact CG-SD 4.24Å; F191-M225 HydrophobicContact CZ-CG 3.95Å; F191-M225 HydrophobicContact CZ-SD 4.38Å; F191-M260 HydrophobicContact CE1-CE 4.25Å; F191-M260 HydrophobicContact CE1-CG 4.47Å; F191-M260 HydrophobicContact CE2-CB 3.95Å; F191-M260 HydrophobicContact CE2-CG 4.17Å; F191-M260 HydrophobicContact CZ-CB 3.81Å; F191-M260 HydrophobicContact CZ-CE 3.73Å; F191-M260 HydrophobicContact CZ-CG 3.67Å; F191-M260 HydrophobicContact CZ-SD 4.5Å; F191-L263 HydrophobicContact CB-CD2 4.01Å; F191-L263 HydrophobicContact CD2-CD2 3.6Å; F191-L263 HydrophobicContact CG-CD2 4.21Å |
| 192 | V | 98.8 | Very high | 97.5 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.3 | -41.2 | 175.4 | 169.4 | 0 | 0 | 0 | 0 | 111 | L143 F166 F183 N188 V189 L194 L195 C196 F214 L218 A221 | L143-V192 HydrophobicContact CD2-CG1 3.91Å; F166-V192 HydrophobicContact CE1-CB 4.4Å; F166-V192 HydrophobicContact CE1-CG1 4.33Å; F166-V192 HydrophobicContact CE1-CG2 4.11Å; F166-V192 HydrophobicContact CZ-CG2 3.89Å; F183-V192 HydrophobicContact CE1-CG2 4.29Å; N188-V192 VanDerWaalsContact O-CG2 3.29Å; N188-V192 WeakPolarHBondContact O-CG2 3.34Å; N188-V192 PolarHBondContact O-N 2.84Å; V189-V192 PolarHBondContact O-N 3.46Å; V192-L194 PolarHBondContact O-N 2.88Å; V192-L195 PolarHBondContact O-N 2.83Å; V192-C196 WeakPolarHBondContact O-CB 3.19Å; V192-C196 PolarHBondContact O-N 3.38Å; V192-C196 PolarHBondContact O-SG 2.98Å; V192-F214 HydrophobicContact CG1-CE2 3.88Å; V192-F214 HydrophobicContact CG1-CZ 4.47Å; V192-L218 HydrophobicContact CB-CD2 4.44Å; V192-L218 HydrophobicContact CG1-CD2 3.74Å; V192-L218 HydrophobicContact CG2-CD2 3.74Å; V192-A221 HydrophobicContact CG2-CB 3.63Å |
| 193 | Y | 98.8 | Very high | 97.3 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.2 | -46.5 | 174.9 | 168.4 | -104.9 | 0 | 0 | 0 | 112 | L143 F146 V189 V190 F191 L195 C196 Q197 V273 E276 L277 Q280 | L143-Y193 HydrophobicContact CD1-CD2 4.19Å; F146-Y193 HydrophobicContact CB-CE2 4.37Å; F146-Y193 AromaticContact CD1-CD2 3.93Å; F146-Y193 HydrophobicContact CD1-CD2 3.93Å; F146-Y193 AromaticContact CD1-CE2 3.88Å; F146-Y193 HydrophobicContact CD1-CE2 3.88Å; F146-Y193 AromaticContact CD2-CE2 3.89Å; F146-Y193 HydrophobicContact CD2-CE2 3.89Å; F146-Y193 HydrophobicContact CE1-CD2 4.28Å; F146-Y193 HydrophobicContact CE1-CE2 4.17Å; F146-Y193 HydrophobicContact CE2-CE2 4.17Å; F146-Y193 HydrophobicContact CG-CD2 4.19Å; F146-Y193 AromaticContact CG-CE2 3.75Å; F146-Y193 HydrophobicContact CG-CE2 3.75Å; F146-Y193 HydrophobicContact CZ-CE2 4.34Å; V189-Y193 WeakPolarHBondContact O-CB 3.44Å; V189-Y193 PolarHBondContact O-N 3.34Å; V190-Y193 WeakPolarHBondContact O-CB 3.44Å; V190-Y193 PolarHBondContact O-N 3.13Å; F191-Y193 VanDerWaalsContact C-N 3.31Å; F191-Y193 PolarHBondContact O-N 3.23Å; Y193-L195 VanDerWaalsContact C-N 3.3Å; Y193-L195 PolarHBondContact O-N 2.92Å; Y193-C196 PolarHBondContact O-N 3.43Å; Y193-C196 VanDerWaalsContact O-N 3.13Å; Y193-Q197 WeakPolarHBondContact O-CB 3.48Å; Y193-Q197 PolarHBondContact O-N 3.25Å; Y193-V273 HydrophobicContact CD1-CG1 3.7Å; Y193-V273 HydrophobicContact CE1-CG1 4.02Å; Y193-E276 HydrophobicContact CE1-CB 4.21Å; Y193-E276 HydrophobicContact CE1-CG 4.4Å; Y193-E276 VanDerWaalsContact OH-CG 3.25Å; Y193-E276 WeakPolarHBondContact OH-CG 3.36Å; Y193-E276 PolarHBondContact OH-OE1 3.24Å; Y193-L277 HydrophobicContact CD1-CB 3.82Å; Y193-L277 HydrophobicContact CD2-CB 4.44Å; Y193-L277 HydrophobicContact CD2-CD1 3.69Å; Y193-L277 HydrophobicContact CE1-CB 4.05Å; Y193-L277 HydrophobicContact CE2-CD1 4.22Å; Y193-L277 HydrophobicContact CG-CB 4.01Å; Y193-L277 HydrophobicContact CG-CD1 3.83Å; Y193-L277 HydrophobicContact CG-CD2 4.35Å; Y193-L277 HydrophobicContact CG-CG 4.27Å; Y193-Q280 HydrophobicContact CE2-CG 4.22Å; Y193-Q280 PolarHBondContact OH-NE2 3.41Å |
| 194 | L | 98.6 | Very high | 97.2 | Very high | 1 Ų | 1 | 29.2 Ų | 29.2 | 1% | 0.005 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -53.1 | -46.2 | 175.4 | 175.6 | 70.8 | 0 | 0 | 0 | 111.9 | V190 F191 V192 K259 L263 F269 V273 | V190-L194 PolarHBondContact O-N 3.39Å; F191-L194 WeakPolarHBondContact O-CB 3.43Å; F191-L194 PolarHBondContact O-N 3.3Å; V192-L194 PolarHBondContact O-N 2.88Å; L194-K259 HydrophobicContact CD1-CB 4.35Å; L194-K259 HydrophobicContact CD1-CD 4.28Å; L194-K259 HydrophobicContact CD2-CB 4.2Å; L194-L263 HydrophobicContact CD2-CB 4.21Å; L194-L263 HydrophobicContact CD2-CD1 4.31Å; L194-L263 HydrophobicContact CD2-CD2 4.17Å; L194-L263 HydrophobicContact CD2-CG 4.46Å; L194-F269 HydrophobicContact CD1-CZ 4.18Å; L194-V273 HydrophobicContact CB-CG1 4.26Å; L194-V273 HydrophobicContact CD1-CG2 4.42Å |
| 195 | L | 98.7 | Very high | 96.9 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -65.5 | -46 | 177.9 | -62.1 | -176.9 | 0 | 0 | 0 | 111.6 | F191 V192 Y193 Q197 E198 A199 C217 L220 A221 I252 L256 M260 | F191-L195 HydrophobicContact CD1-CD1 4.19Å; F191-L195 HydrophobicContact CD1-CG 4.33Å; F191-L195 HydrophobicContact CE1-CD1 3.86Å; F191-L195 HydrophobicContact CE1-CD2 4.37Å; F191-L195 HydrophobicContact CE1-CG 4.12Å; F191-L195 PolarHBondContact O-N 3.07Å; V192-L195 PolarHBondContact O-N 2.83Å; Y193-L195 VanDerWaalsContact C-N 3.3Å; Y193-L195 PolarHBondContact O-N 2.92Å; L195-Q197 VanDerWaalsContact C-N 3.32Å; L195-Q197 PolarHBondContact O-N 3.48Å; L195-E198 PolarHBondContact O-N 3.28Å; L195-A199 WeakPolarHBondContact O-CB 3.47Å; L195-A199 PolarHBondContact O-N 2.88Å; L195-C217 HydrophobicContact CB-CB 3.98Å; L195-C217 HydrophobicContact CD1-CB 4.37Å; L195-C217 VanDerWaalsContact CD1-O 3.24Å; L195-C217 WeakPolarHBondContact CD1-O 3.27Å; L195-L220 HydrophobicContact CD1-CB 4.13Å; L195-A221 HydrophobicContact CD1-CB 4.07Å; L195-I252 HydrophobicContact CD2-CG2 4.06Å; L195-L256 HydrophobicContact CD2-CB 4.44Å; L195-L256 HydrophobicContact CD2-CD1 3.83Å; L195-M260 HydrophobicContact CD2-CG 3.89Å; L195-M260 HydrophobicContact CD2-SD 3.92Å |
| 196 | C | 98.5 | Very high | 96.8 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.4 | -37.6 | -178 | -69 | 0 | 0 | 0 | 0 | 112.4 | L143 F146 L147 V192 Y193 E198 I200 F214 | L143-C196 HydrophobicContact CD1-CB 4.45Å; F146-C196 HydrophobicContact CE1-CB 4.13Å; L147-C196 HydrophobicContact CD2-CB 4.26Å; V192-C196 WeakPolarHBondContact O-CB 3.19Å; V192-C196 PolarHBondContact O-N 3.38Å; V192-C196 PolarHBondContact O-SG 2.98Å; Y193-C196 PolarHBondContact O-N 3.43Å; Y193-C196 VanDerWaalsContact O-N 3.13Å; C196-E198 PolarHBondContact O-N 3.49Å; C196-E198 VanDerWaalsContact O-N 3.17Å; C196-I200 HydrophobicContact CB-CD1 3.92Å; C196-I200 WeakPolarHBondContact O-CB 3.21Å; C196-I200 PolarHBondContact O-N 3.46Å; C196-F214 VanDerWaalsContact SG-CD2 3.56Å |
| 197 | Q | 96.7 | Very high | 96.6 | Very high | 38 Ų | 38 | 31.4 Ų | 31.4 | 18% | 0.178 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -54.5 | -35.5 | -179.7 | -167.9 | -172.1 | 29.9 | 0 | 0 | 112.4 | F146 R150 Y193 L195 E276 | F146-Q197 HydrophobicContact CZ-CB 4.39Å; R150-Q197 PolarHBondContact NH1-O 2.91Å; Y193-Q197 WeakPolarHBondContact O-CB 3.48Å; Y193-Q197 PolarHBondContact O-N 3.25Å; L195-Q197 VanDerWaalsContact C-N 3.32Å; L195-Q197 PolarHBondContact O-N 3.48Å; Q197-E276 PolarHBondContact NE2-OE1 3.35Å; Q197-E276 PolarHBondContact NE2-OE2 3.46Å |
| 198 | E | 91.3 | Very high | 96.5 | Very high | 55 Ų | 55 | 31.5 Ų | 31.5 | 26% | 0.257 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -104.7 | -30.2 | -173.5 | -71.7 | -85.1 | -168.6 | 0 | 0 | 113.3 | L195 C196 R255 L256 K259 | L195-E198 PolarHBondContact O-N 3.28Å; C196-E198 PolarHBondContact O-N 3.49Å; C196-E198 VanDerWaalsContact O-N 3.17Å; E198-R255 IonicContact OE2-CZ 3.85Å; E198-R255 IonicContact OE2-NH2 3.79Å; E198-R255 PolarHBondContact OE2-NH2 2.74Å; E198-L256 HydrophobicContact CB-CD1 3.71Å; E198-L256 HydrophobicContact CB-CD2 3.68Å; E198-L256 HydrophobicContact CB-CG 4.22Å; E198-L256 HydrophobicContact CG-CD1 4.36Å; E198-L256 HydrophobicContact CG-CD2 3.61Å; E198-K259 IonicContact OE1-NZ 3.34Å; E198-K259 PolarHBondContact OE1-NZ 2.82Å |
| 199 | A | 95.9 | Very high | 96.4 | Very high | 20 Ų | 20 | 34.4 Ų | 34.4 | 17% | 0.165 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -81.6 | -35.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L195 T213 C217 I252 | L195-A199 WeakPolarHBondContact O-CB 3.47Å; L195-A199 PolarHBondContact O-N 2.88Å; A199-T213 HydrophobicContact CB-CG2 4.27Å; A199-C217 WeakPolarHBondContact CB-SG 3.49Å; A199-I252 HydrophobicContact CB-CD1 3.71Å; A199-I252 HydrophobicContact CB-CG1 3.89Å |
| 200 | I | 96.9 | Very high | 96.3 | Very high | 2 Ų | 2 | 34.4 Ų | 34.4 | 1% | 0.01 | 20% | 0.199 | C | C | . | . | S | Bend | trans | -94.9 | 110 | -172.8 | -62.2 | 170 | 0 | 0 | 0 | 109.9 | L147 R150 C196 L210 T213 F214 | L147-I200 HydrophobicContact CD1-CD1 4.26Å; L147-I200 HydrophobicContact CD2-CB 4.37Å; L147-I200 HydrophobicContact CD2-CD1 3.46Å; L147-I200 VanDerWaalsContact CD2-CD1 3.46Å; L147-I200 HydrophobicContact CD2-CG1 4.49Å; L147-I200 HydrophobicContact CD2-CG2 4.2Å; R150-I200 HydrophobicContact CG-CG2 4.45Å; R150-I200 PolarHBondContact NH1-O 3.15Å; C196-I200 HydrophobicContact CB-CD1 3.92Å; C196-I200 WeakPolarHBondContact O-CB 3.21Å; C196-I200 PolarHBondContact O-N 3.46Å; I200-L210 HydrophobicContact CD1-CD1 3.91Å; I200-L210 HydrophobicContact CG1-CD1 4.36Å; I200-L210 HydrophobicContact CG2-CD1 3.62Å; I200-T213 HydrophobicContact CG1-CG2 3.75Å; I200-F214 HydrophobicContact CD1-CB 4.29Å; I200-F214 HydrophobicContact CD1-CD2 4.38Å |
| 201 | K | 95.1 | Very high | 96.3 | Very high | 125 Ų | 125 | 36.8 Ų | 36.8 | 54% | 0.543 | 21% | 0.21 | S | C | . | . | trans | -81.5 | 149.8 | -178.5 | -60.9 | -179.7 | -179 | 178.4 | 0 | 111.6 | S203 V204 | K201-S203 WeakPolarHBondContact CB-OG 3.23Å; K201-S203 PolarHBondContact O-N 3.5Å; K201-V204 VanDerWaalsContact O-CG2 3.25Å; K201-V204 WeakPolarHBondContact O-CG2 3.46Å; K201-V204 PolarHBondContact O-N 2.98Å | ||
| 202 | E | 95.3 | Very high | 96.2 | Very high | 116 Ų | 116 | 36.8 Ų | 36.8 | 54% | 0.542 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61 | -22.8 | 170.7 | -71.5 | 175.3 | -161.6 | 0 | 0 | 113.4 | R150 Y152 V204 | R150-E202 HydrophobicContact CG-CG 4.41Å; R150-E202 WeakPolarHBondContact O-CA 3.49Å; Y152-E202 HydrophobicContact CE1-CB 4.12Å; Y152-E202 WeakPolarHBondContact CE1-O 3.32Å; E202-V204 VanDerWaalsContact C-N 3.26Å; E202-V204 PolarHBondContact O-N 3.15Å |
| 203 | S | 94.4 | Very high | 96.1 | Very high | 64 Ų | 64 | 37.9 Ų | 37.9 | 45% | 0.448 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -16 | -177.6 | 60.1 | 0 | 0 | 0 | 0 | 114.3 | K153 K201 S205 | K153-S203 PolarHBondContact NZ-O 3.28Å; K201-S203 WeakPolarHBondContact CB-OG 3.23Å; K201-S203 PolarHBondContact O-N 3.5Å; S203-S205 PolarHBondContact O-N 2.91Å |
| 204 | V | 95.5 | Very high | 96.1 | Very high | 3 Ų | 3 | 37.9 Ų | 37.9 | 2% | 0.018 | 22% | 0.217 | C | C | . | . | trans | -52.8 | 126.2 | -176.4 | 171.2 | 0 | 0 | 0 | 0 | 110.3 | L154 K201 E202 E209 L210 | L154-V204 HydrophobicContact CD1-CG1 4.42Å; K201-V204 VanDerWaalsContact O-CG2 3.25Å; K201-V204 WeakPolarHBondContact O-CG2 3.46Å; K201-V204 PolarHBondContact O-N 2.98Å; E202-V204 VanDerWaalsContact C-N 3.26Å; E202-V204 PolarHBondContact O-N 3.15Å; V204-E209 HydrophobicContact CG1-CB 4.25Å; V204-E209 HydrophobicContact CG1-CG 4.18Å; V204-E209 HydrophobicContact CG2-CG 4.43Å; V204-L210 HydrophobicContact CG1-CB 3.89Å | ||
| 205 | S | 92.8 | Very high | 96.1 | Very high | 80 Ų | 80 | 38.4 Ų | 38.4 | 56% | 0.559 | 22% | 0.22 | S | C | * | . | trans | -118.8 | -4 | -171 | 50.9 | 0 | 0 | 0 | 0 | 114.5 | L154 S203 E209 | L154-S205 WeakPolarHBondContact CD2-O 3.41Å; S203-S205 PolarHBondContact O-N 2.91Å; S205-E209 PolarHBondContact N-OE2 2.9Å | ||
| 206 | S | 95.4 | Very high | 96 | Very high | 51 Ų | 51 | 38.4 Ų | 38.4 | 36% | 0.357 | 22% | 0.22 | S | C | . | . | trans | -133.5 | 148.8 | 174.6 | 73.7 | 0 | 0 | 0 | 0 | 112.7 | A208 E209 L210 | S206-A208 VanDerWaalsContact C-N 3.26Å; S206-A208 PolarHBondContact O-N 3.22Å; S206-E209 PolarHBondContact O-N 2.77Å; S206-E209 WeakPolarHBondContact OG-CB 3.49Å; S206-E209 PolarHBondContact OG-N 2.99Å; S206-E209 VanDerWaalsContact OG-N 3.16Å; S206-L210 PolarHBondContact O-N 2.91Å; S206-L210 VanDerWaalsContact O-N 3.12Å | ||
| 207 | A | 95.2 | Very high | 96.1 | Very high | 47 Ų | 47 | 38.4 Ų | 38.4 | 39% | 0.388 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.6 | -34 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L210 Q211 | A207-L210 PolarHBondContact O-N 2.97Å; A207-Q211 VanDerWaalsContact O-CB 3.27Å; A207-Q211 WeakPolarHBondContact O-CB 3.37Å; A207-Q211 PolarHBondContact O-N 2.9Å |
| 208 | A | 95.1 | Very high | 96.1 | Very high | 42 Ų | 42 | 36.6 Ų | 36.6 | 35% | 0.347 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -67.6 | -37.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | S206 G212 S240 | S206-A208 VanDerWaalsContact C-N 3.26Å; S206-A208 PolarHBondContact O-N 3.22Å; A208-G212 PolarHBondContact O-N 3.38Å; A208-S240 PolarHBondContact O-OG 3.44Å |
| 209 | E | 95.6 | Very high | 96.5 | Very high | 79 Ų | 79 | 35.9 Ų | 35.9 | 37% | 0.369 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -67 | -44 | 173.6 | -179 | -170.6 | 178.7 | 0 | 0 | 111.2 | V204 S205 S206 G212 T213 | V204-E209 HydrophobicContact CG1-CB 4.25Å; V204-E209 HydrophobicContact CG1-CG 4.18Å; V204-E209 HydrophobicContact CG2-CG 4.43Å; S205-E209 PolarHBondContact N-OE2 2.9Å; S206-E209 PolarHBondContact O-N 2.77Å; S206-E209 WeakPolarHBondContact OG-CB 3.49Å; S206-E209 PolarHBondContact OG-N 2.99Å; S206-E209 VanDerWaalsContact OG-N 3.16Å; E209-G212 PolarHBondContact O-N 3.39Å; E209-T213 PolarHBondContact O-N 3.46Å; E209-T213 PolarHBondContact O-OG1 3.37Å |
| 210 | L | 97.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.7 | -52.4 | 174.7 | 177 | 57.7 | 0 | 0 | 0 | 111.1 | C151 L154 L157 I162 W165 I200 V204 S206 A207 G212 T213 F214 | C151-L210 HydrophobicContact CB-CD2 4.43Å; L154-L210 HydrophobicContact CD1-CB 4.11Å; L154-L210 HydrophobicContact CD1-CD2 3.77Å; L157-L210 HydrophobicContact CD1-CD2 4.22Å; L157-L210 HydrophobicContact CD2-CD2 3.33Å; L157-L210 HydrophobicContact CG-CD2 4.42Å; I162-L210 HydrophobicContact CD1-CD2 4.05Å; W165-L210 HydrophobicContact CZ3-CD2 4.38Å; W165-L210 HydrophobicContact CZ3-CG 4.28Å; I200-L210 HydrophobicContact CD1-CD1 3.91Å; I200-L210 HydrophobicContact CG1-CD1 4.36Å; I200-L210 HydrophobicContact CG2-CD1 3.62Å; V204-L210 HydrophobicContact CG1-CB 3.89Å; S206-L210 PolarHBondContact O-N 2.91Å; S206-L210 VanDerWaalsContact O-N 3.12Å; A207-L210 PolarHBondContact O-N 2.97Å; L210-G212 VanDerWaalsContact C-N 3.3Å; L210-G212 PolarHBondContact O-N 3.42Å; L210-T213 PolarHBondContact O-N 3.26Å; L210-F214 VanDerWaalsContact O-CB 3.26Å; L210-F214 WeakPolarHBondContact O-CB 3.24Å; L210-F214 PolarHBondContact O-N 3.19Å |
| 211 | Q | 97.1 | Very high | 96.7 | Very high | 49 Ų | 49 | 35.4 Ų | 35.4 | 23% | 0.229 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.8 | -45.2 | -179.8 | -174.1 | -179.2 | -3.8 | 0 | 0 | 110.5 | W165 A207 T213 F214 Q215 I238 | W165-Q211 HydrophobicContact CD2-CB 4.44Å; W165-Q211 HydrophobicContact CD2-CG 3.96Å; W165-Q211 HydrophobicContact CE3-CB 4.08Å; W165-Q211 HydrophobicContact CE3-CG 3.96Å; W165-Q211 HydrophobicContact CG-CG 4.49Å; W165-Q211 HydrophobicContact CH2-CB 3.87Å; W165-Q211 HydrophobicContact CH2-CG 4.4Å; W165-Q211 HydrophobicContact CZ2-CB 4.24Å; W165-Q211 HydrophobicContact CZ2-CG 4.4Å; W165-Q211 HydrophobicContact CZ3-CB 3.77Å; W165-Q211 HydrophobicContact CZ3-CG 4.18Å; A207-Q211 VanDerWaalsContact O-CB 3.27Å; A207-Q211 WeakPolarHBondContact O-CB 3.37Å; A207-Q211 PolarHBondContact O-N 2.9Å; Q211-T213 PolarHBondContact O-N 3.33Å; Q211-F214 PolarHBondContact O-N 3.01Å; Q211-Q215 HydrophobicContact CG-CG 4.31Å; Q211-Q215 WeakPolarHBondContact O-CB 3.26Å; Q211-Q215 WeakPolarHBondContact O-CG 3.07Å; Q211-Q215 PolarHBondContact O-N 3.44Å; Q211-I238 HydrophobicContact CB-CD1 4.15Å; Q211-I238 HydrophobicContact CG-CD1 4.08Å |
| 212 | G | 96.8 | Very high | 96.9 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63.1 | -41.7 | 179 | 0 | 0 | 0 | 0 | 0 | 113.7 | A208 E209 L210 T216 N241 | A208-G212 PolarHBondContact O-N 3.38Å; E209-G212 PolarHBondContact O-N 3.39Å; L210-G212 VanDerWaalsContact C-N 3.3Å; L210-G212 PolarHBondContact O-N 3.42Å; G212-T216 PolarHBondContact O-N 3.08Å; G212-T216 VanDerWaalsContact O-N 3.07Å; G212-T216 PolarHBondContact O-OG1 3.14Å; G212-N241 VanDerWaalsContact CA-ND2 3.26Å; G212-N241 WeakPolarHBondContact CA-ND2 3.23Å; G212-N241 PolarHBondContact O-ND2 3.2Å |
| 213 | T | 97.4 | Very high | 97.1 | Very high | 24 Ų | 24 | 27 Ų | 27 | 15% | 0.147 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -69 | -41.9 | 176.8 | -52.3 | 0 | 0 | 0 | 0 | 111 | A199 I200 E209 L210 Q211 T216 C217 | A199-T213 HydrophobicContact CB-CG2 4.27Å; I200-T213 HydrophobicContact CG1-CG2 3.75Å; E209-T213 PolarHBondContact O-N 3.46Å; E209-T213 PolarHBondContact O-OG1 3.37Å; L210-T213 PolarHBondContact O-N 3.26Å; Q211-T213 PolarHBondContact O-N 3.33Å; T213-T216 WeakPolarHBondContact O-CB 3.34Å; T213-T216 PolarHBondContact O-N 2.99Å; T213-C217 PolarHBondContact O-N 2.97Å; T213-C217 PolarHBondContact O-SG 2.85Å |
| 214 | F | 98.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -61.6 | -45.1 | 176.1 | -178.5 | -119.1 | 0 | 0 | 0 | 111.7 | L143 L147 I162 W165 F166 V192 C196 I200 L210 Q211 T216 C217 L218 | L143-F214 HydrophobicContact CD2-CE2 4.16Å; L143-F214 HydrophobicContact CD2-CZ 4.3Å; L147-F214 HydrophobicContact CD1-CD2 3.9Å; L147-F214 HydrophobicContact CD1-CE2 4.12Å; L147-F214 HydrophobicContact CD1-CG 4.45Å; I162-F214 HydrophobicContact CG2-CE1 4.19Å; I162-F214 HydrophobicContact CG2-CZ 4.06Å; W165-F214 HydrophobicContact CB-CE1 4.39Å; W165-F214 HydrophobicContact CE3-CD1 4.21Å; F166-F214 HydrophobicContact CB-CE1 4.11Å; F166-F214 HydrophobicContact CB-CZ 4.12Å; F166-F214 HydrophobicContact CD1-CZ 4.27Å; F166-F214 HydrophobicContact CG-CZ 4.35Å; V192-F214 HydrophobicContact CG1-CE2 3.88Å; V192-F214 HydrophobicContact CG1-CZ 4.47Å; C196-F214 VanDerWaalsContact SG-CD2 3.56Å; I200-F214 HydrophobicContact CD1-CB 4.29Å; I200-F214 HydrophobicContact CD1-CD2 4.38Å; L210-F214 VanDerWaalsContact O-CB 3.26Å; L210-F214 WeakPolarHBondContact O-CB 3.24Å; L210-F214 PolarHBondContact O-N 3.19Å; Q211-F214 PolarHBondContact O-N 3.01Å; F214-T216 VanDerWaalsContact C-N 3.29Å; F214-T216 PolarHBondContact O-N 3.19Å; F214-C217 WeakPolarHBondContact O-CB 3.35Å; F214-C217 PolarHBondContact O-N 3.42Å; F214-C217 VanDerWaalsContact O-N 3.13Å; F214-L218 HydrophobicContact CD1-CD1 4.06Å; F214-L218 HydrophobicContact CD1-CG 4.48Å; F214-L218 HydrophobicContact CE1-CD1 3.67Å; F214-L218 HydrophobicContact CE1-CG 4.2Å; F214-L218 HydrophobicContact CE2-CD2 4.39Å; F214-L218 HydrophobicContact CE2-CG 4.44Å; F214-L218 HydrophobicContact CZ-CD1 4.04Å; F214-L218 HydrophobicContact CZ-CD2 4.11Å; F214-L218 HydrophobicContact CZ-CG 4.17Å; F214-L218 WeakPolarHBondContact O-CG 3.17Å; F214-L218 PolarHBondContact O-N 3.34Å |
| 215 | Q | 98 | Very high | 97.4 | Very high | 11 Ų | 11 | 30.4 Ų | 30.4 | 5% | 0.051 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.6 | -32.5 | 176.1 | -71.2 | 176.9 | -34.7 | 0 | 0 | 112.8 | I169 Q211 L218 Y219 F236 | I169-Q215 HydrophobicContact CD1-CG 3.9Å; Q211-Q215 HydrophobicContact CG-CG 4.31Å; Q211-Q215 WeakPolarHBondContact O-CB 3.26Å; Q211-Q215 WeakPolarHBondContact O-CG 3.07Å; Q211-Q215 PolarHBondContact O-N 3.44Å; Q215-L218 PolarHBondContact O-N 2.98Å; Q215-Y219 PolarHBondContact O-N 3.16Å; Q215-F236 WeakPolarHBondContact CB-O 3.19Å; Q215-F236 PolarHBondContact OE1-O 3.45Å |
| 216 | T | 98.3 | Very high | 97.7 | Very high | 1 Ų | 1 | 27.6 Ų | 27.6 | 1% | 0.006 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.4 | -43.8 | 171.8 | -52 | 0 | 0 | 0 | 0 | 110.8 | G212 T213 F214 L218 Y219 L220 F245 T248 S249 I252 | G212-T216 PolarHBondContact O-N 3.08Å; G212-T216 VanDerWaalsContact O-N 3.07Å; G212-T216 PolarHBondContact O-OG1 3.14Å; T213-T216 WeakPolarHBondContact O-CB 3.34Å; T213-T216 PolarHBondContact O-N 2.99Å; F214-T216 VanDerWaalsContact C-N 3.29Å; F214-T216 PolarHBondContact O-N 3.19Å; T216-L218 VanDerWaalsContact C-N 3.33Å; T216-L218 PolarHBondContact O-N 2.93Å; T216-Y219 PolarHBondContact O-N 3.17Å; T216-L220 WeakPolarHBondContact O-CG 3.29Å; T216-L220 PolarHBondContact O-N 2.93Å; T216-L220 VanDerWaalsContact O-N 3.11Å; T216-F245 HydrophobicContact CG2-CD2 4.4Å; T216-F245 HydrophobicContact CG2-CE2 4.28Å; T216-F245 WeakPolarHBondContact OG1-CD2 3.39Å; T216-T248 HydrophobicContact CG2-CG2 4.02Å; T216-S249 VanDerWaalsContact CG2-OG 3.31Å; T216-S249 WeakPolarHBondContact CG2-OG 3.42Å; T216-I252 HydrophobicContact CG2-CD1 4.2Å |
| 217 | C | 98.7 | Very high | 97.8 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.8 | -43 | 173.7 | -61.6 | 0 | 0 | 0 | 0 | 111.4 | L195 A199 T213 F214 L220 A221 | L195-C217 HydrophobicContact CB-CB 3.98Å; L195-C217 HydrophobicContact CD1-CB 4.37Å; L195-C217 VanDerWaalsContact CD1-O 3.24Å; L195-C217 WeakPolarHBondContact CD1-O 3.27Å; A199-C217 WeakPolarHBondContact CB-SG 3.49Å; T213-C217 PolarHBondContact O-N 2.97Å; T213-C217 PolarHBondContact O-SG 2.85Å; F214-C217 WeakPolarHBondContact O-CB 3.35Å; F214-C217 PolarHBondContact O-N 3.42Å; F214-C217 VanDerWaalsContact O-N 3.13Å; C217-L220 PolarHBondContact O-N 3.34Å; C217-A221 WeakPolarHBondContact O-CB 3.43Å; C217-A221 PolarHBondContact O-N 3.28Å |
| 218 | L | 98.7 | Very high | 97.9 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.9 | -49 | 175.2 | -68.5 | -178.6 | 0 | 0 | 0 | 110.9 | F166 I169 V192 F214 Q215 T216 L220 A221 Y222 F236 | F166-L218 HydrophobicContact CB-CD1 4.37Å; F166-L218 HydrophobicContact CD1-CD2 4.13Å; F166-L218 HydrophobicContact CD2-CD1 3.87Å; F166-L218 HydrophobicContact CD2-CD2 3.58Å; F166-L218 HydrophobicContact CD2-CG 4.39Å; F166-L218 HydrophobicContact CE1-CD2 4Å; F166-L218 HydrophobicContact CE2-CD1 4.49Å; F166-L218 HydrophobicContact CE2-CD2 3.46Å; F166-L218 VanDerWaalsContact CE2-CD2 3.46Å; F166-L218 HydrophobicContact CG-CD1 4.2Å; F166-L218 HydrophobicContact CG-CD2 3.95Å; F166-L218 HydrophobicContact CZ-CD2 3.69Å; I169-L218 HydrophobicContact CD1-CD1 3.72Å; V192-L218 HydrophobicContact CB-CD2 4.44Å; V192-L218 HydrophobicContact CG1-CD2 3.74Å; V192-L218 HydrophobicContact CG2-CD2 3.74Å; F214-L218 HydrophobicContact CD1-CD1 4.06Å; F214-L218 HydrophobicContact CD1-CG 4.48Å; F214-L218 HydrophobicContact CE1-CD1 3.67Å; F214-L218 HydrophobicContact CE1-CG 4.2Å; F214-L218 HydrophobicContact CE2-CD2 4.39Å; F214-L218 HydrophobicContact CE2-CG 4.44Å; F214-L218 HydrophobicContact CZ-CD1 4.04Å; F214-L218 HydrophobicContact CZ-CD2 4.11Å; F214-L218 HydrophobicContact CZ-CG 4.17Å; F214-L218 WeakPolarHBondContact O-CG 3.17Å; F214-L218 PolarHBondContact O-N 3.34Å; Q215-L218 PolarHBondContact O-N 2.98Å; T216-L218 VanDerWaalsContact C-N 3.33Å; T216-L218 PolarHBondContact O-N 2.93Å; L218-L220 VanDerWaalsContact C-N 3.26Å; L218-L220 PolarHBondContact O-N 3.47Å; L218-A221 WeakPolarHBondContact O-CA 3.44Å; L218-A221 WeakPolarHBondContact O-CB 3.27Å; L218-A221 PolarHBondContact O-N 3.32Å; L218-Y222 VanDerWaalsContact O-CD2 3.23Å; L218-Y222 WeakPolarHBondContact O-CD2 3.42Å; L218-Y222 PolarHBondContact O-N 3.39Å; L218-F236 HydrophobicContact CB-CD1 3.99Å; L218-F236 HydrophobicContact CB-CE1 3.98Å |
| 219 | Y | 98.8 | Very high | 98.1 | Very high | 39 Ų | 39 | 39.3 Ų | 39.3 | 15% | 0.153 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -54.8 | -43.6 | 179.1 | 178.5 | -107.4 | 0 | 0 | 0 | 112.4 | Q215 T216 S223 L233 F236 F245 W246 | Q215-Y219 PolarHBondContact O-N 3.16Å; T216-Y219 PolarHBondContact O-N 3.17Å; Y219-S223 WeakPolarHBondContact O-CB 3.36Å; Y219-S223 PolarHBondContact O-N 2.91Å; Y219-S223 PolarHBondContact O-OG 2.72Å; Y219-L233 HydrophobicContact CE2-CD1 4.49Å; Y219-F236 HydrophobicContact CD2-CB 4.31Å; Y219-F236 AromaticContact CD2-CD2 3.75Å; Y219-F236 HydrophobicContact CD2-CD2 3.75Å; Y219-F236 HydrophobicContact CD2-CE2 4.11Å; Y219-F236 AromaticContact CD2-CG 3.97Å; Y219-F236 HydrophobicContact CD2-CG 3.97Å; Y219-F236 HydrophobicContact CG-CB 4.47Å; Y219-F236 HydrophobicContact CG-CG 4.37Å; Y219-F245 AromaticContact CD1-CE1 3.77Å; Y219-F245 HydrophobicContact CD1-CE1 3.77Å; Y219-F245 AromaticContact CD1-CZ 3.54Å; Y219-F245 HydrophobicContact CD1-CZ 3.54Å; Y219-F245 HydrophobicContact CD2-CZ 4.36Å; Y219-F245 HydrophobicContact CE1-CE1 4.07Å; Y219-F245 HydrophobicContact CE1-CZ 4.24Å; Y219-F245 HydrophobicContact CG-CE1 4.26Å; Y219-F245 AromaticContact CG-CZ 3.6Å; Y219-F245 HydrophobicContact CG-CZ 3.6Å; Y219-W246 AromaticContact CE1-CH2 3.95Å; Y219-W246 HydrophobicContact CE1-CH2 3.95Å; Y219-W246 AromaticContact CE1-CZ3 3.77Å; Y219-W246 HydrophobicContact CE1-CZ3 3.77Å |
| 220 | L | 98.8 | Very high | 98.2 | Very high | 13 Ų | 13 | 38.8 Ų | 38.8 | 7% | 0.068 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.2 | -40.7 | 175.3 | -67 | 178.8 | 0 | 0 | 0 | 112.4 | L195 T216 C217 L218 S223 Y224 I252 I253 | L195-L220 HydrophobicContact CD1-CB 4.13Å; T216-L220 WeakPolarHBondContact O-CG 3.29Å; T216-L220 PolarHBondContact O-N 2.93Å; T216-L220 VanDerWaalsContact O-N 3.11Å; C217-L220 PolarHBondContact O-N 3.34Å; L218-L220 VanDerWaalsContact C-N 3.26Å; L218-L220 PolarHBondContact O-N 3.47Å; L220-S223 PolarHBondContact O-N 2.93Å; L220-Y224 WeakPolarHBondContact O-CB 3.49Å; L220-Y224 PolarHBondContact O-N 2.9Å; L220-I252 HydrophobicContact CD1-CB 3.6Å; L220-I252 HydrophobicContact CD1-CD1 3.98Å; L220-I252 HydrophobicContact CD1-CG1 4.41Å; L220-I252 HydrophobicContact CD1-CG2 3.44Å; L220-I252 VanDerWaalsContact CD1-CG2 3.44Å; L220-I253 HydrophobicContact CD1-CG1 4.36Å; L220-I253 HydrophobicContact CD2-CD1 3.85Å; L220-I253 HydrophobicContact CD2-CG1 4.02Å |
| 221 | A | 98.8 | Very high | 98.2 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.9 | -43.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | F183 F191 V192 L195 C217 L218 Y224 M225 | F183-A221 HydrophobicContact CE1-CB 4.26Å; F183-A221 WeakPolarHBondContact CE2-O 3.42Å; F183-A221 HydrophobicContact CZ-CB 3.85Å; F183-A221 WeakPolarHBondContact CZ-O 3.25Å; F191-A221 HydrophobicContact CD1-CB 3.9Å; F191-A221 HydrophobicContact CE1-CB 4.18Å; V192-A221 HydrophobicContact CG2-CB 3.63Å; L195-A221 HydrophobicContact CD1-CB 4.07Å; C217-A221 WeakPolarHBondContact O-CB 3.43Å; C217-A221 PolarHBondContact O-N 3.28Å; L218-A221 WeakPolarHBondContact O-CA 3.44Å; L218-A221 WeakPolarHBondContact O-CB 3.27Å; L218-A221 PolarHBondContact O-N 3.32Å; A221-Y224 PolarHBondContact O-N 3.35Å; A221-M225 WeakPolarHBondContact O-CA 3.47Å; A221-M225 WeakPolarHBondContact O-CB 3.03Å; A221-M225 PolarHBondContact O-N 2.81Å |
| 222 | Y | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.9 | -42.9 | 173.6 | -83.8 | -101.6 | 0 | 0 | 0 | 111.1 | F166 I169 D170 L173 F183 L218 Y224 G226 Y231 F236 | F166-Y222 AromaticContact CE2-CE2 4Å; F166-Y222 HydrophobicContact CE2-CE2 4Å; I169-Y222 HydrophobicContact CG2-CE2 4.37Å; D170-Y222 VanDerWaalsContact CA-OH 3.27Å; D170-Y222 WeakPolarHBondContact CA-OH 3.45Å; D170-Y222 VanDerWaalsContact CB-OH 3.24Å; D170-Y222 WeakPolarHBondContact CB-OH 3.48Å; D170-Y222 PolarHBondContact OD1-OH 3.29Å; D170-Y222 VanDerWaalsContact OD1-OH 3.08Å; L173-Y222 HydrophobicContact CD1-CD1 3.73Å; L173-Y222 HydrophobicContact CD1-CE1 3.29Å; F183-Y222 HydrophobicContact CB-CD1 3.92Å; F183-Y222 HydrophobicContact CB-CE1 3.23Å; F183-Y222 HydrophobicContact CB-CE2 4.28Å; F183-Y222 VanDerWaalsContact CB-CZ 3.46Å; F183-Y222 HydrophobicContact CD1-CD1 4.37Å; F183-Y222 AromaticContact CD1-CD2 3.87Å; F183-Y222 HydrophobicContact CD1-CD2 3.87Å; F183-Y222 AromaticContact CD1-CE1 3.99Å; F183-Y222 HydrophobicContact CD1-CE1 3.99Å; F183-Y222 AromaticContact CD1-CE2 3.47Å; F183-Y222 HydrophobicContact CD1-CE2 3.47Å; F183-Y222 VanDerWaalsContact CD1-CE2 3.47Å; F183-Y222 HydrophobicContact CD1-CG 4.34Å; F183-Y222 AromaticContact CD1-CZ 3.54Å; F183-Y222 AromaticContact CD2-CD1 3.91Å; F183-Y222 HydrophobicContact CD2-CD1 3.91Å; F183-Y222 HydrophobicContact CD2-CD2 4.43Å; F183-Y222 HydrophobicContact CD2-CE1 4.09Å; F183-Y222 HydrophobicContact CD2-CG 4.12Å; F183-Y222 AromaticContact CE1-CD2 3.94Å; F183-Y222 HydrophobicContact CE1-CD2 3.94Å; F183-Y222 AromaticContact CE1-CE2 3.9Å; F183-Y222 HydrophobicContact CE1-CE2 3.9Å; F183-Y222 HydrophobicContact CE2-CG 4.32Å; F183-Y222 AromaticContact CG-CD1 3.81Å; F183-Y222 HydrophobicContact CG-CD1 3.81Å; F183-Y222 HydrophobicContact CG-CD2 4.12Å; F183-Y222 AromaticContact CG-CE1 3.52Å; F183-Y222 HydrophobicContact CG-CE1 3.52Å; F183-Y222 AromaticContact CG-CE2 3.89Å; F183-Y222 HydrophobicContact CG-CE2 3.89Å; F183-Y222 HydrophobicContact CG-CG 4.13Å; F183-Y222 AromaticContact CG-CZ 3.57Å; F183-Y222 HydrophobicContact CZ-CD2 4.28Å; L218-Y222 VanDerWaalsContact O-CD2 3.23Å; L218-Y222 WeakPolarHBondContact O-CD2 3.42Å; L218-Y222 PolarHBondContact O-N 3.39Å; Y222-Y224 VanDerWaalsContact C-N 3.26Å; Y222-Y224 PolarHBondContact O-N 3.33Å; Y222-G226 WeakPolarHBondContact O-CA 3.38Å; Y222-G226 PolarHBondContact O-N 2.93Å; Y222-Y231 AromaticContact CD1-CD1 3.85Å; Y222-Y231 HydrophobicContact CD1-CD1 3.85Å; Y222-Y231 HydrophobicContact CD1-CD2 4.46Å; Y222-Y231 AromaticContact CD1-CE1 3.62Å; Y222-Y231 HydrophobicContact CD1-CE1 3.62Å; Y222-Y231 HydrophobicContact CD1-CE2 4.28Å; Y222-Y231 HydrophobicContact CD1-CG 4.25Å; Y222-Y231 AromaticContact CD1-CZ 3.83Å; Y222-Y231 HydrophobicContact CE1-CE1 4.33Å; Y222-Y231 WeakPolarHBondContact O-CE2 3.44Å; Y222-F236 HydrophobicContact CD1-CZ 4.24Å; Y222-F236 AromaticContact CD2-CE1 3.67Å; Y222-F236 HydrophobicContact CD2-CE1 3.67Å; Y222-F236 AromaticContact CD2-CZ 3.85Å; Y222-F236 HydrophobicContact CD2-CZ 3.85Å; Y222-F236 AromaticContact CE2-CE1 3.96Å; Y222-F236 HydrophobicContact CE2-CE1 3.96Å; Y222-F236 HydrophobicContact CE2-CZ 4.22Å; Y222-F236 HydrophobicContact CG-CE1 4.12Å; Y222-F236 AromaticContact CG-CZ 3.83Å; Y222-F236 HydrophobicContact CG-CZ 3.83Å |
| 223 | S | 98.7 | Very high | 98.3 | Very high | 64 Ų | 64 | 40.8 Ų | 40.8 | 45% | 0.448 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -65.5 | -28.1 | 179.3 | -57.1 | 0 | 0 | 0 | 0 | 113.4 | Y219 L220 | Y219-S223 WeakPolarHBondContact O-CB 3.36Å; Y219-S223 PolarHBondContact O-N 2.91Å; Y219-S223 PolarHBondContact O-OG 2.72Å; L220-S223 PolarHBondContact O-N 2.93Å |
| 224 | Y | 98.7 | Very high | 98.3 | Very high | 97 Ų | 97 | 48.3 Ų | 48.3 | 38% | 0.38 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -98 | -46.2 | -176.7 | -169.8 | -85.4 | 0 | 0 | 0 | 113.5 | F191 L220 A221 Y222 M260 L261 | F191-Y224 HydrophobicContact CE1-CD1 4.36Å; F191-Y224 AromaticContact CE2-CD1 3.71Å; F191-Y224 HydrophobicContact CE2-CD1 3.71Å; F191-Y224 AromaticContact CE2-CE1 3.92Å; F191-Y224 HydrophobicContact CE2-CE1 3.92Å; F191-Y224 AromaticContact CZ-CD1 3.43Å; F191-Y224 HydrophobicContact CZ-CD1 3.43Å; F191-Y224 VanDerWaalsContact CZ-CD1 3.43Å; F191-Y224 HydrophobicContact CZ-CE1 4.02Å; F191-Y224 AromaticContact CZ-CG 3.91Å; F191-Y224 HydrophobicContact CZ-CG 3.91Å; L220-Y224 WeakPolarHBondContact O-CB 3.49Å; L220-Y224 PolarHBondContact O-N 2.9Å; A221-Y224 PolarHBondContact O-N 3.35Å; Y222-Y224 VanDerWaalsContact C-N 3.26Å; Y222-Y224 PolarHBondContact O-N 3.33Å; Y224-M260 HydrophobicContact CD1-CE 4.39Å; Y224-M260 HydrophobicContact CD2-CE 3.56Å; Y224-M260 HydrophobicContact CE1-CB 4.48Å; Y224-M260 HydrophobicContact CE2-CB 4.48Å; Y224-M260 HydrophobicContact CE2-CE 4.15Å; Y224-M260 HydrophobicContact CG-CE 3.69Å; Y224-L261 WeakPolarHBondContact OH-CA 3.24Å |
| 225 | M | 98.6 | Very high | 98.2 | Very high | 42 Ų | 42 | 49.2 Ų | 49.2 | 21% | 0.207 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -101.7 | -8.1 | -175.1 | -62.9 | -65.3 | -67.2 | 0 | 0 | 113.2 | F183 F191 A221 N264 | F183-M225 HydrophobicContact CE2-CB 3.86Å; F183-M225 HydrophobicContact CZ-CB 4.16Å; F191-M225 HydrophobicContact CB-CG 4.26Å; F191-M225 HydrophobicContact CD1-CG 3.76Å; F191-M225 HydrophobicContact CD2-CE 4.44Å; F191-M225 HydrophobicContact CD2-CG 3.64Å; F191-M225 HydrophobicContact CD2-SD 3.67Å; F191-M225 HydrophobicContact CE1-CG 3.92Å; F191-M225 HydrophobicContact CE2-CG 3.82Å; F191-M225 HydrophobicContact CE2-SD 3.77Å; F191-M225 HydrophobicContact CG-CG 3.61Å; F191-M225 HydrophobicContact CG-SD 4.24Å; F191-M225 HydrophobicContact CZ-CG 3.95Å; F191-M225 HydrophobicContact CZ-SD 4.38Å; A221-M225 WeakPolarHBondContact O-CA 3.47Å; A221-M225 WeakPolarHBondContact O-CB 3.03Å; A221-M225 PolarHBondContact O-N 2.81Å; M225-N264 WeakPolarHBondContact CE-OD1 3.36Å; M225-N264 PolarHBondContact SD-ND2 2.85Å; M225-N264 PolarHBondContact SD-OD1 2.94Å |
| 226 | G | 97.9 | Very high | 98.2 | Very high | 20 Ų | 20 | 48.7 Ų | 48.7 | 21% | 0.206 | 25% | 0.254 | C | S | . | . | trans | -72.4 | 152 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y222 Y231 | Y222-G226 WeakPolarHBondContact O-CA 3.38Å; Y222-G226 PolarHBondContact O-N 2.93Å; G226-Y231 VanDerWaalsContact CA-OH 3.31Å; G226-Y231 WeakPolarHBondContact CA-OH 3.17Å | ||
| 227 | N | 97.8 | Very high | 98.1 | Very high | 141 Ų | 141 | 50.6 Ų | 50.6 | 75% | 0.754 | 26% | 0.263 | S | S | * | . | S | Bend | trans | -82.5 | -18.5 | 179.8 | -63.5 | -37.5 | 0 | 0 | 0 | 112.7 | Y231 | N227-Y231 PolarHBondContact N-OH 2.84Š|
| 228 | E | 98.3 | Very high | 97.8 | Very high | 68 Ų | 68 | 52.5 Ų | 52.5 | 32% | 0.318 | 27% | 0.273 | S | S | . | . | S | Bend | trans | -84 | 146.5 | -177.3 | -50.4 | -59.3 | 152.9 | 0 | 0 | 110.5 | W178 Q179 S230 Y231 | W178-E228 WeakPolarHBondContact O-CG 3.33Å; Q179-E228 HydrophobicContact CB-CG 3.9Å; E228-S230 PolarHBondContact O-N 3.35Å; E228-S230 VanDerWaalsContact O-N 3.15Å; E228-Y231 HydrophobicContact CB-CE1 3.99Å; E228-Y231 HydrophobicContact CB-CE2 3.94Å; E228-Y231 HydrophobicContact CG-CE1 3.81Å; E228-Y231 HydrophobicContact CG-CE2 4.5Å; E228-Y231 WeakPolarHBondContact CG-OH 3.09Å; E228-Y231 PolarHBondContact N-OH 2.79Å |
| 229 | I | 98.1 | Very high | 97.5 | Very high | 177 Ų | 177 | 59.7 Ų | 59.7 | 91% | 0.908 | 31% | 0.312 | S | S | * | . | S | Bend | trans | -65 | -19.7 | -180 | 62.1 | 170.2 | 0 | 0 | 0 | 113.4 | ||
| 230 | S | 98.3 | Very high | 97 | Very high | 69 Ų | 69 | 61.1 Ų | 61.1 | 48% | 0.483 | 33% | 0.327 | S | S | . | . | trans | -163.6 | 151.4 | -179.9 | 65 | 0 | 0 | 0 | 0 | 111.4 | E228 | E228-S230 PolarHBondContact O-N 3.35Å; E228-S230 VanDerWaalsContact O-N 3.15Å | ||
| 231 | Y | 98.6 | Very high | 96.6 | Very high | 15 Ų | 15 | 60.9 Ų | 60.9 | 6% | 0.059 | 33% | 0.326 | C | S | . | . | trans | -122.6 | 144 | 172.5 | -66.1 | -85.7 | 0 | 0 | 0 | 110.9 | L173 Q179 Y222 G226 N227 E228 | L173-Y231 HydrophobicContact CD1-CD1 4Å; L173-Y231 HydrophobicContact CD1-CE1 4.42Å; L173-Y231 HydrophobicContact CD2-CD1 4.29Å; Q179-Y231 HydrophobicContact CB-CE1 4.38Å; Y222-Y231 AromaticContact CD1-CD1 3.85Å; Y222-Y231 HydrophobicContact CD1-CD1 3.85Å; Y222-Y231 HydrophobicContact CD1-CD2 4.46Å; Y222-Y231 AromaticContact CD1-CE1 3.62Å; Y222-Y231 HydrophobicContact CD1-CE1 3.62Å; Y222-Y231 HydrophobicContact CD1-CE2 4.28Å; Y222-Y231 HydrophobicContact CD1-CG 4.25Å; Y222-Y231 AromaticContact CD1-CZ 3.83Å; Y222-Y231 HydrophobicContact CE1-CE1 4.33Å; Y222-Y231 WeakPolarHBondContact O-CE2 3.44Å; G226-Y231 VanDerWaalsContact CA-OH 3.31Å; G226-Y231 WeakPolarHBondContact CA-OH 3.17Å; N227-Y231 PolarHBondContact N-OH 2.84Å; E228-Y231 HydrophobicContact CB-CE1 3.99Å; E228-Y231 HydrophobicContact CB-CE2 3.94Å; E228-Y231 HydrophobicContact CG-CE1 3.81Å; E228-Y231 HydrophobicContact CG-CE2 4.5Å; E228-Y231 WeakPolarHBondContact CG-OH 3.09Å; E228-Y231 PolarHBondContact N-OH 2.79Å | ||
| 232 | P | 98 | Very high | 96.4 | Very high | 23 Ų | 23 | 66.8 Ų | 66.8 | 15% | 0.149 | 35% | 0.352 | C | S | . | . | trans | -69.1 | 145.1 | 179 | 32.2 | -38.4 | 0 | 0 | 0 | 110.5 | L173 W178 P235 F236 | L173-P232 HydrophobicContact CD2-CG 3.64Å; W178-P232 HydrophobicContact CD2-CB 4.21Å; W178-P232 HydrophobicContact CD2-CG 3.6Å; W178-P232 HydrophobicContact CE3-CB 4.49Å; W178-P232 HydrophobicContact CE3-CG 4.13Å; W178-P232 HydrophobicContact CG-CG 3.79Å; W178-P232 HydrophobicContact CH2-CB 4.08Å; W178-P232 HydrophobicContact CZ2-CB 3.77Å; W178-P232 HydrophobicContact CZ2-CG 4.03Å; W178-P232 HydrophobicContact CZ3-CB 4.42Å; P232-P235 HydrophobicContact CG-CG 4.13Å; P232-P235 VanDerWaalsContact O-CD 3.32Å; P232-P235 WeakPolarHBondContact O-CD 3.38Å; P232-F236 VanDerWaalsContact O-CD2 3.23Å; P232-F236 WeakPolarHBondContact O-CD2 3.23Å; P232-F236 WeakPolarHBondContact O-CE2 3.36Å | ||
| 233 | L | 97.6 | Very high | 96.2 | Very high | 53 Ų | 53 | 74.1 Ų | 74.1 | 28% | 0.277 | 39% | 0.391 | S | S | . | . | S | Bend | trans | -70.6 | -34 | 179 | -179.2 | 62.4 | 0 | 0 | 0 | 113.3 | Y219 P235 F236 I237 F245 W246 | Y219-L233 HydrophobicContact CE2-CD1 4.49Å; L233-P235 VanDerWaalsContact C-CD 3.48Å; L233-F236 PolarHBondContact O-N 3.45Å; L233-I237 HydrophobicContact CD1-CB 4.28Å; L233-I237 HydrophobicContact CD1-CD1 4.33Å; L233-I237 HydrophobicContact CD2-CD1 3.88Å; L233-I237 HydrophobicContact CG-CB 4.16Å; L233-I237 HydrophobicContact CG-CD1 4.16Å; L233-I237 HydrophobicContact CG-CG2 4.04Å; L233-I237 PolarHBondContact O-N 3.36Å; L233-F245 HydrophobicContact CD1-CD1 3.9Å; L233-F245 HydrophobicContact CD1-CE1 3.3Å; L233-F245 HydrophobicContact CD1-CE2 4.09Å; L233-F245 HydrophobicContact CD1-CZ 3.39Å; L233-W246 HydrophobicContact CD1-CH2 4.36Å; L233-W246 HydrophobicContact CD1-CZ2 4.2Å; L233-W246 HydrophobicContact CD2-CZ2 3.84Å |
| 234 | K | 97 | Very high | 96 | Very high | 181 Ų | 181 | 74.2 Ų | 74.2 | 79% | 0.787 | 39% | 0.389 | S | S | * | . | G | 310 helix | trans | -52.4 | -40.4 | -168.3 | -175.3 | 173.2 | -178.6 | 170.3 | 0 | 114.9 | F236 | K234-F236 PolarHBondContact O-N 3.16Š|
| 235 | P | 97.1 | Very high | 96 | Very high | 19 Ų | 19 | 69.6 Ų | 69.6 | 12% | 0.123 | 37% | 0.371 | C | S | . | . | G | 310 helix | trans | -68.2 | -18.4 | 177 | -22.7 | 36.6 | 0 | 0 | 0 | 115 | I169 I172 L173 P232 L233 | I169-P235 HydrophobicContact CG2-CB 4.34Å; I172-P235 HydrophobicContact CG2-CB 4.29Å; I172-P235 HydrophobicContact CG2-CG 3.99Å; L173-P235 HydrophobicContact CD2-CG 4.08Å; P232-P235 HydrophobicContact CG-CG 4.13Å; P232-P235 VanDerWaalsContact O-CD 3.32Å; P232-P235 WeakPolarHBondContact O-CD 3.38Å; L233-P235 VanDerWaalsContact C-CD 3.48Å |
| 236 | F | 97.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 39% | 0.385 | C | S | . | . | G | 310 helix | trans | -107.7 | -3.4 | -172 | -56.3 | -90.6 | 0 | 0 | 0 | 113.8 | I169 L173 Q215 L218 Y219 Y222 P232 L233 K234 F245 | I169-F236 HydrophobicContact CD1-CD1 4.27Å; I169-F236 HydrophobicContact CG2-CD1 4.05Å; I169-F236 HydrophobicContact CG2-CE1 3.51Å; I169-F236 HydrophobicContact CG2-CE2 4.43Å; I169-F236 HydrophobicContact CG2-CZ 3.74Å; L173-F236 HydrophobicContact CD1-CE2 4.25Å; L173-F236 HydrophobicContact CD1-CZ 3.85Å; Q215-F236 WeakPolarHBondContact CB-O 3.19Å; Q215-F236 PolarHBondContact OE1-O 3.45Å; L218-F236 HydrophobicContact CB-CD1 3.99Å; L218-F236 HydrophobicContact CB-CE1 3.98Å; Y219-F236 HydrophobicContact CD2-CB 4.31Å; Y219-F236 AromaticContact CD2-CD2 3.75Å; Y219-F236 HydrophobicContact CD2-CD2 3.75Å; Y219-F236 HydrophobicContact CD2-CE2 4.11Å; Y219-F236 AromaticContact CD2-CG 3.97Å; Y219-F236 HydrophobicContact CD2-CG 3.97Å; Y219-F236 HydrophobicContact CG-CB 4.47Å; Y219-F236 HydrophobicContact CG-CG 4.37Å; Y222-F236 HydrophobicContact CD1-CZ 4.24Å; Y222-F236 AromaticContact CD2-CE1 3.67Å; Y222-F236 HydrophobicContact CD2-CE1 3.67Å; Y222-F236 AromaticContact CD2-CZ 3.85Å; Y222-F236 HydrophobicContact CD2-CZ 3.85Å; Y222-F236 AromaticContact CE2-CE1 3.96Å; Y222-F236 HydrophobicContact CE2-CE1 3.96Å; Y222-F236 HydrophobicContact CE2-CZ 4.22Å; Y222-F236 HydrophobicContact CG-CE1 4.12Å; Y222-F236 AromaticContact CG-CZ 3.83Å; Y222-F236 HydrophobicContact CG-CZ 3.83Å; P232-F236 VanDerWaalsContact O-CD2 3.23Å; P232-F236 WeakPolarHBondContact O-CD2 3.23Å; P232-F236 WeakPolarHBondContact O-CE2 3.36Å; L233-F236 PolarHBondContact O-N 3.45Å; K234-F236 PolarHBondContact O-N 3.16Å; F236-F245 HydrophobicContact CB-CE2 4.33Å; F236-F245 HydrophobicContact CB-CZ 4.48Å; F236-F245 WeakPolarHBondContact O-CE2 3.43Å |
| 237 | I | 95.4 | Very high | 95.9 | Very high | 41 Ų | 41 | 78.2 Ų | 78.2 | 21% | 0.21 | 40% | 0.4 | C | S | . | . | trans | -118.7 | 135.5 | -177.4 | -158.5 | 164.6 | 0 | 0 | 0 | 109.7 | L233 K242 F245 | L233-I237 HydrophobicContact CD1-CB 4.28Å; L233-I237 HydrophobicContact CD1-CD1 4.33Å; L233-I237 HydrophobicContact CD2-CD1 3.88Å; L233-I237 HydrophobicContact CG-CB 4.16Å; L233-I237 HydrophobicContact CG-CD1 4.16Å; L233-I237 HydrophobicContact CG-CG2 4.04Å; L233-I237 PolarHBondContact O-N 3.36Å; I237-K242 HydrophobicContact CD1-CB 4.27Å; I237-K242 HydrophobicContact CD1-CG 3.93Å; I237-K242 HydrophobicContact CG1-CB 4.27Å; I237-K242 HydrophobicContact CG1-CG 4.37Å; I237-F245 HydrophobicContact CD1-CB 4.1Å; I237-F245 HydrophobicContact CD1-CD2 4.42Å; I237-F245 HydrophobicContact CD1-CG 4.13Å; I237-F245 HydrophobicContact CG1-CD2 4.26Å; I237-F245 HydrophobicContact CG1-CG 4.44Å | ||
| 238 | I | 93.1 | Very high | 95.8 | Very high | 40 Ų | 40 | 72.5 Ų | 72.5 | 21% | 0.205 | 37% | 0.37 | C | S | . | . | trans | -125.8 | 163.4 | 175.5 | 54.7 | 174.9 | 0 | 0 | 0 | 108.6 | Q211 S240 N241 K242 | Q211-I238 HydrophobicContact CB-CD1 4.15Å; Q211-I238 HydrophobicContact CG-CD1 4.08Å; I238-S240 WeakPolarHBondContact CD1-OG 3.49Å; I238-S240 WeakPolarHBondContact CG1-OG 3.5Å; I238-S240 PolarHBondContact O-N 3.26Å; I238-S240 VanDerWaalsContact O-N 3.15Å; I238-N241 HydrophobicContact CG1-CB 4.44Å; I238-N241 VanDerWaalsContact CG1-OD1 3.23Å; I238-N241 WeakPolarHBondContact CG1-OD1 3.44Å; I238-N241 PolarHBondContact N-OD1 3.44Å; I238-N241 PolarHBondContact O-N 3.3Å; I238-N241 VanDerWaalsContact O-N 3.17Å; I238-N241 PolarHBondContact O-OD1 3.31Å; I238-K242 PolarHBondContact O-N 3.32Å | ||
| 239 | D | 91.7 | Very high | 95.8 | Very high | 151 Ų | 151 | 69.5 Ų | 69.5 | 81% | 0.807 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -31.2 | -175.5 | -66.2 | -33.4 | 0 | 0 | 0 | 112.3 | N241 | D239-N241 PolarHBondContact O-N 3.49Š|
| 240 | S | 87.4 | Confident | 95.8 | Very high | 69 Ų | 69 | 66.7 Ų | 66.7 | 48% | 0.483 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -21.3 | -179.6 | 59.6 | 0 | 0 | 0 | 0 | 115.1 | A208 I238 | A208-S240 PolarHBondContact O-OG 3.44Å; I238-S240 WeakPolarHBondContact CD1-OG 3.49Å; I238-S240 WeakPolarHBondContact CG1-OG 3.5Å; I238-S240 PolarHBondContact O-N 3.26Å; I238-S240 VanDerWaalsContact O-N 3.15Å |
| 241 | N | 91.1 | Very high | 95.8 | Very high | 8 Ų | 8 | 68.6 Ų | 68.6 | 4% | 0.043 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -116.9 | 1.6 | -178.8 | 74.8 | -23.1 | 0 | 0 | 0 | 113.8 | G212 I238 D239 D243 V244 F245 | G212-N241 VanDerWaalsContact CA-ND2 3.26Å; G212-N241 WeakPolarHBondContact CA-ND2 3.23Å; G212-N241 PolarHBondContact O-ND2 3.2Å; I238-N241 HydrophobicContact CG1-CB 4.44Å; I238-N241 VanDerWaalsContact CG1-OD1 3.23Å; I238-N241 WeakPolarHBondContact CG1-OD1 3.44Å; I238-N241 PolarHBondContact N-OD1 3.44Å; I238-N241 PolarHBondContact O-N 3.3Å; I238-N241 VanDerWaalsContact O-N 3.17Å; I238-N241 PolarHBondContact O-OD1 3.31Å; D239-N241 PolarHBondContact O-N 3.49Å; N241-D243 VanDerWaalsContact C-N 3.33Å; N241-D243 PolarHBondContact O-N 2.97Å; N241-V244 HydrophobicContact CB-CG2 4.19Å; N241-V244 CarbonylContact O-C 3.56Å; N241-V244 WeakPolarHBondContact O-CG2 3.43Å; N241-V244 PolarHBondContact O-N 2.98Å; N241-V244 VanDerWaalsContact O-N 3.15Å; N241-F245 WeakPolarHBondContact O-CA 3.33Å; N241-F245 WeakPolarHBondContact O-CB 3.49Å; N241-F245 PolarHBondContact O-N 3.12Å |
| 242 | K | 93.9 | Very high | 95.8 | Very high | 125 Ų | 125 | 68.4 Ų | 68.4 | 54% | 0.543 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -43.3 | -170.9 | -173.4 | -178.4 | 173.8 | -172 | 0 | 113.6 | I237 I238 V244 | I237-K242 HydrophobicContact CD1-CB 4.27Å; I237-K242 HydrophobicContact CD1-CG 3.93Å; I237-K242 HydrophobicContact CG1-CB 4.27Å; I237-K242 HydrophobicContact CG1-CG 4.37Å; I238-K242 PolarHBondContact O-N 3.32Å; K242-V244 VanDerWaalsContact C-N 3.33Å |
| 243 | D | 95.3 | Very high | 95.8 | Very high | 154 Ų | 154 | 70.8 Ų | 70.8 | 82% | 0.824 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.4 | -17.1 | -175.6 | -59 | -36.6 | 0 | 0 | 0 | 113 | N241 | N241-D243 VanDerWaalsContact C-N 3.33Å; N241-D243 PolarHBondContact O-N 2.97Å |
| 244 | V | 94.8 | Very high | 95.9 | Very high | 66 Ų | 66 | 74.5 Ų | 74.5 | 40% | 0.4 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.9 | -5.5 | -178.3 | -61.8 | 0 | 0 | 0 | 0 | 113.3 | N241 K242 W246 E247 T248 | N241-V244 HydrophobicContact CB-CG2 4.19Å; N241-V244 CarbonylContact O-C 3.56Å; N241-V244 WeakPolarHBondContact O-CG2 3.43Å; N241-V244 PolarHBondContact O-N 2.98Å; N241-V244 VanDerWaalsContact O-N 3.15Å; K242-V244 VanDerWaalsContact C-N 3.33Å; V244-W246 PolarHBondContact O-N 3.43Å; V244-E247 PolarHBondContact O-N 2.92Å; V244-T248 VanDerWaalsContact O-CB 3.26Å; V244-T248 WeakPolarHBondContact O-CB 3.46Å; V244-T248 PolarHBondContact O-N 2.93Å; V244-T248 PolarHBondContact O-OG1 2.85Å |
| 245 | F | 97.6 | Very high | 95.9 | Very high | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -57.5 | -51.4 | -171.9 | -177.8 | -88.4 | 0 | 0 | 0 | 112.3 | T216 Y219 L233 F236 I237 N241 T248 S249 | T216-F245 HydrophobicContact CG2-CD2 4.4Å; T216-F245 HydrophobicContact CG2-CE2 4.28Å; T216-F245 WeakPolarHBondContact OG1-CD2 3.39Å; Y219-F245 AromaticContact CD1-CE1 3.77Å; Y219-F245 HydrophobicContact CD1-CE1 3.77Å; Y219-F245 AromaticContact CD1-CZ 3.54Å; Y219-F245 HydrophobicContact CD1-CZ 3.54Å; Y219-F245 HydrophobicContact CD2-CZ 4.36Å; Y219-F245 HydrophobicContact CE1-CE1 4.07Å; Y219-F245 HydrophobicContact CE1-CZ 4.24Å; Y219-F245 HydrophobicContact CG-CE1 4.26Å; Y219-F245 AromaticContact CG-CZ 3.6Å; Y219-F245 HydrophobicContact CG-CZ 3.6Å; L233-F245 HydrophobicContact CD1-CD1 3.9Å; L233-F245 HydrophobicContact CD1-CE1 3.3Å; L233-F245 HydrophobicContact CD1-CE2 4.09Å; L233-F245 HydrophobicContact CD1-CZ 3.39Å; F236-F245 HydrophobicContact CB-CE2 4.33Å; F236-F245 HydrophobicContact CB-CZ 4.48Å; F236-F245 WeakPolarHBondContact O-CE2 3.43Å; I237-F245 HydrophobicContact CD1-CB 4.1Å; I237-F245 HydrophobicContact CD1-CD2 4.42Å; I237-F245 HydrophobicContact CD1-CG 4.13Å; I237-F245 HydrophobicContact CG1-CD2 4.26Å; I237-F245 HydrophobicContact CG1-CG 4.44Å; N241-F245 WeakPolarHBondContact O-CA 3.33Å; N241-F245 WeakPolarHBondContact O-CB 3.49Å; N241-F245 PolarHBondContact O-N 3.12Å; F245-T248 PolarHBondContact O-N 3.31Å; F245-S249 WeakPolarHBondContact O-CB 3.33Å; F245-S249 PolarHBondContact O-N 2.94Å; F245-S249 PolarHBondContact O-OG 3.05Å |
| 246 | W | 97.9 | Very high | 95.9 | Very high | 134 Ų | 134 | 71.6 Ų | 71.6 | 51% | 0.508 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -72.2 | -38.6 | -177.4 | -66.7 | 121.3 | 0 | 0 | 0 | 112.4 | Y219 L233 V244 T248 S249 L250 | Y219-W246 AromaticContact CE1-CH2 3.95Å; Y219-W246 HydrophobicContact CE1-CH2 3.95Å; Y219-W246 AromaticContact CE1-CZ3 3.77Å; Y219-W246 HydrophobicContact CE1-CZ3 3.77Å; L233-W246 HydrophobicContact CD1-CH2 4.36Å; L233-W246 HydrophobicContact CD1-CZ2 4.2Å; L233-W246 HydrophobicContact CD2-CZ2 3.84Å; V244-W246 PolarHBondContact O-N 3.43Å; W246-T248 VanDerWaalsContact C-N 3.33Å; W246-T248 PolarHBondContact O-N 3.45Å; W246-S249 WeakPolarHBondContact O-CB 3.45Å; W246-S249 PolarHBondContact O-N 3.24Å; W246-L250 WeakPolarHBondContact O-CG 3.35Å; W246-L250 PolarHBondContact O-N 3.39Å |
| 247 | E | 97.2 | Very high | 96 | Very high | 109 Ų | 109 | 73.9 Ų | 73.9 | 51% | 0.509 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 175.2 | -162.8 | -154.5 | 146.4 | 0 | 0 | 110.9 | V244 S249 L250 R251 | V244-E247 PolarHBondContact O-N 2.92Å; E247-S249 VanDerWaalsContact C-N 3.35Å; E247-L250 PolarHBondContact O-N 3.17Å; E247-R251 WeakPolarHBondContact O-CB 3.3Å; E247-R251 PolarHBondContact O-N 3.1Å; E247-R251 IonicContact OE1-CZ 3.85Å; E247-R251 IonicContact OE1-NH2 2.7Å; E247-R251 PolarHBondContact OE1-NH2 3.1Å |
| 248 | T | 96.1 | Very high | 96.1 | Very high | 21 Ų | 21 | 78 Ų | 78 | 13% | 0.129 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -64.1 | -41.3 | 175.5 | -56.3 | 0 | 0 | 0 | 0 | 111 | T216 V244 F245 W246 R251 I252 | T216-T248 HydrophobicContact CG2-CG2 4.02Å; V244-T248 VanDerWaalsContact O-CB 3.26Å; V244-T248 WeakPolarHBondContact O-CB 3.46Å; V244-T248 PolarHBondContact O-N 2.93Å; V244-T248 PolarHBondContact O-OG1 2.85Å; F245-T248 PolarHBondContact O-N 3.31Å; W246-T248 VanDerWaalsContact C-N 3.33Å; W246-T248 PolarHBondContact O-N 3.45Å; T248-R251 PolarHBondContact O-N 3.43Å; T248-I252 HydrophobicContact CG2-CD1 3.95Å; T248-I252 HydrophobicContact CG2-CG1 4.47Å; T248-I252 VanDerWaalsContact O-CG1 3.27Å; T248-I252 WeakPolarHBondContact O-CG1 3.25Å; T248-I252 PolarHBondContact O-N 3.12Å |
| 249 | S | 98.2 | Very high | 96.4 | Very high | 4 Ų | 4 | 79.3 Ų | 79.3 | 3% | 0.028 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -59.1 | -51.2 | 176.7 | -62.8 | 0 | 0 | 0 | 0 | 111.8 | T216 F245 W246 E247 R251 I252 I253 | T216-S249 VanDerWaalsContact CG2-OG 3.31Å; T216-S249 WeakPolarHBondContact CG2-OG 3.42Å; F245-S249 WeakPolarHBondContact O-CB 3.33Å; F245-S249 PolarHBondContact O-N 2.94Å; F245-S249 PolarHBondContact O-OG 3.05Å; W246-S249 WeakPolarHBondContact O-CB 3.45Å; W246-S249 PolarHBondContact O-N 3.24Å; E247-S249 VanDerWaalsContact C-N 3.35Å; S249-R251 VanDerWaalsContact C-N 3.32Å; S249-R251 PolarHBondContact O-N 3.25Å; S249-I252 PolarHBondContact O-N 3.21Å; S249-I253 WeakPolarHBondContact O-CG1 3.32Å; S249-I253 PolarHBondContact O-N 3.48Å |
| 250 | L | 98.3 | Very high | 96.7 | Very high | 118 Ų | 118 | 72.6 Ų | 72.6 | 62% | 0.618 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -61.2 | -41.6 | 178.7 | -69.7 | 173.2 | 0 | 0 | 0 | 111.5 | W246 E247 I252 I253 D254 | W246-L250 WeakPolarHBondContact O-CG 3.35Å; W246-L250 PolarHBondContact O-N 3.39Å; E247-L250 PolarHBondContact O-N 3.17Å; L250-I252 VanDerWaalsContact C-N 3.35Å; L250-I252 PolarHBondContact O-N 2.99Å; L250-I253 PolarHBondContact O-N 3.39Å; L250-D254 WeakPolarHBondContact O-CB 3.31Å; L250-D254 PolarHBondContact O-N 3Å |
| 251 | R | 97.9 | Very high | 97.2 | Very high | 110 Ų | 110 | 74.1 Ų | 74.1 | 42% | 0.415 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 176.9 | -168.7 | -171 | -58.2 | 158.9 | -0.9 | 112.5 | E247 T248 S249 R255 | E247-R251 WeakPolarHBondContact O-CB 3.3Å; E247-R251 PolarHBondContact O-N 3.1Å; E247-R251 IonicContact OE1-CZ 3.85Å; E247-R251 IonicContact OE1-NH2 2.7Å; E247-R251 PolarHBondContact OE1-NH2 3.1Å; T248-R251 PolarHBondContact O-N 3.43Å; S249-R251 VanDerWaalsContact C-N 3.32Å; S249-R251 PolarHBondContact O-N 3.25Å; R251-R255 WeakPolarHBondContact O-CB 3.33Å; R251-R255 WeakPolarHBondContact O-CG 3.31Å; R251-R255 PolarHBondContact O-N 3.37Å |
| 252 | I | 98.1 | Very high | 97.6 | Very high | 10 Ų | 10 | 77.7 Ų | 77.7 | 5% | 0.051 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -66.6 | -45.4 | 176.4 | -68.1 | 167.4 | 0 | 0 | 0 | 110 | L195 A199 T216 L220 T248 S249 L250 R255 L256 | L195-I252 HydrophobicContact CD2-CG2 4.06Å; A199-I252 HydrophobicContact CB-CD1 3.71Å; A199-I252 HydrophobicContact CB-CG1 3.89Å; T216-I252 HydrophobicContact CG2-CD1 4.2Å; L220-I252 HydrophobicContact CD1-CB 3.6Å; L220-I252 HydrophobicContact CD1-CD1 3.98Å; L220-I252 HydrophobicContact CD1-CG1 4.41Å; L220-I252 HydrophobicContact CD1-CG2 3.44Å; L220-I252 VanDerWaalsContact CD1-CG2 3.44Å; T248-I252 HydrophobicContact CG2-CD1 3.95Å; T248-I252 HydrophobicContact CG2-CG1 4.47Å; T248-I252 VanDerWaalsContact O-CG1 3.27Å; T248-I252 WeakPolarHBondContact O-CG1 3.25Å; T248-I252 PolarHBondContact O-N 3.12Å; S249-I252 PolarHBondContact O-N 3.21Å; L250-I252 VanDerWaalsContact C-N 3.35Å; L250-I252 PolarHBondContact O-N 2.99Å; I252-R255 PolarHBondContact O-N 3.06Å; I252-L256 HydrophobicContact CG2-CD1 3.86Å; I252-L256 HydrophobicContact CG2-CG 4.43Å; I252-L256 VanDerWaalsContact O-CB 3.3Å; I252-L256 WeakPolarHBondContact O-CB 3.44Å; I252-L256 PolarHBondContact O-N 3.38Å |
| 253 | I | 98.6 | Very high | 97.7 | Very high | 73 Ų | 73 | 72.2 Ų | 72.2 | 37% | 0.374 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.4 | -48.9 | 178.8 | -68.1 | 164.8 | 0 | 0 | 0 | 110.9 | L220 S249 L250 R255 L256 S257 | L220-I253 HydrophobicContact CD1-CG1 4.36Å; L220-I253 HydrophobicContact CD2-CD1 3.85Å; L220-I253 HydrophobicContact CD2-CG1 4.02Å; S249-I253 WeakPolarHBondContact O-CG1 3.32Å; S249-I253 PolarHBondContact O-N 3.48Å; L250-I253 PolarHBondContact O-N 3.39Å; I253-R255 VanDerWaalsContact C-N 3.29Å; I253-R255 PolarHBondContact O-N 3.49Å; I253-L256 PolarHBondContact O-N 3.03Å; I253-S257 WeakPolarHBondContact O-CB 3.39Å; I253-S257 PolarHBondContact O-N 3.08Å; I253-S257 PolarHBondContact O-OG 3.46Å |
| 254 | D | 98.4 | Very high | 97.8 | Very high | 132 Ų | 132 | 68.9 Ų | 68.9 | 71% | 0.706 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -56.3 | -44.7 | 179.8 | -177.4 | 67.7 | 0 | 0 | 0 | 111.5 | L250 | L250-D254 WeakPolarHBondContact O-CB 3.31Å; L250-D254 PolarHBondContact O-N 3Å |
| 255 | R | 97.9 | Very high | 97.9 | Very high | 134 Ų | 134 | 69.4 Ų | 69.4 | 51% | 0.506 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -80.2 | -33.7 | -177.6 | -67.5 | -176.6 | 67.6 | -144.3 | -10.7 | 114.4 | E198 R251 I252 I253 | E198-R255 IonicContact OE2-CZ 3.85Å; E198-R255 IonicContact OE2-NH2 3.79Å; E198-R255 PolarHBondContact OE2-NH2 2.74Å; R251-R255 WeakPolarHBondContact O-CB 3.33Å; R251-R255 WeakPolarHBondContact O-CG 3.31Å; R251-R255 PolarHBondContact O-N 3.37Å; I252-R255 PolarHBondContact O-N 3.06Å; I253-R255 VanDerWaalsContact C-N 3.29Å; I253-R255 PolarHBondContact O-N 3.49Å |
| 256 | L | 98.2 | Very high | 97.9 | Very high | 4 Ų | 4 | 71.9 Ų | 71.9 | 2% | 0.021 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -115 | -7.8 | -166.4 | -57.5 | -177.3 | 0 | 0 | 0 | 115 | L195 E198 I252 I253 N258 K259 M260 | L195-L256 HydrophobicContact CD2-CB 4.44Å; L195-L256 HydrophobicContact CD2-CD1 3.83Å; E198-L256 HydrophobicContact CB-CD1 3.71Å; E198-L256 HydrophobicContact CB-CD2 3.68Å; E198-L256 HydrophobicContact CB-CG 4.22Å; E198-L256 HydrophobicContact CG-CD1 4.36Å; E198-L256 HydrophobicContact CG-CD2 3.61Å; I252-L256 HydrophobicContact CG2-CD1 3.86Å; I252-L256 HydrophobicContact CG2-CG 4.43Å; I252-L256 VanDerWaalsContact O-CB 3.3Å; I252-L256 WeakPolarHBondContact O-CB 3.44Å; I252-L256 PolarHBondContact O-N 3.38Å; I253-L256 PolarHBondContact O-N 3.03Å; L256-N258 PolarHBondContact O-N 3.41Å; L256-N258 VanDerWaalsContact O-N 3.13Å; L256-K259 HydrophobicContact CD2-CD 4.15Å; L256-K259 CarbonylContact O-C 3.59Å; L256-K259 WeakPolarHBondContact O-CA 3.27Å; L256-K259 PolarHBondContact O-N 3.12Å; L256-M260 HydrophobicContact CB-CG 4.3Å; L256-M260 HydrophobicContact CB-SD 4.21Å; L256-M260 VanDerWaalsContact O-CG 3.27Å; L256-M260 WeakPolarHBondContact O-CG 3.47Å; L256-M260 PolarHBondContact O-N 3.15Å |
| 257 | S | 98.4 | Very high | 97.8 | Very high | 49 Ų | 49 | 69.9 Ų | 69.9 | 34% | 0.343 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -49.1 | -43.1 | 180 | 50.5 | 0 | 0 | 0 | 0 | 113.3 | I253 M260 L261 | I253-S257 WeakPolarHBondContact O-CB 3.39Å; I253-S257 PolarHBondContact O-N 3.08Å; I253-S257 PolarHBondContact O-OG 3.46Å; S257-M260 PolarHBondContact O-N 3.37Å; S257-L261 PolarHBondContact O-N 2.96Å |
| 258 | N | 98.5 | Very high | 97.7 | Very high | 128 Ų | 128 | 70.9 Ų | 70.9 | 68% | 0.684 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.6 | -46.7 | 175.4 | -68.8 | -30.5 | 0 | 0 | 0 | 112.5 | L256 L261 Q262 | L256-N258 PolarHBondContact O-N 3.41Å; L256-N258 VanDerWaalsContact O-N 3.13Å; N258-L261 PolarHBondContact O-N 3.4Å; N258-Q262 VanDerWaalsContact O-CB 3.3Å; N258-Q262 WeakPolarHBondContact O-CB 3.24Å; N258-Q262 PolarHBondContact O-N 3.04Å |
| 259 | K | 98.3 | Very high | 97.8 | Very high | 67 Ų | 67 | 71.2 Ų | 71.2 | 29% | 0.291 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -68.6 | -36.6 | 178.8 | -67.4 | -173.3 | -179.8 | -177.3 | 0 | 111.9 | L194 E198 L256 L261 Q262 L263 F269 | L194-K259 HydrophobicContact CD1-CB 4.35Å; L194-K259 HydrophobicContact CD1-CD 4.28Å; L194-K259 HydrophobicContact CD2-CB 4.2Å; E198-K259 IonicContact OE1-NZ 3.34Å; E198-K259 PolarHBondContact OE1-NZ 2.82Å; L256-K259 HydrophobicContact CD2-CD 4.15Å; L256-K259 CarbonylContact O-C 3.59Å; L256-K259 WeakPolarHBondContact O-CA 3.27Å; L256-K259 PolarHBondContact O-N 3.12Å; K259-L261 VanDerWaalsContact C-N 3.35Å; K259-Q262 PolarHBondContact O-N 3.17Å; K259-L263 WeakPolarHBondContact O-CB 3.17Å; K259-L263 PolarHBondContact O-N 3.31Å; K259-F269 HydrophobicContact CB-CE1 4.43Å; K259-F269 HydrophobicContact CB-CZ 4.41Å; K259-F269 HydrophobicContact CG-CZ 4.48Å |
| 260 | M | 98.4 | Very high | 97.8 | Very high | 9 Ų | 9 | 73.4 Ų | 73.4 | 4% | 0.044 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.8 | -44.7 | 176 | -68.4 | 164.4 | 66.5 | 0 | 0 | 111 | F191 L195 Y224 L256 S257 N264 | F191-M260 HydrophobicContact CE1-CE 4.25Å; F191-M260 HydrophobicContact CE1-CG 4.47Å; F191-M260 HydrophobicContact CE2-CB 3.95Å; F191-M260 HydrophobicContact CE2-CG 4.17Å; F191-M260 HydrophobicContact CZ-CB 3.81Å; F191-M260 HydrophobicContact CZ-CE 3.73Å; F191-M260 HydrophobicContact CZ-CG 3.67Å; F191-M260 HydrophobicContact CZ-SD 4.5Å; L195-M260 HydrophobicContact CD2-CG 3.89Å; L195-M260 HydrophobicContact CD2-SD 3.92Å; Y224-M260 HydrophobicContact CD1-CE 4.39Å; Y224-M260 HydrophobicContact CD2-CE 3.56Å; Y224-M260 HydrophobicContact CE1-CB 4.48Å; Y224-M260 HydrophobicContact CE2-CB 4.48Å; Y224-M260 HydrophobicContact CE2-CE 4.15Å; Y224-M260 HydrophobicContact CG-CE 3.69Å; L256-M260 HydrophobicContact CB-CG 4.3Å; L256-M260 HydrophobicContact CB-SD 4.21Å; L256-M260 VanDerWaalsContact O-CG 3.27Å; L256-M260 WeakPolarHBondContact O-CG 3.47Å; L256-M260 PolarHBondContact O-N 3.15Å; S257-M260 PolarHBondContact O-N 3.37Å; M260-N264 PolarHBondContact O-ND2 3.46Å |
| 261 | L | 98.6 | Very high | 97.7 | Very high | 102 Ų | 102 | 69.1 Ų | 69.1 | 53% | 0.534 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -67.7 | -44.9 | 174.1 | -177.8 | 63.1 | 0 | 0 | 0 | 111.6 | Y224 S257 N258 K259 L263 N264 A265 | Y224-L261 WeakPolarHBondContact OH-CA 3.24Å; S257-L261 PolarHBondContact O-N 2.96Å; N258-L261 PolarHBondContact O-N 3.4Å; K259-L261 VanDerWaalsContact C-N 3.35Å; L261-L263 VanDerWaalsContact C-N 3.3Å; L261-L263 PolarHBondContact O-N 2.81Å; L261-N264 PolarHBondContact O-N 3.08Å; L261-N264 VanDerWaalsContact O-N 3.07Å; L261-A265 WeakPolarHBondContact O-CB 3.38Å; L261-A265 PolarHBondContact O-N 3.5Å |
| 262 | Q | 98.4 | Very high | 97.6 | Very high | 83 Ų | 83 | 70 Ų | 70 | 39% | 0.388 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58.6 | -40.2 | 179.2 | -171.3 | -177.7 | 5.1 | 0 | 0 | 112 | N258 K259 N264 A265 D266 F269 | N258-Q262 VanDerWaalsContact O-CB 3.3Å; N258-Q262 WeakPolarHBondContact O-CB 3.24Å; N258-Q262 PolarHBondContact O-N 3.04Å; K259-Q262 PolarHBondContact O-N 3.17Å; Q262-N264 PolarHBondContact O-N 3.26Å; Q262-A265 PolarHBondContact O-N 3.48Å; Q262-A265 VanDerWaalsContact O-N 3.15Å; Q262-D266 HydrophobicContact CG-CB 4.33Å; Q262-D266 PolarHBondContact O-N 3.44Å; Q262-F269 HydrophobicContact CB-CD1 3.96Å; Q262-F269 HydrophobicContact CB-CE1 4.18Å; Q262-F269 HydrophobicContact CG-CB 4.22Å; Q262-F269 HydrophobicContact CG-CD1 3.62Å; Q262-F269 HydrophobicContact CG-CE1 4.21Å; Q262-F269 HydrophobicContact CG-CG 3.98Å |
| 263 | L | 97.6 | Very high | 97.6 | Very high | 9 Ų | 9 | 69.7 Ų | 69.7 | 5% | 0.047 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -59.4 | -30.2 | 177.9 | -159.1 | 83.3 | 0 | 0 | 0 | 112.5 | V190 F191 L194 K259 L261 F269 F270 V273 | V190-L263 HydrophobicContact CG1-CD2 4.48Å; F191-L263 HydrophobicContact CB-CD2 4.01Å; F191-L263 HydrophobicContact CD2-CD2 3.6Å; F191-L263 HydrophobicContact CG-CD2 4.21Å; L194-L263 HydrophobicContact CD2-CB 4.21Å; L194-L263 HydrophobicContact CD2-CD1 4.31Å; L194-L263 HydrophobicContact CD2-CD2 4.17Å; L194-L263 HydrophobicContact CD2-CG 4.46Å; K259-L263 WeakPolarHBondContact O-CB 3.17Å; K259-L263 PolarHBondContact O-N 3.31Å; L261-L263 VanDerWaalsContact C-N 3.3Å; L261-L263 PolarHBondContact O-N 2.81Å; L263-F269 HydrophobicContact CB-CD1 4.15Å; L263-F269 HydrophobicContact CB-CE1 4.1Å; L263-F269 HydrophobicContact CD1-CD1 3.81Å; L263-F269 HydrophobicContact CD1-CE1 3.73Å; L263-F270 HydrophobicContact CD1-CD2 4.49Å; L263-F270 HydrophobicContact CD2-CD2 4.38Å; L263-F270 HydrophobicContact CG-CD2 4.13Å; L263-V273 HydrophobicContact CD1-CB 3.86Å; L263-V273 HydrophobicContact CD1-CG1 4.21Å; L263-V273 HydrophobicContact CD1-CG2 3.72Å |
| 264 | N | 95.8 | Very high | 97.6 | Very high | 85 Ų | 85 | 66.5 Ų | 66.5 | 46% | 0.455 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -88.1 | -30.4 | 177.4 | -74.7 | -84.6 | 0 | 0 | 0 | 112.9 | M225 M260 L261 Q262 | M225-N264 WeakPolarHBondContact CE-OD1 3.36Å; M225-N264 PolarHBondContact SD-ND2 2.85Å; M225-N264 PolarHBondContact SD-OD1 2.94Å; M260-N264 PolarHBondContact O-ND2 3.46Å; L261-N264 PolarHBondContact O-N 3.08Å; L261-N264 VanDerWaalsContact O-N 3.07Å; Q262-N264 PolarHBondContact O-N 3.26Å |
| 265 | A | 97.3 | Very high | 97.4 | Very high | 76 Ų | 76 | 63.5 Ų | 63.5 | 63% | 0.628 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -86.3 | -30.2 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L261 Q262 | L261-A265 WeakPolarHBondContact O-CB 3.38Å; L261-A265 PolarHBondContact O-N 3.5Å; Q262-A265 PolarHBondContact O-N 3.48Å; Q262-A265 VanDerWaalsContact O-N 3.15Å |
| 266 | D | 97.6 | Very high | 97.4 | Very high | 52 Ų | 52 | 60.7 Ų | 60.7 | 28% | 0.278 | 32% | 0.322 | S | S | . | . | trans | -118.8 | 107.8 | -173.8 | -177.6 | 5.9 | 0 | 0 | 0 | 112.3 | Q262 H268 F269 F270 | Q262-D266 HydrophobicContact CG-CB 4.33Å; Q262-D266 PolarHBondContact O-N 3.44Å; D266-H268 PolarHBondContact O-N 3.01Å; D266-H268 WeakPolarHBondContact OD1-CB 3.39Å; D266-H268 IonicContact OD1-CG 2.75Å; D266-H268 PolarHBondContact OD1-N 3.11Å; D266-H268 IonicContact OD1-ND1 2.95Å; D266-H268 PolarHBondContact OD1-ND1 3.05Å; D266-F269 HydrophobicContact CB-CB 4.02Å; D266-F269 PolarHBondContact O-N 3.39Å; D266-F270 PolarHBondContact O-N 3.01Å | ||
| 267 | P | 95.6 | Very high | 97.3 | Very high | 93 Ų | 93 | 60.5 Ų | 60.5 | 60% | 0.604 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -60.7 | -27 | 176.4 | -24.5 | 34.5 | 0 | 0 | 0 | 114.7 | T271 | P267-T271 WeakPolarHBondContact O-CB 3.45Å; P267-T271 PolarHBondContact O-N 3.25Å; P267-T271 PolarHBondContact O-OG1 2.88Å |
| 268 | H | 96.5 | Very high | 97.2 | Very high | 130 Ų | 130 | 61.3 Ų | 61.3 | 60% | 0.602 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -71.3 | -49 | 178 | -61.7 | 88.8 | 0 | 0 | 0 | 109.8 | D266 F270 T271 E272 | D266-H268 PolarHBondContact O-N 3.01Å; D266-H268 WeakPolarHBondContact OD1-CB 3.39Å; D266-H268 IonicContact OD1-CG 2.75Å; D266-H268 PolarHBondContact OD1-N 3.11Å; D266-H268 IonicContact OD1-ND1 2.95Å; D266-H268 PolarHBondContact OD1-ND1 3.05Å; H268-F270 VanDerWaalsContact C-N 3.31Å; H268-F270 PolarHBondContact O-N 3.47Å; H268-T271 CarbonylContact O-C 3.56Å; H268-T271 WeakPolarHBondContact O-CA 3.42Å; H268-T271 WeakPolarHBondContact O-CB 3.32Å; H268-T271 PolarHBondContact O-N 3.43Å; H268-E272 WeakPolarHBondContact O-CG 3.29Å; H268-E272 PolarHBondContact O-N 2.79Å |
| 269 | F | 97.9 | Very high | 97 | Very high | 27 Ų | 27 | 59.1 Ų | 59.1 | 12% | 0.118 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.1 | -41.4 | 175.2 | -176 | -117.4 | 0 | 0 | 0 | 112.1 | L194 K259 Q262 L263 D266 T271 E272 V273 | L194-F269 HydrophobicContact CD1-CZ 4.18Å; K259-F269 HydrophobicContact CB-CE1 4.43Å; K259-F269 HydrophobicContact CB-CZ 4.41Å; K259-F269 HydrophobicContact CG-CZ 4.48Å; Q262-F269 HydrophobicContact CB-CD1 3.96Å; Q262-F269 HydrophobicContact CB-CE1 4.18Å; Q262-F269 HydrophobicContact CG-CB 4.22Å; Q262-F269 HydrophobicContact CG-CD1 3.62Å; Q262-F269 HydrophobicContact CG-CE1 4.21Å; Q262-F269 HydrophobicContact CG-CG 3.98Å; L263-F269 HydrophobicContact CB-CD1 4.15Å; L263-F269 HydrophobicContact CB-CE1 4.1Å; L263-F269 HydrophobicContact CD1-CD1 3.81Å; L263-F269 HydrophobicContact CD1-CE1 3.73Å; D266-F269 HydrophobicContact CB-CB 4.02Å; D266-F269 PolarHBondContact O-N 3.39Å; F269-T271 VanDerWaalsContact C-N 3.31Å; F269-T271 PolarHBondContact O-N 3.34Å; F269-E272 PolarHBondContact O-N 3.49Å; F269-V273 HydrophobicContact CD2-CG2 4.29Å; F269-V273 HydrophobicContact CE1-CG2 4.21Å; F269-V273 HydrophobicContact CE2-CG2 3.87Å; F269-V273 HydrophobicContact CZ-CG2 3.81Å; F269-V273 WeakPolarHBondContact O-CG2 3.44Å; F269-V273 PolarHBondContact O-N 3.43Å |
| 270 | F | 97.5 | Very high | 96.6 | Very high | 51 Ų | 51 | 56.9 Ų | 56.9 | 22% | 0.224 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.8 | -45.5 | 170.9 | 177.2 | -89.2 | 0 | 0 | 0 | 112.1 | I132 A187 V190 L263 D266 H268 E272 V273 F274 | I132-F270 HydrophobicContact CD1-CD1 4.38Å; I132-F270 HydrophobicContact CD1-CE1 4.23Å; A187-F270 HydrophobicContact CB-CE2 4.04Å; A187-F270 HydrophobicContact CB-CZ 4.15Å; V190-F270 HydrophobicContact CB-CE2 4.03Å; V190-F270 HydrophobicContact CB-CZ 4.38Å; V190-F270 HydrophobicContact CG1-CD2 4.29Å; V190-F270 HydrophobicContact CG1-CE2 3.99Å; V190-F270 HydrophobicContact CG1-CZ 4.47Å; V190-F270 HydrophobicContact CG2-CE2 4.32Å; V190-F270 HydrophobicContact CG2-CZ 4.16Å; L263-F270 HydrophobicContact CD1-CD2 4.49Å; L263-F270 HydrophobicContact CD2-CD2 4.38Å; L263-F270 HydrophobicContact CG-CD2 4.13Å; D266-F270 PolarHBondContact O-N 3.01Å; H268-F270 VanDerWaalsContact C-N 3.31Å; H268-F270 PolarHBondContact O-N 3.47Å; F270-E272 PolarHBondContact O-N 2.91Å; F270-V273 PolarHBondContact O-N 2.91Å; F270-F274 HydrophobicContact CE1-CB 4.3Å; F270-F274 VanDerWaalsContact O-CB 3.25Å; F270-F274 WeakPolarHBondContact O-CB 3.4Å; F270-F274 PolarHBondContact O-N 3.11Å |
| 271 | T | 96.3 | Very high | 95.6 | Very high | 27 Ų | 27 | 61.5 Ų | 61.5 | 17% | 0.166 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.5 | -40.1 | -179.7 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | I132 P267 H268 F269 F274 Q275 | I132-T271 HydrophobicContact CD1-CG2 4Å; P267-T271 WeakPolarHBondContact O-CB 3.45Å; P267-T271 PolarHBondContact O-N 3.25Å; P267-T271 PolarHBondContact O-OG1 2.88Å; H268-T271 CarbonylContact O-C 3.56Å; H268-T271 WeakPolarHBondContact O-CA 3.42Å; H268-T271 WeakPolarHBondContact O-CB 3.32Å; H268-T271 PolarHBondContact O-N 3.43Å; F269-T271 VanDerWaalsContact C-N 3.31Å; F269-T271 PolarHBondContact O-N 3.34Å; T271-F274 PolarHBondContact O-N 3.22Å; T271-Q275 HydrophobicContact CG2-CG 4.43Å; T271-Q275 VanDerWaalsContact O-CG 3.29Å; T271-Q275 WeakPolarHBondContact O-CG 3.29Å; T271-Q275 PolarHBondContact O-N 3.23Å |
| 272 | E | 96.9 | Very high | 93.9 | Very high | 128 Ų | 128 | 61.4 Ų | 61.4 | 60% | 0.598 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -59.5 | -53.4 | 175.5 | -72.6 | 176.3 | 177.3 | 0 | 0 | 111.3 | H268 F269 F270 F274 Q275 E276 | H268-E272 WeakPolarHBondContact O-CG 3.29Å; H268-E272 PolarHBondContact O-N 2.79Å; F269-E272 PolarHBondContact O-N 3.49Å; F270-E272 PolarHBondContact O-N 2.91Å; E272-F274 VanDerWaalsContact C-N 3.3Å; E272-F274 PolarHBondContact O-N 3.37Å; E272-Q275 PolarHBondContact O-N 3.33Å; E272-Q275 VanDerWaalsContact O-N 3.17Å; E272-E276 PolarHBondContact O-N 2.7Å |
| 273 | V | 97.9 | Very high | 92 | Very high | 5 Ų | 5 | 59.8 Ų | 59.8 | 3% | 0.03 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.1 | -37.4 | 179.9 | -179.3 | 0 | 0 | 0 | 0 | 111.1 | V190 Y193 L194 L263 F269 F270 E276 L277 | V190-V273 HydrophobicContact CG1-CB 4.05Å; V190-V273 HydrophobicContact CG1-CG1 3.67Å; Y193-V273 HydrophobicContact CD1-CG1 3.7Å; Y193-V273 HydrophobicContact CE1-CG1 4.02Å; L194-V273 HydrophobicContact CB-CG1 4.26Å; L194-V273 HydrophobicContact CD1-CG2 4.42Å; L263-V273 HydrophobicContact CD1-CB 3.86Å; L263-V273 HydrophobicContact CD1-CG1 4.21Å; L263-V273 HydrophobicContact CD1-CG2 3.72Å; F269-V273 HydrophobicContact CD2-CG2 4.29Å; F269-V273 HydrophobicContact CE1-CG2 4.21Å; F269-V273 HydrophobicContact CE2-CG2 3.87Å; F269-V273 HydrophobicContact CZ-CG2 3.81Å; F269-V273 WeakPolarHBondContact O-CG2 3.44Å; F269-V273 PolarHBondContact O-N 3.43Å; F270-V273 PolarHBondContact O-N 2.91Å; V273-E276 PolarHBondContact O-N 3.15Å; V273-L277 PolarHBondContact O-N 3.12Å |
| 274 | F | 97.2 | Very high | 89.8 | Confident | 6 Ų | 6 | 61.1 Ų | 61.1 | 3% | 0.026 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.4 | -47.4 | 173.4 | 171.6 | -81.4 | 0 | 0 | 0 | 111.7 | I132 A134 L139 V190 F270 T271 E272 E276 L277 K278 | I132-F274 HydrophobicContact CB-CE1 4.46Å; I132-F274 HydrophobicContact CG2-CD1 3.31Å; I132-F274 HydrophobicContact CG2-CD2 3.69Å; I132-F274 HydrophobicContact CG2-CE1 3.01Å; I132-F274 HydrophobicContact CG2-CE2 3.35Å; I132-F274 HydrophobicContact CG2-CG 3.69Å; I132-F274 HydrophobicContact CG2-CZ 3.03Å; A134-F274 HydrophobicContact CB-CE2 4.04Å; A134-F274 HydrophobicContact CB-CZ 3.62Å; L139-F274 HydrophobicContact CD1-CD2 4.44Å; L139-F274 HydrophobicContact CD1-CE2 3.9Å; L139-F274 HydrophobicContact CD2-CD2 4.36Å; L139-F274 HydrophobicContact CD2-CE2 3.76Å; L139-F274 HydrophobicContact CD2-CZ 4.16Å; L139-F274 HydrophobicContact CG-CE2 4.4Å; V190-F274 HydrophobicContact CG1-CB 4.35Å; V190-F274 HydrophobicContact CG2-CB 4.05Å; V190-F274 HydrophobicContact CG2-CD2 3.69Å; V190-F274 HydrophobicContact CG2-CG 4.34Å; F270-F274 HydrophobicContact CE1-CB 4.3Å; F270-F274 VanDerWaalsContact O-CB 3.25Å; F270-F274 WeakPolarHBondContact O-CB 3.4Å; F270-F274 PolarHBondContact O-N 3.11Å; T271-F274 PolarHBondContact O-N 3.22Å; E272-F274 VanDerWaalsContact C-N 3.3Å; E272-F274 PolarHBondContact O-N 3.37Å; F274-E276 VanDerWaalsContact C-N 3.34Å; F274-L277 PolarHBondContact O-N 3.19Å; F274-K278 HydrophobicContact CE1-CB 4.43Å; F274-K278 HydrophobicContact CE1-CD 3.84Å; F274-K278 HydrophobicContact CZ-CD 4.01Å; F274-K278 PolarHBondContact O-N 3.24Å |
| 275 | Q | 95.6 | Very high | 87.7 | Confident | 68 Ų | 68 | 63.8 Ų | 63.8 | 32% | 0.318 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.9 | -38.1 | 179.7 | -66.8 | -61.9 | -10 | 0 | 0 | 110.9 | T271 E272 L277 K278 N279 | T271-Q275 HydrophobicContact CG2-CG 4.43Å; T271-Q275 VanDerWaalsContact O-CG 3.29Å; T271-Q275 WeakPolarHBondContact O-CG 3.29Å; T271-Q275 PolarHBondContact O-N 3.23Å; E272-Q275 PolarHBondContact O-N 3.33Å; E272-Q275 VanDerWaalsContact O-N 3.17Å; Q275-L277 VanDerWaalsContact C-N 3.31Å; Q275-L277 PolarHBondContact O-N 3.28Å; Q275-K278 PolarHBondContact O-N 3.39Å; Q275-K278 VanDerWaalsContact O-N 3.14Å; Q275-N279 WeakPolarHBondContact O-CB 3.21Å; Q275-N279 PolarHBondContact O-N 3.32Å; Q275-N279 PolarHBondContact O-ND2 3.36Å; Q275-N279 PolarHBondContact O-OD1 3.43Å |
| 276 | E | 96.5 | Very high | 85.5 | Confident | 76 Ų | 76 | 63.9 Ų | 63.9 | 36% | 0.355 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.7 | -45.3 | 175 | -162.1 | -169.2 | 168 | 0 | 0 | 111.2 | Y193 Q197 E272 V273 F274 N279 Q280 | Y193-E276 HydrophobicContact CE1-CB 4.21Å; Y193-E276 HydrophobicContact CE1-CG 4.4Å; Y193-E276 VanDerWaalsContact OH-CG 3.25Å; Y193-E276 WeakPolarHBondContact OH-CG 3.36Å; Y193-E276 PolarHBondContact OH-OE1 3.24Å; Q197-E276 PolarHBondContact NE2-OE1 3.35Å; Q197-E276 PolarHBondContact NE2-OE2 3.46Å; E272-E276 PolarHBondContact O-N 2.7Å; V273-E276 PolarHBondContact O-N 3.15Å; F274-E276 VanDerWaalsContact C-N 3.34Å; E276-N279 PolarHBondContact O-N 3.44Å; E276-Q280 VanDerWaalsContact O-CG 3.32Å; E276-Q280 WeakPolarHBondContact O-CG 3.47Å; E276-Q280 PolarHBondContact O-N 3.08Å; E276-Q280 PolarHBondContact O-NE2 3.29Å |
| 277 | L | 97.3 | Very high | 83.1 | Confident | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.6 | -45.3 | 173.7 | 175.1 | 57.9 | 0 | 0 | 0 | 111.3 | L139 C142 L143 V189 V190 Y193 V273 F274 Q275 N279 Q280 | L139-L277 HydrophobicContact CB-CD2 4.18Å; L139-L277 HydrophobicContact CD2-CD2 4.04Å; L139-L277 HydrophobicContact CD2-CG 4.31Å; C142-L277 HydrophobicContact CB-CD1 3.79Å; C142-L277 HydrophobicContact CB-CG 4.18Å; C142-L277 VanDerWaalsContact CB-O 3.27Å; C142-L277 WeakPolarHBondContact CB-O 3.17Å; L143-L277 HydrophobicContact CB-CD1 4.12Å; V189-L277 HydrophobicContact CG1-CD2 4.03Å; V190-L277 HydrophobicContact CG2-CD2 4.24Å; Y193-L277 HydrophobicContact CD1-CB 3.82Å; Y193-L277 HydrophobicContact CD2-CB 4.44Å; Y193-L277 HydrophobicContact CD2-CD1 3.69Å; Y193-L277 HydrophobicContact CE1-CB 4.05Å; Y193-L277 HydrophobicContact CE2-CD1 4.22Å; Y193-L277 HydrophobicContact CG-CB 4.01Å; Y193-L277 HydrophobicContact CG-CD1 3.83Å; Y193-L277 HydrophobicContact CG-CD2 4.35Å; Y193-L277 HydrophobicContact CG-CG 4.27Å; V273-L277 PolarHBondContact O-N 3.12Å; F274-L277 PolarHBondContact O-N 3.19Å; Q275-L277 VanDerWaalsContact C-N 3.31Å; Q275-L277 PolarHBondContact O-N 3.28Å; L277-N279 VanDerWaalsContact C-N 3.3Å; L277-N279 PolarHBondContact O-N 3.11Å; L277-Q280 HydrophobicContact CD1-CG 4.44Å; L277-Q280 WeakPolarHBondContact O-CB 3.26Å; L277-Q280 WeakPolarHBondContact O-CG 3.41Å; L277-Q280 PolarHBondContact O-N 3.25Å; L277-Q280 VanDerWaalsContact O-N 3.12Å |
| 278 | K | 95 | Very high | 80.9 | Confident | 66 Ų | 66 | 67.9 Ų | 67.9 | 29% | 0.287 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -63.9 | -37.2 | -178.2 | -140.7 | -176.5 | 77.9 | -174.7 | 0 | 112.4 | A134 F274 Q275 Q280 R281 | A134-K278 HydrophobicContact CB-CD 4.32Å; F274-K278 HydrophobicContact CE1-CB 4.43Å; F274-K278 HydrophobicContact CE1-CD 3.84Å; F274-K278 HydrophobicContact CZ-CD 4.01Å; F274-K278 PolarHBondContact O-N 3.24Å; Q275-K278 PolarHBondContact O-N 3.39Å; Q275-K278 VanDerWaalsContact O-N 3.14Å; K278-Q280 PolarHBondContact O-N 3.16Å; K278-R281 PolarHBondContact O-N 3.33Å |
| 279 | N | 93.9 | Very high | 78.2 | Confident | 82 Ų | 82 | 69 Ų | 69 | 44% | 0.439 | 36% | 0.36 | S | S | . | . | G | 310 helix | trans | -70.4 | -9.6 | 178.4 | -65.4 | -13 | 0 | 0 | 0 | 113.1 | Q275 E276 L277 R281 D282 | Q275-N279 WeakPolarHBondContact O-CB 3.21Å; Q275-N279 PolarHBondContact O-N 3.32Å; Q275-N279 PolarHBondContact O-ND2 3.36Å; Q275-N279 PolarHBondContact O-OD1 3.43Å; E276-N279 PolarHBondContact O-N 3.44Å; L277-N279 VanDerWaalsContact C-N 3.3Å; L277-N279 PolarHBondContact O-N 3.11Å; N279-R281 PolarHBondContact O-N 3.44Å; N279-D282 PolarHBondContact O-N 3.49Å |
| 280 | Q | 91.3 | Very high | 75.2 | Confident | 19 Ų | 19 | 81.4 Ų | 81.4 | 9% | 0.089 | 41% | 0.406 | C | S | . | . | G | 310 helix | trans | -64.4 | -18.8 | 175.2 | -57.3 | -58.8 | -39.6 | 0 | 0 | 112.7 | C142 F146 R149 Y193 E276 L277 K278 | C142-Q280 HydrophobicContact CB-CB 4.39Å; F146-Q280 HydrophobicContact CB-CB 4.1Å; F146-Q280 HydrophobicContact CB-CG 3.88Å; R149-Q280 PolarHBondContact NH2-O 3.37Å; Y193-Q280 HydrophobicContact CE2-CG 4.22Å; Y193-Q280 PolarHBondContact OH-NE2 3.41Å; E276-Q280 VanDerWaalsContact O-CG 3.32Å; E276-Q280 WeakPolarHBondContact O-CG 3.47Å; E276-Q280 PolarHBondContact O-N 3.08Å; E276-Q280 PolarHBondContact O-NE2 3.29Å; L277-Q280 HydrophobicContact CD1-CG 4.44Å; L277-Q280 WeakPolarHBondContact O-CB 3.26Å; L277-Q280 WeakPolarHBondContact O-CG 3.41Å; L277-Q280 PolarHBondContact O-N 3.25Å; L277-Q280 VanDerWaalsContact O-N 3.12Å; K278-Q280 PolarHBondContact O-N 3.16Å |
| 281 | R | 76.4 | Confident | 74.1 | Confident | 106 Ų | 106 | 83 Ų | 83 | 40% | 0.4 | 42% | 0.415 | S | S | . | . | G | 310 helix | trans | -72.2 | -39.9 | 174.3 | -178.9 | -176.4 | 178.3 | 174.4 | -4.6 | 113.3 | E138 R141 K278 N279 S283 S284 | E138-R281 IonicContact OE1-NH1 3.86Å; E138-R281 PolarHBondContact OE1-NH1 3.4Å; R141-R281 VanDerWaalsContact NH2-CZ 3.28Å; K278-R281 PolarHBondContact O-N 3.33Å; N279-R281 PolarHBondContact O-N 3.44Å; R281-S283 VanDerWaalsContact C-N 3.3Å; R281-S283 PolarHBondContact O-N 3.1Å; R281-S284 PolarHBondContact O-N 3.34Å; R281-S284 PolarHBondContact O-OG 3.39Å |
| 282 | D | 62.7 | Low | 72.9 | Confident | 101 Ų | 101 | 85.9 Ų | 85.9 | 54% | 0.54 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -78.4 | -21 | -170.1 | -58.6 | -31.6 | 0 | 0 | 0 | 112.1 | N279 S286 | N279-D282 PolarHBondContact O-N 3.49Å; D282-S286 PolarHBondContact O-OG 3.34Å |
| 283 | S | 59.9 | Low | 71.6 | Confident | 49 Ų | 49 | 83.6 Ų | 83.6 | 34% | 0.343 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -74 | -22.1 | 177.1 | -60.6 | 0 | 0 | 0 | 0 | 113.8 | R281 S286 | R281-S283 VanDerWaalsContact C-N 3.3Å; R281-S283 PolarHBondContact O-N 3.1Å; S283-S286 PolarHBondContact O-OG 3.18Å |
| 284 | S | 51.7 | Low | 70 | Confident | 37 Ų | 37 | 88.2 Ų | 88.2 | 26% | 0.259 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -80.7 | -33.8 | 177.9 | 38 | 0 | 0 | 0 | 0 | 113.5 | R281 | R281-S284 PolarHBondContact O-N 3.34Å; R281-S284 PolarHBondContact O-OG 3.39Å |
| 285 | E | 50.7 | Low | 68.3 | Low | 141 Ų | 141 | 93.3 Ų | 93.3 | 66% | 0.659 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -72.9 | -40.5 | -179.2 | -66.1 | -98.6 | 135.8 | 0 | 0 | 111.2 | S287 L288 | E285-S287 PolarHBondContact O-N 3.46Å; E285-L288 PolarHBondContact O-N 3.36Å |
| 286 | S | 50.3 | Low | 66.5 | Low | 77 Ų | 77 | 95 Ų | 95 | 54% | 0.538 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -14.4 | -180 | 53.6 | 0 | 0 | 0 | 0 | 115.3 | D282 S283 | D282-S286 PolarHBondContact O-OG 3.34Å; S283-S286 PolarHBondContact O-OG 3.18Å |
| 287 | S | 48.3 | Very low | 64.4 | Low | 86 Ų | 86 | 96.4 Ų | 96.4 | 60% | 0.601 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -8.6 | 176.5 | -68.2 | 0 | 0 | 0 | 0 | 113.9 | E285 | E285-S287 PolarHBondContact O-N 3.46Š|
| 288 | L | 48.8 | Very low | 61.8 | Low | 144 Ų | 144 | 103.8 Ų | 103.8 | 75% | 0.754 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | -13.2 | 177.3 | -73.2 | 163.2 | 0 | 0 | 0 | 113 | E285 | E285-L288 PolarHBondContact O-N 3.36Š|
| 289 | D | 40.8 | Very low | 59.1 | Low | 152 Ų | 152 | 106.9 Ų | 106.9 | 81% | 0.813 | 54% | 0.544 | S | S | * | . | trans | -97.1 | 16.2 | 178.5 | -76.8 | -22.3 | 0 | 0 | 0 | 113.8 | ||||
| 290 | R | 33.8 | Very low | 55.9 | Low | 289 Ų | 289 | 109.2 Ų | 109.2 | 100% | 1.091 | 55% | 0.553 | S | S | * | * | trans | -132.2 | 0 | 174.5 | -85.6 | -173.7 | 172.1 | -179.6 | -1 | 111.6 |
Retrieved 290 of 290 residues in 131.9 ms
(Link to these results)